A0A087Y005_POEFO Loading...

Bifunctional peptidase and (3S)-lysyl hydroxylase JMJD7

Bifunctional enzyme that acts both as an endopeptidase and 2-oxoglutarate-dependent monooxygenase. Endopeptidase that cleaves histones N-terminal tails at the carboxyl side of methylated arginine or lysine residues, to generate 'tailless nucleosomes', which may trigger transcription elongation. Preferentially recognizes and cleaves monomethylated and dimethylated arginine residues of histones H2, H3 and H4. After initial cleavage, continues to digest histones tails via its aminopeptidase activity. Additionally, may play a role in protein biosynthesis by modifying the translation machinery. Acts as a Fe(2+) and 2-oxoglutarate-dependent monooxygenase, catalyzing (S)-stereospecific hydroxylation at C-3 of 'Lys-22' of DRG1 and 'Lys-21' of DRG2 translation factors (TRAFAC), promoting their interaction with ribonucleic acids (RNA).

AlphaFold DB , UniProt , Accession A0A087Y005, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 312 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	69.7	Low	88.2	Confident	129 Å²	129	87.6 Å²	87.6	64%	0.635	43%	0.426	S	S	*	.				0	-58.7	0	-73.2	-77.9	-87.3	0	0	109.2	S3 V4 Q5 I307	M1-S3 PolarHBondContact O-N 3.46Å; M1-V4 WeakPolarHBondContact O-CB 3.03Å; M1-V4 PolarHBondContact O-N 3.24Å; M1-Q5 PolarHBondContact O-N 2.93Å; M1-I307 HydrophobicContact CE-CG2 4.4Å; M1-I307 VanDerWaalsContact CE-O 3.29Å; M1-I307 WeakPolarHBondContact CE-O 3.37Å; M1-I307 HydrophobicContact SD-CG2 4.02Å
2	E	75.3	Confident	88.8	Confident	147 Å²	147	80.3 Å²	80.3	69%	0.687	39%	0.391	S	S	*	.	H	α-helix	trans	-54.9	-47.2	176.9	-150.3	168.4	-155.6	0	0	113.1	V4 Q5 E6	E2-V4 PolarHBondContact O-N 2.78Å; E2-V4 VanDerWaalsContact O-N 3.15Å; E2-Q5 PolarHBondContact O-N 3.3Å; E2-E6 WeakPolarHBondContact O-CG 3.3Å; E2-E6 PolarHBondContact O-N 2.75Å
3	S	85.9	Confident	89.1	Confident	76 Å²	76	78 Å²	78	53%	0.531	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-21.3	175	64.7	0	0	0	0	115	M1 R7	M1-S3 PolarHBondContact O-N 3.46Å; S3-R7 WeakPolarHBondContact O-CG 3.29Å
4	V	88.5	Confident	89.5	Confident	57 Å²	57	81.6 Å²	81.6	35%	0.345	40%	0.397	S	S	.	.	H	α-helix	trans	-83.8	-42.6	176.9	176.1	0	0	0	0	109.6	M1 E2 E6 R7 L8	M1-V4 WeakPolarHBondContact O-CB 3.03Å; M1-V4 PolarHBondContact O-N 3.24Å; E2-V4 PolarHBondContact O-N 2.78Å; E2-V4 VanDerWaalsContact O-N 3.15Å; V4-E6 VanDerWaalsContact C-N 3.34Å; V4-E6 PolarHBondContact O-N 3.39Å; V4-R7 PolarHBondContact O-N 2.75Å; V4-L8 HydrophobicContact CG1-CD1 4.3Å; V4-L8 HydrophobicContact CG1-CG 4.48Å; V4-L8 WeakPolarHBondContact O-CG 3.49Å; V4-L8 PolarHBondContact O-N 2.98Å
5	Q	87.4	Confident	89.9	Confident	73 Å²	73	76.7 Å²	76.7	34%	0.341	37%	0.374	S	S	.	.	H	α-helix	trans	-56.8	-46.6	174.3	-75.7	170.5	-18	0	0	111.6	M1 E2 R7 L8 V9 A308	M1-Q5 PolarHBondContact O-N 2.93Å; E2-Q5 PolarHBondContact O-N 3.3Å; Q5-R7 VanDerWaalsContact C-N 3.29Å; Q5-R7 PolarHBondContact O-N 3.17Å; Q5-L8 PolarHBondContact O-N 3.42Å; Q5-V9 WeakPolarHBondContact O-CG2 3.43Å; Q5-V9 PolarHBondContact O-N 2.71Å; Q5-A308 HydrophobicContact CG-CB 3.78Å; Q5-A308 PolarHBondContact NE2-O 3.27Å
6	E	91.3	Very high	90.1	Very high	107 Å²	107	73.2 Å²	73.2	50%	0.5	36%	0.357	S	S	.	.	H	α-helix	trans	-57	-43.1	176.2	-71.5	175	169.2	0	0	111.9	E2 V4 V9 E10	E2-E6 WeakPolarHBondContact O-CG 3.3Å; E2-E6 PolarHBondContact O-N 2.75Å; V4-E6 VanDerWaalsContact C-N 3.34Å; V4-E6 PolarHBondContact O-N 3.39Å; E6-V9 WeakPolarHBondContact O-CB 3.47Å; E6-V9 PolarHBondContact O-N 3.35Å; E6-E10 WeakPolarHBondContact O-CG 3.34Å; E6-E10 PolarHBondContact O-N 2.94Å
7	R	94.6	Very high	90.3	Very high	157 Å²	157	76.1 Å²	76.1	59%	0.592	37%	0.374	S	S	*	.	H	α-helix	trans	-70.3	-33.5	-180	-64.8	-69.7	161.5	-162.6	-7.2	113	S3 V4 Q5 V9 E10 F11	S3-R7 WeakPolarHBondContact O-CG 3.29Å; V4-R7 PolarHBondContact O-N 2.75Å; Q5-R7 VanDerWaalsContact C-N 3.29Å; Q5-R7 PolarHBondContact O-N 3.17Å; R7-V9 VanDerWaalsContact C-N 3.32Å; R7-E10 WeakPolarHBondContact CD-OE2 3.48Å; R7-E10 IonicContact CZ-OE2 2.6Å; R7-E10 VanDerWaalsContact CZ-OE2 3.24Å; R7-E10 IonicContact NE-OE2 3.73Å; R7-E10 IonicContact NH1-OE1 3.97Å; R7-E10 IonicContact NH1-OE2 3.59Å; R7-E10 PolarHBondContact NH1-OE2 3.42Å; R7-F11 VanDerWaalsContact O-CB 3.25Å; R7-F11 WeakPolarHBondContact O-CB 3.48Å; R7-F11 PolarHBondContact O-N 2.93Å
8	L	94	Very high	90.6	Very high	15 Å²	15	80.3 Å²	80.3	8%	0.079	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-37.9	173.2	-69.6	172.7	0	0	0	111.5	V4 Q5 S12 P199 L301 L304 A308	V4-L8 HydrophobicContact CG1-CD1 4.3Å; V4-L8 HydrophobicContact CG1-CG 4.48Å; V4-L8 WeakPolarHBondContact O-CG 3.49Å; V4-L8 PolarHBondContact O-N 2.98Å; Q5-L8 PolarHBondContact O-N 3.42Å; L8-S12 PolarHBondContact O-N 3.4Å; L8-P199 HydrophobicContact CB-CB 4.16Å; L8-P199 HydrophobicContact CB-CG 4.09Å; L8-P199 HydrophobicContact CD2-CG 4.43Å; L8-L301 HydrophobicContact CD2-CD1 3.59Å; L8-L304 HydrophobicContact CD1-CB 4.37Å; L8-L304 HydrophobicContact CD2-CB 4.15Å; L8-A308 HydrophobicContact CD1-CB 3.79Å
9	V	93.2	Very high	90.8	Very high	40 Å²	40	79.8 Å²	79.8	24%	0.242	39%	0.391	C	S	.	.	H	α-helix	trans	-65.1	-52.4	175	173.7	0	0	0	0	110.5	Q5 E6 R7 F11 S12 L13 F200 L250	Q5-V9 WeakPolarHBondContact O-CG2 3.43Å; Q5-V9 PolarHBondContact O-N 2.71Å; E6-V9 WeakPolarHBondContact O-CB 3.47Å; E6-V9 PolarHBondContact O-N 3.35Å; R7-V9 VanDerWaalsContact C-N 3.32Å; V9-F11 VanDerWaalsContact C-N 3.28Å; V9-F11 PolarHBondContact O-N 3.08Å; V9-S12 PolarHBondContact O-N 2.84Å; V9-L13 HydrophobicContact CG1-CD1 4.02Å; V9-L13 WeakPolarHBondContact O-CG 3.38Å; V9-L13 PolarHBondContact O-N 3.07Å; V9-F200 HydrophobicContact CB-CE1 4.22Å; V9-F200 HydrophobicContact CB-CZ 4.29Å; V9-F200 HydrophobicContact CG1-CE1 4.36Å; V9-F200 HydrophobicContact CG1-CZ 4.14Å; V9-F200 HydrophobicContact CG2-CE1 3.82Å; V9-F200 HydrophobicContact CG2-CZ 4.38Å; V9-L250 HydrophobicContact CG1-CD1 4.03Å; V9-L250 HydrophobicContact CG2-CD1 4.18Å
10	E	94.7	Very high	91	Very high	71 Å²	71	76.6 Å²	76.6	33%	0.332	38%	0.376	S	S	.	.	H	α-helix	trans	-58	-41	178.7	-72.3	174.2	172.9	0	0	111.9	E6 R7 S12 L13 E14	E6-E10 WeakPolarHBondContact O-CG 3.34Å; E6-E10 PolarHBondContact O-N 2.94Å; R7-E10 WeakPolarHBondContact CD-OE2 3.48Å; R7-E10 IonicContact CZ-OE2 2.6Å; R7-E10 VanDerWaalsContact CZ-OE2 3.24Å; R7-E10 IonicContact NE-OE2 3.73Å; R7-E10 IonicContact NH1-OE1 3.97Å; R7-E10 IonicContact NH1-OE2 3.59Å; R7-E10 PolarHBondContact NH1-OE2 3.42Å; E10-S12 PolarHBondContact O-N 2.79Å; E10-L13 PolarHBondContact O-N 3.12Å; E10-E14 WeakPolarHBondContact O-CB 3.48Å; E10-E14 WeakPolarHBondContact O-CG 3.3Å; E10-E14 PolarHBondContact O-N 3.29Å
11	F	95.4	Very high	91.2	Very high	92 Å²	92	75.4 Å²	75.4	40%	0.404	37%	0.371	S	S	.	.	H	α-helix	trans	-55.9	-48.1	178.4	168.2	-100.5	0	0	0	113.1	R7 V9 A15 T196 L301	R7-F11 VanDerWaalsContact O-CB 3.25Å; R7-F11 WeakPolarHBondContact O-CB 3.48Å; R7-F11 PolarHBondContact O-N 2.93Å; V9-F11 VanDerWaalsContact C-N 3.28Å; V9-F11 PolarHBondContact O-N 3.08Å; F11-A15 WeakPolarHBondContact O-CB 3.49Å; F11-A15 PolarHBondContact O-N 2.89Å; F11-T196 HydrophobicContact CE1-CG2 3.79Å; F11-T196 HydrophobicContact CZ-CG2 3.8Å; F11-L301 HydrophobicContact CD1-CD1 3.81Å; F11-L301 HydrophobicContact CD1-CD2 4.37Å; F11-L301 HydrophobicContact CE1-CD1 3.84Å; F11-L301 HydrophobicContact CE1-CD2 3.69Å; F11-L301 HydrophobicContact CE1-CG 4.4Å
12	S	95.3	Very high	92.4	Very high	0 Å²	0	79 Å²	79	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.4	-44.9	177	164.9	0	0	0	0	111	L8 V9 E10 E14 A15 H16 T196 D197 F200	L8-S12 PolarHBondContact O-N 3.4Å; V9-S12 PolarHBondContact O-N 2.84Å; E10-S12 PolarHBondContact O-N 2.79Å; S12-E14 PolarHBondContact O-N 2.94Å; S12-A15 WeakPolarHBondContact O-CB 3.35Å; S12-A15 PolarHBondContact O-N 3.23Å; S12-H16 PolarHBondContact O-CD2 2.92Å; S12-H16 PolarHBondContact O-N 2.87Å; S12-T196 WeakPolarHBondContact CB-O 3.33Å; S12-D197 PolarHBondContact OG-OD1 2.97Å; S12-F200 VanDerWaalsContact CB-CE2 3.5Å; S12-F200 VanDerWaalsContact OG-CE2 3.22Å; S12-F200 WeakPolarHBondContact OG-CE2 3.31Å
13	L	92.3	Very high	93.4	Very high	50 Å²	50	75.7 Å²	75.7	26%	0.262	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-44.1	-179.8	-65.3	173.9	0	0	0	111.9	V9 E10 H16 D17	V9-L13 HydrophobicContact CG1-CD1 4.02Å; V9-L13 WeakPolarHBondContact O-CG 3.38Å; V9-L13 PolarHBondContact O-N 3.07Å; E10-L13 PolarHBondContact O-N 3.12Å; L13-H16 WeakPolarHBondContact O-CB 3.39Å; L13-H16 PolarHBondContact O-N 3.13Å; L13-D17 PolarHBondContact O-N 3.01Å
14	E	95.6	Very high	94	Very high	129 Å²	129	72.5 Å²	72.5	60%	0.603	35%	0.353	S	S	*	.	H	α-helix	trans	-65.4	-39	176.2	-72.8	-176.6	-177.2	0	0	112.1	E10 S12 H16 D17 L18	E10-E14 WeakPolarHBondContact O-CB 3.48Å; E10-E14 WeakPolarHBondContact O-CG 3.3Å; E10-E14 PolarHBondContact O-N 3.29Å; S12-E14 PolarHBondContact O-N 2.94Å; E14-H16 VanDerWaalsContact C-N 3.31Å; E14-H16 PolarHBondContact O-N 3.33Å; E14-D17 PolarHBondContact O-N 2.97Å; E14-L18 WeakPolarHBondContact O-CB 3.43Å; E14-L18 PolarHBondContact O-N 3.44Å
15	A	95.3	Very high	94.5	Very high	7 Å²	7	71.4 Å²	71.4	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-59.9	-42.8	174.5	0	0	0	0	0	111.8	F11 S12 Y19 L20 T196	F11-A15 WeakPolarHBondContact O-CB 3.49Å; F11-A15 PolarHBondContact O-N 2.89Å; S12-A15 WeakPolarHBondContact O-CB 3.35Å; S12-A15 PolarHBondContact O-N 3.23Å; A15-Y19 HydrophobicContact CB-CE1 3.88Å; A15-Y19 WeakPolarHBondContact O-CD1 3.45Å; A15-Y19 PolarHBondContact O-N 2.66Å; A15-L20 PolarHBondContact O-N 3.47Å; A15-T196 HydrophobicContact CB-CG2 3.8Å
16	H	93.6	Very high	95	Very high	21 Å²	21	71.9 Å²	71.9	10%	0.097	35%	0.35	C	S	.	.	H	α-helix	trans	-61.7	-41.6	174.7	-84.2	-72.9	0	0	0	112.9	S12 L13 E14 D197	S12-H16 PolarHBondContact O-CD2 2.92Å; S12-H16 PolarHBondContact O-N 2.87Å; L13-H16 WeakPolarHBondContact O-CB 3.39Å; L13-H16 PolarHBondContact O-N 3.13Å; E14-H16 VanDerWaalsContact C-N 3.31Å; E14-H16 PolarHBondContact O-N 3.33Å; H16-D197 IonicContact CD2-OD1 3.57Å; H16-D197 PolarHBondContact CD2-OD1 2.99Å; H16-D197 IonicContact CE1-OD1 2.62Å; H16-D197 IonicContact CE1-OD2 2.74Å; H16-D197 IonicContact NE2-OD1 3.54Å; H16-D197 PolarHBondContact NE2-OD1 3.14Å; H16-D197 IonicContact NE2-OD2 3Å; H16-D197 PolarHBondContact NE2-OD2 2.98Å
17	D	93.6	Very high	95.4	Very high	122 Å²	122	68.7 Å²	68.7	65%	0.652	34%	0.336	S	S	*	.	H	α-helix	trans	-81.3	-28.6	-175.5	-69.6	-7.3	0	0	0	112.8	L13 E14 R252	L13-D17 PolarHBondContact O-N 3.01Å; E14-D17 PolarHBondContact O-N 2.97Å; D17-R252 IonicContact OD1-NH1 2.74Å; D17-R252 PolarHBondContact OD1-NH1 3.16Å
18	L	95.4	Very high	95.5	Very high	152 Å²	152	66.9 Å²	66.9	80%	0.796	33%	0.334	S	S	*	.	H	α-helix	trans	-83	-50.7	-175.7	-179.8	64.3	0	0	0	113.2	E14	E14-L18 WeakPolarHBondContact O-CB 3.43Å; E14-L18 PolarHBondContact O-N 3.44Å
19	Y	93.8	Very high	95.6	Very high	71 Å²	71	67.3 Å²	67.3	28%	0.278	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-27.6	-168.7	84.3	-84.4	0	0	0	115.3	A15 P43 K45	A15-Y19 HydrophobicContact CB-CE1 3.88Å; A15-Y19 WeakPolarHBondContact O-CD1 3.45Å; A15-Y19 PolarHBondContact O-N 2.66Å; Y19-P43 WeakPolarHBondContact CE2-O 3.47Å; Y19-K45 HydrophobicContact CD2-CG 4.46Å; Y19-K45 WeakPolarHBondContact O-CE 3.43Å; Y19-K45 PolarHBondContact O-NZ 3.43Å
20	L	94.8	Very high	95.8	Very high	15 Å²	15	68.8 Å²	68.8	8%	0.079	35%	0.352	C	S	.	.			trans	-71.5	147.7	-177.6	-62.9	170.8	0	0	0	112.2	A15 P194 W270	A15-L20 PolarHBondContact O-N 3.47Å; L20-P194 HydrophobicContact CD1-CB 3.64Å; L20-P194 HydrophobicContact CD1-CG 3.62Å; L20-P194 HydrophobicContact CD2-CB 4.21Å; L20-W270 HydrophobicContact CD2-CH2 4.07Å; L20-W270 HydrophobicContact CD2-CZ2 3.78Å
21	N	94.8	Very high	95.9	Very high	52 Å²	52	66.1 Å²	66.1	28%	0.278	34%	0.341	S	S	.	.			trans	-82.5	146.7	176.4	-61.3	-45.8	0	0	0	110.1	S23 P25	N21-S23 VanDerWaalsContact CB-O 3.25Å; N21-S23 WeakPolarHBondContact CB-O 3.28Å; N21-S23 PolarHBondContact O-N 2.66Å; N21-P25 HydrophobicContact CB-CG 4.19Å; N21-P25 VanDerWaalsContact ND2-CG 3.27Å; N21-P25 WeakPolarHBondContact ND2-CG 3.47Å
22	K	94.8	Very high	96	Very high	205 Å²	205	68.3 Å²	68.3	89%	0.891	35%	0.353	S	S	*	.	S	Bend	trans	-72.9	-11.6	175.4	-63.2	-175.2	178.9	-178.2	0	114.1	L254	K22-L254 WeakPolarHBondContact O-CD2 3.32Å
23	S	97.3	Very high	96.1	Very high	78 Å²	78	69.6 Å²	69.6	55%	0.545	36%	0.361	S	S	.	.	S	Bend	trans	-154.1	157.8	178.2	58.9	0	0	0	0	109.1	N21 P25	N21-S23 VanDerWaalsContact CB-O 3.25Å; N21-S23 WeakPolarHBondContact CB-O 3.28Å; N21-S23 PolarHBondContact O-N 2.66Å; S23-P25 WeakPolarHBondContact O-CD 3.47Å
24	V	98.5	Very high	96.4	Very high	8 Å²	8	73.8 Å²	73.8	5%	0.048	38%	0.383	C	S	.	.			trans	-69.9	114.4	175.4	-176.6	0	0	0	0	109.7	H26 P46 I48 L192 L254 C256 L264	V24-H26 PolarHBondContact O-ND1 3.03Å; V24-P46 HydrophobicContact CG1-CB 4.4Å; V24-P46 HydrophobicContact CG2-CG 4.35Å; V24-I48 HydrophobicContact CG1-CD1 4.39Å; V24-I48 HydrophobicContact CG1-CG1 4.02Å; V24-L192 HydrophobicContact CG2-CD1 4.05Å; V24-L254 HydrophobicContact CG2-CB 4.3Å; V24-C256 HydrophobicContact CB-CB 3.91Å; V24-C256 HydrophobicContact CG1-CB 4.43Å; V24-C256 HydrophobicContact CG2-CB 3.74Å; V24-L264 HydrophobicContact CG1-CD1 4.26Å
25	P	98.4	Very high	96.6	Very high	34 Å²	34	71.8 Å²	71.8	22%	0.221	37%	0.374	C	S	.	.			trans	-72.7	162.1	-178.6	-16.5	33.2	0	0	0	112	N21 S23 W40 P46 C47 I48	N21-P25 HydrophobicContact CB-CG 4.19Å; N21-P25 VanDerWaalsContact ND2-CG 3.27Å; N21-P25 WeakPolarHBondContact ND2-CG 3.47Å; S23-P25 WeakPolarHBondContact O-CD 3.47Å; P25-W40 HydrophobicContact CB-CH2 3.72Å; P25-W40 HydrophobicContact CB-CZ3 4.29Å; P25-W40 HydrophobicContact CG-CH2 3.73Å; P25-W40 HydrophobicContact CG-CZ3 3.88Å; P25-P46 WeakPolarHBondContact CD-O 3.43Å; P25-C47 WeakPolarHBondContact O-CA 3.47Å; P25-I48 PolarHBondContact O-N 2.9Å
26	H	98.6	Very high	96.7	Very high	83 Å²	83	71.4 Å²	71.4	38%	0.384	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.9	178	-64.6	63.7	0	0	0	110.9	V24 I48	V24-H26 PolarHBondContact O-ND1 3.03Å; H26-I48 CarbonylContact C-O 3.55Å; H26-I48 VanDerWaalsContact CA-O 3.25Å; H26-I48 WeakPolarHBondContact CA-O 3.3Å
27	L	98.5	Very high	97	Very high	40 Å²	40	74.8 Å²	74.8	21%	0.209	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	138.7	166.1	-59.9	-174.6	0	0	0	108.5	G29 P31 W40 I48 I49 R50	L27-G29 VanDerWaalsContact C-N 3.31Å; L27-G29 PolarHBondContact O-N 2.77Å; L27-P31 HydrophobicContact CD1-CB 4.25Å; L27-P31 HydrophobicContact CD1-CG 4.3Å; L27-W40 HydrophobicContact CD1-CZ2 4.34Å; L27-W40 HydrophobicContact CD2-CZ2 3.83Å; L27-W40 HydrophobicContact CG-CZ2 4.23Å; L27-I48 PolarHBondContact N-O 3.25Å; L27-I49 HydrophobicContact CB-CG1 4.46Å; L27-I49 HydrophobicContact CB-CG2 4.19Å; L27-I49 HydrophobicContact CD1-CG1 4.23Å; L27-R50 WeakPolarHBondContact O-CB 3.22Å; L27-R50 PolarHBondContact O-N 3.09Å
28	E	97.8	Very high	97.2	Very high	120 Å²	120	76.2 Å²	76.2	56%	0.561	38%	0.38	S	S	*	.	S	Bend	trans	-83.8	-6.6	-176.8	-66.9	-59.7	141.2	0	0	113.7	R50 N51	E28-R50 CarbonylContact C-O 3.59Å; E28-R50 IonicContact OE1-CZ 2.75Å; E28-R50 IonicContact OE1-NH1 3.96Å; E28-R50 PolarHBondContact OE1-NH1 3.27Å; E28-R50 IonicContact OE2-NH1 3.24Å; E28-N51 PolarHBondContact O-ND2 3.43Å
29	G	96.6	Very high	97.3	Very high	24 Å²	24	71.4 Å²	71.4	25%	0.247	36%	0.355	C	S	.	.	S	Bend	trans	-165	173.3	-178.3	0	0	0	0	0	112.2	L27 I49 R50	L27-G29 VanDerWaalsContact C-N 3.31Å; L27-G29 PolarHBondContact O-N 2.77Å; G29-I49 VanDerWaalsContact O-CG2 3.3Å; G29-I49 WeakPolarHBondContact O-CG2 2.97Å; G29-R50 WeakPolarHBondContact CA-O 3.07Å; G29-R50 PolarHBondContact N-O 2.99Å
30	P	96.3	Very high	97.5	Very high	70 Å²	70	69.2 Å²	69.2	46%	0.455	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-61.4	131.9	177.5	26.5	-33.5	0	0	0	110.6
31	P	96.7	Very high	97.7	Very high	15 Å²	15	68.6 Å²	68.6	10%	0.097	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-79.6	157.9	-179.5	31.1	-32.9	0	0	0	112	L27 F36 W147	L27-P31 HydrophobicContact CD1-CB 4.25Å; L27-P31 HydrophobicContact CD1-CG 4.3Å; P31-F36 HydrophobicContact CB-CB 4.01Å; P31-F36 HydrophobicContact CB-CD2 4.08Å; P31-F36 HydrophobicContact CB-CG 4.43Å; P31-F36 HydrophobicContact CG-CB 3.72Å; P31-F36 HydrophobicContact CG-CD2 3.32Å; P31-F36 HydrophobicContact CG-CE2 4.12Å; P31-F36 HydrophobicContact CG-CG 3.7Å; P31-W147 HydrophobicContact CG-CD2 4.42Å; P31-W147 HydrophobicContact CG-CE3 4.01Å; P31-W147 HydrophobicContact CG-CH2 4.48Å; P31-W147 HydrophobicContact CG-CZ3 4.07Å
32	E	98.1	Very high	97.9	Very high	138 Å²	138	67.6 Å²	67.6	65%	0.645	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-65.5	137.9	167	-70.8	-61.2	145.1	0	0	110.4	L34 Q35 F36	E32-L34 VanDerWaalsContact C-N 3.35Å; E32-L34 PolarHBondContact O-N 3.23Å; E32-Q35 HydrophobicContact CB-CB 4.13Å; E32-Q35 WeakPolarHBondContact O-CA 3.26Å; E32-Q35 WeakPolarHBondContact O-CB 3.4Å; E32-Q35 PolarHBondContact O-N 3.33Å; E32-F36 PolarHBondContact O-N 2.9Å
33	P	98.6	Very high	98	Very high	27 Å²	27	59.7 Å²	59.7	18%	0.175	31%	0.314	C	S	.	.	H	α-helix	trans	-52.3	-46.1	-173.5	-30	35	0	0	0	114.6	Q35 F36 Y37 W147 T150 A151	P33-Q35 PolarHBondContact O-N 3.19Å; P33-F36 PolarHBondContact O-N 3.42Å; P33-Y37 PolarHBondContact O-N 3.16Å; P33-W147 HydrophobicContact CG-CB 4.09Å; P33-T150 HydrophobicContact CB-CG2 3.83Å; P33-T150 HydrophobicContact CG-CG2 3.81Å; P33-A151 HydrophobicContact CB-CB 4.05Å; P33-A151 WeakPolarHBondContact O-CB 3.13Å
34	L	98.3	Very high	98.1	Very high	139 Å²	139	56.6 Å²	56.6	73%	0.728	29%	0.292	S	S	*	.	H	α-helix	trans	-64.2	-41	178.4	176.1	62.5	0	0	0	112	E32 F36 R38	E32-L34 VanDerWaalsContact C-N 3.35Å; E32-L34 PolarHBondContact O-N 3.23Å; L34-F36 VanDerWaalsContact C-N 3.33Å; L34-R38 WeakPolarHBondContact O-CB 3.39Å; L34-R38 PolarHBondContact O-N 2.99Å
35	Q	98.3	Very high	98.1	Very high	86 Å²	86	58 Å²	58	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-43.5	177.3	-175.9	179.3	5	0	0	110.1	E32 P33 Y37 R38 D39	E32-Q35 HydrophobicContact CB-CB 4.13Å; E32-Q35 WeakPolarHBondContact O-CA 3.26Å; E32-Q35 WeakPolarHBondContact O-CB 3.4Å; E32-Q35 PolarHBondContact O-N 3.33Å; P33-Q35 PolarHBondContact O-N 3.19Å; Q35-Y37 VanDerWaalsContact C-N 3.34Å; Q35-Y37 PolarHBondContact O-N 3.3Å; Q35-R38 PolarHBondContact O-N 2.91Å; Q35-D39 WeakPolarHBondContact CG-OD2 3.31Å; Q35-D39 WeakPolarHBondContact O-CB 3.16Å; Q35-D39 PolarHBondContact O-N 3.46Å
36	F	98.6	Very high	98.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-44.1	-179.7	-167	-111.6	0	0	0	112.1	P31 E32 P33 L34 R38 W40 I41 I49 W147 M148 Y265	P31-F36 HydrophobicContact CB-CB 4.01Å; P31-F36 HydrophobicContact CB-CD2 4.08Å; P31-F36 HydrophobicContact CB-CG 4.43Å; P31-F36 HydrophobicContact CG-CB 3.72Å; P31-F36 HydrophobicContact CG-CD2 3.32Å; P31-F36 HydrophobicContact CG-CE2 4.12Å; P31-F36 HydrophobicContact CG-CG 3.7Å; E32-F36 PolarHBondContact O-N 2.9Å; P33-F36 PolarHBondContact O-N 3.42Å; L34-F36 VanDerWaalsContact C-N 3.33Å; F36-R38 PolarHBondContact O-N 2.98Å; F36-W40 HydrophobicContact CD2-CB 4.06Å; F36-W40 AromaticContact CD2-CD1 3.37Å; F36-W40 AromaticContact CD2-CG 3.91Å; F36-W40 HydrophobicContact CD2-CG 3.91Å; F36-W40 HydrophobicContact CE2-CB 3.82Å; F36-W40 AromaticContact CE2-CD1 3.7Å; F36-W40 AromaticContact CE2-CG 3.81Å; F36-W40 HydrophobicContact CE2-CG 3.81Å; F36-W40 HydrophobicContact CZ-CB 4.21Å; F36-W40 WeakPolarHBondContact O-CB 3.37Å; F36-W40 PolarHBondContact O-N 3.44Å; F36-I41 HydrophobicContact CD1-CD1 3.53Å; F36-I41 HydrophobicContact CD1-CG1 3.79Å; F36-I41 HydrophobicContact CE1-CD1 3.74Å; F36-I41 HydrophobicContact CE1-CG1 3.68Å; F36-I41 PolarHBondContact O-N 2.87Å; F36-I49 HydrophobicContact CE2-CD1 4.09Å; F36-I49 HydrophobicContact CZ-CD1 4.41Å; F36-W147 HydrophobicContact CD1-CE3 4.1Å; F36-W147 AromaticContact CD1-CZ3 3.56Å; F36-W147 HydrophobicContact CD1-CZ3 3.56Å; F36-W147 HydrophobicContact CD2-CZ3 4.16Å; F36-W147 HydrophobicContact CE1-CH2 4.33Å; F36-W147 AromaticContact CE1-CZ3 3.57Å; F36-W147 HydrophobicContact CE1-CZ3 3.57Å; F36-W147 HydrophobicContact CE2-CH2 4.47Å; F36-W147 HydrophobicContact CE2-CZ3 4.13Å; F36-W147 HydrophobicContact CG-CE3 4.25Å; F36-W147 AromaticContact CG-CZ3 3.86Å; F36-W147 HydrophobicContact CG-CZ3 3.86Å; F36-W147 HydrophobicContact CZ-CH2 4.2Å; F36-W147 AromaticContact CZ-CZ3 3.83Å; F36-W147 HydrophobicContact CZ-CZ3 3.83Å; F36-M148 HydrophobicContact CD1-SD 3.97Å; F36-M148 HydrophobicContact CE1-CE 4.25Å; F36-M148 HydrophobicContact CE1-SD 3.56Å; F36-M148 VanDerWaalsContact CE1-SD 3.56Å; F36-Y265 HydrophobicContact CE1-CD1 4.38Å; F36-Y265 HydrophobicContact CE1-CD2 4.37Å; F36-Y265 HydrophobicContact CE1-CG 4.31Å; F36-Y265 HydrophobicContact CE2-CD1 4.19Å; F36-Y265 HydrophobicContact CE2-CG 4.37Å; F36-Y265 AromaticContact CZ-CD1 3.57Å; F36-Y265 HydrophobicContact CZ-CD1 3.57Å; F36-Y265 AromaticContact CZ-CD2 3.98Å; F36-Y265 HydrophobicContact CZ-CD2 3.98Å; F36-Y265 HydrophobicContact CZ-CE1 4.09Å; F36-Y265 HydrophobicContact CZ-CE2 4.48Å; F36-Y265 AromaticContact CZ-CG 3.51Å; F36-Y265 HydrophobicContact CZ-CG 3.51Å
37	Y	98.7	Very high	98.1	Very high	91 Å²	91	52.7 Å²	52.7	36%	0.357	27%	0.27	S	S	.	.	I	π-helix	trans	-60.9	-46.9	175.9	-161.8	-81.3	0	0	0	111.9	P33 Q35 I41 G42 A151 L152	P33-Y37 PolarHBondContact O-N 3.16Å; Q35-Y37 VanDerWaalsContact C-N 3.34Å; Q35-Y37 PolarHBondContact O-N 3.3Å; Y37-I41 HydrophobicContact CD2-CB 4.22Å; Y37-I41 HydrophobicContact CD2-CD1 3.91Å; Y37-I41 HydrophobicContact CD2-CG2 4.15Å; Y37-I41 HydrophobicContact CE2-CG2 4.05Å; Y37-I41 HydrophobicContact CG-CB 4.42Å; Y37-I41 HydrophobicContact CG-CD1 4.5Å; Y37-I41 PolarHBondContact O-N 2.87Å; Y37-G42 WeakPolarHBondContact O-CA 3.11Å; Y37-G42 PolarHBondContact O-N 3.46Å; Y37-A151 WeakPolarHBondContact CD2-O 3.48Å; Y37-L152 HydrophobicContact CE2-CD2 4.27Å
38	R	98.5	Very high	98.1	Very high	152 Å²	152	50.8 Å²	50.8	57%	0.574	26%	0.26	S	S	*	.	I	π-helix	trans	-67.7	-42.5	-177.7	-175	-171.4	66.6	-148.8	-8	113.2	L34 Q35 F36 P43	L34-R38 WeakPolarHBondContact O-CB 3.39Å; L34-R38 PolarHBondContact O-N 2.99Å; Q35-R38 PolarHBondContact O-N 2.91Å; F36-R38 PolarHBondContact O-N 2.98Å; R38-P43 WeakPolarHBondContact O-CD 3.15Å
39	D	98.2	Very high	98.2	Very high	51 Å²	51	45.1 Å²	45.1	27%	0.273	23%	0.233	S	C	.	.	I	π-helix	trans	-95.1	-20.8	-166.5	-61.2	-16.8	0	0	0	112.7	Q35 P43	Q35-D39 WeakPolarHBondContact CG-OD2 3.31Å; Q35-D39 WeakPolarHBondContact O-CB 3.16Å; Q35-D39 PolarHBondContact O-N 3.46Å; D39-P43 VanDerWaalsContact C-CG 3.47Å; D39-P43 WeakPolarHBondContact O-CG 3.48Å
40	W	98.5	Very high	98.3	Very high	26 Å²	26	48 Å²	48	10%	0.098	24%	0.237	C	C	.	.	I	π-helix	trans	-127.3	-55.1	-174.8	-52.8	96.8	0	0	0	113.7	P25 L27 F36 N44 K45 P46 C47 Y265	P25-W40 HydrophobicContact CB-CH2 3.72Å; P25-W40 HydrophobicContact CB-CZ3 4.29Å; P25-W40 HydrophobicContact CG-CH2 3.73Å; P25-W40 HydrophobicContact CG-CZ3 3.88Å; L27-W40 HydrophobicContact CD1-CZ2 4.34Å; L27-W40 HydrophobicContact CD2-CZ2 3.83Å; L27-W40 HydrophobicContact CG-CZ2 4.23Å; F36-W40 HydrophobicContact CD2-CB 4.06Å; F36-W40 AromaticContact CD2-CD1 3.37Å; F36-W40 AromaticContact CD2-CG 3.91Å; F36-W40 HydrophobicContact CD2-CG 3.91Å; F36-W40 HydrophobicContact CE2-CB 3.82Å; F36-W40 AromaticContact CE2-CD1 3.7Å; F36-W40 AromaticContact CE2-CG 3.81Å; F36-W40 HydrophobicContact CE2-CG 3.81Å; F36-W40 HydrophobicContact CZ-CB 4.21Å; F36-W40 WeakPolarHBondContact O-CB 3.37Å; F36-W40 PolarHBondContact O-N 3.44Å; W40-N44 WeakPolarHBondContact O-CA 3.39Å; W40-N44 PolarHBondContact O-N 3.37Å; W40-K45 HydrophobicContact CE3-CB 3.93Å; W40-K45 HydrophobicContact CZ3-CB 4.33Å; W40-K45 PolarHBondContact O-N 2.82Å; W40-P46 WeakPolarHBondContact CZ3-O 3.34Å; W40-C47 HydrophobicContact CD2-CB 3.95Å; W40-C47 HydrophobicContact CE3-CB 3.57Å; W40-C47 HydrophobicContact CH2-CB 3.77Å; W40-C47 HydrophobicContact CZ2-CB 4.1Å; W40-C47 HydrophobicContact CZ3-CB 3.48Å; W40-C47 VanDerWaalsContact CZ3-CB 3.48Å; W40-Y265 HydrophobicContact CB-CD1 3.91Å; W40-Y265 HydrophobicContact CB-CE1 3.77Å
41	I	98.5	Very high	98.4	Very high	2 Å²	2	49 Å²	49	1%	0.01	24%	0.238	C	C	.	.	I	π-helix	trans	-68.9	-54.3	-175.8	-57.6	171.4	0	0	0	111.5	F36 Y37 N44 M148 A151 L152 Y265 K294	F36-I41 HydrophobicContact CD1-CD1 3.53Å; F36-I41 HydrophobicContact CD1-CG1 3.79Å; F36-I41 HydrophobicContact CE1-CD1 3.74Å; F36-I41 HydrophobicContact CE1-CG1 3.68Å; F36-I41 PolarHBondContact O-N 2.87Å; Y37-I41 HydrophobicContact CD2-CB 4.22Å; Y37-I41 HydrophobicContact CD2-CD1 3.91Å; Y37-I41 HydrophobicContact CD2-CG2 4.15Å; Y37-I41 HydrophobicContact CE2-CG2 4.05Å; Y37-I41 HydrophobicContact CG-CB 4.42Å; Y37-I41 HydrophobicContact CG-CD1 4.5Å; Y37-I41 PolarHBondContact O-N 2.87Å; I41-N44 PolarHBondContact O-N 2.96Å; I41-M148 HydrophobicContact CD1-CE 4.27Å; I41-M148 HydrophobicContact CD1-SD 3.87Å; I41-A151 HydrophobicContact CD1-CB 4.1Å; I41-L152 HydrophobicContact CD1-CD2 3.82Å; I41-L152 HydrophobicContact CD1-CG 4.12Å; I41-L152 HydrophobicContact CG2-CD2 4.03Å; I41-Y265 WeakPolarHBondContact CA-OH 3.04Å; I41-Y265 HydrophobicContact CG1-CE1 4.4Å; I41-K294 PolarHBondContact O-NZ 3.27Å
42	G	98.1	Very high	98.4	Very high	30 Å²	30	48.7 Å²	48.7	31%	0.309	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-59.3	177.8	0	0	0	0	0	112.1	Y37 N44 K294	Y37-G42 WeakPolarHBondContact O-CA 3.11Å; Y37-G42 PolarHBondContact O-N 3.46Å; G42-N44 PolarHBondContact O-N 2.73Å; G42-K294 PolarHBondContact O-NZ 3.08Å; G42-K294 VanDerWaalsContact O-NZ 3.09Å
43	P	97.9	Very high	98.4	Very high	40 Å²	40	42.2 Å²	42.2	26%	0.26	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-0.1	178.5	32.3	-36.6	0	0	0	114.2	Y19 R38 D39 K45	Y19-P43 WeakPolarHBondContact CE2-O 3.47Å; R38-P43 WeakPolarHBondContact O-CD 3.15Å; D39-P43 VanDerWaalsContact C-CG 3.47Å; D39-P43 WeakPolarHBondContact O-CG 3.48Å; P43-K45 HydrophobicContact CB-CD 4.27Å; P43-K45 HydrophobicContact CB-CG 4.23Å; P43-K45 HydrophobicContact CG-CD 4.26Å; P43-K45 HydrophobicContact CG-CG 4.33Å
44	N	98.6	Very high	98.4	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.07	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	58.4	176.9	-171.5	-109.7	0	0	0	113.1	W40 I41 G42 P267 S268 W270 K294	W40-N44 WeakPolarHBondContact O-CA 3.39Å; W40-N44 PolarHBondContact O-N 3.37Å; I41-N44 PolarHBondContact O-N 2.96Å; G42-N44 PolarHBondContact O-N 2.73Å; N44-P267 WeakPolarHBondContact ND2-CB 3.22Å; N44-S268 PolarHBondContact ND2-O 2.8Å; N44-W270 PolarHBondContact O-NE1 3.46Å; N44-W270 VanDerWaalsContact OD1-CD1 3.32Å; N44-W270 PolarHBondContact OD1-NE1 3.19Å; N44-K294 HydrophobicContact CB-CD 4.46Å
45	K	98.5	Very high	98.3	Very high	38 Å²	38	42.9 Å²	42.9	17%	0.165	21%	0.211	C	C	.	.			trans	-119.7	135.1	-177.4	-65.1	179.8	-178.8	-170.4	0	112.2	Y19 W40 P43 Y265 P267	Y19-K45 HydrophobicContact CD2-CG 4.46Å; Y19-K45 WeakPolarHBondContact O-CE 3.43Å; Y19-K45 PolarHBondContact O-NZ 3.43Å; W40-K45 HydrophobicContact CE3-CB 3.93Å; W40-K45 HydrophobicContact CZ3-CB 4.33Å; W40-K45 PolarHBondContact O-N 2.82Å; P43-K45 HydrophobicContact CB-CD 4.27Å; P43-K45 HydrophobicContact CB-CG 4.23Å; P43-K45 HydrophobicContact CG-CD 4.26Å; P43-K45 HydrophobicContact CG-CG 4.33Å; K45-Y265 WeakPolarHBondContact O-CD1 3.47Å; K45-Y265 VanDerWaalsContact O-CE1 3.29Å; K45-Y265 WeakPolarHBondContact O-CE1 3.5Å; K45-P267 WeakPolarHBondContact O-CG 3.29Å
46	P	98.8	Very high	98.3	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.026	19%	0.193	C	C	.	.			trans	-76	151.1	175.7	31	-35.8	0	0	0	111.7	V24 P25 W40 L192 L264 Y265 P267 W270	V24-P46 HydrophobicContact CG1-CB 4.4Å; V24-P46 HydrophobicContact CG2-CG 4.35Å; P25-P46 WeakPolarHBondContact CD-O 3.43Å; W40-P46 WeakPolarHBondContact CZ3-O 3.34Å; P46-L192 HydrophobicContact CB-CD1 4.09Å; P46-L192 HydrophobicContact CG-CD1 4.23Å; P46-L264 HydrophobicContact CB-CD1 4.5Å; P46-Y265 VanDerWaalsContact CA-O 3.26Å; P46-Y265 WeakPolarHBondContact CA-O 3.39Å; P46-Y265 WeakPolarHBondContact CB-O 3.45Å; P46-P267 HydrophobicContact CB-CG 4.31Å; P46-W270 VanDerWaalsContact CD-CH2 3.48Å; P46-W270 HydrophobicContact CG-CE3 4.32Å; P46-W270 HydrophobicContact CG-CH2 3.79Å; P46-W270 HydrophobicContact CG-CZ2 4.09Å; P46-W270 HydrophobicContact CG-CZ3 3.92Å
47	C	98.9	Very high	98.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.4	168.8	61.7	0	0	0	0	111.6	P25 W40 Y265	P25-C47 WeakPolarHBondContact O-CA 3.47Å; W40-C47 HydrophobicContact CD2-CB 3.95Å; W40-C47 HydrophobicContact CE3-CB 3.57Å; W40-C47 HydrophobicContact CH2-CB 3.77Å; W40-C47 HydrophobicContact CZ2-CB 4.1Å; W40-C47 HydrophobicContact CZ3-CB 3.48Å; W40-C47 VanDerWaalsContact CZ3-CB 3.48Å; C47-Y265 PolarHBondContact N-O 3.25Å; C47-Y265 PolarHBondContact O-N 2.98Å
48	I	98.9	Very high	98.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.8	166.4	-68	170.3	0	0	0	108.6	V24 P25 H26 L27 C256 V258 E262 M263 L264	V24-I48 HydrophobicContact CG1-CD1 4.39Å; V24-I48 HydrophobicContact CG1-CG1 4.02Å; P25-I48 PolarHBondContact O-N 2.9Å; H26-I48 CarbonylContact C-O 3.55Å; H26-I48 VanDerWaalsContact CA-O 3.25Å; H26-I48 WeakPolarHBondContact CA-O 3.3Å; L27-I48 PolarHBondContact N-O 3.25Å; I48-C256 HydrophobicContact CD1-CB 4.06Å; I48-V258 HydrophobicContact CD1-CG2 4.32Å; I48-V258 HydrophobicContact CG1-CG2 4.45Å; I48-E262 HydrophobicContact CG2-CB 3.95Å; I48-E262 HydrophobicContact CG2-CG 4.35Å; I48-M263 CarbonylContact C-O 3.6Å; I48-M263 WeakPolarHBondContact CA-O 3.31Å; I48-L264 HydrophobicContact CG1-CD1 4.12Å
49	I	98.8	Very high	98.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	113	-178.4	-47.2	160.2	0	0	0	106.9	L27 G29 F36 A52 W147 M263	L27-I49 HydrophobicContact CB-CG1 4.46Å; L27-I49 HydrophobicContact CB-CG2 4.19Å; L27-I49 HydrophobicContact CD1-CG1 4.23Å; G29-I49 VanDerWaalsContact O-CG2 3.3Å; G29-I49 WeakPolarHBondContact O-CG2 2.97Å; F36-I49 HydrophobicContact CE2-CD1 4.09Å; F36-I49 HydrophobicContact CZ-CD1 4.41Å; I49-A52 HydrophobicContact CB-CB 4.25Å; I49-A52 HydrophobicContact CG2-CB 3.77Å; I49-W147 HydrophobicContact CD1-CH2 3.54Å; I49-W147 HydrophobicContact CD1-CZ2 3.96Å; I49-W147 HydrophobicContact CD1-CZ3 4.49Å; I49-M263 HydrophobicContact CB-CB 4.36Å; I49-M263 HydrophobicContact CD1-SD 4.06Å; I49-M263 PolarHBondContact N-O 3.16Å; I49-M263 PolarHBondContact O-N 3.28Å
50	R	98.6	Very high	98.2	Very high	85 Å²	85	34.9 Å²	34.9	32%	0.321	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	157.4	174	-63	-177.3	171.8	153.7	0.7	110	L27 E28 G29 A52 E262	L27-R50 WeakPolarHBondContact O-CB 3.22Å; L27-R50 PolarHBondContact O-N 3.09Å; E28-R50 CarbonylContact C-O 3.59Å; E28-R50 IonicContact OE1-CZ 2.75Å; E28-R50 IonicContact OE1-NH1 3.96Å; E28-R50 PolarHBondContact OE1-NH1 3.27Å; E28-R50 IonicContact OE2-NH1 3.24Å; G29-R50 WeakPolarHBondContact CA-O 3.07Å; G29-R50 PolarHBondContact N-O 2.99Å; R50-A52 PolarHBondContact O-N 3.43Å; R50-E262 HydrophobicContact CG-CG 4.26Å; R50-E262 IonicContact CZ-OE1 2.75Å; R50-E262 IonicContact NE-OE1 3.92Å; R50-E262 PolarHBondContact NE-OE1 2.86Å; R50-E262 VanDerWaalsContact NE-OE1 3.07Å; R50-E262 IonicContact NH2-OE1 3.79Å
51	N	97.8	Very high	98.2	Very high	92 Å²	92	38.4 Å²	38.4	49%	0.492	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	21.7	174.6	-49.6	-53.9	0	0	0	114.5	E28 S54	E28-N51 PolarHBondContact O-ND2 3.43Å; N51-S54 WeakPolarHBondContact CA-OG 3.41Å
52	A	97.8	Very high	98.2	Very high	8 Å²	8	38.8 Å²	38.8	7%	0.066	21%	0.213	C	C	.	.	S	Bend	trans	-76.8	-24.2	-176.1	0	0	0	0	0	113.1	I49 R50 M263	I49-A52 HydrophobicContact CB-CB 4.25Å; I49-A52 HydrophobicContact CG2-CB 3.77Å; R50-A52 PolarHBondContact O-N 3.43Å; A52-M263 HydrophobicContact CB-CB 4.27Å; A52-M263 HydrophobicContact CB-CE 4.06Å; A52-M263 HydrophobicContact CB-SD 4.18Å
53	F	98.1	Very high	98.1	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	22%	0.215	C	C	.	.	S	Bend	trans	-141.9	28.8	-175.6	60.5	-84.1	0	0	0	112.3	H55 W56 L59 C182 V183 I184 G261 E262 M263	F53-H55 PolarHBondContact O-N 3.36Å; F53-H55 VanDerWaalsContact O-N 3.08Å; F53-W56 HydrophobicContact CB-CD2 3.62Å; F53-W56 HydrophobicContact CB-CE3 3.97Å; F53-W56 HydrophobicContact CB-CG 3.95Å; F53-W56 HydrophobicContact CB-CH2 4.24Å; F53-W56 HydrophobicContact CB-CZ2 3.98Å; F53-W56 HydrophobicContact CB-CZ3 4.26Å; F53-W56 HydrophobicContact CD2-CD2 4.08Å; F53-W56 AromaticContact CD2-CE3 3.67Å; F53-W56 HydrophobicContact CD2-CE3 3.67Å; F53-W56 HydrophobicContact CD2-CZ3 4.06Å; F53-W56 HydrophobicContact CG-CD2 4.23Å; F53-W56 HydrophobicContact CG-CE3 4.08Å; F53-W56 HydrophobicContact CG-CZ3 4.23Å; F53-W56 WeakPolarHBondContact O-CB 3.25Å; F53-W56 PolarHBondContact O-N 3.48Å; F53-L59 HydrophobicContact CD2-CD1 3.9Å; F53-L59 HydrophobicContact CD2-CD2 4.37Å; F53-L59 HydrophobicContact CD2-CG 4.13Å; F53-L59 HydrophobicContact CE2-CD1 4.03Å; F53-L59 HydrophobicContact CE2-CD2 3.74Å; F53-L59 HydrophobicContact CE2-CG 4Å; F53-L59 WeakPolarHBondContact O-CD1 3.48Å; F53-C182 HydrophobicContact CD1-CB 4.37Å; F53-C182 HydrophobicContact CE1-CB 3.93Å; F53-C182 HydrophobicContact CE2-CB 4.31Å; F53-C182 HydrophobicContact CZ-CB 3.88Å; F53-V183 WeakPolarHBondContact CZ-O 3.47Å; F53-I184 HydrophobicContact CD2-CD1 4.33Å; F53-I184 HydrophobicContact CE2-CD1 3.81Å; F53-G261 VanDerWaalsContact CZ-C 3.4Å; F53-E262 WeakPolarHBondContact CE1-O 3.48Å; F53-E262 WeakPolarHBondContact CZ-O 3.22Å; F53-M263 HydrophobicContact CD1-CB 4.19Å; F53-M263 HydrophobicContact CD1-CE 4.02Å; F53-M263 HydrophobicContact CE1-CB 3.84Å
54	S	97.4	Very high	98	Very high	69 Å²	69	40.4 Å²	40.4	48%	0.483	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18	178.7	-59.1	0	0	0	0	113.8	N51 W56	N51-S54 WeakPolarHBondContact CA-OG 3.41Å; S54-W56 VanDerWaalsContact C-N 3.35Å
55	H	97.3	Very high	98	Very high	112 Å²	112	45.9 Å²	45.9	52%	0.519	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-11	176	58.9	-69.1	0	0	0	113.8	F53 P57 E142	F53-H55 PolarHBondContact O-N 3.36Å; F53-H55 VanDerWaalsContact O-N 3.08Å; H55-P57 WeakPolarHBondContact O-CD 3.22Å; H55-E142 IonicContact CD2-OE1 3.16Å; H55-E142 IonicContact CE1-OE2 3.98Å; H55-E142 PolarHBondContact CE1-OE2 3.5Å; H55-E142 IonicContact NE2-OE1 3.85Å; H55-E142 PolarHBondContact NE2-OE1 3.16Å; H55-E142 VanDerWaalsContact NE2-OE1 3.16Å; H55-E142 IonicContact NE2-OE2 2.73Å; H55-E142 PolarHBondContact NE2-OE2 2.88Å
56	W	98.4	Very high	98	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.027	24%	0.24	C	C	.	.			trans	-71.5	124.1	-179.3	-71.6	6.4	0	0	0	111.6	F53 S54 A58 L59 L141 E142 C182 I184 F285	F53-W56 HydrophobicContact CB-CD2 3.62Å; F53-W56 HydrophobicContact CB-CE3 3.97Å; F53-W56 HydrophobicContact CB-CG 3.95Å; F53-W56 HydrophobicContact CB-CH2 4.24Å; F53-W56 HydrophobicContact CB-CZ2 3.98Å; F53-W56 HydrophobicContact CB-CZ3 4.26Å; F53-W56 HydrophobicContact CD2-CD2 4.08Å; F53-W56 AromaticContact CD2-CE3 3.67Å; F53-W56 HydrophobicContact CD2-CE3 3.67Å; F53-W56 HydrophobicContact CD2-CZ3 4.06Å; F53-W56 HydrophobicContact CG-CD2 4.23Å; F53-W56 HydrophobicContact CG-CE3 4.08Å; F53-W56 HydrophobicContact CG-CZ3 4.23Å; F53-W56 WeakPolarHBondContact O-CB 3.25Å; F53-W56 PolarHBondContact O-N 3.48Å; S54-W56 VanDerWaalsContact C-N 3.35Å; W56-A58 HydrophobicContact CB-CB 4.48Å; W56-A58 PolarHBondContact O-N 2.87Å; W56-A58 VanDerWaalsContact O-N 3.12Å; W56-L59 PolarHBondContact O-N 2.77Å; W56-L141 HydrophobicContact CD2-CB 3.54Å; W56-L141 HydrophobicContact CE3-CB 3.51Å; W56-L141 HydrophobicContact CG-CB 4.02Å; W56-L141 HydrophobicContact CH2-CB 4.49Å; W56-L141 HydrophobicContact CZ2-CB 4.48Å; W56-L141 HydrophobicContact CZ3-CB 4.02Å; W56-E142 HydrophobicContact CZ2-CB 4.13Å; W56-E142 PolarHBondContact NE1-OE2 3.23Å; W56-C182 HydrophobicContact CZ3-CB 4.24Å; W56-I184 HydrophobicContact CE3-CD1 4.1Å; W56-I184 HydrophobicContact CZ3-CD1 4.24Å; W56-F285 AromaticContact CH2-CE2 3.49Å; W56-F285 HydrophobicContact CH2-CE2 3.49Å; W56-F285 VanDerWaalsContact CH2-CE2 3.49Å; W56-F285 AromaticContact CH2-CZ 3.46Å; W56-F285 HydrophobicContact CH2-CZ 3.46Å; W56-F285 VanDerWaalsContact CH2-CZ 3.46Å; W56-F285 HydrophobicContact CZ2-CE2 4.34Å; W56-F285 HydrophobicContact CZ2-CZ 4.02Å; W56-F285 HydrophobicContact CZ3-CE2 4.29Å; W56-F285 HydrophobicContact CZ3-CZ 4.35Å
57	P	98.4	Very high	97.9	Very high	51 Å²	51	45.3 Å²	45.3	33%	0.331	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.9	173.1	-27.4	33.3	0	0	0	113.7	H55 L59 S60 R61 D140	H55-P57 WeakPolarHBondContact O-CD 3.22Å; P57-L59 PolarHBondContact O-N 2.97Å; P57-L59 VanDerWaalsContact O-N 3.13Å; P57-S60 PolarHBondContact O-N 2.72Å; P57-S60 PolarHBondContact O-OG 3.08Å; P57-R61 HydrophobicContact CB-CG 4.3Å; P57-R61 WeakPolarHBondContact O-CB 3.41Å; P57-R61 WeakPolarHBondContact O-CG 3.34Å; P57-R61 PolarHBondContact O-N 3.4Å; P57-D140 HydrophobicContact CB-CB 4.31Å; P57-D140 WeakPolarHBondContact CD-O 3.34Å
58	A	98.3	Very high	97.9	Very high	1 Å²	1	49 Å²	49	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-48.4	-40	179.7	0	0	0	0	0	113.8	W56 S60 R61 W62 D140 I184	W56-A58 HydrophobicContact CB-CB 4.48Å; W56-A58 PolarHBondContact O-N 2.87Å; W56-A58 VanDerWaalsContact O-N 3.12Å; A58-S60 PolarHBondContact O-N 3.01Å; A58-S60 VanDerWaalsContact O-N 3.14Å; A58-R61 PolarHBondContact O-N 3.11Å; A58-W62 HydrophobicContact CB-CD2 3.7Å; A58-W62 HydrophobicContact CB-CE3 4.22Å; A58-W62 HydrophobicContact CB-CG 4Å; A58-W62 HydrophobicContact CB-CZ2 4Å; A58-W62 WeakPolarHBondContact O-CB 3.33Å; A58-W62 PolarHBondContact O-N 2.96Å; A58-D140 HydrophobicContact CB-CB 4.15Å; A58-D140 WeakPolarHBondContact CB-O 3.47Å; A58-D140 PolarHBondContact N-O 2.82Å; A58-I184 HydrophobicContact CB-CD1 4.45Å; A58-I184 HydrophobicContact CB-CG2 4.09Å; A58-I184 WeakPolarHBondContact O-CG2 3.42Å
59	L	97.9	Very high	97.8	Very high	56 Å²	56	57.1 Å²	57.1	29%	0.293	29%	0.29	S	S	.	.	H	α-helix	trans	-59.5	-27.5	-179.8	-78.5	173.6	0	0	0	114	F53 W56 P57 I184	F53-L59 HydrophobicContact CD2-CD1 3.9Å; F53-L59 HydrophobicContact CD2-CD2 4.37Å; F53-L59 HydrophobicContact CD2-CG 4.13Å; F53-L59 HydrophobicContact CE2-CD1 4.03Å; F53-L59 HydrophobicContact CE2-CD2 3.74Å; F53-L59 HydrophobicContact CE2-CG 4Å; F53-L59 WeakPolarHBondContact O-CD1 3.48Å; W56-L59 PolarHBondContact O-N 2.77Å; P57-L59 PolarHBondContact O-N 2.97Å; P57-L59 VanDerWaalsContact O-N 3.13Å; L59-I184 HydrophobicContact CD2-CG2 4.46Å
60	S	97.3	Very high	97.8	Very high	97 Å²	97	60.7 Å²	60.7	68%	0.678	31%	0.306	S	S	*	.	H	α-helix	trans	-106.5	-27.4	178.9	64.7	0	0	0	0	113.2	P57 A58	P57-S60 PolarHBondContact O-N 2.72Å; P57-S60 PolarHBondContact O-OG 3.08Å; A58-S60 PolarHBondContact O-N 3.01Å; A58-S60 VanDerWaalsContact O-N 3.14Å
61	R	97.8	Very high	97.7	Very high	100 Å²	100	56.7 Å²	56.7	38%	0.377	29%	0.291	S	S	.	.	H	α-helix	trans	-93.4	-31.2	-171.3	-68	-177.9	72.8	172.4	13.3	113.7	P57 A58 T63 Y66 D140	P57-R61 HydrophobicContact CB-CG 4.3Å; P57-R61 WeakPolarHBondContact O-CB 3.41Å; P57-R61 WeakPolarHBondContact O-CG 3.34Å; P57-R61 PolarHBondContact O-N 3.4Å; A58-R61 PolarHBondContact O-N 3.11Å; R61-T63 PolarHBondContact O-N 3.11Å; R61-Y66 HydrophobicContact CB-CD1 4.2Å; R61-Y66 HydrophobicContact CB-CE1 4.12Å; R61-Y66 HydrophobicContact CB-CG 4.48Å; R61-Y66 PolarHBondContact NE-OH 2.93Å; R61-Y66 VanDerWaalsContact NH2-CE2 3.3Å; R61-Y66 PolarHBondContact NH2-OH 3Å; R61-Y66 VanDerWaalsContact NH2-OH 3.16Å; R61-Y66 WeakPolarHBondContact O-CB 3.46Å; R61-Y66 WeakPolarHBondContact O-CD1 3.46Å; R61-D140 WeakPolarHBondContact CD-OD1 3.4Å; R61-D140 IonicContact CZ-OD1 3.84Å; R61-D140 VanDerWaalsContact CZ-OD1 3.29Å; R61-D140 IonicContact NE-OD1 3.07Å; R61-D140 IonicContact NH1-OD1 2.97Å; R61-D140 PolarHBondContact NH1-OD1 3.31Å
62	W	98	Very high	97.7	Very high	10 Å²	10	52.5 Å²	52.5	4%	0.038	27%	0.269	C	S	.	.			trans	-78.5	63.4	-171.2	-70.4	10.2	0	0	0	112.5	A58 Y66 L67 L130 L137 D140 L141 F161 I184 I281 V283	A58-W62 HydrophobicContact CB-CD2 3.7Å; A58-W62 HydrophobicContact CB-CE3 4.22Å; A58-W62 HydrophobicContact CB-CG 4Å; A58-W62 HydrophobicContact CB-CZ2 4Å; A58-W62 WeakPolarHBondContact O-CB 3.33Å; A58-W62 PolarHBondContact O-N 2.96Å; W62-Y66 AromaticContact CD1-CD1 3.98Å; W62-Y66 AromaticContact CD1-CE1 3.73Å; W62-L67 HydrophobicContact CB-CD2 4.4Å; W62-L67 HydrophobicContact CD2-CD2 4.46Å; W62-L67 HydrophobicContact CG-CD2 4.15Å; W62-L130 HydrophobicContact CH2-CD1 4.4Å; W62-L137 HydrophobicContact CH2-CD1 4.19Å; W62-L137 HydrophobicContact CZ2-CB 3.83Å; W62-L137 HydrophobicContact CZ2-CD1 3.93Å; W62-L137 HydrophobicContact CZ2-CG 4.33Å; W62-D140 HydrophobicContact CZ2-CB 4.41Å; W62-D140 PolarHBondContact NE1-OD2 3.24Å; W62-D140 VanDerWaalsContact NE1-OD2 3.11Å; W62-L141 HydrophobicContact CH2-CD2 3.43Å; W62-L141 VanDerWaalsContact CH2-CD2 3.43Å; W62-L141 HydrophobicContact CZ2-CD2 3.59Å; W62-L141 HydrophobicContact CZ3-CD2 4.45Å; W62-F161 AromaticContact CE3-CE2 3.99Å; W62-F161 HydrophobicContact CE3-CE2 3.99Å; W62-F161 AromaticContact CH2-CD2 3.89Å; W62-F161 HydrophobicContact CH2-CD2 3.89Å; W62-F161 HydrophobicContact CH2-CE2 4.01Å; W62-F161 AromaticContact CZ3-CD2 3.69Å; W62-F161 HydrophobicContact CZ3-CD2 3.69Å; W62-F161 AromaticContact CZ3-CE2 3.48Å; W62-F161 HydrophobicContact CZ3-CE2 3.48Å; W62-F161 VanDerWaalsContact CZ3-CE2 3.48Å; W62-I184 HydrophobicContact CB-CG2 4.22Å; W62-I184 HydrophobicContact CD2-CG2 4.31Å; W62-I184 HydrophobicContact CE3-CB 4.2Å; W62-I184 HydrophobicContact CE3-CG1 4.03Å; W62-I184 HydrophobicContact CE3-CG2 3.83Å; W62-I184 HydrophobicContact CG-CG2 4.49Å; W62-I184 HydrophobicContact CZ3-CG1 3.99Å; W62-I281 HydrophobicContact CB-CD1 4.43Å; W62-I281 HydrophobicContact CE3-CG2 3.54Å; W62-I281 HydrophobicContact CZ3-CG2 3.8Å; W62-I281 WeakPolarHBondContact O-CD1 3.36Å; W62-V283 HydrophobicContact CH2-CG2 3.62Å; W62-V283 HydrophobicContact CZ3-CG2 3.58Å
63	T	97.3	Very high	97.7	Very high	57 Å²	57	57.3 Å²	57.3	35%	0.35	30%	0.303	S	S	.	.			trans	-88	160.1	166.2	80.9	0	0	0	0	109.9	R61 E65 Y66 L67	R61-T63 PolarHBondContact O-N 3.11Å; T63-E65 VanDerWaalsContact CB-OE2 3.29Å; T63-E65 WeakPolarHBondContact CB-OE2 3.44Å; T63-E65 PolarHBondContact O-N 2.87Å; T63-E65 PolarHBondContact OG1-N 3.03Å; T63-E65 PolarHBondContact OG1-OE2 3.02Å; T63-Y66 PolarHBondContact O-N 2.9Å; T63-Y66 PolarHBondContact OG1-N 2.84Å; T63-L67 WeakPolarHBondContact O-CG 3.05Å; T63-L67 PolarHBondContact O-N 3.15Å
64	P	96.3	Very high	97.6	Very high	47 Å²	47	60.5 Å²	60.5	31%	0.305	32%	0.316	S	S	.	.	H	α-helix	trans	-54.7	-39.2	175.4	-26.1	35.3	0	0	0	113.3	L67 R68 E112	P64-L67 PolarHBondContact O-N 3.39Å; P64-R68 WeakPolarHBondContact O-CB 3.3Å; P64-R68 PolarHBondContact O-N 3.17Å; P64-E112 WeakPolarHBondContact CB-OE1 3.26Å
65	E	97.4	Very high	97.5	Very high	127 Å²	127	62.2 Å²	62.2	59%	0.593	32%	0.318	S	S	*	.	H	α-helix	trans	-64.2	-46.5	179.1	-58.3	76.2	-166.9	0	0	111.7	T63 R68 E69	T63-E65 VanDerWaalsContact CB-OE2 3.29Å; T63-E65 WeakPolarHBondContact CB-OE2 3.44Å; T63-E65 PolarHBondContact O-N 2.87Å; T63-E65 PolarHBondContact OG1-N 3.03Å; T63-E65 PolarHBondContact OG1-OE2 3.02Å; E65-R68 PolarHBondContact O-N 2.86Å; E65-E69 WeakPolarHBondContact O-CB 3.36Å; E65-E69 PolarHBondContact O-N 2.86Å
66	Y	98.2	Very high	97.5	Very high	31 Å²	31	57 Å²	57	12%	0.122	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-46.2	177.6	173.6	-103.7	0	0	0	111.5	R61 W62 T63 R68 E69 K70 L137 D140	R61-Y66 HydrophobicContact CB-CD1 4.2Å; R61-Y66 HydrophobicContact CB-CE1 4.12Å; R61-Y66 HydrophobicContact CB-CG 4.48Å; R61-Y66 PolarHBondContact NE-OH 2.93Å; R61-Y66 VanDerWaalsContact NH2-CE2 3.3Å; R61-Y66 PolarHBondContact NH2-OH 3Å; R61-Y66 VanDerWaalsContact NH2-OH 3.16Å; R61-Y66 WeakPolarHBondContact O-CB 3.46Å; R61-Y66 WeakPolarHBondContact O-CD1 3.46Å; W62-Y66 AromaticContact CD1-CD1 3.98Å; W62-Y66 AromaticContact CD1-CE1 3.73Å; T63-Y66 PolarHBondContact O-N 2.9Å; T63-Y66 PolarHBondContact OG1-N 2.84Å; Y66-R68 VanDerWaalsContact C-N 3.3Å; Y66-R68 PolarHBondContact O-N 3.38Å; Y66-E69 PolarHBondContact O-N 2.83Å; Y66-K70 HydrophobicContact CE1-CB 4.38Å; Y66-K70 HydrophobicContact CE1-CG 4.41Å; Y66-K70 HydrophobicContact CE2-CB 4.4Å; Y66-K70 HydrophobicContact CE2-CD 4.17Å; Y66-K70 WeakPolarHBondContact O-CB 3.33Å; Y66-K70 PolarHBondContact O-N 3.18Å; Y66-L137 HydrophobicContact CE1-CD2 4.4Å; Y66-D140 VanDerWaalsContact CE1-OD2 3.26Å; Y66-D140 WeakPolarHBondContact CE1-OD2 3.4Å; Y66-D140 PolarHBondContact OH-OD1 3.32Å; Y66-D140 PolarHBondContact OH-OD2 2.95Å
67	L	98.1	Very high	97.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-38.2	179.4	-66	175.1	0	0	0	111.1	W62 T63 P64 K70 I71 G72 F104 L108 L137 I281	W62-L67 HydrophobicContact CB-CD2 4.4Å; W62-L67 HydrophobicContact CD2-CD2 4.46Å; W62-L67 HydrophobicContact CG-CD2 4.15Å; T63-L67 WeakPolarHBondContact O-CG 3.05Å; T63-L67 PolarHBondContact O-N 3.15Å; P64-L67 PolarHBondContact O-N 3.39Å; L67-K70 PolarHBondContact O-N 2.81Å; L67-I71 HydrophobicContact CB-CG1 4.44Å; L67-I71 HydrophobicContact CD2-CD1 4.23Å; L67-I71 CarbonylContact O-C 3.6Å; L67-I71 WeakPolarHBondContact O-CG1 3.25Å; L67-I71 PolarHBondContact O-N 3.26Å; L67-G72 PolarHBondContact O-N 2.89Å; L67-G72 VanDerWaalsContact O-N 3.16Å; L67-F104 HydrophobicContact CB-CD1 4.43Å; L67-F104 HydrophobicContact CB-CE1 3.73Å; L67-F104 HydrophobicContact CB-CZ 4.39Å; L67-F104 HydrophobicContact CD1-CE1 4.11Å; L67-F104 HydrophobicContact CD1-CZ 4.14Å; L67-F104 HydrophobicContact CG-CE1 4.45Å; L67-L108 HydrophobicContact CB-CD1 4.33Å; L67-L137 HydrophobicContact CD2-CD1 4.13Å; L67-L137 HydrophobicContact CD2-CD2 3.83Å; L67-I281 HydrophobicContact CD1-CD1 3.82Å
68	R	97.5	Very high	97.3	Very high	76 Å²	76	54.4 Å²	54.4	29%	0.287	28%	0.278	S	S	.	.	H	α-helix	trans	-63.3	-43.3	174.5	-170.5	-179.7	-65.2	-86.5	7.7	111.9	P64 E65 Y66 G72 S105 L108 D109 E112	P64-R68 WeakPolarHBondContact O-CB 3.3Å; P64-R68 PolarHBondContact O-N 3.17Å; E65-R68 PolarHBondContact O-N 2.86Å; Y66-R68 VanDerWaalsContact C-N 3.3Å; Y66-R68 PolarHBondContact O-N 3.38Å; R68-G72 WeakPolarHBondContact O-CA 3.15Å; R68-G72 PolarHBondContact O-N 2.99Å; R68-G72 VanDerWaalsContact O-N 3.08Å; R68-S105 PolarHBondContact NH1-O 2.87Å; R68-L108 HydrophobicContact CB-CD1 3.98Å; R68-D109 IonicContact CZ-OD1 3.53Å; R68-D109 IonicContact NH1-OD1 3.23Å; R68-D109 PolarHBondContact NH1-OD1 3.46Å; R68-D109 IonicContact NH1-OD2 3.53Å; R68-D109 IonicContact NH2-OD1 3.92Å; R68-D109 PolarHBondContact NH2-OD1 2.92Å; R68-E112 IonicContact CZ-OE2 3.24Å; R68-E112 IonicContact NH2-OE2 2.8Å; R68-E112 PolarHBondContact NH2-OE2 3.4Å
69	E	97.9	Very high	97.3	Very high	172 Å²	172	54.7 Å²	54.7	80%	0.804	28%	0.281	S	S	*	.	H	α-helix	trans	-66.3	-46.3	175.7	-174.6	-175.2	165.6	0	0	111.8	E65 Y66	E65-E69 WeakPolarHBondContact O-CB 3.36Å; E65-E69 PolarHBondContact O-N 2.86Å; Y66-E69 PolarHBondContact O-N 2.83Å
70	K	97.6	Very high	97.3	Very high	76 Å²	76	52 Å²	52	33%	0.33	27%	0.267	S	S	.	.	H	α-helix	trans	-76.7	-45.9	-170.4	-170.4	82.9	177.3	-156.7	0	113.1	Y66 L67 E136 L137	Y66-K70 HydrophobicContact CE1-CB 4.38Å; Y66-K70 HydrophobicContact CE1-CG 4.41Å; Y66-K70 HydrophobicContact CE2-CB 4.4Å; Y66-K70 HydrophobicContact CE2-CD 4.17Å; Y66-K70 WeakPolarHBondContact O-CB 3.33Å; Y66-K70 PolarHBondContact O-N 3.18Å; L67-K70 PolarHBondContact O-N 2.81Å; K70-E136 WeakPolarHBondContact CE-O 3.38Å; K70-E136 HydrophobicContact CG-CB 4.41Å; K70-L137 HydrophobicContact CG-CD2 4.19Å
71	I	97.4	Very high	97.3	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-132.3	9.2	-171.4	58.9	166	0	0	0	113.2	L67 S73 K74 F104 L134 E136 L137	L67-I71 HydrophobicContact CB-CG1 4.44Å; L67-I71 HydrophobicContact CD2-CD1 4.23Å; L67-I71 CarbonylContact O-C 3.6Å; L67-I71 WeakPolarHBondContact O-CG1 3.25Å; L67-I71 PolarHBondContact O-N 3.26Å; I71-S73 PolarHBondContact O-N 3.06Å; I71-K74 HydrophobicContact CB-CG 4.03Å; I71-K74 HydrophobicContact CG2-CG 4.41Å; I71-K74 VanDerWaalsContact O-CB 3.26Å; I71-K74 WeakPolarHBondContact O-CB 3.45Å; I71-K74 WeakPolarHBondContact O-CG 3.35Å; I71-K74 PolarHBondContact O-N 3.3Å; I71-F104 HydrophobicContact CD1-CD1 4.06Å; I71-F104 HydrophobicContact CD1-CD2 3.51Å; I71-F104 HydrophobicContact CD1-CE1 4.01Å; I71-F104 HydrophobicContact CD1-CE2 3.47Å; I71-F104 VanDerWaalsContact CD1-CE2 3.47Å; I71-F104 HydrophobicContact CD1-CG 3.83Å; I71-F104 HydrophobicContact CD1-CZ 3.73Å; I71-F104 HydrophobicContact CG1-CD1 4.1Å; I71-F104 HydrophobicContact CG1-CD2 4.22Å; I71-F104 HydrophobicContact CG1-CE1 4.36Å; I71-F104 HydrophobicContact CG1-CE2 4.49Å; I71-F104 HydrophobicContact CG1-CG 4.04Å; I71-F104 VanDerWaalsContact O-CB 3.31Å; I71-F104 WeakPolarHBondContact O-CB 3.29Å; I71-L134 HydrophobicContact CB-CD2 4.4Å; I71-L134 HydrophobicContact CD1-CD1 4.33Å; I71-L134 HydrophobicContact CD1-CD2 3.66Å; I71-E136 HydrophobicContact CG2-CB 3.88Å; I71-L137 HydrophobicContact CD1-CD1 3.73Å; I71-L137 HydrophobicContact CD1-CD2 4.22Å; I71-L137 HydrophobicContact CD1-CG 4.08Å; I71-L137 HydrophobicContact CG2-CD2 4.16Å; I71-L137 HydrophobicContact CG2-CG 4.21Å
72	G	97.3	Very high	97.3	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.031	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.2	-172.5	0	0	0	0	0	115.4	L67 R68 F104 S105	L67-G72 PolarHBondContact O-N 2.89Å; L67-G72 VanDerWaalsContact O-N 3.16Å; R68-G72 WeakPolarHBondContact O-CA 3.15Å; R68-G72 PolarHBondContact O-N 2.99Å; R68-G72 VanDerWaalsContact O-N 3.08Å; G72-F104 PolarHBondContact O-N 2.8Å; G72-S105 WeakPolarHBondContact CA-OG 3.17Å; G72-S105 WeakPolarHBondContact O-CB 3.25Å; G72-S105 PolarHBondContact O-N 3.09Å; G72-S105 PolarHBondContact O-OG 3.36Å
73	S	97.1	Very high	97.2	Very high	110 Å²	110	48.8 Å²	48.8	77%	0.769	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.8	179.1	65.2	0	0	0	0	114.1	I71	I71-S73 PolarHBondContact O-N 3.06Å
74	K	96.6	Very high	97.1	Very high	67 Å²	67	46.2 Å²	46.2	29%	0.291	24%	0.237	S	C	.	.			trans	-71.3	131.6	-178.4	-70.1	-71	-174.7	160.5	0	110.6	I71 S103 F104 E136	I71-K74 HydrophobicContact CB-CG 4.03Å; I71-K74 HydrophobicContact CG2-CG 4.41Å; I71-K74 VanDerWaalsContact O-CB 3.26Å; I71-K74 WeakPolarHBondContact O-CB 3.45Å; I71-K74 WeakPolarHBondContact O-CG 3.35Å; I71-K74 PolarHBondContact O-N 3.3Å; K74-S103 CarbonylContact O-C 3.55Å; K74-S103 VanDerWaalsContact O-CA 3.25Å; K74-S103 WeakPolarHBondContact O-CA 3.41Å; K74-F104 PolarHBondContact O-N 2.94Å; K74-E136 WeakPolarHBondContact CE-OE1 3.25Å; K74-E136 VanDerWaalsContact CE-OE2 3.32Å; K74-E136 WeakPolarHBondContact CE-OE2 3.38Å; K74-E136 IonicContact NZ-OE1 3.93Å; K74-E136 PolarHBondContact NZ-OE1 2.67Å; K74-E136 IonicContact NZ-OE2 3.93Å; K74-E136 PolarHBondContact NZ-OE2 3.44Å
75	M	96.6	Very high	97.2	Very high	106 Å²	106	47 Å²	47	52%	0.522	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	123.7	170	-63	-59.1	-63.7	0	0	108.6	Q101 M102	M75-Q101 VanDerWaalsContact CE-C 3.46Å; M75-Q101 HydrophobicContact CE-CB 4Å; M75-Q101 WeakPolarHBondContact CE-O 3.42Å; M75-M102 WeakPolarHBondContact CA-O 3.37Å
76	I	95.6	Very high	97	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	157.3	-177.6	51.7	158.2	0	0	0	110.2	V78 Q101 M102 F104 V107 I123 E133 L134	I76-V78 HydrophobicContact CD1-CG2 4.09Å; I76-V78 HydrophobicContact CG1-CG2 4.13Å; I76-Q101 WeakPolarHBondContact O-CA 3.43Å; I76-M102 WeakPolarHBondContact CG1-O 3.31Å; I76-M102 PolarHBondContact N-O 3.04Å; I76-M102 PolarHBondContact O-N 2.8Å; I76-F104 HydrophobicContact CD1-CD2 3.66Å; I76-F104 HydrophobicContact CD1-CE2 4.26Å; I76-F104 HydrophobicContact CD1-CG 4.47Å; I76-V107 HydrophobicContact CD1-CG2 4.44Å; I76-I123 HydrophobicContact CD1-CD1 3.26Å; I76-I123 HydrophobicContact CD1-CG1 3.68Å; I76-I123 HydrophobicContact CD1-CG2 4.29Å; I76-E133 HydrophobicContact CG2-CB 4.3Å; I76-L134 HydrophobicContact CG2-CD2 3.81Å; I76-L134 HydrophobicContact CG2-CG 4.43Å
77	S	96.3	Very high	96.9	Very high	4 Å²	4	41.9 Å²	41.9	3%	0.028	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127.1	171.2	-159	0	0	0	0	110.7	E99 E133	S77-E99 PolarHBondContact OG-OE2 3.23Å; S77-E133 PolarHBondContact N-OE2 2.98Å
78	V	97.4	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127	178.8	-172.8	0	0	0	0	108.6	I76 V80 R100 M102 V107 F121 I123	I76-V78 HydrophobicContact CD1-CG2 4.09Å; I76-V78 HydrophobicContact CG1-CG2 4.13Å; V78-V80 HydrophobicContact CG1-CG2 4.47Å; V78-R100 PolarHBondContact N-O 3.02Å; V78-R100 PolarHBondContact O-N 2.76Å; V78-M102 HydrophobicContact CB-CG 4.48Å; V78-M102 HydrophobicContact CB-SD 4.06Å; V78-M102 HydrophobicContact CG1-SD 4.25Å; V78-M102 HydrophobicContact CG2-CB 3.89Å; V78-M102 HydrophobicContact CG2-CG 4.21Å; V78-M102 HydrophobicContact CG2-SD 4.16Å; V78-V107 HydrophobicContact CG1-CG2 4.47Å; V78-V107 HydrophobicContact CG2-CG2 3.57Å; V78-F121 HydrophobicContact CG1-CB 4.27Å; V78-F121 HydrophobicContact CG1-CD1 4.08Å; V78-I123 HydrophobicContact CG2-CG1 4.28Å
79	A	97.9	Very high	96.9	Very high	8 Å²	8	40.5 Å²	40.5	7%	0.066	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	130.5	171.3	0	0	0	0	0	109.4	P97 Y122 Q124	A79-P97 HydrophobicContact CB-CB 3.68Å; A79-P97 HydrophobicContact CB-CG 3.78Å; A79-Y122 WeakPolarHBondContact CB-O 3.4Å; A79-Y122 PolarHBondContact N-O 3.14Å; A79-Y122 PolarHBondContact O-N 2.78Å; A79-Q124 HydrophobicContact CB-CG 3.56Å
80	V	97.9	Very high	96.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.3	176.3	-168.9	0	0	0	0	109.3	V78 E98 R100 V120 F121 F219	V78-V80 HydrophobicContact CG1-CG2 4.47Å; V80-E98 PolarHBondContact N-O 3.22Å; V80-E98 PolarHBondContact O-N 2.79Å; V80-R100 HydrophobicContact CG2-CG 4.08Å; V80-V120 WeakPolarHBondContact CA-O 2.93Å; V80-F121 HydrophobicContact CG1-CD1 4.44Å; V80-F121 HydrophobicContact CG1-CE1 4.05Å; V80-F121 HydrophobicContact CG1-CE2 4.36Å; V80-F121 HydrophobicContact CG1-CZ 3.99Å; V80-F121 HydrophobicContact CG2-CD1 3.67Å; V80-F121 HydrophobicContact CG2-CE1 3.6Å; V80-F121 HydrophobicContact CG2-CG 4.5Å; V80-F121 HydrophobicContact CG2-CZ 4.37Å; V80-F219 HydrophobicContact CG1-CE1 4.13Å; V80-F219 HydrophobicContact CG1-CZ 3.78Å
81	T	97.8	Very high	96.5	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.9	179	58.4	0	0	0	0	110.4	N83 G84 A86 P97 G119 V120 Y211	T81-N83 VanDerWaalsContact C-N 3.28Å; T81-N83 PolarHBondContact O-N 3.19Å; T81-G84 WeakPolarHBondContact OG1-CA 3.26Å; T81-G84 PolarHBondContact OG1-N 2.74Å; T81-A86 HydrophobicContact CG2-CB 3.96Å; T81-P97 HydrophobicContact CG2-CB 3.7Å; T81-G119 CarbonylContact O-C 3.53Å; T81-G119 WeakPolarHBondContact O-CA 3.26Å; T81-V120 PolarHBondContact N-O 3.01Å; T81-V120 VanDerWaalsContact N-O 3.11Å; T81-V120 PolarHBondContact O-N 2.73Å; T81-Y211 HydrophobicContact CG2-CD2 4.19Å; T81-Y211 HydrophobicContact CG2-CE2 4.45Å
82	P	97	Very high	96.4	Very high	52 Å²	52	38.8 Å²	38.8	34%	0.338	24%	0.238	S	C	.	.	S	Bend	trans	-69.4	-25.5	178.2	25.4	-33.1	0	0	0	113.7	Y211 F219	P82-Y211 HydrophobicContact CG-CD1 3.88Å; P82-Y211 HydrophobicContact CG-CD2 4.49Å; P82-Y211 HydrophobicContact CG-CE1 3.54Å; P82-Y211 HydrophobicContact CG-CE2 4.19Å; P82-Y211 HydrophobicContact CG-CG 4.35Å; P82-F219 HydrophobicContact CB-CB 3.94Å; P82-F219 HydrophobicContact CB-CD2 3.75Å; P82-F219 HydrophobicContact CB-CE2 4.44Å; P82-F219 HydrophobicContact CB-CG 3.86Å; P82-F219 HydrophobicContact CG-CB 4.04Å; P82-F219 HydrophobicContact CG-CG 4.2Å
83	N	95.4	Very high	96.3	Very high	82 Å²	82	41.4 Å²	41.4	44%	0.439	25%	0.246	S	C	.	.	S	Bend	trans	-131.5	-0.3	-167.3	62	-1.6	0	0	0	113.9	T81 Y85	T81-N83 VanDerWaalsContact C-N 3.28Å; T81-N83 PolarHBondContact O-N 3.19Å; N83-Y85 PolarHBondContact OD1-N 3.01Å; N83-Y85 VanDerWaalsContact OD1-N 3.09Å
84	G	96.9	Very high	96.4	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.021	21%	0.212	C	C	.	.	S	Bend	trans	91.3	-7.9	-178.9	0	0	0	0	0	115.8	T81 A86 N167 A168 V169	T81-G84 WeakPolarHBondContact OG1-CA 3.26Å; T81-G84 PolarHBondContact OG1-N 2.74Å; G84-A86 PolarHBondContact O-N 2.9Å; G84-N167 VanDerWaalsContact CA-O 3.27Å; G84-N167 WeakPolarHBondContact CA-O 3.34Å; G84-A168 WeakPolarHBondContact O-CA 3.46Å; G84-V169 PolarHBondContact O-N 3.17Å
85	Y	96.7	Very high	96.4	Very high	64 Å²	64	33.6 Å²	33.6	25%	0.251	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	96.4	-179	-73.6	-103	0	0	0	110.4	N83 A88 V169 D236	N83-Y85 PolarHBondContact OD1-N 3.01Å; N83-Y85 VanDerWaalsContact OD1-N 3.09Å; Y85-A88 HydrophobicContact CD1-CB 4.49Å; Y85-V169 HydrophobicContact CD1-CB 4.19Å; Y85-V169 HydrophobicContact CD1-CG1 4.13Å; Y85-V169 HydrophobicContact CE1-CB 4.08Å; Y85-V169 HydrophobicContact CE1-CG1 3.75Å; Y85-V169 HydrophobicContact CE2-CB 4.41Å; Y85-V169 HydrophobicContact CE2-CG2 4.37Å; Y85-V169 HydrophobicContact CG-CB 4.45Å; Y85-D236 PolarHBondContact OH-OD2 2.99Å; Y85-D236 VanDerWaalsContact OH-OD2 3.05Å
86	A	93.9	Very high	96.5	Very high	6 Å²	6	31.2 Å²	31.2	5%	0.05	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	148.6	167.9	0	0	0	0	0	110.1	T81 G84 A88 P97 Q124	T81-A86 HydrophobicContact CG2-CB 3.96Å; G84-A86 PolarHBondContact O-N 2.9Å; A86-A88 PolarHBondContact O-N 3.34Å; A86-P97 HydrophobicContact CB-CB 3.97Å; A86-P97 HydrophobicContact CB-CG 3.94Å; A86-Q124 VanDerWaalsContact CB-NE2 3.29Å
87	D	96.3	Very high	96.6	Very high	44 Å²	44	31.7 Å²	31.7	24%	0.235	19%	0.19	C	C	.	.	S	Bend	trans	51.6	57.5	175.3	-55.3	-55.7	0	0	0	111.3	F94 V95 S171 W232	D87-F94 HydrophobicContact CB-CE2 4Å; D87-F94 HydrophobicContact CB-CZ 3.8Å; D87-V95 WeakPolarHBondContact CA-O 3.27Å; D87-V95 PolarHBondContact N-O 3.32Å; D87-S171 PolarHBondContact O-OG 3.44Å; D87-W232 HydrophobicContact CB-CZ2 4.33Å; D87-W232 WeakPolarHBondContact O-CZ2 3.43Å; D87-W232 PolarHBondContact O-NE1 2.84Å; D87-W232 VanDerWaalsContact O-NE1 3.17Å
88	A	97.4	Very high	96.6	Very high	11 Å²	11	33.2 Å²	33.2	9%	0.091	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	159.1	-172.9	0	0	0	0	0	111.8	Y85 A86 A90 V95	Y85-A88 HydrophobicContact CD1-CB 4.49Å; A86-A88 PolarHBondContact O-N 3.34Å; A88-A90 PolarHBondContact O-N 2.82Å; A88-V95 PolarHBondContact N-O 2.82Å; A88-V95 PolarHBondContact O-N 2.98Å
89	V	97.1	Very high	96.5	Very high	37 Å²	37	39.3 Å²	39.3	22%	0.224	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123	172.8	177.7	0	0	0	0	109.5	R93 Y206 W232 P234	V89-R93 CarbonylContact C-O 3.47Å; V89-R93 VanDerWaalsContact CA-O 3.29Å; V89-R93 WeakPolarHBondContact CA-O 3.42Å; V89-Y206 HydrophobicContact CG1-CD1 3.92Å; V89-Y206 HydrophobicContact CG1-CE1 3.59Å; V89-Y206 HydrophobicContact CG1-CE2 4.35Å; V89-Y206 HydrophobicContact CG1-CG 4.45Å; V89-Y206 HydrophobicContact CG2-CD1 4.4Å; V89-Y206 HydrophobicContact CG2-CD2 3.71Å; V89-Y206 HydrophobicContact CG2-CE1 4.31Å; V89-Y206 HydrophobicContact CG2-CE2 3.59Å; V89-Y206 HydrophobicContact CG2-CG 4.14Å; V89-W232 HydrophobicContact CG2-CB 4.03Å; V89-W232 HydrophobicContact CG2-CG 4.35Å; V89-P234 HydrophobicContact CB-CB 4.33Å; V89-P234 HydrophobicContact CG1-CB 4.21Å; V89-P234 HydrophobicContact CG2-CB 4.23Å
90	A	95.1	Very high	96.4	Very high	38 Å²	38	41.1 Å²	41.1	31%	0.314	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	108.1	171.2	0	0	0	0	0	109.2	A88 D92 R93 V95	A88-A90 PolarHBondContact O-N 2.82Å; A90-D92 PolarHBondContact O-N 3.16Å; A90-R93 PolarHBondContact N-O 3.27Å; A90-R93 PolarHBondContact O-N 2.77Å; A90-V95 HydrophobicContact CB-CG2 3.77Å
91	G	93.1	Very high	96.4	Very high	70 Å²	70	46.5 Å²	46.5	72%	0.722	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	-114.5	-173.3	0	0	0	0	0	111.8
92	D	94.1	Very high	96.4	Very high	105 Å²	105	47.7 Å²	47.7	56%	0.561	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	13.9	178.8	73.8	-39.3	0	0	0	113.2	A90	A90-D92 PolarHBondContact O-N 3.16Å
93	R	97	Very high	96.4	Very high	58 Å²	58	46.4 Å²	46.4	22%	0.219	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	150.2	-179.1	-63.5	-60.6	-172.9	-115.4	7	112	V89 A90 V95 Q207 A209 V221 D223	V89-R93 CarbonylContact C-O 3.47Å; V89-R93 VanDerWaalsContact CA-O 3.29Å; V89-R93 WeakPolarHBondContact CA-O 3.42Å; A90-R93 PolarHBondContact N-O 3.27Å; A90-R93 PolarHBondContact O-N 2.77Å; R93-V95 HydrophobicContact CB-CG2 3.81Å; R93-Q207 WeakPolarHBondContact CA-O 3.45Å; R93-Q207 VanDerWaalsContact CD-O 3.29Å; R93-Q207 WeakPolarHBondContact CD-O 3.49Å; R93-A209 HydrophobicContact CB-CB 4.29Å; R93-A209 HydrophobicContact CG-CB 4.39Å; R93-V221 HydrophobicContact CG-CG1 4.48Å; R93-D223 WeakPolarHBondContact CD-OD1 3.35Å; R93-D223 IonicContact CZ-OD1 3.6Å; R93-D223 IonicContact CZ-OD2 3.42Å; R93-D223 VanDerWaalsContact NE-CG 3.33Å; R93-D223 IonicContact NE-OD1 2.72Å; R93-D223 PolarHBondContact NE-OD1 3.09Å; R93-D223 IonicContact NE-OD2 3.35Å; R93-D223 PolarHBondContact NE-OD2 3.32Å; R93-D223 IonicContact NH2-OD1 3.66Å; R93-D223 IonicContact NH2-OD2 2.7Å; R93-D223 PolarHBondContact NH2-OD2 2.86Å
94	F	97.8	Very high	96.5	Very high	11 Å²	11	42.5 Å²	42.5	5%	0.048	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.8	160.5	167.4	-98.9	0	0	0	106.5	D87 M96 Q207 S208 A209 V230 W232	D87-F94 HydrophobicContact CB-CE2 4Å; D87-F94 HydrophobicContact CB-CZ 3.8Å; F94-M96 HydrophobicContact CD1-CG 4.26Å; F94-M96 HydrophobicContact CE1-CG 3.56Å; F94-M96 HydrophobicContact CE1-SD 4.24Å; F94-M96 HydrophobicContact CZ-CG 4.24Å; F94-Q207 PolarHBondContact N-O 2.96Å; F94-S208 CarbonylContact O-C 3.58Å; F94-S208 WeakPolarHBondContact O-CA 3.42Å; F94-A209 PolarHBondContact O-N 2.85Å; F94-V230 HydrophobicContact CB-CB 4.43Å; F94-V230 HydrophobicContact CD1-CB 4.12Å; F94-V230 HydrophobicContact CD1-CG1 4.13Å; F94-V230 HydrophobicContact CD1-CG2 4.12Å; F94-V230 HydrophobicContact CE1-CG1 4.35Å; F94-V230 HydrophobicContact CG-CB 4.29Å; F94-V230 HydrophobicContact CG-CG1 4.28Å; F94-W232 HydrophobicContact CD2-CB 3.98Å; F94-W232 AromaticContact CD2-CD2 3.7Å; F94-W232 HydrophobicContact CD2-CD2 3.7Å; F94-W232 HydrophobicContact CD2-CE3 4.15Å; F94-W232 AromaticContact CD2-CG 3.61Å; F94-W232 HydrophobicContact CD2-CG 3.61Å; F94-W232 AromaticContact CE2-CD2 3.38Å; F94-W232 HydrophobicContact CE2-CD2 3.38Å; F94-W232 AromaticContact CE2-CE2 3.53Å; F94-W232 AromaticContact CE2-CE3 3.66Å; F94-W232 HydrophobicContact CE2-CE3 3.66Å; F94-W232 AromaticContact CE2-CG 3.82Å; F94-W232 HydrophobicContact CE2-CG 3.82Å; F94-W232 HydrophobicContact CE2-CH2 4.14Å; F94-W232 AromaticContact CE2-CZ2 3.9Å; F94-W232 HydrophobicContact CE2-CZ2 3.9Å; F94-W232 HydrophobicContact CE2-CZ3 4.03Å; F94-W232 AromaticContact CE2-NE1 3.98Å; F94-W232 HydrophobicContact CZ-CD2 4.34Å; F94-W232 HydrophobicContact CZ-CE3 4.21Å; F94-W232 HydrophobicContact CZ-CH2 4.38Å; F94-W232 HydrophobicContact CZ-CZ3 4.23Å
95	V	97.9	Very high	96.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.1	-170.6	-166.7	0	0	0	0	110.1	D87 A88 A90 R93 A209 Y211 V221	D87-V95 WeakPolarHBondContact CA-O 3.27Å; D87-V95 PolarHBondContact N-O 3.32Å; A88-V95 PolarHBondContact N-O 2.82Å; A88-V95 PolarHBondContact O-N 2.98Å; A90-V95 HydrophobicContact CB-CG2 3.77Å; R93-V95 HydrophobicContact CB-CG2 3.81Å; V95-A209 WeakPolarHBondContact CA-O 3.48Å; V95-A209 HydrophobicContact CG2-CB 4.42Å; V95-Y211 HydrophobicContact CB-CD2 4.49Å; V95-Y211 HydrophobicContact CB-CE2 4.04Å; V95-Y211 HydrophobicContact CG1-CD1 3.93Å; V95-Y211 HydrophobicContact CG1-CD2 3.51Å; V95-Y211 HydrophobicContact CG1-CE1 3.87Å; V95-Y211 HydrophobicContact CG1-CE2 3.46Å; V95-Y211 VanDerWaalsContact CG1-CE2 3.46Å; V95-Y211 HydrophobicContact CG1-CG 3.75Å; V95-V221 HydrophobicContact CG1-CG1 4.24Å; V95-V221 HydrophobicContact CG1-CG2 4.31Å; V95-V221 HydrophobicContact CG2-CG1 3.92Å; V95-V221 HydrophobicContact CG2-CG2 4.39Å
96	M	97.3	Very high	96.6	Very high	57 Å²	57	42.9 Å²	42.9	28%	0.281	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	153.6	173.1	-63.6	179.2	-55.5	0	0	110.2	F94 S208 A209 V210 Y211 N224	F94-M96 HydrophobicContact CD1-CG 4.26Å; F94-M96 HydrophobicContact CE1-CG 3.56Å; F94-M96 HydrophobicContact CE1-SD 4.24Å; F94-M96 HydrophobicContact CZ-CG 4.24Å; M96-S208 WeakPolarHBondContact CE-OG 3.29Å; M96-A209 PolarHBondContact N-O 2.85Å; M96-V210 HydrophobicContact CB-CG2 4.33Å; M96-V210 WeakPolarHBondContact O-CA 3.44Å; M96-Y211 PolarHBondContact O-N 3.23Å; M96-N224 WeakPolarHBondContact CE-ND2 3.27Å
97	P	97.4	Very high	96.8	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.071	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-66.6	159.4	176.5	31.6	-37.6	0	0	0	111.9	A79 T81 A86 V210	A79-P97 HydrophobicContact CB-CB 3.68Å; A79-P97 HydrophobicContact CB-CG 3.78Å; T81-P97 HydrophobicContact CG2-CB 3.7Å; A86-P97 HydrophobicContact CB-CB 3.97Å; A86-P97 HydrophobicContact CB-CG 3.94Å; P97-V210 VanDerWaalsContact O-CG2 3.22Å; P97-V210 WeakPolarHBondContact O-CG2 3.45Å
98	E	97	Very high	96.9	Very high	35 Å²	35	40.7 Å²	40.7	16%	0.164	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.3	163.1	-168	-172.8	152.1	0	0	108.8	V80 R100 Y211 E213	V80-E98 PolarHBondContact N-O 3.22Å; V80-E98 PolarHBondContact O-N 2.79Å; E98-R100 VanDerWaalsContact CD-NE 3.33Å; E98-R100 VanDerWaalsContact CD-NH2 3.35Å; E98-R100 HydrophobicContact CG-CG 4.44Å; E98-R100 IonicContact OE1-CZ 3.94Å; E98-R100 IonicContact OE1-NE 2.88Å; E98-R100 PolarHBondContact OE1-NE 3.05Å; E98-R100 IonicContact OE1-NH2 2.62Å; E98-R100 PolarHBondContact OE1-NH2 3.46Å; E98-R100 IonicContact OE2-CZ 3.46Å; E98-R100 IonicContact OE2-NE 3.48Å; E98-R100 IonicContact OE2-NH2 2.93Å; E98-R100 PolarHBondContact OE2-NH2 2.62Å; E98-Y211 VanDerWaalsContact CB-O 3.27Å; E98-Y211 WeakPolarHBondContact CB-O 3.36Å; E98-E213 WeakPolarHBondContact OE2-CB 3.32Å; E98-E213 PolarHBondContact OE2-N 2.88Å
99	E	96.5	Very high	96.9	Very high	129 Å²	129	42.1 Å²	42.1	60%	0.603	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.8	173.4	-72	-163.3	-164.3	0	0	111.3	S77	S77-E99 PolarHBondContact OG-OE2 3.23Å
100	R	95.8	Very high	96.9	Very high	46 Å²	46	41 Å²	41	17%	0.174	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.4	176.6	-59.9	-171.5	-171.2	164.2	12.2	111.4	V78 V80 E98 M102 E213	V78-R100 PolarHBondContact N-O 3.02Å; V78-R100 PolarHBondContact O-N 2.76Å; V80-R100 HydrophobicContact CG2-CG 4.08Å; E98-R100 VanDerWaalsContact CD-NE 3.33Å; E98-R100 VanDerWaalsContact CD-NH2 3.35Å; E98-R100 HydrophobicContact CG-CG 4.44Å; E98-R100 IonicContact OE1-CZ 3.94Å; E98-R100 IonicContact OE1-NE 2.88Å; E98-R100 PolarHBondContact OE1-NE 3.05Å; E98-R100 IonicContact OE1-NH2 2.62Å; E98-R100 PolarHBondContact OE1-NH2 3.46Å; E98-R100 IonicContact OE2-CZ 3.46Å; E98-R100 IonicContact OE2-NE 3.48Å; E98-R100 IonicContact OE2-NH2 2.93Å; E98-R100 PolarHBondContact OE2-NH2 2.62Å; R100-M102 HydrophobicContact CB-CG 4.01Å; R100-M102 HydrophobicContact CB-SD 4.26Å; R100-E213 IonicContact CZ-OE2 3.46Å; R100-E213 IonicContact NH1-OE2 3.2Å; R100-E213 PolarHBondContact NH1-OE2 2.87Å; R100-E213 IonicContact NH2-OE2 3.53Å; R100-E213 PolarHBondContact NH2-OE2 2.86Å
101	Q	96.7	Very high	96.9	Very high	113 Å²	113	39.8 Å²	39.8	53%	0.528	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	114.5	166.5	-69.7	-62.9	-53.6	0	0	109.1	M75 I76	M75-Q101 VanDerWaalsContact CE-C 3.46Å; M75-Q101 HydrophobicContact CE-CB 4Å; M75-Q101 WeakPolarHBondContact CE-O 3.42Å; I76-Q101 WeakPolarHBondContact O-CA 3.43Å
102	M	97.3	Very high	97.1	Very high	29 Å²	29	40.4 Å²	40.4	14%	0.143	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	150.1	-178.7	-60.9	-179.3	64.1	0	0	110.7	M75 I76 V78 R100 V107 I110 F121	M75-M102 WeakPolarHBondContact CA-O 3.37Å; I76-M102 WeakPolarHBondContact CG1-O 3.31Å; I76-M102 PolarHBondContact N-O 3.04Å; I76-M102 PolarHBondContact O-N 2.8Å; V78-M102 HydrophobicContact CB-CG 4.48Å; V78-M102 HydrophobicContact CB-SD 4.06Å; V78-M102 HydrophobicContact CG1-SD 4.25Å; V78-M102 HydrophobicContact CG2-CB 3.89Å; V78-M102 HydrophobicContact CG2-CG 4.21Å; V78-M102 HydrophobicContact CG2-SD 4.16Å; R100-M102 HydrophobicContact CB-CG 4.01Å; R100-M102 HydrophobicContact CB-SD 4.26Å; M102-V107 HydrophobicContact CB-CG2 4.01Å; M102-V107 HydrophobicContact CE-CG2 4.33Å; M102-V107 HydrophobicContact SD-CG2 4.5Å; M102-I110 HydrophobicContact CE-CD1 3.58Å; M102-F121 HydrophobicContact CE-CD1 4.16Å; M102-F121 HydrophobicContact CE-CE1 3.91Å; M102-F121 HydrophobicContact SD-CD1 3.91Å; M102-F121 HydrophobicContact SD-CE1 3.8Å
103	S	97.8	Very high	97	Very high	25 Å²	25	37.1 Å²	37.1	18%	0.175	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	143	170.1	84.8	0	0	0	0	110	K74 S105 S106 V107	K74-S103 CarbonylContact O-C 3.55Å; K74-S103 VanDerWaalsContact O-CA 3.25Å; K74-S103 WeakPolarHBondContact O-CA 3.41Å; S103-S105 PolarHBondContact O-N 3.37Å; S103-S106 WeakPolarHBondContact O-CB 3.34Å; S103-S106 PolarHBondContact O-N 2.91Å; S103-S106 WeakPolarHBondContact OG-CB 3.49Å; S103-S106 PolarHBondContact OG-N 3.36Å; S103-S106 PolarHBondContact OG-OG 2.83Å; S103-V107 PolarHBondContact O-N 3.29Å
104	F	97.8	Very high	97	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-40	179	-161.8	-80.7	0	0	0	111.8	L67 I71 G72 K74 I76 S106 V107 L108 I123 L134 F161 L163	L67-F104 HydrophobicContact CB-CD1 4.43Å; L67-F104 HydrophobicContact CB-CE1 3.73Å; L67-F104 HydrophobicContact CB-CZ 4.39Å; L67-F104 HydrophobicContact CD1-CE1 4.11Å; L67-F104 HydrophobicContact CD1-CZ 4.14Å; L67-F104 HydrophobicContact CG-CE1 4.45Å; I71-F104 HydrophobicContact CD1-CD1 4.06Å; I71-F104 HydrophobicContact CD1-CD2 3.51Å; I71-F104 HydrophobicContact CD1-CE1 4.01Å; I71-F104 HydrophobicContact CD1-CE2 3.47Å; I71-F104 VanDerWaalsContact CD1-CE2 3.47Å; I71-F104 HydrophobicContact CD1-CG 3.83Å; I71-F104 HydrophobicContact CD1-CZ 3.73Å; I71-F104 HydrophobicContact CG1-CD1 4.1Å; I71-F104 HydrophobicContact CG1-CD2 4.22Å; I71-F104 HydrophobicContact CG1-CE1 4.36Å; I71-F104 HydrophobicContact CG1-CE2 4.49Å; I71-F104 HydrophobicContact CG1-CG 4.04Å; I71-F104 VanDerWaalsContact O-CB 3.31Å; I71-F104 WeakPolarHBondContact O-CB 3.29Å; G72-F104 PolarHBondContact O-N 2.8Å; K74-F104 PolarHBondContact O-N 2.94Å; I76-F104 HydrophobicContact CD1-CD2 3.66Å; I76-F104 HydrophobicContact CD1-CE2 4.26Å; I76-F104 HydrophobicContact CD1-CG 4.47Å; F104-S106 VanDerWaalsContact C-N 3.31Å; F104-S106 PolarHBondContact O-N 2.95Å; F104-V107 PolarHBondContact O-N 3.02Å; F104-V107 VanDerWaalsContact O-N 3.17Å; F104-L108 HydrophobicContact CD1-CD1 3.73Å; F104-L108 HydrophobicContact CD1-CD2 4.48Å; F104-L108 HydrophobicContact CD1-CG 3.8Å; F104-L108 HydrophobicContact CE1-CD1 3.73Å; F104-L108 HydrophobicContact CE1-CD2 3.87Å; F104-L108 HydrophobicContact CE1-CG 3.7Å; F104-L108 PolarHBondContact O-N 2.76Å; F104-I123 HydrophobicContact CD2-CD1 4.34Å; F104-I123 HydrophobicContact CE2-CD1 3.92Å; F104-I123 HydrophobicContact CZ-CD1 4.5Å; F104-L134 HydrophobicContact CD2-CD2 4.35Å; F104-L134 HydrophobicContact CE2-CD1 4.35Å; F104-F161 AromaticContact CE2-CE1 3.84Å; F104-F161 HydrophobicContact CE2-CE1 3.84Å; F104-F161 HydrophobicContact CE2-CZ 4.11Å; F104-F161 HydrophobicContact CZ-CE1 4.06Å; F104-F161 AromaticContact CZ-CZ 3.94Å; F104-F161 HydrophobicContact CZ-CZ 3.94Å; F104-L163 HydrophobicContact CE1-CD2 4.11Å; F104-L163 HydrophobicContact CE2-CD2 4.41Å; F104-L163 HydrophobicContact CZ-CD2 3.64Å
105	S	97.9	Very high	96.8	Very high	25 Å²	25	41.6 Å²	41.6	18%	0.175	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-40.6	175.8	-62.2	0	0	0	0	112.4	R68 G72 S103 V107 L108 D109	R68-S105 PolarHBondContact NH1-O 2.87Å; G72-S105 WeakPolarHBondContact CA-OG 3.17Å; G72-S105 WeakPolarHBondContact O-CB 3.25Å; G72-S105 PolarHBondContact O-N 3.09Å; G72-S105 PolarHBondContact O-OG 3.36Å; S103-S105 PolarHBondContact O-N 3.37Å; S105-V107 VanDerWaalsContact C-N 3.28Å; S105-V107 PolarHBondContact O-N 3.03Å; S105-L108 PolarHBondContact O-N 3.05Å; S105-D109 PolarHBondContact O-N 2.82Å
106	S	97.9	Very high	96.5	Very high	49 Å²	49	49 Å²	49	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-34.3	178.5	-58.1	0	0	0	0	112.1	S103 F104 I110	S103-S106 WeakPolarHBondContact O-CB 3.34Å; S103-S106 PolarHBondContact O-N 2.91Å; S103-S106 WeakPolarHBondContact OG-CB 3.49Å; S103-S106 PolarHBondContact OG-N 3.36Å; S103-S106 PolarHBondContact OG-OG 2.83Å; F104-S106 VanDerWaalsContact C-N 3.31Å; F104-S106 PolarHBondContact O-N 2.95Å; S106-I110 WeakPolarHBondContact O-CD1 3.4Å; S106-I110 VanDerWaalsContact O-CG1 3.31Å; S106-I110 WeakPolarHBondContact O-CG1 3.29Å; S106-I110 PolarHBondContact O-N 2.96Å
107	V	97.4	Very high	96.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.7	-44.3	174.5	-177	0	0	0	0	110.4	I76 V78 M102 S103 F104 S105 D109 I110 I111 I123	I76-V107 HydrophobicContact CD1-CG2 4.44Å; V78-V107 HydrophobicContact CG1-CG2 4.47Å; V78-V107 HydrophobicContact CG2-CG2 3.57Å; M102-V107 HydrophobicContact CB-CG2 4.01Å; M102-V107 HydrophobicContact CE-CG2 4.33Å; M102-V107 HydrophobicContact SD-CG2 4.5Å; S103-V107 PolarHBondContact O-N 3.29Å; F104-V107 PolarHBondContact O-N 3.02Å; F104-V107 VanDerWaalsContact O-N 3.17Å; S105-V107 VanDerWaalsContact C-N 3.28Å; S105-V107 PolarHBondContact O-N 3.03Å; V107-D109 VanDerWaalsContact C-N 3.32Å; V107-D109 PolarHBondContact O-N 3.48Å; V107-I110 PolarHBondContact O-N 2.85Å; V107-I110 VanDerWaalsContact O-N 3.16Å; V107-I111 HydrophobicContact CG1-CD1 3.88Å; V107-I111 HydrophobicContact CG1-CG1 4.42Å; V107-I111 WeakPolarHBondContact O-CG1 3.35Å; V107-I111 PolarHBondContact O-N 3.04Å; V107-I123 HydrophobicContact CG1-CD1 3.97Å; V107-I123 HydrophobicContact CG1-CG1 4.28Å
108	L	97.8	Very high	95.9	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-58.7	-43.1	174.2	-70.6	178.5	0	0	0	111.7	L67 R68 F104 S105 I110 I111 E112 L163	L67-L108 HydrophobicContact CB-CD1 4.33Å; R68-L108 HydrophobicContact CB-CD1 3.98Å; F104-L108 HydrophobicContact CD1-CD1 3.73Å; F104-L108 HydrophobicContact CD1-CD2 4.48Å; F104-L108 HydrophobicContact CD1-CG 3.8Å; F104-L108 HydrophobicContact CE1-CD1 3.73Å; F104-L108 HydrophobicContact CE1-CD2 3.87Å; F104-L108 HydrophobicContact CE1-CG 3.7Å; F104-L108 PolarHBondContact O-N 2.76Å; S105-L108 PolarHBondContact O-N 3.05Å; L108-I110 PolarHBondContact O-N 2.89Å; L108-I111 PolarHBondContact O-N 3.34Å; L108-E112 WeakPolarHBondContact O-CB 3.43Å; L108-E112 VanDerWaalsContact O-CG 3.3Å; L108-E112 WeakPolarHBondContact O-CG 3.4Å; L108-E112 PolarHBondContact O-N 3.09Å; L108-L163 HydrophobicContact CD2-CD2 3.93Å
109	D	97.9	Very high	95.9	Very high	40 Å²	40	54.9 Å²	54.9	21%	0.214	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-33.2	178	-65.2	-23.5	0	0	0	112.6	R68 S105 V107 G113 T114 V115	R68-D109 IonicContact CZ-OD1 3.53Å; R68-D109 IonicContact NH1-OD1 3.23Å; R68-D109 PolarHBondContact NH1-OD1 3.46Å; R68-D109 IonicContact NH1-OD2 3.53Å; R68-D109 IonicContact NH2-OD1 3.92Å; R68-D109 PolarHBondContact NH2-OD1 2.92Å; S105-D109 PolarHBondContact O-N 2.82Å; V107-D109 VanDerWaalsContact C-N 3.32Å; V107-D109 PolarHBondContact O-N 3.48Å; D109-G113 PolarHBondContact O-N 3.11Å; D109-T114 WeakPolarHBondContact O-CA 3.19Å; D109-T114 WeakPolarHBondContact O-CB 3.23Å; D109-T114 PolarHBondContact O-N 2.93Å; D109-V115 HydrophobicContact CB-CB 4.14Å; D109-V115 HydrophobicContact CB-CG2 3.84Å; D109-V115 PolarHBondContact O-N 2.87Å
110	I	97.1	Very high	95.9	Very high	13 Å²	13	49.3 Å²	49.3	7%	0.067	27%	0.272	C	S	.	.	H	α-helix	trans	-73.8	-49.3	176.7	-66.5	162.8	0	0	0	110.5	M102 S106 V107 L108 E112 G113 V115 K117 F121	M102-I110 HydrophobicContact CE-CD1 3.58Å; S106-I110 WeakPolarHBondContact O-CD1 3.4Å; S106-I110 VanDerWaalsContact O-CG1 3.31Å; S106-I110 WeakPolarHBondContact O-CG1 3.29Å; S106-I110 PolarHBondContact O-N 2.96Å; V107-I110 PolarHBondContact O-N 2.85Å; V107-I110 VanDerWaalsContact O-N 3.16Å; L108-I110 PolarHBondContact O-N 2.89Å; I110-E112 VanDerWaalsContact C-N 3.32Å; I110-E112 PolarHBondContact O-N 2.95Å; I110-G113 WeakPolarHBondContact O-CA 3.45Å; I110-G113 PolarHBondContact O-N 2.99Å; I110-V115 WeakPolarHBondContact CA-O 3.45Å; I110-V115 HydrophobicContact CG1-CB 4.4Å; I110-V115 HydrophobicContact CG1-CG1 4.37Å; I110-K117 HydrophobicContact CD1-CB 4.26Å; I110-K117 HydrophobicContact CD1-CG 3.78Å; I110-K117 HydrophobicContact CG1-CB 4.42Å; I110-K117 HydrophobicContact CG1-CG 3.96Å; I110-F121 HydrophobicContact CD1-CD1 4.05Å; I110-F121 HydrophobicContact CD1-CD2 4.47Å; I110-F121 HydrophobicContact CD1-CE1 3.9Å; I110-F121 HydrophobicContact CD1-CE2 4.34Å; I110-F121 HydrophobicContact CD1-CG 4.35Å; I110-F121 HydrophobicContact CD1-CZ 4.08Å; I110-F121 HydrophobicContact CG2-CD2 3.69Å; I110-F121 HydrophobicContact CG2-CE2 4.1Å; I110-F121 HydrophobicContact CG2-CG 4.14Å
111	I	95.8	Very high	96	Very high	13 Å²	13	47.1 Å²	47.1	7%	0.067	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-40	178.6	-66.8	175.3	0	0	0	110.5	V107 L108 G113 L163 E165 H278	V107-I111 HydrophobicContact CG1-CD1 3.88Å; V107-I111 HydrophobicContact CG1-CG1 4.42Å; V107-I111 WeakPolarHBondContact O-CG1 3.35Å; V107-I111 PolarHBondContact O-N 3.04Å; L108-I111 PolarHBondContact O-N 3.34Å; I111-G113 PolarHBondContact O-N 2.83Å; I111-G113 VanDerWaalsContact O-N 3.17Å; I111-L163 HydrophobicContact CD1-CD1 3.79Å; I111-L163 HydrophobicContact CD1-CD2 4.11Å; I111-L163 HydrophobicContact CD1-CG 3.67Å; I111-E165 HydrophobicContact CG1-CG 4.15Å; I111-H278 PolarHBondContact O-NE2 2.85Å
112	E	96	Very high	96.1	Very high	84 Å²	84	42 Å²	42	39%	0.393	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-6.9	176.5	-68	175.3	148.9	0	0	113	P64 R68 L108 I110 T114	P64-E112 WeakPolarHBondContact CB-OE1 3.26Å; R68-E112 IonicContact CZ-OE2 3.24Å; R68-E112 IonicContact NH2-OE2 2.8Å; R68-E112 PolarHBondContact NH2-OE2 3.4Å; L108-E112 WeakPolarHBondContact O-CB 3.43Å; L108-E112 VanDerWaalsContact O-CG 3.3Å; L108-E112 WeakPolarHBondContact O-CG 3.4Å; L108-E112 PolarHBondContact O-N 3.09Å; I110-E112 VanDerWaalsContact C-N 3.32Å; I110-E112 PolarHBondContact O-N 2.95Å; E112-T114 PolarHBondContact O-N 2.62Å
113	G	93.9	Very high	96.1	Very high	35 Å²	35	40.7 Å²	40.7	36%	0.361	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	3.6	-178.3	0	0	0	0	0	114.3	D109 I110 I111 V115 Q116	D109-G113 PolarHBondContact O-N 3.11Å; I110-G113 WeakPolarHBondContact O-CA 3.45Å; I110-G113 PolarHBondContact O-N 2.99Å; I111-G113 PolarHBondContact O-N 2.83Å; I111-G113 VanDerWaalsContact O-N 3.17Å; G113-V115 PolarHBondContact O-N 2.74Å; G113-Q116 PolarHBondContact O-NE2 3.42Å; G113-Q116 VanDerWaalsContact O-NE2 3.08Å
114	T	95	Very high	95.8	Very high	104 Å²	104	40.2 Å²	40.2	64%	0.638	23%	0.228	S	C	*	.	S	Bend	trans	-63.1	-32.7	177	-44.7	0	0	0	0	111.7	D109 E112	D109-T114 WeakPolarHBondContact O-CA 3.19Å; D109-T114 WeakPolarHBondContact O-CB 3.23Å; D109-T114 PolarHBondContact O-N 2.93Å; E112-T114 PolarHBondContact O-N 2.62Å
115	V	94.8	Very high	95.3	Very high	59 Å²	59	43.2 Å²	43.2	36%	0.358	24%	0.241	S	C	.	.	S	Bend	trans	-124.8	125.8	175.5	173.9	0	0	0	0	109.3	D109 I110 G113 K117	D109-V115 HydrophobicContact CB-CB 4.14Å; D109-V115 HydrophobicContact CB-CG2 3.84Å; D109-V115 PolarHBondContact O-N 2.87Å; I110-V115 WeakPolarHBondContact CA-O 3.45Å; I110-V115 HydrophobicContact CG1-CB 4.4Å; I110-V115 HydrophobicContact CG1-CG1 4.37Å; G113-V115 PolarHBondContact O-N 2.74Å; V115-K117 HydrophobicContact CG1-CG 4.19Å
116	Q	90.7	Very high	94.6	Very high	158 Å²	158	44.4 Å²	44.4	74%	0.738	24%	0.244	S	C	*	.			trans	-90.7	129.2	175.8	-63.2	-63	-48.1	0	0	110.2	G113	G113-Q116 PolarHBondContact O-NE2 3.42Å; G113-Q116 VanDerWaalsContact O-NE2 3.08Å
117	K	91.8	Very high	94	Very high	127 Å²	127	45.8 Å²	45.8	55%	0.552	25%	0.252	S	S	*	.			trans	-135	150.1	175.4	-72.7	-66.9	-173.3	171.3	0	109.7	I110 V115 F121	I110-K117 HydrophobicContact CD1-CB 4.26Å; I110-K117 HydrophobicContact CD1-CG 3.78Å; I110-K117 HydrophobicContact CG1-CB 4.42Å; I110-K117 HydrophobicContact CG1-CG 3.96Å; V115-K117 HydrophobicContact CG1-CG 4.19Å; K117-F121 HydrophobicContact CB-CE2 3.61Å; K117-F121 HydrophobicContact CB-CZ 3.59Å; K117-F121 HydrophobicContact CG-CZ 4.25Å
118	T	92	Very high	93.5	Very high	80 Å²	80	46.2 Å²	46.2	49%	0.491	26%	0.256	S	S	.	.	S	Bend	trans	-75.9	142.2	174	-48.4	0	0	0	0	109.8	G217 F219	T118-G217 WeakPolarHBondContact CG2-O 3.32Å; T118-F219 HydrophobicContact CG2-CE2 4.25Å
119	G	95.1	Very high	92.9	Very high	19 Å²	19	46.1 Å²	46.1	20%	0.196	26%	0.255	C	S	.	.	S	Bend	trans	95.4	-176.5	-177.3	0	0	0	0	0	112.6	T81	T81-G119 CarbonylContact O-C 3.53Å; T81-G119 WeakPolarHBondContact O-CA 3.26Å
120	V	97.6	Very high	92.4	Very high	11 Å²	11	44.2 Å²	44.2	7%	0.067	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.5	-178.1	-178	0	0	0	0	108.1	V80 T81 E165 N167 A168	V80-V120 WeakPolarHBondContact CA-O 2.93Å; T81-V120 PolarHBondContact N-O 3.01Å; T81-V120 VanDerWaalsContact N-O 3.11Å; T81-V120 PolarHBondContact O-N 2.73Å; V120-E165 WeakPolarHBondContact CA-OE2 3.32Å; V120-E165 HydrophobicContact CG1-CB 4.1Å; V120-N167 HydrophobicContact CG1-CB 4.04Å; V120-N167 HydrophobicContact CG2-CB 4.13Å; V120-A168 HydrophobicContact CG1-CB 3.9Å
121	F	98.1	Very high	91.9	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.3	-169.8	-65.6	-100.8	0	0	0	111.2	V78 V80 M102 I110 K117 E165	V78-F121 HydrophobicContact CG1-CB 4.27Å; V78-F121 HydrophobicContact CG1-CD1 4.08Å; V80-F121 HydrophobicContact CG1-CD1 4.44Å; V80-F121 HydrophobicContact CG1-CE1 4.05Å; V80-F121 HydrophobicContact CG1-CE2 4.36Å; V80-F121 HydrophobicContact CG1-CZ 3.99Å; V80-F121 HydrophobicContact CG2-CD1 3.67Å; V80-F121 HydrophobicContact CG2-CE1 3.6Å; V80-F121 HydrophobicContact CG2-CG 4.5Å; V80-F121 HydrophobicContact CG2-CZ 4.37Å; M102-F121 HydrophobicContact CE-CD1 4.16Å; M102-F121 HydrophobicContact CE-CE1 3.91Å; M102-F121 HydrophobicContact SD-CD1 3.91Å; M102-F121 HydrophobicContact SD-CE1 3.8Å; I110-F121 HydrophobicContact CD1-CD1 4.05Å; I110-F121 HydrophobicContact CD1-CD2 4.47Å; I110-F121 HydrophobicContact CD1-CE1 3.9Å; I110-F121 HydrophobicContact CD1-CE2 4.34Å; I110-F121 HydrophobicContact CD1-CG 4.35Å; I110-F121 HydrophobicContact CD1-CZ 4.08Å; I110-F121 HydrophobicContact CG2-CD2 3.69Å; I110-F121 HydrophobicContact CG2-CE2 4.1Å; I110-F121 HydrophobicContact CG2-CG 4.14Å; K117-F121 HydrophobicContact CB-CE2 3.61Å; K117-F121 HydrophobicContact CB-CZ 3.59Å; K117-F121 HydrophobicContact CG-CZ 4.25Å; F121-E165 WeakPolarHBondContact CD2-OE2 3.26Å; F121-E165 PolarHBondContact N-OE2 3.04Å; F121-E165 PolarHBondContact O-N 2.92Å
122	Y	98.1	Very high	91.5	Very high	6 Å²	6	52.5 Å²	52.5	2%	0.024	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	125.1	179.5	-169.1	-158.6	0	0	0	111.9	A79 Q124 W162 L163 A168 K188	A79-Y122 WeakPolarHBondContact CB-O 3.4Å; A79-Y122 PolarHBondContact N-O 3.14Å; A79-Y122 PolarHBondContact O-N 2.78Å; Y122-Q124 HydrophobicContact CD1-CB 3.57Å; Y122-Q124 HydrophobicContact CD1-CG 3.84Å; Y122-Q124 HydrophobicContact CD2-CB 4.32Å; Y122-Q124 HydrophobicContact CE1-CB 3.61Å; Y122-Q124 HydrophobicContact CE1-CG 4.3Å; Y122-Q124 HydrophobicContact CE2-CB 4.4Å; Y122-Q124 HydrophobicContact CG-CB 3.93Å; Y122-Q124 HydrophobicContact CG-CG 4.22Å; Y122-Q124 PolarHBondContact O-N 3.48Å; Y122-W162 HydrophobicContact CE1-CE3 4.03Å; Y122-W162 AromaticContact CE1-CZ3 3.97Å; Y122-W162 HydrophobicContact CE1-CZ3 3.97Å; Y122-W162 HydrophobicContact CE2-CB 4.43Å; Y122-W162 AromaticContact CE2-CE3 3.91Å; Y122-W162 HydrophobicContact CE2-CE3 3.91Å; Y122-W162 AromaticContact CZ-CE3 3.37Å; Y122-W162 AromaticContact CZ-CZ3 3.77Å; Y122-W162 WeakPolarHBondContact OH-CZ3 3.44Å; Y122-L163 WeakPolarHBondContact CD2-O 3.49Å; Y122-A168 HydrophobicContact CD1-CB 3.92Å; Y122-A168 HydrophobicContact CD2-CB 4.44Å; Y122-A168 HydrophobicContact CG-CB 3.81Å; Y122-K188 PolarHBondContact OH-NZ 2.83Å
123	I	97.1	Very high	91.1	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	104.3	168.6	-57.6	168	0	0	0	106.6	I76 V78 F104 V107 F161 W162 L163	I76-I123 HydrophobicContact CD1-CD1 3.26Å; I76-I123 HydrophobicContact CD1-CG1 3.68Å; I76-I123 HydrophobicContact CD1-CG2 4.29Å; V78-I123 HydrophobicContact CG2-CG1 4.28Å; F104-I123 HydrophobicContact CD2-CD1 4.34Å; F104-I123 HydrophobicContact CE2-CD1 3.92Å; F104-I123 HydrophobicContact CZ-CD1 4.5Å; V107-I123 HydrophobicContact CG1-CD1 3.97Å; V107-I123 HydrophobicContact CG1-CG1 4.28Å; I123-F161 HydrophobicContact CD1-CE1 4.35Å; I123-F161 HydrophobicContact CG2-CD1 4.01Å; I123-F161 HydrophobicContact CG2-CE1 4.43Å; I123-W162 WeakPolarHBondContact O-CA 3.5Å; I123-L163 HydrophobicContact CB-CB 4.43Å; I123-L163 WeakPolarHBondContact CB-O 3.29Å; I123-L163 HydrophobicContact CD1-CB 4.03Å; I123-L163 HydrophobicContact CD1-CD2 4.03Å; I123-L163 HydrophobicContact CD1-CG 4.26Å; I123-L163 PolarHBondContact N-O 2.83Å; I123-L163 PolarHBondContact O-N 3.06Å
124	Q	91.5	Very high	91	Very high	15 Å²	15	48.4 Å²	48.4	7%	0.07	26%	0.256	C	S	.	.			trans	-140.9	17.3	-170.3	62.7	161	25.7	0	0	114.6	A79 A86 Y122 Q126 W162	A79-Q124 HydrophobicContact CB-CG 3.56Å; A86-Q124 VanDerWaalsContact CB-NE2 3.29Å; Y122-Q124 HydrophobicContact CD1-CB 3.57Å; Y122-Q124 HydrophobicContact CD1-CG 3.84Å; Y122-Q124 HydrophobicContact CD2-CB 4.32Å; Y122-Q124 HydrophobicContact CE1-CB 3.61Å; Y122-Q124 HydrophobicContact CE1-CG 4.3Å; Y122-Q124 HydrophobicContact CE2-CB 4.4Å; Y122-Q124 HydrophobicContact CG-CB 3.93Å; Y122-Q124 HydrophobicContact CG-CG 4.22Å; Y122-Q124 PolarHBondContact O-N 3.48Å; Q124-Q126 WeakPolarHBondContact O-CG 3.32Å; Q124-Q126 PolarHBondContact O-N 2.88Å; Q124-W162 HydrophobicContact CB-CE3 3.69Å; Q124-W162 HydrophobicContact CB-CH2 4.47Å; Q124-W162 HydrophobicContact CB-CZ3 3.43Å; Q124-W162 VanDerWaalsContact CB-CZ3 3.43Å
125	K	88.1	Confident	90.9	Very high	62 Å²	62	46.4 Å²	46.4	27%	0.27	25%	0.245	S	C	.	.			trans	-70.2	115.7	-176.7	-175.4	171.3	170.8	-170.7	0	110.9	C127 N129 E133	K125-C127 VanDerWaalsContact C-N 3.32Å; K125-C127 HydrophobicContact CG-CB 4.47Å; K125-C127 PolarHBondContact O-N 2.98Å; K125-N129 HydrophobicContact CB-CB 4.22Å; K125-N129 WeakPolarHBondContact O-CB 3.41Å; K125-N129 PolarHBondContact O-ND2 3.2Å; K125-N129 PolarHBondContact O-OD1 2.86Å; K125-E133 WeakPolarHBondContact CD-OE1 3.46Å; K125-E133 WeakPolarHBondContact CE-OE1 3.19Å; K125-E133 IonicContact NZ-OE1 3.73Å; K125-E133 PolarHBondContact NZ-OE1 2.82Å
126	Q	82.8	Confident	90.9	Very high	51 Å²	51	46.4 Å²	46.4	24%	0.238	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	38.5	-168.5	-42.2	-178.2	25.3	0	0	112.7	Q124 N160 W162 W286	Q124-Q126 WeakPolarHBondContact O-CG 3.32Å; Q124-Q126 PolarHBondContact O-N 2.88Å; Q126-N160 VanDerWaalsContact C-OD1 3.26Å; Q126-N160 WeakPolarHBondContact CA-OD1 3.2Å; Q126-W162 VanDerWaalsContact CD-CH2 3.49Å; Q126-W162 HydrophobicContact CG-CH2 3.66Å; Q126-W162 HydrophobicContact CG-CZ2 3.98Å; Q126-W162 HydrophobicContact CG-CZ3 4.49Å; Q126-W286 HydrophobicContact CB-CH2 3.71Å; Q126-W286 HydrophobicContact CB-CZ2 4.5Å; Q126-W286 HydrophobicContact CB-CZ3 3.85Å; Q126-W286 HydrophobicContact CG-CH2 4.37Å
127	C	85.1	Confident	91.2	Very high	77 Å²	77	38.9 Å²	38.9	52%	0.52	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	42.9	-177.8	-61.9	0	0	0	0	111.3	K125 N129 Q132 N160	K125-C127 VanDerWaalsContact C-N 3.32Å; K125-C127 HydrophobicContact CG-CB 4.47Å; K125-C127 PolarHBondContact O-N 2.98Å; C127-N129 VanDerWaalsContact C-N 3.31Å; C127-N129 PolarHBondContact O-N 3.03Å; C127-Q132 VanDerWaalsContact O-CD 3.28Å; C127-Q132 PolarHBondContact O-NE2 2.96Å; C127-Q132 VanDerWaalsContact O-NE2 3.08Å; C127-Q132 PolarHBondContact O-OE1 3.3Å; C127-N160 PolarHBondContact N-OD1 3.04Å
128	S	86.4	Confident	91.2	Very high	10 Å²	10	34.4 Å²	34.4	7%	0.07	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	39.7	-173.3	-164.1	0	0	0	0	113	L130 L131 Q132 V159 N160	S128-L130 PolarHBondContact O-N 3.49Å; S128-L130 VanDerWaalsContact O-N 3.13Å; S128-L131 PolarHBondContact O-N 3.16Å; S128-Q132 PolarHBondContact O-N 3.21Å; S128-V159 CarbonylContact C-O 3.52Å; S128-V159 VanDerWaalsContact C-O 3.31Å; S128-V159 VanDerWaalsContact CA-O 3.24Å; S128-V159 WeakPolarHBondContact CA-O 3.38Å; S128-V159 PolarHBondContact OG-N 3.28Å; S128-N160 WeakPolarHBondContact CA-OD1 3.24Å; S128-N160 PolarHBondContact N-OD1 3.13Å
129	N	86.1	Confident	91.4	Very high	2 Å²	2	37 Å²	37	1%	0.011	20%	0.2	C	C	.	.	H	α-helix	trans	-58.3	-27.3	-174.9	68.7	-22.3	0	0	0	113.1	K125 C127 E133 L134 N160 F161	K125-N129 HydrophobicContact CB-CB 4.22Å; K125-N129 WeakPolarHBondContact O-CB 3.41Å; K125-N129 PolarHBondContact O-ND2 3.2Å; K125-N129 PolarHBondContact O-OD1 2.86Å; C127-N129 VanDerWaalsContact C-N 3.31Å; C127-N129 PolarHBondContact O-N 3.03Å; N129-E133 HydrophobicContact CB-CG 4.34Å; N129-E133 WeakPolarHBondContact O-CA 3.38Å; N129-E133 VanDerWaalsContact O-CB 3.31Å; N129-E133 WeakPolarHBondContact O-CB 3.39Å; N129-E133 PolarHBondContact O-N 3.3Å; N129-L134 PolarHBondContact O-N 3.29Å; N129-N160 WeakPolarHBondContact OD1-CA 2.87Å; N129-F161 PolarHBondContact ND2-O 3.25Å; N129-F161 PolarHBondContact OD1-N 3.04Å
130	L	88.2	Confident	91.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-48.1	175	-178.8	63.2	0	0	0	111	W62 S128 L134 L137 L141 V159 F161 V283	W62-L130 HydrophobicContact CH2-CD1 4.4Å; S128-L130 PolarHBondContact O-N 3.49Å; S128-L130 VanDerWaalsContact O-N 3.13Å; L130-L134 HydrophobicContact CD1-CB 4.17Å; L130-L134 CarbonylContact O-C 3.55Å; L130-L134 WeakPolarHBondContact O-CA 3.47Å; L130-L134 PolarHBondContact O-N 3.46Å; L130-L134 VanDerWaalsContact O-O 3.13Å; L130-L137 HydrophobicContact CD1-CB 3.92Å; L130-L137 HydrophobicContact CD1-CD1 4.24Å; L130-L141 HydrophobicContact CD2-CD1 3.91Å; L130-L141 HydrophobicContact CD2-CD2 3.91Å; L130-L141 HydrophobicContact CD2-CG 4.46Å; L130-V159 HydrophobicContact CB-CG1 4.5Å; L130-V159 VanDerWaalsContact CB-O 3.31Å; L130-V159 WeakPolarHBondContact CB-O 3.44Å; L130-V159 HydrophobicContact CD2-CG1 3.67Å; L130-V159 PolarHBondContact N-O 3.34Å; L130-F161 HydrophobicContact CB-CB 4.06Å; L130-F161 HydrophobicContact CD1-CB 4.13Å; L130-F161 HydrophobicContact CD1-CD2 4.3Å; L130-V283 HydrophobicContact CD2-CG1 3.94Å; L130-V283 HydrophobicContact CD2-CG2 4.43Å
131	L	85.6	Confident	91.4	Very high	69 Å²	69	36.2 Å²	36.2	36%	0.361	19%	0.191	S	C	.	.	H	α-helix	trans	-76	-30.5	-178.1	-55.6	-176	0	0	0	112.5	S128 V138 V159	S128-L131 PolarHBondContact O-N 3.16Å; L131-V138 HydrophobicContact CD2-CG1 4.49Å; L131-V138 HydrophobicContact CD2-CG2 3.69Å; L131-V159 HydrophobicContact CD1-CB 4.29Å; L131-V159 HydrophobicContact CD1-CG2 3.99Å; L131-V159 HydrophobicContact CG-CB 4.14Å; L131-V159 HydrophobicContact CG-CG2 4.36Å
132	Q	87.9	Confident	91.3	Very high	131 Å²	131	38.9 Å²	38.9	61%	0.612	20%	0.203	S	C	*	.	H	α-helix	trans	-92.3	-42.2	-174.2	-64.2	-176	17.8	0	0	113.5	C127 S128	C127-Q132 VanDerWaalsContact O-CD 3.28Å; C127-Q132 PolarHBondContact O-NE2 2.96Å; C127-Q132 VanDerWaalsContact O-NE2 3.08Å; C127-Q132 PolarHBondContact O-OE1 3.3Å; S128-Q132 PolarHBondContact O-N 3.21Å
133	E	87.5	Confident	91	Very high	32 Å²	32	41.7 Å²	41.7	15%	0.15	22%	0.223	C	C	.	.	H	α-helix	trans	-101.7	-28.1	-174.4	-55.7	-171.8	175.8	0	0	112.5	I76 S77 K125 N129 P135	I76-E133 HydrophobicContact CG2-CB 4.3Å; S77-E133 PolarHBondContact N-OE2 2.98Å; K125-E133 WeakPolarHBondContact CD-OE1 3.46Å; K125-E133 WeakPolarHBondContact CE-OE1 3.19Å; K125-E133 IonicContact NZ-OE1 3.73Å; K125-E133 PolarHBondContact NZ-OE1 2.82Å; N129-E133 HydrophobicContact CB-CG 4.34Å; N129-E133 WeakPolarHBondContact O-CA 3.38Å; N129-E133 VanDerWaalsContact O-CB 3.31Å; N129-E133 WeakPolarHBondContact O-CB 3.39Å; N129-E133 PolarHBondContact O-N 3.3Å; E133-P135 WeakPolarHBondContact O-CD 3.37Å
134	L	91.9	Very high	90.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.237	C	C	.	.			trans	-125.3	45.6	-173.8	-58.6	177.1	0	0	0	113.9	I71 I76 F104 N129 L130 E136 L137 F161	I71-L134 HydrophobicContact CB-CD2 4.4Å; I71-L134 HydrophobicContact CD1-CD1 4.33Å; I71-L134 HydrophobicContact CD1-CD2 3.66Å; I76-L134 HydrophobicContact CG2-CD2 3.81Å; I76-L134 HydrophobicContact CG2-CG 4.43Å; F104-L134 HydrophobicContact CD2-CD2 4.35Å; F104-L134 HydrophobicContact CE2-CD1 4.35Å; N129-L134 PolarHBondContact O-N 3.29Å; L130-L134 HydrophobicContact CD1-CB 4.17Å; L130-L134 CarbonylContact O-C 3.55Å; L130-L134 WeakPolarHBondContact O-CA 3.47Å; L130-L134 PolarHBondContact O-N 3.46Å; L130-L134 VanDerWaalsContact O-O 3.13Å; L134-E136 PolarHBondContact O-N 3.25Å; L134-L137 HydrophobicContact CB-CD1 4.23Å; L134-L137 HydrophobicContact CB-CG 4.37Å; L134-L137 HydrophobicContact CD1-CD1 4.14Å; L134-L137 PolarHBondContact O-N 3.2Å; L134-F161 HydrophobicContact CD1-CB 4.09Å; L134-F161 HydrophobicContact CD1-CD1 3.73Å; L134-F161 HydrophobicContact CD1-CD2 4.28Å; L134-F161 HydrophobicContact CD1-CE1 4.22Å; L134-F161 HydrophobicContact CD1-CG 3.77Å
135	P	93.3	Very high	91.3	Very high	62 Å²	62	44.1 Å²	44.1	40%	0.403	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-59.9	-23.8	-175.3	26.8	-35.8	0	0	0	113.4	E133 L137 V138	E133-P135 WeakPolarHBondContact O-CD 3.37Å; P135-L137 PolarHBondContact O-N 3.11Å; P135-V138 WeakPolarHBondContact O-CB 3.43Å; P135-V138 WeakPolarHBondContact O-CG2 3.48Å; P135-V138 PolarHBondContact O-N 2.96Å; P135-V138 VanDerWaalsContact O-N 3.16Å
136	E	94.9	Very high	91.7	Very high	59 Å²	59	43.7 Å²	43.7	28%	0.276	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-65.1	-18.9	177.3	-65.4	81.1	-178.3	0	0	114.1	K70 I71 K74 L134	K70-E136 WeakPolarHBondContact CE-O 3.38Å; K70-E136 HydrophobicContact CG-CB 4.41Å; I71-E136 HydrophobicContact CG2-CB 3.88Å; K74-E136 WeakPolarHBondContact CE-OE1 3.25Å; K74-E136 VanDerWaalsContact CE-OE2 3.32Å; K74-E136 WeakPolarHBondContact CE-OE2 3.38Å; K74-E136 IonicContact NZ-OE1 3.93Å; K74-E136 PolarHBondContact NZ-OE1 2.67Å; K74-E136 IonicContact NZ-OE2 3.93Å; K74-E136 PolarHBondContact NZ-OE2 3.44Å; L134-E136 PolarHBondContact O-N 3.25Å
137	L	95.7	Very high	92.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-88.6	-11.9	177.3	-65	-170.7	0	0	0	113.1	W62 Y66 L67 K70 I71 L130 L134 P135 D139 D140 F161	W62-L137 HydrophobicContact CH2-CD1 4.19Å; W62-L137 HydrophobicContact CZ2-CB 3.83Å; W62-L137 HydrophobicContact CZ2-CD1 3.93Å; W62-L137 HydrophobicContact CZ2-CG 4.33Å; Y66-L137 HydrophobicContact CE1-CD2 4.4Å; L67-L137 HydrophobicContact CD2-CD1 4.13Å; L67-L137 HydrophobicContact CD2-CD2 3.83Å; K70-L137 HydrophobicContact CG-CD2 4.19Å; I71-L137 HydrophobicContact CD1-CD1 3.73Å; I71-L137 HydrophobicContact CD1-CD2 4.22Å; I71-L137 HydrophobicContact CD1-CG 4.08Å; I71-L137 HydrophobicContact CG2-CD2 4.16Å; I71-L137 HydrophobicContact CG2-CG 4.21Å; L130-L137 HydrophobicContact CD1-CB 3.92Å; L130-L137 HydrophobicContact CD1-CD1 4.24Å; L134-L137 HydrophobicContact CB-CD1 4.23Å; L134-L137 HydrophobicContact CB-CG 4.37Å; L134-L137 HydrophobicContact CD1-CD1 4.14Å; L134-L137 PolarHBondContact O-N 3.2Å; P135-L137 PolarHBondContact O-N 3.11Å; L137-D139 PolarHBondContact O-N 3.42Å; L137-D140 WeakPolarHBondContact O-CB 3.25Å; L137-D140 PolarHBondContact O-N 2.92Å; L137-F161 HydrophobicContact CD1-CD2 4.22Å; L137-F161 HydrophobicContact CD1-CE2 4.05Å
138	V	92.9	Very high	93.1	Very high	34 Å²	34	39 Å²	39	21%	0.206	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-64	-30.5	-174.1	176.1	0	0	0	0	111.8	L131 P135 D140 L141	L131-V138 HydrophobicContact CD2-CG1 4.49Å; L131-V138 HydrophobicContact CD2-CG2 3.69Å; P135-V138 WeakPolarHBondContact O-CB 3.43Å; P135-V138 WeakPolarHBondContact O-CG2 3.48Å; P135-V138 PolarHBondContact O-N 2.96Å; P135-V138 VanDerWaalsContact O-N 3.16Å; V138-D140 PolarHBondContact O-N 3.18Å; V138-D140 VanDerWaalsContact O-N 3.15Å; V138-L141 PolarHBondContact O-N 2.84Å
139	D	94.6	Very high	93.7	Very high	134 Å²	134	39.1 Å²	39.1	72%	0.717	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-67.1	-12.4	176.7	-65.9	-28	0	0	0	113.7	L137	L137-D139 PolarHBondContact O-N 3.42Å
140	D	97.4	Very high	94.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-93.4	-1.1	-179.3	-67.1	-34.6	0	0	0	113.8	P57 A58 R61 W62 Y66 L137 V138	P57-D140 HydrophobicContact CB-CB 4.31Å; P57-D140 WeakPolarHBondContact CD-O 3.34Å; A58-D140 HydrophobicContact CB-CB 4.15Å; A58-D140 WeakPolarHBondContact CB-O 3.47Å; A58-D140 PolarHBondContact N-O 2.82Å; R61-D140 WeakPolarHBondContact CD-OD1 3.4Å; R61-D140 IonicContact CZ-OD1 3.84Å; R61-D140 VanDerWaalsContact CZ-OD1 3.29Å; R61-D140 IonicContact NE-OD1 3.07Å; R61-D140 IonicContact NH1-OD1 2.97Å; R61-D140 PolarHBondContact NH1-OD1 3.31Å; W62-D140 HydrophobicContact CZ2-CB 4.41Å; W62-D140 PolarHBondContact NE1-OD2 3.24Å; W62-D140 VanDerWaalsContact NE1-OD2 3.11Å; Y66-D140 VanDerWaalsContact CE1-OD2 3.26Å; Y66-D140 WeakPolarHBondContact CE1-OD2 3.4Å; Y66-D140 PolarHBondContact OH-OD1 3.32Å; Y66-D140 PolarHBondContact OH-OD2 2.95Å; L137-D140 WeakPolarHBondContact O-CB 3.25Å; L137-D140 PolarHBondContact O-N 2.92Å; V138-D140 PolarHBondContact O-N 3.18Å; V138-D140 VanDerWaalsContact O-N 3.15Å
141	L	96.8	Very high	94.7	Very high	13 Å²	13	44.5 Å²	44.5	7%	0.068	24%	0.242	C	C	.	.	S	Bend	trans	-156	173.4	-179.3	56.8	83.3	0	0	0	112.1	W56 W62 L130 V138 V283	W56-L141 HydrophobicContact CD2-CB 3.54Å; W56-L141 HydrophobicContact CE3-CB 3.51Å; W56-L141 HydrophobicContact CG-CB 4.02Å; W56-L141 HydrophobicContact CH2-CB 4.49Å; W56-L141 HydrophobicContact CZ2-CB 4.48Å; W56-L141 HydrophobicContact CZ3-CB 4.02Å; W62-L141 HydrophobicContact CH2-CD2 3.43Å; W62-L141 VanDerWaalsContact CH2-CD2 3.43Å; W62-L141 HydrophobicContact CZ2-CD2 3.59Å; W62-L141 HydrophobicContact CZ3-CD2 4.45Å; L130-L141 HydrophobicContact CD2-CD1 3.91Å; L130-L141 HydrophobicContact CD2-CD2 3.91Å; L130-L141 HydrophobicContact CD2-CG 4.46Å; V138-L141 PolarHBondContact O-N 2.84Å; L141-V283 HydrophobicContact CD2-CG1 4.33Å; L141-V283 HydrophobicContact CD2-CG2 3.88Å
142	E	95.2	Very high	95.3	Very high	57 Å²	57	42 Å²	42	27%	0.266	23%	0.23	S	C	.	.			trans	-85.4	138.7	175.5	-68.4	167.7	138.5	0	0	111	H55 W56 H144 F285	H55-E142 IonicContact CD2-OE1 3.16Å; H55-E142 IonicContact CE1-OE2 3.98Å; H55-E142 PolarHBondContact CE1-OE2 3.5Å; H55-E142 IonicContact NE2-OE1 3.85Å; H55-E142 PolarHBondContact NE2-OE1 3.16Å; H55-E142 VanDerWaalsContact NE2-OE1 3.16Å; H55-E142 IonicContact NE2-OE2 2.73Å; H55-E142 PolarHBondContact NE2-OE2 2.88Å; W56-E142 HydrophobicContact CZ2-CB 4.13Å; W56-E142 PolarHBondContact NE1-OE2 3.23Å; E142-H144 VanDerWaalsContact CB-O 3.29Å; E142-H144 WeakPolarHBondContact CB-O 3.44Å; E142-H144 PolarHBondContact O-N 3.05Å; E142-F285 WeakPolarHBondContact O-CE1 3.34Å; E142-F285 WeakPolarHBondContact O-CZ 3.21Å
143	P	92.1	Very high	95.8	Very high	66 Å²	66	39.1 Å²	39.1	43%	0.429	24%	0.235	S	C	.	.	S	Bend	trans	-71.9	-8.6	179.5	29.4	-34.3	0	0	0	113	V159	P143-V159 WeakPolarHBondContact O-CG2 3.38Å
144	H	95.7	Very high	96.3	Very high	64 Å²	64	40 Å²	40	30%	0.296	24%	0.238	S	C	.	.	S	Bend	trans	-155.9	163.9	170.7	72.8	109	0	0	0	109.7	E142 P146 S149 P156	E142-H144 VanDerWaalsContact CB-O 3.29Å; E142-H144 WeakPolarHBondContact CB-O 3.44Å; E142-H144 PolarHBondContact O-N 3.05Å; H144-P146 WeakPolarHBondContact O-CD 3.42Å; H144-S149 WeakPolarHBondContact ND1-CB 3.08Å; H144-S149 PolarHBondContact ND1-OG 3.26Å; H144-P156 VanDerWaalsContact CB-CD 3.42Å; H144-P156 HydrophobicContact CB-CG 3.7Å
145	V	98.1	Very high	96.6	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	27%	0.265	C	S	.	.			trans	-92.5	110.8	175.3	179.5	0	0	0	0	109.4	W147 M148 S149 L180 M263 F285 Y287	V145-W147 HydrophobicContact CG1-CD2 3.81Å; V145-W147 HydrophobicContact CG1-CG 4.14Å; V145-W147 HydrophobicContact CG1-CH2 4.22Å; V145-W147 HydrophobicContact CG1-CZ2 3.5Å; V145-W147 VanDerWaalsContact CG1-NE1 3.26Å; V145-W147 PolarHBondContact O-N 2.8Å; V145-M148 HydrophobicContact CB-CB 4.02Å; V145-M148 HydrophobicContact CG1-CB 4Å; V145-M148 PolarHBondContact O-N 3.22Å; V145-M148 VanDerWaalsContact O-N 3.16Å; V145-S149 PolarHBondContact O-N 2.85Å; V145-S149 PolarHBondContact O-OG 3.02Å; V145-L180 HydrophobicContact CB-CD1 3.72Å; V145-L180 HydrophobicContact CG1-CD1 3.84Å; V145-L180 HydrophobicContact CG2-CD1 3.7Å; V145-M263 HydrophobicContact CG1-CE 4.36Å; V145-M263 HydrophobicContact CG2-CE 3.89Å; V145-F285 HydrophobicContact CG2-CD2 3.98Å; V145-F285 HydrophobicContact CG2-CE2 4.16Å; V145-F285 HydrophobicContact CG2-CG 4.21Å; V145-F285 HydrophobicContact CG2-CZ 4.44Å; V145-Y287 PolarHBondContact N-OH 3.36Å; V145-Y287 VanDerWaalsContact N-OH 3.11Å; V145-Y287 PolarHBondContact O-OH 3.32Å
146	P	98	Very high	96.8	Very high	52 Å²	52	42 Å²	42	34%	0.338	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-41.9	-166.7	-28.2	36.4	0	0	0	115	H144 T150	H144-P146 WeakPolarHBondContact O-CD 3.42Å; P146-T150 WeakPolarHBondContact O-CB 3.16Å; P146-T150 PolarHBondContact O-N 3.4Å; P146-T150 PolarHBondContact O-OG1 2.98Å
147	W	98.1	Very high	96.9	Very high	29 Å²	29	43.7 Å²	43.7	11%	0.11	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-33.5	-179.7	54.7	-99.8	0	0	0	112.1	P31 P33 F36 I49 V145 A151 L180 M263	P31-W147 HydrophobicContact CG-CD2 4.42Å; P31-W147 HydrophobicContact CG-CE3 4.01Å; P31-W147 HydrophobicContact CG-CH2 4.48Å; P31-W147 HydrophobicContact CG-CZ3 4.07Å; P33-W147 HydrophobicContact CG-CB 4.09Å; F36-W147 HydrophobicContact CD1-CE3 4.1Å; F36-W147 AromaticContact CD1-CZ3 3.56Å; F36-W147 HydrophobicContact CD1-CZ3 3.56Å; F36-W147 HydrophobicContact CD2-CZ3 4.16Å; F36-W147 HydrophobicContact CE1-CH2 4.33Å; F36-W147 AromaticContact CE1-CZ3 3.57Å; F36-W147 HydrophobicContact CE1-CZ3 3.57Å; F36-W147 HydrophobicContact CE2-CH2 4.47Å; F36-W147 HydrophobicContact CE2-CZ3 4.13Å; F36-W147 HydrophobicContact CG-CE3 4.25Å; F36-W147 AromaticContact CG-CZ3 3.86Å; F36-W147 HydrophobicContact CG-CZ3 3.86Å; F36-W147 HydrophobicContact CZ-CH2 4.2Å; F36-W147 AromaticContact CZ-CZ3 3.83Å; F36-W147 HydrophobicContact CZ-CZ3 3.83Å; I49-W147 HydrophobicContact CD1-CH2 3.54Å; I49-W147 HydrophobicContact CD1-CZ2 3.96Å; I49-W147 HydrophobicContact CD1-CZ3 4.49Å; V145-W147 HydrophobicContact CG1-CD2 3.81Å; V145-W147 HydrophobicContact CG1-CG 4.14Å; V145-W147 HydrophobicContact CG1-CH2 4.22Å; V145-W147 HydrophobicContact CG1-CZ2 3.5Å; V145-W147 VanDerWaalsContact CG1-NE1 3.26Å; V145-W147 PolarHBondContact O-N 2.8Å; W147-A151 WeakPolarHBondContact O-CB 3.4Å; W147-A151 PolarHBondContact O-N 3.24Å; W147-L180 HydrophobicContact CH2-CD1 3.82Å; W147-L180 HydrophobicContact CH2-CD2 3.98Å; W147-L180 HydrophobicContact CZ2-CD1 4.24Å; W147-L180 HydrophobicContact CZ3-CD1 4.4Å; W147-M263 HydrophobicContact CH2-SD 3.98Å; W147-M263 HydrophobicContact CZ2-CE 4.35Å; W147-M263 HydrophobicContact CZ2-SD 3.62Å
148	M	98.4	Very high	96.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.4	-46.3	175.5	-178.3	58.4	161.1	0	0	111.1	F36 I41 V145 T150 A151 L152 E178 L180 Y265 Y287	F36-M148 HydrophobicContact CD1-SD 3.97Å; F36-M148 HydrophobicContact CE1-CE 4.25Å; F36-M148 HydrophobicContact CE1-SD 3.56Å; F36-M148 VanDerWaalsContact CE1-SD 3.56Å; I41-M148 HydrophobicContact CD1-CE 4.27Å; I41-M148 HydrophobicContact CD1-SD 3.87Å; V145-M148 HydrophobicContact CB-CB 4.02Å; V145-M148 HydrophobicContact CG1-CB 4Å; V145-M148 PolarHBondContact O-N 3.22Å; V145-M148 VanDerWaalsContact O-N 3.16Å; M148-T150 PolarHBondContact O-N 3.04Å; M148-A151 WeakPolarHBondContact O-CB 3.38Å; M148-A151 PolarHBondContact O-N 2.79Å; M148-A151 VanDerWaalsContact O-N 3.09Å; M148-L152 HydrophobicContact CE-CD1 3.45Å; M148-L152 VanDerWaalsContact CE-CD1 3.45Å; M148-L152 HydrophobicContact CE-CG 4.13Å; M148-L152 HydrophobicContact CG-CD1 4.18Å; M148-L152 PolarHBondContact O-N 2.97Å; M148-L152 HydrophobicContact SD-CD1 3.89Å; M148-L152 HydrophobicContact SD-CG 4.08Å; M148-E178 HydrophobicContact CE-CB 3.65Å; M148-L180 HydrophobicContact CB-CD1 3.6Å; M148-L180 HydrophobicContact CE-CG 4.39Å; M148-L180 HydrophobicContact CG-CD1 3.58Å; M148-L180 HydrophobicContact CG-CG 4.22Å; M148-L180 HydrophobicContact SD-CD1 4.44Å; M148-Y265 HydrophobicContact CE-CD2 4.4Å; M148-Y265 HydrophobicContact CE-CE2 4.07Å; M148-Y287 HydrophobicContact CB-CE2 4.41Å; M148-Y287 HydrophobicContact CE-CD2 4.35Å; M148-Y287 HydrophobicContact CG-CD2 4.03Å; M148-Y287 HydrophobicContact CG-CE1 4.29Å; M148-Y287 HydrophobicContact CG-CE2 3.64Å
149	S	98.6	Very high	97.1	Very high	13 Å²	13	42.6 Å²	42.6	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-38.2	175.2	-71.2	0	0	0	0	112.3	H144 V145 G153 K154 Y287	H144-S149 WeakPolarHBondContact ND1-CB 3.08Å; H144-S149 PolarHBondContact ND1-OG 3.26Å; V145-S149 PolarHBondContact O-N 2.85Å; V145-S149 PolarHBondContact O-OG 3.02Å; S149-G153 VanDerWaalsContact O-CA 3.31Å; S149-G153 WeakPolarHBondContact O-CA 3.48Å; S149-G153 PolarHBondContact O-N 3.46Å; S149-K154 WeakPolarHBondContact CA-O 3.49Å; S149-K154 VanDerWaalsContact CB-O 3.26Å; S149-K154 WeakPolarHBondContact CB-O 3.33Å; S149-K154 PolarHBondContact O-N 3.19Å; S149-K154 PolarHBondContact OG-O 2.93Å; S149-Y287 WeakPolarHBondContact OG-CE1 3.29Å; S149-Y287 PolarHBondContact OG-OH 2.87Å
150	T	98.5	Very high	97.3	Very high	98 Å²	98	36.2 Å²	36.2	60%	0.601	22%	0.224	S	C	*	.	H	α-helix	trans	-68.3	-41.3	174.8	-56.6	0	0	0	0	111.5	P33 P146 M148	P33-T150 HydrophobicContact CB-CG2 3.83Å; P33-T150 HydrophobicContact CG-CG2 3.81Å; P146-T150 WeakPolarHBondContact O-CB 3.16Å; P146-T150 PolarHBondContact O-N 3.4Å; P146-T150 PolarHBondContact O-OG1 2.98Å; M148-T150 PolarHBondContact O-N 3.04Å
151	A	98.4	Very high	97.3	Very high	17 Å²	17	36.2 Å²	36.2	14%	0.14	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-42.9	179.6	0	0	0	0	0	112.1	P33 Y37 I41 W147 M148	P33-A151 HydrophobicContact CB-CB 4.05Å; P33-A151 WeakPolarHBondContact O-CB 3.13Å; Y37-A151 WeakPolarHBondContact CD2-O 3.48Å; I41-A151 HydrophobicContact CD1-CB 4.1Å; W147-A151 WeakPolarHBondContact O-CB 3.4Å; W147-A151 PolarHBondContact O-N 3.24Å; M148-A151 WeakPolarHBondContact O-CB 3.38Å; M148-A151 PolarHBondContact O-N 2.79Å; M148-A151 VanDerWaalsContact O-N 3.09Å
152	L	98.1	Very high	97.4	Very high	18 Å²	18	36 Å²	36	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-86.7	-15.2	-179.8	-68.7	177.8	0	0	0	113.9	Y37 I41 M148 K154 E178 Y287	Y37-L152 HydrophobicContact CE2-CD2 4.27Å; I41-L152 HydrophobicContact CD1-CD2 3.82Å; I41-L152 HydrophobicContact CD1-CG 4.12Å; I41-L152 HydrophobicContact CG2-CD2 4.03Å; M148-L152 HydrophobicContact CE-CD1 3.45Å; M148-L152 VanDerWaalsContact CE-CD1 3.45Å; M148-L152 HydrophobicContact CE-CG 4.13Å; M148-L152 HydrophobicContact CG-CD1 4.18Å; M148-L152 PolarHBondContact O-N 2.97Å; M148-L152 HydrophobicContact SD-CD1 3.89Å; M148-L152 HydrophobicContact SD-CG 4.08Å; L152-K154 VanDerWaalsContact C-N 3.26Å; L152-K154 HydrophobicContact CB-CG 3.96Å; L152-K154 PolarHBondContact O-N 2.85Å; L152-E178 HydrophobicContact CD1-CB 4.2Å; L152-E178 HydrophobicContact CD1-CG 4.32Å; L152-E178 HydrophobicContact CD2-CG 4.42Å; L152-Y287 VanDerWaalsContact CD1-CB 3.48Å; L152-Y287 HydrophobicContact CD1-CD1 3.88Å; L152-Y287 HydrophobicContact CD1-CD2 4.41Å; L152-Y287 HydrophobicContact CD1-CG 3.69Å
153	G	98.1	Very high	97.5	Very high	70 Å²	70	33.4 Å²	33.4	72%	0.722	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.1	21.7	-174.5	0	0	0	0	0	114.2	S149	S149-G153 VanDerWaalsContact O-CA 3.31Å; S149-G153 WeakPolarHBondContact O-CA 3.48Å; S149-G153 PolarHBondContact O-N 3.46Å
154	K	97.9	Very high	97.8	Very high	51 Å²	51	30.3 Å²	30.3	22%	0.222	19%	0.19	C	C	.	.	S	Bend	trans	-146	161.1	-177.9	71.8	-177.1	77.8	176.7	0	113	S149 L152 Y287 D288 E290	S149-K154 WeakPolarHBondContact CA-O 3.49Å; S149-K154 VanDerWaalsContact CB-O 3.26Å; S149-K154 WeakPolarHBondContact CB-O 3.33Å; S149-K154 PolarHBondContact O-N 3.19Å; S149-K154 PolarHBondContact OG-O 2.93Å; L152-K154 VanDerWaalsContact C-N 3.26Å; L152-K154 HydrophobicContact CB-CG 3.96Å; L152-K154 PolarHBondContact O-N 2.85Å; K154-Y287 HydrophobicContact CG-CD1 4.17Å; K154-D288 PolarHBondContact NZ-O 2.88Å; K154-E290 WeakPolarHBondContact CE-OE1 3.47Å; K154-E290 IonicContact NZ-OE1 2.68Å; K154-E290 PolarHBondContact NZ-OE1 2.91Å
155	S	97.6	Very high	97.9	Very high	81 Å²	81	28.6 Å²	28.6	57%	0.566	18%	0.182	S	C	*	.			trans	-85.1	161.4	170.3	-69.2	0	0	0	0	110.6
156	P	97.6	Very high	97.9	Very high	23 Å²	23	30.1 Å²	30.1	15%	0.149	20%	0.195	C	C	.	.			trans	-67.5	143.8	172.4	29.1	-34.5	0	0	0	110.5	H144 V159 F285 W286 Y287	H144-P156 VanDerWaalsContact CB-CD 3.42Å; H144-P156 HydrophobicContact CB-CG 3.7Å; P156-V159 HydrophobicContact CG-CG2 4.14Å; P156-F285 HydrophobicContact CB-CB 4.3Å; P156-F285 HydrophobicContact CG-CD1 4.28Å; P156-W286 CarbonylContact C-O 3Å; P156-W286 WeakPolarHBondContact CA-O 3.18Å; P156-W286 VanDerWaalsContact CB-O 3.32Å; P156-W286 WeakPolarHBondContact CB-O 3.44Å; P156-Y287 HydrophobicContact CB-CD1 4.2Å; P156-Y287 HydrophobicContact CB-CD2 4.31Å; P156-Y287 HydrophobicContact CB-CE1 3.98Å; P156-Y287 HydrophobicContact CB-CE2 4.06Å; P156-Y287 HydrophobicContact CB-CG 4.36Å; P156-Y287 HydrophobicContact CG-CE1 4.28Å; P156-Y287 VanDerWaalsContact N-CE1 3.31Å
157	D	96.6	Very high	97.8	Very high	95 Å²	95	32.8 Å²	32.8	51%	0.508	21%	0.207	S	C	.	.	S	Bend	trans	-77	-32.4	174.5	-75.7	22.3	0	0	0	111	Y177 W286 D288	D157-Y177 HydrophobicContact CB-CE1 4.25Å; D157-W286 PolarHBondContact N-O 3.27Å; D157-D288 WeakPolarHBondContact OD2-CB 3.46Å
158	A	96.4	Very high	97.8	Very high	9 Å²	9	31.5 Å²	31.5	7%	0.074	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	145.6	177.8	0	0	0	0	0	112.2	W286	A158-W286 HydrophobicContact CB-CB 4.36Å; A158-W286 HydrophobicContact CB-CE3 4.28Å; A158-W286 PolarHBondContact N-O 2.8Å; A158-W286 PolarHBondContact O-N 2.68Å
159	V	97.3	Very high	97.8	Very high	1 Å²	1	32 Å²	32	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	113.8	167.4	-168.1	0	0	0	0	108.2	S128 L130 L131 P143 P156 V283 N284 F285	S128-V159 CarbonylContact C-O 3.52Å; S128-V159 VanDerWaalsContact C-O 3.31Å; S128-V159 VanDerWaalsContact CA-O 3.24Å; S128-V159 WeakPolarHBondContact CA-O 3.38Å; S128-V159 PolarHBondContact OG-N 3.28Å; L130-V159 HydrophobicContact CB-CG1 4.5Å; L130-V159 VanDerWaalsContact CB-O 3.31Å; L130-V159 WeakPolarHBondContact CB-O 3.44Å; L130-V159 HydrophobicContact CD2-CG1 3.67Å; L130-V159 PolarHBondContact N-O 3.34Å; L131-V159 HydrophobicContact CD1-CB 4.29Å; L131-V159 HydrophobicContact CD1-CG2 3.99Å; L131-V159 HydrophobicContact CG-CB 4.14Å; L131-V159 HydrophobicContact CG-CG2 4.36Å; P143-V159 WeakPolarHBondContact O-CG2 3.38Å; P156-V159 HydrophobicContact CG-CG2 4.14Å; V159-V283 HydrophobicContact CG1-CG1 3.74Å; V159-N284 CarbonylContact C-O 3.41Å; V159-N284 WeakPolarHBondContact CA-O 3.35Å; V159-F285 HydrophobicContact CB-CD1 4.39Å; V159-F285 HydrophobicContact CB-CE1 4.44Å; V159-F285 HydrophobicContact CG1-CD1 3.86Å; V159-F285 HydrophobicContact CG1-CE1 3.58Å; V159-F285 HydrophobicContact CG1-CG 4.5Å; V159-F285 HydrophobicContact CG1-CZ 3.97Å; V159-F285 HydrophobicContact CG2-CD1 3.73Å; V159-F285 HydrophobicContact CG2-CE1 3.95Å
160	N	97.8	Very high	97.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	142.4	-174	-40.4	-64.3	0	0	0	112	Q126 C127 S128 N129 V283 N284	Q126-N160 VanDerWaalsContact C-OD1 3.26Å; Q126-N160 WeakPolarHBondContact CA-OD1 3.2Å; C127-N160 PolarHBondContact N-OD1 3.04Å; S128-N160 WeakPolarHBondContact CA-OD1 3.24Å; S128-N160 PolarHBondContact N-OD1 3.13Å; N129-N160 WeakPolarHBondContact OD1-CA 2.87Å; N160-V283 CarbonylContact O-C 3.55Å; N160-V283 VanDerWaalsContact O-CA 3.23Å; N160-V283 WeakPolarHBondContact O-CA 3.25Å; N160-N284 VanDerWaalsContact CB-OD1 3.26Å; N160-N284 WeakPolarHBondContact CB-OD1 3.44Å; N160-N284 PolarHBondContact N-O 3.14Å; N160-N284 PolarHBondContact ND2-OD1 3.35Å; N160-N284 PolarHBondContact O-N 2.88Å
161	F	98.1	Very high	97.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	136.5	172.5	177.5	-88.4	0	0	0	110	W62 F104 I123 N129 L130 L134 L137 L163 I281	W62-F161 AromaticContact CE3-CE2 3.99Å; W62-F161 HydrophobicContact CE3-CE2 3.99Å; W62-F161 AromaticContact CH2-CD2 3.89Å; W62-F161 HydrophobicContact CH2-CD2 3.89Å; W62-F161 HydrophobicContact CH2-CE2 4.01Å; W62-F161 AromaticContact CZ3-CD2 3.69Å; W62-F161 HydrophobicContact CZ3-CD2 3.69Å; W62-F161 AromaticContact CZ3-CE2 3.48Å; W62-F161 HydrophobicContact CZ3-CE2 3.48Å; W62-F161 VanDerWaalsContact CZ3-CE2 3.48Å; F104-F161 AromaticContact CE2-CE1 3.84Å; F104-F161 HydrophobicContact CE2-CE1 3.84Å; F104-F161 HydrophobicContact CE2-CZ 4.11Å; F104-F161 HydrophobicContact CZ-CE1 4.06Å; F104-F161 AromaticContact CZ-CZ 3.94Å; F104-F161 HydrophobicContact CZ-CZ 3.94Å; I123-F161 HydrophobicContact CD1-CE1 4.35Å; I123-F161 HydrophobicContact CG2-CD1 4.01Å; I123-F161 HydrophobicContact CG2-CE1 4.43Å; N129-F161 PolarHBondContact ND2-O 3.25Å; N129-F161 PolarHBondContact OD1-N 3.04Å; L130-F161 HydrophobicContact CB-CB 4.06Å; L130-F161 HydrophobicContact CD1-CB 4.13Å; L130-F161 HydrophobicContact CD1-CD2 4.3Å; L134-F161 HydrophobicContact CD1-CB 4.09Å; L134-F161 HydrophobicContact CD1-CD1 3.73Å; L134-F161 HydrophobicContact CD1-CD2 4.28Å; L134-F161 HydrophobicContact CD1-CE1 4.22Å; L134-F161 HydrophobicContact CD1-CG 3.77Å; L137-F161 HydrophobicContact CD1-CD2 4.22Å; L137-F161 HydrophobicContact CD1-CE2 4.05Å; F161-L163 HydrophobicContact CE1-CB 3.58Å; F161-L163 HydrophobicContact CE1-CD2 4.45Å; F161-L163 HydrophobicContact CZ-CB 3.97Å; F161-I281 HydrophobicContact CE2-CG2 3.68Å; F161-I281 HydrophobicContact CZ-CG2 3.94Å
162	W	98.4	Very high	97.7	Very high	9 Å²	9	27.5 Å²	27.5	3%	0.034	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.6	-178.9	-55.7	87.7	0	0	0	111	Y122 I123 Q124 Q126 I281 A282 N284	Y122-W162 HydrophobicContact CE1-CE3 4.03Å; Y122-W162 AromaticContact CE1-CZ3 3.97Å; Y122-W162 HydrophobicContact CE1-CZ3 3.97Å; Y122-W162 HydrophobicContact CE2-CB 4.43Å; Y122-W162 AromaticContact CE2-CE3 3.91Å; Y122-W162 HydrophobicContact CE2-CE3 3.91Å; Y122-W162 AromaticContact CZ-CE3 3.37Å; Y122-W162 AromaticContact CZ-CZ3 3.77Å; Y122-W162 WeakPolarHBondContact OH-CZ3 3.44Å; I123-W162 WeakPolarHBondContact O-CA 3.5Å; Q124-W162 HydrophobicContact CB-CE3 3.69Å; Q124-W162 HydrophobicContact CB-CH2 4.47Å; Q124-W162 HydrophobicContact CB-CZ3 3.43Å; Q124-W162 VanDerWaalsContact CB-CZ3 3.43Å; Q126-W162 VanDerWaalsContact CD-CH2 3.49Å; Q126-W162 HydrophobicContact CG-CH2 3.66Å; Q126-W162 HydrophobicContact CG-CZ2 3.98Å; Q126-W162 HydrophobicContact CG-CZ3 4.49Å; W162-I281 WeakPolarHBondContact O-CA 3.49Å; W162-A282 HydrophobicContact CB-CB 4.19Å; W162-A282 PolarHBondContact N-O 3.41Å; W162-A282 PolarHBondContact O-N 3.5Å; W162-N284 PolarHBondContact NE1-OD1 2.72Å
163	L	98.4	Very high	97.7	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.016	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	123.6	171.4	167	63.1	0	0	0	109.5	F104 L108 I111 Y122 I123 F161 C280 I281	F104-L163 HydrophobicContact CE1-CD2 4.11Å; F104-L163 HydrophobicContact CE2-CD2 4.41Å; F104-L163 HydrophobicContact CZ-CD2 3.64Å; L108-L163 HydrophobicContact CD2-CD2 3.93Å; I111-L163 HydrophobicContact CD1-CD1 3.79Å; I111-L163 HydrophobicContact CD1-CD2 4.11Å; I111-L163 HydrophobicContact CD1-CG 3.67Å; Y122-L163 WeakPolarHBondContact CD2-O 3.49Å; I123-L163 HydrophobicContact CB-CB 4.43Å; I123-L163 WeakPolarHBondContact CB-O 3.29Å; I123-L163 HydrophobicContact CD1-CB 4.03Å; I123-L163 HydrophobicContact CD1-CD2 4.03Å; I123-L163 HydrophobicContact CD1-CG 4.26Å; I123-L163 PolarHBondContact N-O 2.83Å; I123-L163 PolarHBondContact O-N 3.06Å; F161-L163 HydrophobicContact CE1-CB 3.58Å; F161-L163 HydrophobicContact CE1-CD2 4.45Å; F161-L163 HydrophobicContact CZ-CB 3.97Å; L163-C280 WeakPolarHBondContact CA-O 3.25Å; L163-I281 HydrophobicContact CD1-CG1 3.88Å
164	G	97.3	Very high	97.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	171.3	-177.7	0	0	0	0	0	115.2	G279	G164-G279 WeakPolarHBondContact O-CA 3.48Å; G164-G279 PolarHBondContact O-N 3.09Å
165	E	98.3	Very high	97.7	Very high	28 Å²	28	25.2 Å²	25.2	13%	0.131	15%	0.146	C	C	.	.			trans	-71.8	158.1	173.1	-63.8	-175.3	74.5	0	0	112.1	I111 V120 F121 N167 A168 Q276 H278	I111-E165 HydrophobicContact CG1-CG 4.15Å; V120-E165 WeakPolarHBondContact CA-OE2 3.32Å; V120-E165 HydrophobicContact CG1-CB 4.1Å; F121-E165 WeakPolarHBondContact CD2-OE2 3.26Å; F121-E165 PolarHBondContact N-OE2 3.04Å; F121-E165 PolarHBondContact O-N 2.92Å; E165-N167 PolarHBondContact O-N 3.29Å; E165-A168 WeakPolarHBondContact O-CB 3.39Å; E165-A168 PolarHBondContact O-N 3.37Å; E165-Q276 PolarHBondContact O-NE2 3.06Å; E165-H278 IonicContact OE1-CE1 3.17Å
166	A	97.4	Very high	97.7	Very high	35 Å²	35	23.6 Å²	23.6	29%	0.289	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.3	178.7	0	0	0	0	0	113.7	A168 Q276 H278	A166-A168 VanDerWaalsContact C-N 3.3Å; A166-Q276 WeakPolarHBondContact CA-O 3.23Å; A166-H278 HydrophobicContact CB-CB 3.85Å; A166-H278 PolarHBondContact N-ND1 3.08Å
167	N	97.2	Very high	97.8	Very high	109 Å²	109	25.3 Å²	25.3	58%	0.583	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-10.8	-179.5	-66.1	-19.7	0	0	0	112.6	G84 V120 E165 V169	G84-N167 VanDerWaalsContact CA-O 3.27Å; G84-N167 WeakPolarHBondContact CA-O 3.34Å; V120-N167 HydrophobicContact CG1-CB 4.04Å; V120-N167 HydrophobicContact CG2-CB 4.13Å; E165-N167 PolarHBondContact O-N 3.29Å; N167-V169 PolarHBondContact O-N 2.8Å
168	A	97.6	Very high	97.9	Very high	2 Å²	2	21 Å²	21	2%	0.017	11%	0.114	C	C	.	.			trans	-74	116.1	175.2	0	0	0	0	0	109.6	G84 V120 Y122 E165 A166 Q276	G84-A168 WeakPolarHBondContact O-CA 3.46Å; V120-A168 HydrophobicContact CG1-CB 3.9Å; Y122-A168 HydrophobicContact CD1-CB 3.92Å; Y122-A168 HydrophobicContact CD2-CB 4.44Å; Y122-A168 HydrophobicContact CG-CB 3.81Å; E165-A168 WeakPolarHBondContact O-CB 3.39Å; E165-A168 PolarHBondContact O-N 3.37Å; A166-A168 VanDerWaalsContact C-N 3.3Å; A168-Q276 PolarHBondContact O-NE2 3.2Å
169	V	97.6	Very high	98	Very high	10 Å²	10	20.8 Å²	20.8	6%	0.061	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.5	-175	179.4	0	0	0	0	109.3	G84 Y85 N167 H273 R275	G84-V169 PolarHBondContact O-N 3.17Å; Y85-V169 HydrophobicContact CD1-CB 4.19Å; Y85-V169 HydrophobicContact CD1-CG1 4.13Å; Y85-V169 HydrophobicContact CE1-CB 4.08Å; Y85-V169 HydrophobicContact CE1-CG1 3.75Å; Y85-V169 HydrophobicContact CE2-CB 4.41Å; Y85-V169 HydrophobicContact CE2-CG2 4.37Å; Y85-V169 HydrophobicContact CG-CB 4.45Å; N167-V169 PolarHBondContact O-N 2.8Å; V169-H273 WeakPolarHBondContact CG1-NE2 3.14Å; V169-R275 HydrophobicContact CG1-CG 4.42Å; V169-R275 HydrophobicContact CG2-CG 4.14Å
170	T	97.3	Very high	98.1	Very high	18 Å²	18	20.8 Å²	20.8	11%	0.11	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.9	169	-53.9	0	0	0	0	108.4	H173 H273 V274	T170-H173 WeakPolarHBondContact CG2-CE1 3.49Å; T170-H273 PolarHBondContact O-CD2 3.23Å; T170-V274 PolarHBondContact N-O 3.35Å; T170-V274 PolarHBondContact O-N 3.17Å; T170-V274 VanDerWaalsContact O-N 3.09Å
171	S	97.7	Very high	98.1	Very high	12 Å²	12	21.2 Å²	21.2	8%	0.084	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	165.3	-177.8	81.2	0	0	0	0	112.2	D87 H173 W232	D87-S171 PolarHBondContact O-OG 3.44Å; S171-H173 PolarHBondContact O-N 3.46Å; S171-H173 PolarHBondContact O-ND1 3.2Å; S171-W232 PolarHBondContact OG-NE1 2.9Å
172	M	98.4	Very high	98.2	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.015	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	122.1	-178.9	-175.8	66.9	74.9	0	0	110.7	I191 L193 I233 P237 F271 H272 H273	M172-I191 HydrophobicContact CE-CB 4.47Å; M172-I191 HydrophobicContact CE-CG2 4.04Å; M172-L193 HydrophobicContact CE-CD1 3.92Å; M172-I233 HydrophobicContact CB-CD1 4.45Å; M172-I233 HydrophobicContact CB-CG2 4.27Å; M172-I233 HydrophobicContact CG-CD1 3.85Å; M172-I233 HydrophobicContact CG-CG2 4.32Å; M172-P237 HydrophobicContact CB-CG 4.49Å; M172-P237 HydrophobicContact CE-CB 3.69Å; M172-P237 HydrophobicContact CE-CG 3.66Å; M172-F271 HydrophobicContact CG-CB 4.4Å; M172-F271 HydrophobicContact SD-CB 3.69Å; M172-H272 WeakPolarHBondContact CA-O 3.42Å; M172-H272 PolarHBondContact SD-N 3.41Å; M172-H272 VanDerWaalsContact SD-N 3.37Å; M172-H273 HydrophobicContact CB-CB 4.32Å; M172-H273 HydrophobicContact CE-CB 3.79Å; M172-H273 HydrophobicContact SD-CB 4.19Å
173	H	98.4	Very high	98.2	Very high	19 Å²	19	20.8 Å²	20.8	9%	0.088	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	178	178.9	67.8	-65.6	0	0	0	110.6	T170 S171 D175 W232 F271 H272	T170-H173 WeakPolarHBondContact CG2-CE1 3.49Å; S171-H173 PolarHBondContact O-N 3.46Å; S171-H173 PolarHBondContact O-ND1 3.2Å; H173-D175 IonicContact CD2-OD1 3.83Å; H173-D175 IonicContact NE2-OD1 3.24Å; H173-D175 IonicContact NE2-OD2 3.61Å; H173-W232 HydrophobicContact CB-CH2 3.94Å; H173-W232 HydrophobicContact CB-CZ2 3.71Å; H173-F271 CarbonylContact O-C 3.57Å; H173-F271 WeakPolarHBondContact O-CA 3.06Å; H173-H272 AromaticContact CD2-CE1 3.92Å; H173-H272 AromaticContact CE1-CD2 3.67Å; H173-H272 AromaticContact CE1-CE1 3.65Å; H173-H272 AromaticContact CE1-NE2 3.17Å; H173-H272 PolarHBondContact CE1-NE2 3.27Å; H173-H272 PolarHBondContact N-O 3.13Å; H173-H272 VanDerWaalsContact N-O 3.12Å; H173-H272 PolarHBondContact ND1-O 2.8Å; H173-H272 AromaticContact NE2-CE1 3.44Å; H173-H272 PolarHBondContact NE2-CE1 3.36Å; H173-H272 AromaticContact NE2-NE2 3.2Å; H173-H272 PolarHBondContact NE2-NE2 3.05Å; H173-H272 PolarHBondContact O-N 3.47Å; H173-H272 PolarHBondContact O-ND1 2.6Å
174	K	98.4	Very high	98.2	Very high	51 Å²	51	21 Å²	21	22%	0.222	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.2	174.6	65.9	175.5	174.1	71.3	0	110.3	L269 F271 F298	K174-L269 HydrophobicContact CD-CD2 4.46Å; K174-F271 HydrophobicContact CB-CD1 3.93Å; K174-F271 HydrophobicContact CB-CE1 4.18Å; K174-F271 HydrophobicContact CB-CG 4.42Å; K174-F271 HydrophobicContact CD-CD1 4.33Å; K174-F271 HydrophobicContact CD-CE1 3.7Å; K174-F271 HydrophobicContact CD-CZ 3.93Å; K174-F271 HydrophobicContact CG-CD1 4.27Å; K174-F271 HydrophobicContact CG-CE1 4.05Å; K174-F298 HydrophobicContact CD-CE1 4.05Å; K174-F298 HydrophobicContact CD-CZ 3.65Å; K174-F298 VanDerWaalsContact CE-CE1 3.49Å; K174-F298 VanDerWaalsContact CE-CZ 3.42Å
175	D	98.3	Very high	98.3	Very high	22 Å²	22	23.4 Å²	23.4	12%	0.118	13%	0.13	C	C	.	.			trans	-116.8	146.8	177.8	-64.5	-43.7	0	0	0	112	H173 Y177 L269 H272	H173-D175 IonicContact CD2-OD1 3.83Å; H173-D175 IonicContact NE2-OD1 3.24Å; H173-D175 IonicContact NE2-OD2 3.61Å; D175-Y177 HydrophobicContact CB-CD2 4.26Å; D175-Y177 PolarHBondContact O-N 3.26Å; D175-Y177 VanDerWaalsContact O-N 3.15Å; D175-L269 PolarHBondContact O-N 3.2Å; D175-H272 IonicContact OD2-CE1 3.42Å; D175-H272 PolarHBondContact OD2-CE1 2.96Å; D175-H272 IonicContact OD2-NE2 3.57Å
176	P	97.8	Very high	98.3	Very high	47 Å²	47	23.6 Å²	23.6	31%	0.305	14%	0.139	S	C	.	.	S	Bend	trans	-82.1	33.6	171.2	37.1	-36.3	0	0	0	112.3	M289	P176-M289 HydrophobicContact CB-CG 4.42Å; P176-M289 HydrophobicContact CB-SD 4.11Å; P176-M289 WeakPolarHBondContact O-CB 3.48Å; P176-M289 VanDerWaalsContact O-CG 3.24Å; P176-M289 WeakPolarHBondContact O-CG 3.17Å; P176-M289 PolarHBondContact O-N 3.38Å; P176-M289 VanDerWaalsContact O-N 3.13Å
177	Y	98.6	Very high	98.3	Very high	58 Å²	58	25 Å²	25	23%	0.227	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	143.3	-176.4	-67.2	-78.1	0	0	0	111.4	D157 D175 N179 S268 W286 Y287 D288	D157-Y177 HydrophobicContact CB-CE1 4.25Å; D175-Y177 HydrophobicContact CB-CD2 4.26Å; D175-Y177 PolarHBondContact O-N 3.26Å; D175-Y177 VanDerWaalsContact O-N 3.15Å; Y177-N179 PolarHBondContact O-N 3.27Å; Y177-S268 WeakPolarHBondContact O-CA 3.44Å; Y177-S268 PolarHBondContact O-N 3Å; Y177-W286 HydrophobicContact CD1-CB 3.77Å; Y177-W286 HydrophobicContact CD1-CG 4.25Å; Y177-W286 AromaticContact CD2-CD2 3.81Å; Y177-W286 HydrophobicContact CD2-CD2 3.81Å; Y177-W286 AromaticContact CD2-CE3 3.82Å; Y177-W286 HydrophobicContact CD2-CE3 3.82Å; Y177-W286 HydrophobicContact CD2-CG 4.17Å; Y177-W286 HydrophobicContact CD2-CH2 4.46Å; Y177-W286 HydrophobicContact CD2-CZ3 4.17Å; Y177-W286 HydrophobicContact CE1-CB 4.36Å; Y177-W286 HydrophobicContact CE2-CD2 4.26Å; Y177-W286 AromaticContact CE2-CE3 3.78Å; Y177-W286 HydrophobicContact CE2-CE3 3.78Å; Y177-W286 AromaticContact CE2-CZ3 3.94Å; Y177-W286 HydrophobicContact CE2-CZ3 3.94Å; Y177-W286 HydrophobicContact CG-CB 3.87Å; Y177-W286 HydrophobicContact CG-CD2 4Å; Y177-W286 HydrophobicContact CG-CE3 4.3Å; Y177-W286 AromaticContact CG-CG 3.85Å; Y177-W286 HydrophobicContact CG-CG 3.85Å; Y177-Y287 CarbonylContact C-O 3.56Å; Y177-Y287 WeakPolarHBondContact CA-O 3.43Å; Y177-D288 HydrophobicContact CD1-CB 4.45Å; Y177-D288 HydrophobicContact CE1-CB 4.28Å
178	E	98.8	Very high	98.4	Very high	5 Å²	5	19.9 Å²	19.9	2%	0.023	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	112.2	160.5	-56.2	-67.9	-173.1	0	0	107.8	M148 L152 Y265 P267 S268 Y287	M148-E178 HydrophobicContact CE-CB 3.65Å; L152-E178 HydrophobicContact CD1-CB 4.2Å; L152-E178 HydrophobicContact CD1-CG 4.32Å; L152-E178 HydrophobicContact CD2-CG 4.42Å; E178-Y265 HydrophobicContact CB-CE2 4.28Å; E178-Y265 WeakPolarHBondContact OE2-CE2 3.45Å; E178-Y265 PolarHBondContact OE2-OH 2.95Å; E178-P267 WeakPolarHBondContact OE2-CA 3.39Å; E178-S268 PolarHBondContact OE2-N 2.86Å; E178-Y287 PolarHBondContact N-O 3.32Å; E178-Y287 PolarHBondContact O-N 3.36Å; E178-Y287 VanDerWaalsContact O-N 3.07Å
179	N	98.8	Very high	98.5	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.027	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.9	-168.6	-172.5	-1	0	0	0	111.1	Y177 L266 N284 F285 W286	Y177-N179 PolarHBondContact O-N 3.27Å; N179-L266 HydrophobicContact CB-CB 4.11Å; N179-L266 HydrophobicContact CB-CG 4.45Å; N179-L266 PolarHBondContact N-O 2.8Å; N179-L266 PolarHBondContact O-N 2.84Å; N179-N284 WeakPolarHBondContact OD1-CB 3.49Å; N179-N284 PolarHBondContact OD1-ND2 2.7Å; N179-F285 WeakPolarHBondContact CA-O 3.29Å; N179-W286 VanDerWaalsContact CG-CD1 3.48Å; N179-W286 PolarHBondContact ND2-NE1 3.44Å; N179-W286 VanDerWaalsContact ND2-NE1 3.19Å
180	L	98.9	Very high	98.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	106	167.2	-65.8	-175.9	0	0	0	109.7	V145 W147 M148 M263 L264 Y265 N284 F285 Y287	V145-L180 HydrophobicContact CB-CD1 3.72Å; V145-L180 HydrophobicContact CG1-CD1 3.84Å; V145-L180 HydrophobicContact CG2-CD1 3.7Å; W147-L180 HydrophobicContact CH2-CD1 3.82Å; W147-L180 HydrophobicContact CH2-CD2 3.98Å; W147-L180 HydrophobicContact CZ2-CD1 4.24Å; W147-L180 HydrophobicContact CZ3-CD1 4.4Å; M148-L180 HydrophobicContact CB-CD1 3.6Å; M148-L180 HydrophobicContact CE-CG 4.39Å; M148-L180 HydrophobicContact CG-CD1 3.58Å; M148-L180 HydrophobicContact CG-CG 4.22Å; M148-L180 HydrophobicContact SD-CD1 4.44Å; L180-M263 HydrophobicContact CB-CG 4.32Å; L180-M263 HydrophobicContact CB-SD 4.11Å; L180-M263 HydrophobicContact CD1-CE 4.47Å; L180-M263 HydrophobicContact CD1-SD 3.94Å; L180-M263 HydrophobicContact CD2-CG 4.41Å; L180-M263 HydrophobicContact CD2-SD 3.93Å; L180-M263 HydrophobicContact CG-SD 4.23Å; L180-L264 WeakPolarHBondContact CA-O 3.35Å; L180-Y265 HydrophobicContact CD2-CD2 3.89Å; L180-Y265 HydrophobicContact CD2-CG 4.32Å; L180-N284 CarbonylContact O-C 3.48Å; L180-N284 WeakPolarHBondContact O-CA 3.47Å; L180-F285 HydrophobicContact CB-CB 4.38Å; L180-F285 HydrophobicContact CB-CD2 4.42Å; L180-F285 PolarHBondContact N-O 3.05Å; L180-F285 PolarHBondContact O-N 3.12Å; L180-Y287 HydrophobicContact CD1-CE2 4.39Å
181	Y	98.9	Very high	98.6	Very high	10 Å²	10	22 Å²	22	4%	0.039	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.3	-176.2	-150	-75.8	0	0	0	110.9	V183 K188 F190 M263 L264 A282 N284	Y181-V183 HydrophobicContact CD1-CG2 4.49Å; Y181-K188 HydrophobicContact CE1-CD 3.93Å; Y181-K188 HydrophobicContact CE1-CG 3.92Å; Y181-K188 PolarHBondContact OH-NZ 3.19Å; Y181-F190 HydrophobicContact CD1-CE2 4.48Å; Y181-F190 AromaticContact CD1-CZ 3.91Å; Y181-F190 HydrophobicContact CD1-CZ 3.91Å; Y181-F190 HydrophobicContact CD2-CZ 4.15Å; Y181-F190 HydrophobicContact CE1-CZ 4.14Å; Y181-F190 HydrophobicContact CE2-CZ 4.39Å; Y181-F190 AromaticContact CG-CZ 3.91Å; Y181-F190 HydrophobicContact CG-CZ 3.91Å; Y181-M263 CarbonylContact O-C 3.45Å; Y181-M263 WeakPolarHBondContact O-CA 3.3Å; Y181-L264 PolarHBondContact N-O 3.26Å; Y181-L264 PolarHBondContact O-N 3.34Å; Y181-A282 HydrophobicContact CD1-CB 4.21Å; Y181-A282 HydrophobicContact CE1-CB 3.49Å; Y181-A282 VanDerWaalsContact CE1-CB 3.49Å; Y181-N284 HydrophobicContact CD2-CB 3.7Å; Y181-N284 HydrophobicContact CE2-CB 4.1Å; Y181-N284 HydrophobicContact CG-CB 4.14Å
182	C	98.8	Very high	98.7	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.5	-174.5	-49.7	0	0	0	0	110.2	F53 W56 M263 A282 V283	F53-C182 HydrophobicContact CD1-CB 4.37Å; F53-C182 HydrophobicContact CE1-CB 3.93Å; F53-C182 HydrophobicContact CE2-CB 4.31Å; F53-C182 HydrophobicContact CZ-CB 3.88Å; W56-C182 HydrophobicContact CZ3-CB 4.24Å; C182-M263 WeakPolarHBondContact SG-CE 3.49Å; C182-A282 CarbonylContact O-C 3.5Å; C182-A282 VanDerWaalsContact O-CA 3.25Å; C182-A282 WeakPolarHBondContact O-CA 3.46Å; C182-A282 WeakPolarHBondContact O-CB 3.24Å; C182-V283 WeakPolarHBondContact CA-O 3.41Å; C182-V283 VanDerWaalsContact CB-O 3.29Å; C182-V283 WeakPolarHBondContact CB-O 3.26Å; C182-V283 PolarHBondContact N-O 3.03Å; C182-V283 PolarHBondContact O-N 2.98Å
183	V	98.9	Very high	98.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.4	176.1	179.6	0	0	0	0	109.3	F53 Y181 G186 K188 V258 K259 A260 G261 E262 A282	F53-V183 WeakPolarHBondContact CZ-O 3.47Å; Y181-V183 HydrophobicContact CD1-CG2 4.49Å; V183-G186 WeakPolarHBondContact CG1-O 3.17Å; V183-K188 HydrophobicContact CG2-CB 4.08Å; V183-K188 HydrophobicContact CG2-CG 3.82Å; V183-V258 HydrophobicContact CB-CG1 4.28Å; V183-V258 HydrophobicContact CG2-CB 3.89Å; V183-V258 HydrophobicContact CG2-CG1 3.66Å; V183-K259 WeakPolarHBondContact CB-O 3.38Å; V183-A260 CarbonylContact O-C 3.26Å; V183-A260 WeakPolarHBondContact O-CA 3.35Å; V183-G261 PolarHBondContact O-N 3.48Å; V183-E262 PolarHBondContact N-O 3.08Å; V183-E262 VanDerWaalsContact N-O 3.11Å; V183-A282 HydrophobicContact CG2-CB 4.49Å
184	I	98.7	Very high	98.7	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.031	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-43.8	-179.2	-51.9	-56.3	0	0	0	110.4	F53 W56 A58 L59 W62 I281 V283	F53-I184 HydrophobicContact CD2-CD1 4.33Å; F53-I184 HydrophobicContact CE2-CD1 3.81Å; W56-I184 HydrophobicContact CE3-CD1 4.1Å; W56-I184 HydrophobicContact CZ3-CD1 4.24Å; A58-I184 HydrophobicContact CB-CD1 4.45Å; A58-I184 HydrophobicContact CB-CG2 4.09Å; A58-I184 WeakPolarHBondContact O-CG2 3.42Å; L59-I184 HydrophobicContact CD2-CG2 4.46Å; W62-I184 HydrophobicContact CB-CG2 4.22Å; W62-I184 HydrophobicContact CD2-CG2 4.31Å; W62-I184 HydrophobicContact CE3-CB 4.2Å; W62-I184 HydrophobicContact CE3-CG1 4.03Å; W62-I184 HydrophobicContact CE3-CG2 3.83Å; W62-I184 HydrophobicContact CG-CG2 4.49Å; W62-I184 HydrophobicContact CZ3-CG1 3.99Å; I184-I281 HydrophobicContact CB-CB 4.4Å; I184-I281 HydrophobicContact CB-CG2 4.23Å; I184-I281 PolarHBondContact N-O 2.81Å; I184-V283 HydrophobicContact CG1-CG2 4.25Å
185	S	98.6	Very high	98.7	Very high	52 Å²	52	18.6 Å²	18.6	36%	0.364	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	142.2	178.7	-177.9	0	0	0	0	110.5	C280 I281	S185-C280 WeakPolarHBondContact O-CA 3.37Å; S185-C280 PolarHBondContact O-SG 3.29Å; S185-I281 PolarHBondContact N-O 3.08Å; S185-I281 VanDerWaalsContact N-O 3.09Å; S185-I281 PolarHBondContact O-N 3.12Å
186	G	98.5	Very high	98.7	Very high	31 Å²	31	18.1 Å²	18.1	32%	0.32	10%	0.103	S	C	.	.	S	Bend	trans	81	-149	-176	0	0	0	0	0	113.3	V183 A260 S277	V183-G186 WeakPolarHBondContact CG1-O 3.17Å; G186-A260 PolarHBondContact O-N 3.37Å; G186-S277 VanDerWaalsContact CA-OG 3.31Å; G186-S277 WeakPolarHBondContact CA-OG 3.32Å
187	E	98.8	Very high	98.7	Very high	66 Å²	66	15.9 Å²	15.9	31%	0.308	9%	0.089	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	150.6	177.9	57.6	-177.1	-166.4	0	0	112.5	H189 T257 V258 K259 Q276 S277	E187-H189 IonicContact OE1-CE1 2.66Å; E187-H189 PolarHBondContact OE1-CE1 3.31Å; E187-H189 VanDerWaalsContact OE1-CE1 3.23Å; E187-H189 IonicContact OE1-NE2 3.29Å; E187-T257 HydrophobicContact CB-CG2 3.98Å; E187-T257 HydrophobicContact CG-CG2 4.43Å; E187-V258 CarbonylContact C-O 3.6Å; E187-V258 VanDerWaalsContact CA-O 3.28Å; E187-V258 WeakPolarHBondContact CA-O 3.22Å; E187-K259 HydrophobicContact CB-CG 4.38Å; E187-Q276 CarbonylContact O-C 3.58Å; E187-Q276 WeakPolarHBondContact O-CA 3.31Å; E187-S277 PolarHBondContact N-OG 3.43Å; E187-S277 PolarHBondContact O-N 3.25Å
188	K	98.9	Very high	98.6	Very high	1 Å²	1	13.3 Å²	13.3	0%	0.004	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135	174.5	-72.1	-92.4	171.6	169.5	0	109.4	Y122 Y181 V183 F190 T257 V258 V274 R275 Q276	Y122-K188 PolarHBondContact OH-NZ 2.83Å; Y181-K188 HydrophobicContact CE1-CD 3.93Å; Y181-K188 HydrophobicContact CE1-CG 3.92Å; Y181-K188 PolarHBondContact OH-NZ 3.19Å; V183-K188 HydrophobicContact CG2-CB 4.08Å; V183-K188 HydrophobicContact CG2-CG 3.82Å; K188-F190 HydrophobicContact CB-CD2 4.19Å; K188-F190 HydrophobicContact CB-CE2 3.5Å; K188-F190 VanDerWaalsContact CB-CE2 3.5Å; K188-F190 HydrophobicContact CB-CZ 4.21Å; K188-F190 HydrophobicContact CG-CE2 4.47Å; K188-T257 CarbonylContact O-C 3.31Å; K188-T257 VanDerWaalsContact O-CA 3.3Å; K188-T257 WeakPolarHBondContact O-CA 3.46Å; K188-V258 PolarHBondContact N-O 2.9Å; K188-V258 PolarHBondContact O-N 3.46Å; K188-V274 HydrophobicContact CD-CG1 3.74Å; K188-R275 CarbonylContact C-O 3.46Å; K188-R275 WeakPolarHBondContact CA-O 3.14Å; K188-Q276 HydrophobicContact CD-CB 3.88Å; K188-Q276 VanDerWaalsContact CE-OE1 3.27Å
189	H	98.8	Very high	98.5	Very high	49 Å²	49	13.3 Å²	13.3	23%	0.227	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121	177.5	-47.1	-75.8	0	0	0	109.4	E187 T257 V274 R275	E187-H189 IonicContact OE1-CE1 2.66Å; E187-H189 PolarHBondContact OE1-CE1 3.31Å; E187-H189 VanDerWaalsContact OE1-CE1 3.23Å; E187-H189 IonicContact OE1-NE2 3.29Å; H189-T257 WeakPolarHBondContact ND1-CG2 3.42Å; H189-T257 PolarHBondContact ND1-OG1 3.2Å; H189-V274 WeakPolarHBondContact O-CA 3.24Å; H189-R275 HydrophobicContact CB-CB 4.31Å; H189-R275 PolarHBondContact N-O 3.29Å; H189-R275 PolarHBondContact O-N 2.74Å
190	F	98.9	Very high	98.3	Very high	3 Å²	3	13.2 Å²	13.2	1%	0.013	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	136.3	-178.7	-68.3	-97.9	0	0	0	110.5	Y181 K188 L192 C255 C256 V258 L264 H273 V274	Y181-F190 HydrophobicContact CD1-CE2 4.48Å; Y181-F190 AromaticContact CD1-CZ 3.91Å; Y181-F190 HydrophobicContact CD1-CZ 3.91Å; Y181-F190 HydrophobicContact CD2-CZ 4.15Å; Y181-F190 HydrophobicContact CE1-CZ 4.14Å; Y181-F190 HydrophobicContact CE2-CZ 4.39Å; Y181-F190 AromaticContact CG-CZ 3.91Å; Y181-F190 HydrophobicContact CG-CZ 3.91Å; K188-F190 HydrophobicContact CB-CD2 4.19Å; K188-F190 HydrophobicContact CB-CE2 3.5Å; K188-F190 VanDerWaalsContact CB-CE2 3.5Å; K188-F190 HydrophobicContact CB-CZ 4.21Å; K188-F190 HydrophobicContact CG-CE2 4.47Å; F190-L192 HydrophobicContact CB-CD2 3.84Å; F190-L192 HydrophobicContact CB-CG 4.09Å; F190-L192 HydrophobicContact CD1-CD2 4.16Å; F190-L192 HydrophobicContact CG-CD2 4.4Å; F190-C255 WeakPolarHBondContact O-CA 3.17Å; F190-C256 PolarHBondContact N-O 3.47Å; F190-C256 PolarHBondContact O-N 2.72Å; F190-V258 HydrophobicContact CD2-CG2 3.83Å; F190-V258 HydrophobicContact CE2-CB 4.41Å; F190-V258 HydrophobicContact CE2-CG2 3.7Å; F190-L264 HydrophobicContact CD1-CD2 3.93Å; F190-L264 HydrophobicContact CD2-CD2 3.75Å; F190-L264 HydrophobicContact CE1-CD2 3.97Å; F190-L264 HydrophobicContact CE2-CD2 3.78Å; F190-L264 HydrophobicContact CG-CD2 3.83Å; F190-L264 HydrophobicContact CZ-CD2 3.91Å; F190-H273 WeakPolarHBondContact CA-O 3.28Å; F190-V274 HydrophobicContact CD1-CB 4.47Å; F190-V274 HydrophobicContact CD1-CG1 4.24Å; F190-V274 HydrophobicContact CD1-CG2 3.65Å; F190-V274 HydrophobicContact CE1-CB 4.32Å; F190-V274 HydrophobicContact CE1-CG1 3.87Å; F190-V274 HydrophobicContact CE1-CG2 3.49Å; F190-V274 VanDerWaalsContact CE1-CG2 3.49Å; F190-V274 HydrophobicContact CE2-CG1 4.4Å; F190-V274 HydrophobicContact CZ-CG1 3.95Å; F190-V274 HydrophobicContact CZ-CG2 4.37Å
191	I	98.8	Very high	98.2	Very high	22 Å²	22	13.4 Å²	13.4	11%	0.113	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122	158.8	-60.6	173.8	0	0	0	106.1	M172 P237 L238 P253 H272 H273	M172-I191 HydrophobicContact CE-CB 4.47Å; M172-I191 HydrophobicContact CE-CG2 4.04Å; I191-P237 HydrophobicContact CD1-CB 4.13Å; I191-P237 HydrophobicContact CD1-CG 4.13Å; I191-P237 HydrophobicContact CG2-CB 4.27Å; I191-L238 HydrophobicContact CD1-CD2 3.64Å; I191-L238 HydrophobicContact CD1-CG 4.39Å; I191-P253 HydrophobicContact CG2-CB 3.76Å; I191-H272 CarbonylContact O-C 3.54Å; I191-H272 VanDerWaalsContact O-CA 3.24Å; I191-H272 WeakPolarHBondContact O-CA 3.49Å; I191-H273 HydrophobicContact CB-CB 4.33Å; I191-H273 PolarHBondContact N-O 2.97Å; I191-H273 PolarHBondContact O-N 3.07Å
192	L	98.9	Very high	98.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.4	-174.7	-54.2	-179.2	0	0	0	110.3	V24 P46 F190 P253 L254 L266 W270 F271 H272	V24-L192 HydrophobicContact CG2-CD1 4.05Å; P46-L192 HydrophobicContact CB-CD1 4.09Å; P46-L192 HydrophobicContact CG-CD1 4.23Å; F190-L192 HydrophobicContact CB-CD2 3.84Å; F190-L192 HydrophobicContact CB-CG 4.09Å; F190-L192 HydrophobicContact CD1-CD2 4.16Å; F190-L192 HydrophobicContact CG-CD2 4.4Å; L192-P253 CarbonylContact O-C 3.56Å; L192-P253 WeakPolarHBondContact O-CA 3.37Å; L192-L254 HydrophobicContact CB-CB 4.27Å; L192-L254 PolarHBondContact N-O 2.93Å; L192-L254 PolarHBondContact O-N 3.15Å; L192-L266 HydrophobicContact CD2-CD1 3.78Å; L192-W270 HydrophobicContact CB-CE3 3.9Å; L192-W270 HydrophobicContact CB-CZ3 4.08Å; L192-F271 CarbonylContact C-O 3.58Å; L192-F271 VanDerWaalsContact CA-O 3.32Å; L192-F271 WeakPolarHBondContact CA-O 3.39Å; L192-H272 HydrophobicContact CD2-CB 3.49Å; L192-H272 VanDerWaalsContact CD2-CB 3.49Å
193	L	98.6	Very high	98	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.3	169.6	-69.8	157.9	0	0	0	109	M172 D197 I201 Y248 A251 P253 F271	M172-L193 HydrophobicContact CE-CD1 3.92Å; L193-D197 HydrophobicContact CB-CB 4.4Å; L193-D197 HydrophobicContact CD2-CB 4.41Å; L193-D197 WeakPolarHBondContact CD2-OD2 3.44Å; L193-I201 HydrophobicContact CB-CD1 4.05Å; L193-I201 HydrophobicContact CD1-CD1 3.92Å; L193-I201 HydrophobicContact CD1-CG1 4.18Å; L193-Y248 HydrophobicContact CD1-CE2 3.73Å; L193-A251 HydrophobicContact CD2-CB 3.81Å; L193-P253 HydrophobicContact CD2-CB 4.02Å; L193-P253 HydrophobicContact CG-CB 4.41Å; L193-F271 HydrophobicContact CB-CB 4.08Å; L193-F271 HydrophobicContact CB-CD2 4.43Å; L193-F271 PolarHBondContact N-O 3.09Å; L193-F271 PolarHBondContact O-N 3.13Å
194	P	98.5	Very high	97.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.103	C	C	.	.			trans	-66.3	157.1	-179.5	31.5	-38.4	0	0	0	110.8	L20 T196 D197 W270	L20-P194 HydrophobicContact CD1-CB 3.64Å; L20-P194 HydrophobicContact CD1-CG 3.62Å; L20-P194 HydrophobicContact CD2-CB 4.21Å; P194-T196 WeakPolarHBondContact CG-OG1 3.42Å; P194-T196 PolarHBondContact O-N 3.02Å; P194-D197 HydrophobicContact CG-CB 4.13Å; P194-D197 PolarHBondContact O-N 2.71Å; P194-W270 HydrophobicContact CB-CE3 4.44Å; P194-W270 HydrophobicContact CB-CH2 3.76Å; P194-W270 HydrophobicContact CB-CZ2 3.83Å; P194-W270 HydrophobicContact CB-CZ3 4.07Å
195	P	98.4	Very high	97.6	Very high	13 Å²	13	22.7 Å²	22.7	8%	0.084	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-55.6	-28.2	174.9	-21.6	29.9	0	0	0	112.9	D197 R198 L269 F298	P195-D197 PolarHBondContact O-N 3.42Å; P195-R198 VanDerWaalsContact O-CB 3.25Å; P195-R198 WeakPolarHBondContact O-CB 3.36Å; P195-R198 PolarHBondContact O-N 3.23Å; P195-L269 HydrophobicContact CB-CB 4.23Å; P195-L269 HydrophobicContact CG-CB 3.89Å; P195-F298 HydrophobicContact CB-CD2 3.62Å; P195-F298 HydrophobicContact CB-CE2 3.86Å
196	T	98.1	Very high	97.5	Very high	13 Å²	13	21.3 Å²	21.3	8%	0.08	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-68	-17.5	177.9	54.8	0	0	0	0	113.8	F11 S12 A15 P194 R198 P199	F11-T196 HydrophobicContact CE1-CG2 3.79Å; F11-T196 HydrophobicContact CZ-CG2 3.8Å; S12-T196 WeakPolarHBondContact CB-O 3.33Å; A15-T196 HydrophobicContact CB-CG2 3.8Å; P194-T196 WeakPolarHBondContact CG-OG1 3.42Å; P194-T196 PolarHBondContact O-N 3.02Å; T196-R198 VanDerWaalsContact C-N 3.25Å; T196-R198 PolarHBondContact O-N 2.99Å; T196-P199 VanDerWaalsContact O-CD 3.3Å; T196-P199 WeakPolarHBondContact O-CD 3.17Å
197	D	97.8	Very high	97.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-83.6	1.2	175.2	-76.8	14.2	0	0	0	112.7	S12 H16 L193 P194 P195 P199 F200 I201 R252	S12-D197 PolarHBondContact OG-OD1 2.97Å; H16-D197 IonicContact CD2-OD1 3.57Å; H16-D197 PolarHBondContact CD2-OD1 2.99Å; H16-D197 IonicContact CE1-OD1 2.62Å; H16-D197 IonicContact CE1-OD2 2.74Å; H16-D197 IonicContact NE2-OD1 3.54Å; H16-D197 PolarHBondContact NE2-OD1 3.14Å; H16-D197 IonicContact NE2-OD2 3Å; H16-D197 PolarHBondContact NE2-OD2 2.98Å; L193-D197 HydrophobicContact CB-CB 4.4Å; L193-D197 HydrophobicContact CD2-CB 4.41Å; L193-D197 WeakPolarHBondContact CD2-OD2 3.44Å; P194-D197 HydrophobicContact CG-CB 4.13Å; P194-D197 PolarHBondContact O-N 2.71Å; P195-D197 PolarHBondContact O-N 3.42Å; D197-P199 VanDerWaalsContact C-N 3.26Å; D197-P199 VanDerWaalsContact O-N 3.09Å; D197-F200 PolarHBondContact O-N 3.31Å; D197-I201 HydrophobicContact CB-CD1 4.27Å; D197-I201 WeakPolarHBondContact O-CG1 3.06Å; D197-I201 PolarHBondContact O-N 3.17Å; D197-R252 PolarHBondContact OD2-N 2.86Å
198	R	97.2	Very high	97.4	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.015	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-45.2	-39.2	176.3	174.3	63.2	-173.9	80.9	0	114.7	P195 T196 F200 I201 F271 F298 L301 E302 E306	P195-R198 VanDerWaalsContact O-CB 3.25Å; P195-R198 WeakPolarHBondContact O-CB 3.36Å; P195-R198 PolarHBondContact O-N 3.23Å; T196-R198 VanDerWaalsContact C-N 3.25Å; T196-R198 PolarHBondContact O-N 2.99Å; R198-F200 PolarHBondContact O-N 2.84Å; R198-I201 PolarHBondContact NH1-O 3.38Å; R198-I201 PolarHBondContact O-N 2.9Å; R198-F271 HydrophobicContact CB-CE2 4.23Å; R198-F271 HydrophobicContact CB-CZ 4.19Å; R198-F298 HydrophobicContact CB-CE2 4.08Å; R198-F298 HydrophobicContact CG-CE2 4.33Å; R198-F298 HydrophobicContact CG-CZ 4.42Å; R198-L301 HydrophobicContact CB-CD2 3.98Å; R198-L301 HydrophobicContact CB-CG 4.34Å; R198-E302 HydrophobicContact CG-CB 4.38Å; R198-E302 IonicContact CZ-OE1 3.94Å; R198-E302 IonicContact NE-OE1 3.52Å; R198-E302 PolarHBondContact NE-OE1 3.02Å; R198-E302 VanDerWaalsContact NE-OE1 3.09Å; R198-E302 IonicContact NH2-OE1 3.09Å; R198-E306 IonicContact NH2-OE1 2.73Å
199	P	96.1	Very high	97.3	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.032	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-58.6	-29.2	177.7	-26.9	36.8	0	0	0	114	L8 T196 D197 Q247 L301	L8-P199 HydrophobicContact CB-CB 4.16Å; L8-P199 HydrophobicContact CB-CG 4.09Å; L8-P199 HydrophobicContact CD2-CG 4.43Å; T196-P199 VanDerWaalsContact O-CD 3.3Å; T196-P199 WeakPolarHBondContact O-CD 3.17Å; D197-P199 VanDerWaalsContact C-N 3.26Å; D197-P199 VanDerWaalsContact O-N 3.09Å; P199-Q247 PolarHBondContact O-OE1 3.18Å; P199-Q247 VanDerWaalsContact O-OE1 3.08Å; P199-L301 HydrophobicContact CG-CD1 3.86Å; P199-L301 HydrophobicContact CG-CG 4.34Å
200	F	96.1	Very high	97.3	Very high	3 Å²	3	18.2 Å²	18.2	1%	0.013	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-96.1	-6.6	-175.3	-49.5	-34	0	0	0	113.6	V9 S12 D197 R198 Q247 L250 A251	V9-F200 HydrophobicContact CB-CE1 4.22Å; V9-F200 HydrophobicContact CB-CZ 4.29Å; V9-F200 HydrophobicContact CG1-CE1 4.36Å; V9-F200 HydrophobicContact CG1-CZ 4.14Å; V9-F200 HydrophobicContact CG2-CE1 3.82Å; V9-F200 HydrophobicContact CG2-CZ 4.38Å; S12-F200 VanDerWaalsContact CB-CE2 3.5Å; S12-F200 VanDerWaalsContact OG-CE2 3.22Å; S12-F200 WeakPolarHBondContact OG-CE2 3.31Å; D197-F200 PolarHBondContact O-N 3.31Å; R198-F200 PolarHBondContact O-N 2.84Å; F200-Q247 WeakPolarHBondContact CB-O 3.4Å; F200-Q247 HydrophobicContact CD1-CB 4.46Å; F200-L250 HydrophobicContact CD1-CB 3.97Å; F200-L250 HydrophobicContact CD1-CD1 4.13Å; F200-L250 HydrophobicContact CD2-CB 3.77Å; F200-L250 HydrophobicContact CE1-CB 3.89Å; F200-L250 HydrophobicContact CE1-CD1 3.73Å; F200-L250 HydrophobicContact CE1-CG 4.48Å; F200-L250 HydrophobicContact CE2-CB 3.62Å; F200-L250 HydrophobicContact CG-CB 3.92Å; F200-L250 HydrophobicContact CZ-CB 3.7Å; F200-L250 HydrophobicContact CZ-CD1 4.1Å; F200-A251 HydrophobicContact CB-CB 4.09Å; F200-A251 HydrophobicContact CD2-CB 4.3Å
201	I	96.8	Very high	97.2	Very high	3 Å²	3	19 Å²	19	2%	0.015	10%	0.101	C	C	.	.	S	Bend	trans	-98.3	114.8	-177.3	-63.1	169.5	0	0	0	108.1	L193 D197 R198 Y203 I233 F271	L193-I201 HydrophobicContact CB-CD1 4.05Å; L193-I201 HydrophobicContact CD1-CD1 3.92Å; L193-I201 HydrophobicContact CD1-CG1 4.18Å; D197-I201 HydrophobicContact CB-CD1 4.27Å; D197-I201 WeakPolarHBondContact O-CG1 3.06Å; D197-I201 PolarHBondContact O-N 3.17Å; R198-I201 PolarHBondContact NH1-O 3.38Å; R198-I201 PolarHBondContact O-N 2.9Å; I201-Y203 HydrophobicContact CG2-CD2 4.5Å; I201-Y203 HydrophobicContact CG2-CE2 4.24Å; I201-I233 HydrophobicContact CG2-CD1 3.51Å; I201-I233 HydrophobicContact CG2-CG1 3.83Å; I201-I233 HydrophobicContact CG2-CG2 4.05Å; I201-F271 HydrophobicContact CD1-CB 4.14Å; I201-F271 HydrophobicContact CD1-CD1 4.03Å; I201-F271 HydrophobicContact CD1-CD2 3.24Å; I201-F271 HydrophobicContact CD1-CE1 4.23Å; I201-F271 HydrophobicContact CD1-CE2 3.49Å; I201-F271 VanDerWaalsContact CD1-CE2 3.49Å; I201-F271 HydrophobicContact CD1-CG 3.53Å; I201-F271 HydrophobicContact CD1-CZ 3.99Å; I201-F271 HydrophobicContact CG2-CD1 4.46Å; I201-F271 HydrophobicContact CG2-CE1 4.41Å
202	P	95.9	Very high	97.1	Very high	20 Å²	20	22.2 Å²	22.2	13%	0.13	12%	0.115	C	C	.	.			trans	-70.9	141.7	-177.7	29.6	-34.3	0	0	0	110.7	I233 P234 L235 F245	P202-I233 WeakPolarHBondContact O-CA 3.22Å; P202-P234 HydrophobicContact CB-CG 4.37Å; P202-P234 HydrophobicContact CG-CG 4.37Å; P202-P234 WeakPolarHBondContact O-CD 3.17Å; P202-L235 HydrophobicContact CG-CB 3.67Å; P202-L235 HydrophobicContact CG-CD1 4.16Å; P202-F245 HydrophobicContact CB-CD1 3.44Å; P202-F245 VanDerWaalsContact CB-CD1 3.44Å; P202-F245 HydrophobicContact CB-CE1 3.62Å; P202-F245 HydrophobicContact CB-CG 4.11Å; P202-F245 HydrophobicContact CB-CZ 4.42Å; P202-F245 HydrophobicContact CG-CB 4.24Å; P202-F245 HydrophobicContact CG-CD1 3.64Å; P202-F245 HydrophobicContact CG-CD2 4.24Å; P202-F245 HydrophobicContact CG-CE1 3.96Å; P202-F245 HydrophobicContact CG-CG 3.78Å; P202-F245 HydrophobicContact CG-CZ 4.38Å
203	Y	96.1	Very high	96.9	Very high	58 Å²	58	25.1 Å²	25.1	23%	0.227	13%	0.129	C	C	.	.			trans	-124	142.7	169.6	-93.4	-94.2	0	0	0	109.3	I201 P231 W232 I233 F271	I201-Y203 HydrophobicContact CG2-CD2 4.5Å; I201-Y203 HydrophobicContact CG2-CE2 4.24Å; Y203-P231 HydrophobicContact CD1-CB 4.14Å; Y203-W232 WeakPolarHBondContact CA-O 3.27Å; Y203-I233 HydrophobicContact CD1-CG1 4.37Å; Y203-I233 HydrophobicContact CD2-CG1 4.01Å; Y203-I233 HydrophobicContact CE1-CG1 3.97Å; Y203-I233 HydrophobicContact CE2-CD1 3.85Å; Y203-I233 HydrophobicContact CE2-CG1 3.57Å; Y203-I233 HydrophobicContact CG-CG1 4.4Å; Y203-F271 AromaticContact CE2-CE1 3.93Å; Y203-F271 HydrophobicContact CE2-CE1 3.93Å; Y203-F271 WeakPolarHBondContact OH-CE1 3.45Å
204	G	94.8	Very high	96.6	Very high	18 Å²	18	27.9 Å²	27.9	19%	0.186	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	158.4	171.7	0	0	0	0	0	111.1	Y206 P231 W232	G204-Y206 VanDerWaalsContact CA-CE2 3.46Å; G204-Y206 WeakPolarHBondContact O-CD2 3.4Å; G204-Y206 VanDerWaalsContact O-CE2 3.22Å; G204-Y206 WeakPolarHBondContact O-CE2 3.28Å; G204-P231 CarbonylContact O-C 3.47Å; G204-P231 VanDerWaalsContact O-CA 3.29Å; G204-P231 WeakPolarHBondContact O-CA 3.48Å; G204-W232 PolarHBondContact N-O 2.91Å; G204-W232 PolarHBondContact O-N 3.22Å
205	L	95.9	Very high	96	Very high	116 Å²	116	36 Å²	36	61%	0.607	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.6	175.2	-69.7	174.6	0	0	0	110.2	K229 P231	L205-K229 HydrophobicContact CB-CB 4.19Å; L205-K229 HydrophobicContact CB-CD 4.13Å; L205-P231 HydrophobicContact CD2-CB 3.91Å
206	Y	96.6	Very high	95.1	Very high	22 Å²	22	39.6 Å²	39.6	9%	0.086	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.5	-173.5	-60.2	-81.1	0	0	0	111.5	V89 G204 S208 K229 V230 W232 P234	V89-Y206 HydrophobicContact CG1-CD1 3.92Å; V89-Y206 HydrophobicContact CG1-CE1 3.59Å; V89-Y206 HydrophobicContact CG1-CE2 4.35Å; V89-Y206 HydrophobicContact CG1-CG 4.45Å; V89-Y206 HydrophobicContact CG2-CD1 4.4Å; V89-Y206 HydrophobicContact CG2-CD2 3.71Å; V89-Y206 HydrophobicContact CG2-CE1 4.31Å; V89-Y206 HydrophobicContact CG2-CE2 3.59Å; V89-Y206 HydrophobicContact CG2-CG 4.14Å; G204-Y206 VanDerWaalsContact CA-CE2 3.46Å; G204-Y206 WeakPolarHBondContact O-CD2 3.4Å; G204-Y206 VanDerWaalsContact O-CE2 3.22Å; G204-Y206 WeakPolarHBondContact O-CE2 3.28Å; Y206-S208 PolarHBondContact O-N 3.37Å; Y206-K229 CarbonylContact O-C 3.47Å; Y206-K229 WeakPolarHBondContact O-CA 3.39Å; Y206-K229 WeakPolarHBondContact O-CB 3.39Å; Y206-V230 PolarHBondContact N-O 3.31Å; Y206-V230 PolarHBondContact O-N 3.44Å; Y206-W232 HydrophobicContact CD2-CB 4.12Å; Y206-P234 HydrophobicContact CE2-CB 4.45Å; Y206-P234 WeakPolarHBondContact OH-CB 3.42Å; Y206-P234 WeakPolarHBondContact OH-CG 3.39Å
207	Q	97.2	Very high	94.5	Very high	36 Å²	36	39.7 Å²	39.7	17%	0.168	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	130.4	169.2	-179	63	50	0	0	108.4	R93 F94 N224 S227	R93-Q207 WeakPolarHBondContact CA-O 3.45Å; R93-Q207 VanDerWaalsContact CD-O 3.29Å; R93-Q207 WeakPolarHBondContact CD-O 3.49Å; F94-Q207 PolarHBondContact N-O 2.96Å; Q207-N224 PolarHBondContact NE2-O 3.13Å; Q207-S227 PolarHBondContact NE2-O 3Å; Q207-S227 PolarHBondContact NE2-OG 2.95Å; Q207-S227 VanDerWaalsContact NE2-OG 3.11Å
208	S	97.4	Very high	94.3	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.6	176.2	173.2	0	0	0	0	110.1	F94 M96 Y206 N224 S227	F94-S208 CarbonylContact O-C 3.58Å; F94-S208 WeakPolarHBondContact O-CA 3.42Å; M96-S208 WeakPolarHBondContact CE-OG 3.29Å; Y206-S208 PolarHBondContact O-N 3.37Å; S208-N224 WeakPolarHBondContact O-CB 3.48Å; S208-N224 PolarHBondContact O-N 3.2Å; S208-N224 PolarHBondContact OG-ND2 3.31Å; S208-S227 WeakPolarHBondContact CB-OG 3.39Å
209	A	97.6	Very high	94.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	169.4	174.5	0	0	0	0	0	110	R93 F94 V95 M96 V221 I222	R93-A209 HydrophobicContact CB-CB 4.29Å; R93-A209 HydrophobicContact CG-CB 4.39Å; F94-A209 PolarHBondContact O-N 2.85Å; V95-A209 WeakPolarHBondContact CA-O 3.48Å; V95-A209 HydrophobicContact CG2-CB 4.42Å; M96-A209 PolarHBondContact N-O 2.85Å; A209-V221 HydrophobicContact CB-CG1 3.42Å; A209-V221 VanDerWaalsContact CB-CG1 3.42Å; A209-I222 CarbonylContact C-O 3.58Å; A209-I222 WeakPolarHBondContact CA-O 3.29Å; A209-I222 VanDerWaalsContact CB-O 3.28Å; A209-I222 WeakPolarHBondContact CB-O 3.35Å
210	V	97.5	Very high	94.2	Very high	40 Å²	40	51.7 Å²	51.7	24%	0.242	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.6	176.6	71.4	0	0	0	0	110.1	M96 P97 I222	M96-V210 HydrophobicContact CB-CG2 4.33Å; M96-V210 WeakPolarHBondContact O-CA 3.44Å; P97-V210 VanDerWaalsContact O-CG2 3.22Å; P97-V210 WeakPolarHBondContact O-CG2 3.45Å; V210-I222 HydrophobicContact CG1-CB 4.29Å; V210-I222 PolarHBondContact N-O 2.98Å; V210-I222 PolarHBondContact O-N 3.5Å
211	Y	97.7	Very high	94.3	Very high	19 Å²	19	54.6 Å²	54.6	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	143.3	167.1	-75.4	-60.1	0	0	0	110.9	T81 P82 V95 M96 E98 F219 K220 V221	T81-Y211 HydrophobicContact CG2-CD2 4.19Å; T81-Y211 HydrophobicContact CG2-CE2 4.45Å; P82-Y211 HydrophobicContact CG-CD1 3.88Å; P82-Y211 HydrophobicContact CG-CD2 4.49Å; P82-Y211 HydrophobicContact CG-CE1 3.54Å; P82-Y211 HydrophobicContact CG-CE2 4.19Å; P82-Y211 HydrophobicContact CG-CG 4.35Å; V95-Y211 HydrophobicContact CB-CD2 4.49Å; V95-Y211 HydrophobicContact CB-CE2 4.04Å; V95-Y211 HydrophobicContact CG1-CD1 3.93Å; V95-Y211 HydrophobicContact CG1-CD2 3.51Å; V95-Y211 HydrophobicContact CG1-CE1 3.87Å; V95-Y211 HydrophobicContact CG1-CE2 3.46Å; V95-Y211 VanDerWaalsContact CG1-CE2 3.46Å; V95-Y211 HydrophobicContact CG1-CG 3.75Å; M96-Y211 PolarHBondContact O-N 3.23Å; E98-Y211 VanDerWaalsContact CB-O 3.27Å; E98-Y211 WeakPolarHBondContact CB-O 3.36Å; Y211-F219 HydrophobicContact CD1-CB 4.37Å; Y211-K220 CarbonylContact C-O 3.58Å; Y211-K220 WeakPolarHBondContact CA-O 3.32Å; Y211-V221 HydrophobicContact CD1-CG2 3.96Å; Y211-V221 HydrophobicContact CE1-CG2 3.64Å
212	Q	96.4	Very high	94.2	Very high	90 Å²	90	57.7 Å²	57.7	42%	0.421	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	115.5	172.4	-172.3	177.4	52.7	0	0	110.3	Q214 K220 I222	Q212-Q214 PolarHBondContact O-NE2 3.3Å; Q212-K220 PolarHBondContact N-O 2.97Å; Q212-K220 PolarHBondContact O-N 3.49Å; Q212-I222 HydrophobicContact CB-CG1 4Å
213	E	94.3	Very high	94.3	Very high	61 Å²	61	59.6 Å²	59.6	29%	0.285	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	133.3	170.3	-173.8	177.4	-166.6	0	0	110.3	E98 R100 G217 E218 F219	E98-E213 WeakPolarHBondContact OE2-CB 3.32Å; E98-E213 PolarHBondContact OE2-N 2.88Å; R100-E213 IonicContact CZ-OE2 3.46Å; R100-E213 IonicContact NH1-OE2 3.2Å; R100-E213 PolarHBondContact NH1-OE2 2.87Å; R100-E213 IonicContact NH2-OE2 3.53Å; R100-E213 PolarHBondContact NH2-OE2 2.86Å; E213-G217 VanDerWaalsContact OE1-CA 3.29Å; E213-G217 WeakPolarHBondContact OE1-CA 3.45Å; E213-E218 CarbonylContact C-O 3.58Å; E213-E218 WeakPolarHBondContact CA-O 3.34Å; E213-F219 HydrophobicContact CB-CD1 4.13Å; E213-F219 HydrophobicContact CB-CE1 3.84Å; E213-F219 HydrophobicContact CB-CE2 4.49Å; E213-F219 HydrophobicContact CB-CZ 4.03Å; E213-F219 HydrophobicContact CG-CE2 4.49Å; E213-F219 HydrophobicContact CG-CZ 4.39Å
214	Q	92.9	Very high	94.1	Very high	59 Å²	59	59.3 Å²	59.3	28%	0.276	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-103.4	168.8	177.5	-54.8	-66	-56.7	0	0	110.3	Q212 G216 G217 E218 K220	Q212-Q214 PolarHBondContact O-NE2 3.3Å; Q214-G216 PolarHBondContact O-N 2.93Å; Q214-G216 VanDerWaalsContact O-N 3.14Å; Q214-G217 PolarHBondContact O-N 3.05Å; Q214-E218 WeakPolarHBondContact CB-O 3.36Å; Q214-E218 PolarHBondContact N-O 2.77Å; Q214-K220 HydrophobicContact CG-CB 4.26Å; Q214-K220 HydrophobicContact CG-CD 3.71Å; Q214-K220 HydrophobicContact CG-CG 3.76Å
215	D	84.9	Confident	93.6	Very high	171 Å²	171	64.3 Å²	64.3	91%	0.914	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	121.9	170.7	-67.7	-30.2	0	0	0	110.5
216	G	80.9	Confident	93	Very high	88 Å²	88	66.8 Å²	66.8	91%	0.907	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.5	-1.1	-177.1	0	0	0	0	0	115.4	Q214	Q214-G216 PolarHBondContact O-N 2.93Å; Q214-G216 VanDerWaalsContact O-N 3.14Å
217	G	85.4	Confident	92.6	Very high	15 Å²	15	67.7 Å²	67.7	16%	0.155	38%	0.377	C	S	.	.	S	Bend	trans	88.9	10.2	170.7	0	0	0	0	0	115.6	T118 E213 Q214	T118-G217 WeakPolarHBondContact CG2-O 3.32Å; E213-G217 VanDerWaalsContact OE1-CA 3.29Å; E213-G217 WeakPolarHBondContact OE1-CA 3.45Å; Q214-G217 PolarHBondContact O-N 3.05Å
218	E	92.4	Very high	92.3	Very high	130 Å²	130	74.2 Å²	74.2	61%	0.607	41%	0.408	S	S	*	.			trans	-83.4	136.4	174	-171.4	-176.3	178.6	0	0	110.4	E213 Q214	E213-E218 CarbonylContact C-O 3.58Å; E213-E218 WeakPolarHBondContact CA-O 3.34Å; Q214-E218 WeakPolarHBondContact CB-O 3.36Å; Q214-E218 PolarHBondContact N-O 2.77Å
219	F	95.5	Very high	92.1	Very high	30 Å²	30	80 Å²	80	13%	0.132	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.1	174.7	-74	-95.7	0	0	0	111.1	V80 P82 T118 Y211 E213	V80-F219 HydrophobicContact CG1-CE1 4.13Å; V80-F219 HydrophobicContact CG1-CZ 3.78Å; P82-F219 HydrophobicContact CB-CB 3.94Å; P82-F219 HydrophobicContact CB-CD2 3.75Å; P82-F219 HydrophobicContact CB-CE2 4.44Å; P82-F219 HydrophobicContact CB-CG 3.86Å; P82-F219 HydrophobicContact CG-CB 4.04Å; P82-F219 HydrophobicContact CG-CG 4.2Å; T118-F219 HydrophobicContact CG2-CE2 4.25Å; Y211-F219 HydrophobicContact CD1-CB 4.37Å; E213-F219 HydrophobicContact CB-CD1 4.13Å; E213-F219 HydrophobicContact CB-CE1 3.84Å; E213-F219 HydrophobicContact CB-CE2 4.49Å; E213-F219 HydrophobicContact CB-CZ 4.03Å; E213-F219 HydrophobicContact CG-CE2 4.49Å; E213-F219 HydrophobicContact CG-CZ 4.39Å
220	K	96.1	Very high	92	Very high	100 Å²	100	81.9 Å²	81.9	44%	0.435	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	151.7	169.3	-71	-175.7	-177.1	167.3	0	111.1	Y211 Q212 Q214 I222	Y211-K220 CarbonylContact C-O 3.58Å; Y211-K220 WeakPolarHBondContact CA-O 3.32Å; Q212-K220 PolarHBondContact N-O 2.97Å; Q212-K220 PolarHBondContact O-N 3.49Å; Q214-K220 HydrophobicContact CG-CB 4.26Å; Q214-K220 HydrophobicContact CG-CD 3.71Å; Q214-K220 HydrophobicContact CG-CG 3.76Å; K220-I222 HydrophobicContact CB-CD1 4.14Å
221	V	97.1	Very high	92	Very high	65 Å²	65	83.4 Å²	83.4	39%	0.394	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.3	171.5	178.7	0	0	0	0	107.8	R93 V95 A209 Y211	R93-V221 HydrophobicContact CG-CG1 4.48Å; V95-V221 HydrophobicContact CG1-CG1 4.24Å; V95-V221 HydrophobicContact CG1-CG2 4.31Å; V95-V221 HydrophobicContact CG2-CG1 3.92Å; V95-V221 HydrophobicContact CG2-CG2 4.39Å; A209-V221 HydrophobicContact CB-CG1 3.42Å; A209-V221 VanDerWaalsContact CB-CG1 3.42Å; Y211-V221 HydrophobicContact CD1-CG2 3.96Å; Y211-V221 HydrophobicContact CE1-CG2 3.64Å
222	I	96.7	Very high	92	Very high	68 Å²	68	85 Å²	85	35%	0.349	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.6	-178.6	-51.9	-60.1	0	0	0	108.9	A209 V210 Q212 K220	A209-I222 CarbonylContact C-O 3.58Å; A209-I222 WeakPolarHBondContact CA-O 3.29Å; A209-I222 VanDerWaalsContact CB-O 3.28Å; A209-I222 WeakPolarHBondContact CB-O 3.35Å; V210-I222 HydrophobicContact CG1-CB 4.29Å; V210-I222 PolarHBondContact N-O 2.98Å; V210-I222 PolarHBondContact O-N 3.5Å; Q212-I222 HydrophobicContact CB-CG1 4Å; K220-I222 HydrophobicContact CB-CD1 4.14Å
223	D	96.2	Very high	92	Very high	60 Å²	60	81 Å²	81	32%	0.321	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	136.7	180	-72.1	-12	0	0	0	111.9	R93 V225	R93-D223 WeakPolarHBondContact CD-OD1 3.35Å; R93-D223 IonicContact CZ-OD1 3.6Å; R93-D223 IonicContact CZ-OD2 3.42Å; R93-D223 VanDerWaalsContact NE-CG 3.33Å; R93-D223 IonicContact NE-OD1 2.72Å; R93-D223 PolarHBondContact NE-OD1 3.09Å; R93-D223 IonicContact NE-OD2 3.35Å; R93-D223 PolarHBondContact NE-OD2 3.32Å; R93-D223 IonicContact NH2-OD1 3.66Å; R93-D223 IonicContact NH2-OD2 2.7Å; R93-D223 PolarHBondContact NH2-OD2 2.86Å; D223-V225 PolarHBondContact O-N 2.92Å; D223-V225 VanDerWaalsContact O-N 3.14Å
224	N	92.4	Very high	92.2	Very high	51 Å²	51	79.3 Å²	79.3	27%	0.273	44%	0.436	S	S	.	.			trans	-84.6	82.7	166.8	-66.7	-33.6	0	0	0	108.6	M96 Q207 S208 D226 S227	M96-N224 WeakPolarHBondContact CE-ND2 3.27Å; Q207-N224 PolarHBondContact NE2-O 3.13Å; S208-N224 WeakPolarHBondContact O-CB 3.48Å; S208-N224 PolarHBondContact O-N 3.2Å; S208-N224 PolarHBondContact OG-ND2 3.31Å; N224-D226 PolarHBondContact O-N 3.04Å; N224-D226 VanDerWaalsContact O-N 3.1Å; N224-S227 WeakPolarHBondContact CB-OG 3.25Å; N224-S227 WeakPolarHBondContact O-CB 3.48Å; N224-S227 PolarHBondContact O-N 2.95Å; N224-S227 PolarHBondContact O-OG 3.21Å
225	V	83.6	Confident	92.3	Very high	123 Å²	123	76.9 Å²	76.9	75%	0.745	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.7	-166.9	-147.8	0	0	0	0	113.8	D223	D223-V225 PolarHBondContact O-N 2.92Å; D223-V225 VanDerWaalsContact O-N 3.14Å
226	D	84.8	Confident	92.9	Very high	169 Å²	169	71 Å²	71	90%	0.904	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	6	-179.7	-61.7	-43.8	0	0	0	113.8	N224	N224-D226 PolarHBondContact O-N 3.04Å; N224-D226 VanDerWaalsContact O-N 3.1Å
227	S	87.1	Confident	93.6	Very high	40 Å²	40	67.6 Å²	67.6	28%	0.28	36%	0.355	S	S	.	.	S	Bend	trans	-90.7	146	-179.1	68	0	0	0	0	112.5	Q207 S208 N224	Q207-S227 PolarHBondContact NE2-O 3Å; Q207-S227 PolarHBondContact NE2-OG 2.95Å; Q207-S227 VanDerWaalsContact NE2-OG 3.11Å; S208-S227 WeakPolarHBondContact CB-OG 3.39Å; N224-S227 WeakPolarHBondContact CB-OG 3.25Å; N224-S227 WeakPolarHBondContact O-CB 3.48Å; N224-S227 PolarHBondContact O-N 2.95Å; N224-S227 PolarHBondContact O-OG 3.21Å
228	H	90.8	Very high	94.2	Very high	174 Å²	174	70.4 Å²	70.4	81%	0.806	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-64.5	150.1	167	-64.7	-63.3	0	0	0	110.6	V230	H228-V230 PolarHBondContact O-N 3.02Å
229	K	94.4	Very high	94.3	Very high	128 Å²	128	70.7 Å²	70.7	56%	0.557	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-61.2	139.9	171.2	-69.4	-170.6	176.9	-172.7	0	110.2	L205 Y206	L205-K229 HydrophobicContact CB-CB 4.19Å; L205-K229 HydrophobicContact CB-CD 4.13Å; Y206-K229 CarbonylContact O-C 3.47Å; Y206-K229 WeakPolarHBondContact O-CA 3.39Å; Y206-K229 WeakPolarHBondContact O-CB 3.39Å
230	V	95.7	Very high	94.4	Very high	38 Å²	38	70.9 Å²	70.9	23%	0.23	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.8	-178.4	-178.7	0	0	0	0	108.8	F94 Y206 H228 W232	F94-V230 HydrophobicContact CB-CB 4.43Å; F94-V230 HydrophobicContact CD1-CB 4.12Å; F94-V230 HydrophobicContact CD1-CG1 4.13Å; F94-V230 HydrophobicContact CD1-CG2 4.12Å; F94-V230 HydrophobicContact CE1-CG1 4.35Å; F94-V230 HydrophobicContact CG-CB 4.29Å; F94-V230 HydrophobicContact CG-CG1 4.28Å; Y206-V230 PolarHBondContact N-O 3.31Å; Y206-V230 PolarHBondContact O-N 3.44Å; H228-V230 PolarHBondContact O-N 3.02Å; V230-W232 HydrophobicContact CG1-CE3 4.07Å; V230-W232 PolarHBondContact O-N 2.99Å
231	P	96.1	Very high	94.4	Very high	73 Å²	73	69.8 Å²	69.8	47%	0.474	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	121.3	167.8	28.2	-31.1	0	0	0	109.4	Y203 G204 L205	Y203-P231 HydrophobicContact CD1-CB 4.14Å; G204-P231 CarbonylContact O-C 3.47Å; G204-P231 VanDerWaalsContact O-CA 3.29Å; G204-P231 WeakPolarHBondContact O-CA 3.48Å; L205-P231 HydrophobicContact CD2-CB 3.91Å
232	W	97.9	Very high	94.3	Very high	51 Å²	51	69 Å²	69	19%	0.193	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	162.1	177.9	-149.8	-99.6	0	0	0	112.4	D87 V89 F94 S171 H173 Y203 G204 Y206 V230 P234	D87-W232 HydrophobicContact CB-CZ2 4.33Å; D87-W232 WeakPolarHBondContact O-CZ2 3.43Å; D87-W232 PolarHBondContact O-NE1 2.84Å; D87-W232 VanDerWaalsContact O-NE1 3.17Å; V89-W232 HydrophobicContact CG2-CB 4.03Å; V89-W232 HydrophobicContact CG2-CG 4.35Å; F94-W232 HydrophobicContact CD2-CB 3.98Å; F94-W232 AromaticContact CD2-CD2 3.7Å; F94-W232 HydrophobicContact CD2-CD2 3.7Å; F94-W232 HydrophobicContact CD2-CE3 4.15Å; F94-W232 AromaticContact CD2-CG 3.61Å; F94-W232 HydrophobicContact CD2-CG 3.61Å; F94-W232 AromaticContact CE2-CD2 3.38Å; F94-W232 HydrophobicContact CE2-CD2 3.38Å; F94-W232 AromaticContact CE2-CE2 3.53Å; F94-W232 AromaticContact CE2-CE3 3.66Å; F94-W232 HydrophobicContact CE2-CE3 3.66Å; F94-W232 AromaticContact CE2-CG 3.82Å; F94-W232 HydrophobicContact CE2-CG 3.82Å; F94-W232 HydrophobicContact CE2-CH2 4.14Å; F94-W232 AromaticContact CE2-CZ2 3.9Å; F94-W232 HydrophobicContact CE2-CZ2 3.9Å; F94-W232 HydrophobicContact CE2-CZ3 4.03Å; F94-W232 AromaticContact CE2-NE1 3.98Å; F94-W232 HydrophobicContact CZ-CD2 4.34Å; F94-W232 HydrophobicContact CZ-CE3 4.21Å; F94-W232 HydrophobicContact CZ-CH2 4.38Å; F94-W232 HydrophobicContact CZ-CZ3 4.23Å; S171-W232 PolarHBondContact OG-NE1 2.9Å; H173-W232 HydrophobicContact CB-CH2 3.94Å; H173-W232 HydrophobicContact CB-CZ2 3.71Å; Y203-W232 WeakPolarHBondContact CA-O 3.27Å; G204-W232 PolarHBondContact N-O 2.91Å; G204-W232 PolarHBondContact O-N 3.22Å; Y206-W232 HydrophobicContact CD2-CB 4.12Å; V230-W232 HydrophobicContact CG1-CE3 4.07Å; V230-W232 PolarHBondContact O-N 2.99Å; W232-P234 WeakPolarHBondContact O-CD 3.47Å
233	I	97.8	Very high	94.3	Very high	7 Å²	7	74.5 Å²	74.5	4%	0.036	39%	0.392	C	S	.	.			trans	-87.6	115.4	178.3	-61	168.6	0	0	0	108.5	M172 I201 P202 Y203 L235 F271	M172-I233 HydrophobicContact CB-CD1 4.45Å; M172-I233 HydrophobicContact CB-CG2 4.27Å; M172-I233 HydrophobicContact CG-CD1 3.85Å; M172-I233 HydrophobicContact CG-CG2 4.32Å; I201-I233 HydrophobicContact CG2-CD1 3.51Å; I201-I233 HydrophobicContact CG2-CG1 3.83Å; I201-I233 HydrophobicContact CG2-CG2 4.05Å; P202-I233 WeakPolarHBondContact O-CA 3.22Å; Y203-I233 HydrophobicContact CD1-CG1 4.37Å; Y203-I233 HydrophobicContact CD2-CG1 4.01Å; Y203-I233 HydrophobicContact CE1-CG1 3.97Å; Y203-I233 HydrophobicContact CE2-CD1 3.85Å; Y203-I233 HydrophobicContact CE2-CG1 3.57Å; Y203-I233 HydrophobicContact CG-CG1 4.4Å; I233-L235 VanDerWaalsContact C-N 3.33Å; I233-L235 HydrophobicContact CG2-CB 4.18Å; I233-F271 HydrophobicContact CD1-CD1 3.68Å; I233-F271 HydrophobicContact CD1-CE1 4.02Å
234	P	97.1	Very high	94.2	Very high	25 Å²	25	78.5 Å²	78.5	16%	0.162	40%	0.403	C	S	.	.			trans	-84.6	-6	179.9	33.5	-36.5	0	0	0	114.5	V89 P202 Y206 W232 F245	V89-P234 HydrophobicContact CB-CB 4.33Å; V89-P234 HydrophobicContact CG1-CB 4.21Å; V89-P234 HydrophobicContact CG2-CB 4.23Å; P202-P234 HydrophobicContact CB-CG 4.37Å; P202-P234 HydrophobicContact CG-CG 4.37Å; P202-P234 WeakPolarHBondContact O-CD 3.17Å; Y206-P234 HydrophobicContact CE2-CB 4.45Å; Y206-P234 WeakPolarHBondContact OH-CB 3.42Å; Y206-P234 WeakPolarHBondContact OH-CG 3.39Å; W232-P234 WeakPolarHBondContact O-CD 3.47Å; P234-F245 HydrophobicContact CB-CZ 4.08Å; P234-F245 HydrophobicContact CG-CE1 3.97Å; P234-F245 HydrophobicContact CG-CE2 4.19Å; P234-F245 HydrophobicContact CG-CZ 3.44Å; P234-F245 VanDerWaalsContact CG-CZ 3.44Å
235	L	96.4	Very high	94.3	Very high	8 Å²	8	77.6 Å²	77.6	4%	0.042	40%	0.396	C	S	.	.			trans	-85.8	125.9	-176.3	178.4	144.7	0	0	0	110.1	P202 I233 P237 P240 F245 Y248	P202-L235 HydrophobicContact CG-CB 3.67Å; P202-L235 HydrophobicContact CG-CD1 4.16Å; I233-L235 VanDerWaalsContact C-N 3.33Å; I233-L235 HydrophobicContact CG2-CB 4.18Å; L235-P237 HydrophobicContact CD2-CB 4.36Å; L235-P237 WeakPolarHBondContact O-CD 3.4Å; L235-P240 HydrophobicContact CD1-CB 4.03Å; L235-P240 HydrophobicContact CD2-CB 4.23Å; L235-P240 HydrophobicContact CG-CB 4.17Å; L235-F245 HydrophobicContact CB-CD2 4.13Å; L235-F245 HydrophobicContact CB-CE2 4.3Å; L235-F245 HydrophobicContact CD1-CB 3.86Å; L235-F245 HydrophobicContact CD1-CD2 3.87Å; L235-F245 HydrophobicContact CD1-CG 4.15Å; L235-F245 HydrophobicContact CG-CD2 4.39Å; L235-Y248 HydrophobicContact CD1-CD1 3.68Å; L235-Y248 HydrophobicContact CD1-CD2 3.87Å; L235-Y248 HydrophobicContact CD1-CE1 4.27Å; L235-Y248 HydrophobicContact CD1-CE2 4.43Å; L235-Y248 HydrophobicContact CD1-CG 3.46Å; L235-Y248 VanDerWaalsContact CD1-CG 3.46Å; L235-Y248 HydrophobicContact CD2-CD1 4.03Å; L235-Y248 HydrophobicContact CD2-CD2 4.02Å; L235-Y248 HydrophobicContact CD2-CE1 3.76Å; L235-Y248 HydrophobicContact CD2-CE2 3.73Å; L235-Y248 HydrophobicContact CD2-CG 4.16Å; L235-Y248 HydrophobicContact CG-CD1 4.49Å; L235-Y248 HydrophobicContact CG-CG 4.5Å
236	D	96.6	Very high	94.9	Very high	48 Å²	48	75.2 Å²	75.2	26%	0.257	38%	0.384	S	S	.	.			trans	-82	116.4	165	-171.3	-23.6	0	0	0	108.6	Y85 L238 D239 P240	Y85-D236 PolarHBondContact OH-OD2 2.99Å; Y85-D236 VanDerWaalsContact OH-OD2 3.05Å; D236-L238 PolarHBondContact O-N 3Å; D236-L238 VanDerWaalsContact OD1-CB 3.26Å; D236-L238 WeakPolarHBondContact OD1-CB 3.49Å; D236-L238 PolarHBondContact OD1-N 3.43Å; D236-D239 CarbonylContact O-C 3.38Å; D236-D239 VanDerWaalsContact O-C 3.26Å; D236-D239 PolarHBondContact O-N 2.61Å; D236-P240 VanDerWaalsContact O-CA 3.25Å; D236-P240 WeakPolarHBondContact O-CA 3.31Å; D236-P240 VanDerWaalsContact O-N 3.13Å
237	P	96.9	Very high	95.3	Very high	17 Å²	17	70.6 Å²	70.6	11%	0.11	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-13.9	179.8	31.9	-39.1	0	0	0	113.7	M172 I191 L235 Y248 H273	M172-P237 HydrophobicContact CB-CG 4.49Å; M172-P237 HydrophobicContact CE-CB 3.69Å; M172-P237 HydrophobicContact CE-CG 3.66Å; I191-P237 HydrophobicContact CD1-CB 4.13Å; I191-P237 HydrophobicContact CD1-CG 4.13Å; I191-P237 HydrophobicContact CG2-CB 4.27Å; L235-P237 HydrophobicContact CD2-CB 4.36Å; L235-P237 WeakPolarHBondContact O-CD 3.4Å; P237-Y248 WeakPolarHBondContact CB-OH 3.18Å; P237-H273 HydrophobicContact CG-CB 3.66Å
238	L	96.2	Very high	95.7	Very high	74 Å²	74	69.3 Å²	69.3	39%	0.387	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-32	175.8	-61.9	174.2	0	0	0	112.5	I191 D236	I191-L238 HydrophobicContact CD1-CD2 3.64Å; I191-L238 HydrophobicContact CD1-CG 4.39Å; D236-L238 PolarHBondContact O-N 3Å; D236-L238 VanDerWaalsContact OD1-CB 3.26Å; D236-L238 WeakPolarHBondContact OD1-CB 3.49Å; D236-L238 PolarHBondContact OD1-N 3.43Å
239	D	96.2	Very high	95.9	Very high	136 Å²	136	69.1 Å²	69.1	73%	0.727	34%	0.338	S	S	*	.	S	Bend	trans	-141.3	71	177.7	-169.7	24	0	0	0	110	D236 D241	D236-D239 CarbonylContact O-C 3.38Å; D236-D239 VanDerWaalsContact O-C 3.26Å; D236-D239 PolarHBondContact O-N 2.61Å; D239-D241 PolarHBondContact O-N 3.07Å
240	P	96	Very high	96	Very high	34 Å²	34	66.4 Å²	66.4	22%	0.221	33%	0.329	C	S	.	.			trans	-70.5	124	-172.6	27	-34.8	0	0	0	111.5	L235 D236 M242 Y248	L235-P240 HydrophobicContact CD1-CB 4.03Å; L235-P240 HydrophobicContact CD2-CB 4.23Å; L235-P240 HydrophobicContact CG-CB 4.17Å; D236-P240 VanDerWaalsContact O-CA 3.25Å; D236-P240 WeakPolarHBondContact O-CA 3.31Å; D236-P240 VanDerWaalsContact O-N 3.13Å; P240-M242 VanDerWaalsContact C-N 3.3Å; P240-M242 HydrophobicContact CB-CE 4.05Å; P240-M242 HydrophobicContact CB-SD 4.3Å; P240-M242 HydrophobicContact CG-CE 3.68Å; P240-M242 HydrophobicContact CG-CG 4.46Å; P240-M242 HydrophobicContact CG-SD 4.46Å; P240-M242 WeakPolarHBondContact O-CG 3.42Å; P240-M242 PolarHBondContact O-N 3.04Å; P240-Y248 HydrophobicContact CB-CD1 3.61Å; P240-Y248 HydrophobicContact CB-CE1 3.71Å; P240-Y248 HydrophobicContact CG-CD1 4.17Å; P240-Y248 HydrophobicContact CG-CE1 4.03Å
241	D	95.8	Very high	96	Very high	77 Å²	77	65.1 Å²	65.1	41%	0.412	32%	0.322	S	S	.	.			trans	-69.4	87	169.9	-175.8	-12.9	0	0	0	110.2	D239 E243 R244 F245	D239-D241 PolarHBondContact O-N 3.07Å; D241-E243 PolarHBondContact O-N 2.82Å; D241-E243 PolarHBondContact OD1-N 3.33Å; D241-E243 VanDerWaalsContact OD1-N 3.13Å; D241-R244 HydrophobicContact CB-CB 4.17Å; D241-R244 PolarHBondContact O-N 3.47Å; D241-R244 WeakPolarHBondContact OD1-CB 3.14Å; D241-R244 PolarHBondContact OD1-N 2.75Å; D241-R244 VanDerWaalsContact OD2-CB 3.25Å; D241-R244 WeakPolarHBondContact OD2-CB 3.37Å; D241-F245 HydrophobicContact CB-CD2 4.35Å; D241-F245 PolarHBondContact O-N 2.84Å
242	M	95.8	Very high	95.9	Very high	48 Å²	48	66.8 Å²	66.8	24%	0.236	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-10.6	-178.7	-64.6	-65.8	-165.9	0	0	113.5	P240 P246 Y248 R249	P240-M242 VanDerWaalsContact C-N 3.3Å; P240-M242 HydrophobicContact CB-CE 4.05Å; P240-M242 HydrophobicContact CB-SD 4.3Å; P240-M242 HydrophobicContact CG-CE 3.68Å; P240-M242 HydrophobicContact CG-CG 4.46Å; P240-M242 HydrophobicContact CG-SD 4.46Å; P240-M242 WeakPolarHBondContact O-CG 3.42Å; P240-M242 PolarHBondContact O-N 3.04Å; M242-P246 VanDerWaalsContact O-CA 3.29Å; M242-P246 WeakPolarHBondContact O-CA 3.18Å; M242-Y248 HydrophobicContact CE-CD1 3.63Å; M242-Y248 HydrophobicContact CE-CE1 4.32Å; M242-Y248 HydrophobicContact SD-CD1 4.04Å; M242-R249 VanDerWaalsContact CB-NH2 3.35Å; M242-R249 HydrophobicContact CE-CG 3.99Å; M242-R249 HydrophobicContact CG-CG 4.28Å; M242-R249 HydrophobicContact SD-CB 4.44Å; M242-R249 HydrophobicContact SD-CG 3.43Å; M242-R249 WeakPolarHBondContact SD-CG 3.33Å
243	E	96.1	Very high	95.9	Very high	184 Å²	184	67.2 Å²	67.2	86%	0.86	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-44.2	171.4	-65.1	-169.7	168.5	0	0	109.8	D241	D241-E243 PolarHBondContact O-N 2.82Å; D241-E243 PolarHBondContact OD1-N 3.33Å; D241-E243 VanDerWaalsContact OD1-N 3.13Å
244	R	94.7	Very high	95.9	Very high	144 Å²	144	67.5 Å²	67.5	54%	0.543	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-35.6	176	-171.2	177.7	174.1	-167.7	-1.5	113	D241 P246	D241-R244 HydrophobicContact CB-CB 4.17Å; D241-R244 PolarHBondContact O-N 3.47Å; D241-R244 WeakPolarHBondContact OD1-CB 3.14Å; D241-R244 PolarHBondContact OD1-N 2.75Å; D241-R244 VanDerWaalsContact OD2-CB 3.25Å; D241-R244 WeakPolarHBondContact OD2-CB 3.37Å; R244-P246 VanDerWaalsContact C-CD 3.44Å; R244-P246 WeakPolarHBondContact O-CD 3.26Å
245	F	95.4	Very high	96	Very high	31 Å²	31	70.8 Å²	70.8	14%	0.136	35%	0.353	C	S	.	.			trans	-126.4	62.1	-175.4	-50.6	-63.3	0	0	0	112.4	P202 P234 L235 D241 Q247 Y248	P202-F245 HydrophobicContact CB-CD1 3.44Å; P202-F245 VanDerWaalsContact CB-CD1 3.44Å; P202-F245 HydrophobicContact CB-CE1 3.62Å; P202-F245 HydrophobicContact CB-CG 4.11Å; P202-F245 HydrophobicContact CB-CZ 4.42Å; P202-F245 HydrophobicContact CG-CB 4.24Å; P202-F245 HydrophobicContact CG-CD1 3.64Å; P202-F245 HydrophobicContact CG-CD2 4.24Å; P202-F245 HydrophobicContact CG-CE1 3.96Å; P202-F245 HydrophobicContact CG-CG 3.78Å; P202-F245 HydrophobicContact CG-CZ 4.38Å; P234-F245 HydrophobicContact CB-CZ 4.08Å; P234-F245 HydrophobicContact CG-CE1 3.97Å; P234-F245 HydrophobicContact CG-CE2 4.19Å; P234-F245 HydrophobicContact CG-CZ 3.44Å; P234-F245 VanDerWaalsContact CG-CZ 3.44Å; L235-F245 HydrophobicContact CB-CD2 4.13Å; L235-F245 HydrophobicContact CB-CE2 4.3Å; L235-F245 HydrophobicContact CD1-CB 3.86Å; L235-F245 HydrophobicContact CD1-CD2 3.87Å; L235-F245 HydrophobicContact CD1-CG 4.15Å; L235-F245 HydrophobicContact CG-CD2 4.39Å; D241-F245 HydrophobicContact CB-CD2 4.35Å; D241-F245 PolarHBondContact O-N 2.84Å; F245-Q247 PolarHBondContact O-N 3.44Å; F245-Q247 VanDerWaalsContact O-N 3.13Å; F245-Y248 WeakPolarHBondContact O-CB 3.46Å; F245-Y248 PolarHBondContact O-N 3.25Å; F245-Y248 VanDerWaalsContact O-N 3.07Å
246	P	94.9	Very high	96.1	Very high	74 Å²	74	71.2 Å²	71.2	48%	0.481	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-62.5	-26.4	-172.5	24.8	-35.3	0	0	0	114.2	M242 R244 Y248 R249	M242-P246 VanDerWaalsContact O-CA 3.29Å; M242-P246 WeakPolarHBondContact O-CA 3.18Å; R244-P246 VanDerWaalsContact C-CD 3.44Å; R244-P246 WeakPolarHBondContact O-CD 3.26Å; P246-Y248 PolarHBondContact O-N 3.41Å; P246-R249 WeakPolarHBondContact O-CB 3.17Å; P246-R249 WeakPolarHBondContact O-CG 3.49Å; P246-R249 PolarHBondContact O-N 3.42Å
247	Q	93	Very high	96.2	Very high	72 Å²	72	71.4 Å²	71.4	34%	0.336	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-64.9	-25.2	177.9	-65.5	-167.2	21.2	0	0	112.9	P199 F200 F245 R249 L250 N309	P199-Q247 PolarHBondContact O-OE1 3.18Å; P199-Q247 VanDerWaalsContact O-OE1 3.08Å; F200-Q247 WeakPolarHBondContact CB-O 3.4Å; F200-Q247 HydrophobicContact CD1-CB 4.46Å; F245-Q247 PolarHBondContact O-N 3.44Å; F245-Q247 VanDerWaalsContact O-N 3.13Å; Q247-R249 PolarHBondContact O-N 3.33Å; Q247-R249 VanDerWaalsContact O-N 3.08Å; Q247-L250 WeakPolarHBondContact O-CB 3.2Å; Q247-L250 PolarHBondContact O-N 3.06Å; Q247-N309 PolarHBondContact NE2-OD1 3.11Å
248	Y	96.3	Very high	96.3	Very high	13 Å²	13	70.6 Å²	70.6	5%	0.051	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-61.3	-20.5	178.5	-171.4	-109.8	0	0	0	112.8	L193 L235 P237 P240 M242 F245 P246 L250 A251	L193-Y248 HydrophobicContact CD1-CE2 3.73Å; L235-Y248 HydrophobicContact CD1-CD1 3.68Å; L235-Y248 HydrophobicContact CD1-CD2 3.87Å; L235-Y248 HydrophobicContact CD1-CE1 4.27Å; L235-Y248 HydrophobicContact CD1-CE2 4.43Å; L235-Y248 HydrophobicContact CD1-CG 3.46Å; L235-Y248 VanDerWaalsContact CD1-CG 3.46Å; L235-Y248 HydrophobicContact CD2-CD1 4.03Å; L235-Y248 HydrophobicContact CD2-CD2 4.02Å; L235-Y248 HydrophobicContact CD2-CE1 3.76Å; L235-Y248 HydrophobicContact CD2-CE2 3.73Å; L235-Y248 HydrophobicContact CD2-CG 4.16Å; L235-Y248 HydrophobicContact CG-CD1 4.49Å; L235-Y248 HydrophobicContact CG-CG 4.5Å; P237-Y248 WeakPolarHBondContact CB-OH 3.18Å; P240-Y248 HydrophobicContact CB-CD1 3.61Å; P240-Y248 HydrophobicContact CB-CE1 3.71Å; P240-Y248 HydrophobicContact CG-CD1 4.17Å; P240-Y248 HydrophobicContact CG-CE1 4.03Å; M242-Y248 HydrophobicContact CE-CD1 3.63Å; M242-Y248 HydrophobicContact CE-CE1 4.32Å; M242-Y248 HydrophobicContact SD-CD1 4.04Å; F245-Y248 WeakPolarHBondContact O-CB 3.46Å; F245-Y248 PolarHBondContact O-N 3.25Å; F245-Y248 VanDerWaalsContact O-N 3.07Å; P246-Y248 PolarHBondContact O-N 3.41Å; Y248-L250 PolarHBondContact O-N 3.19Å; Y248-L250 VanDerWaalsContact O-N 3.12Å; Y248-A251 HydrophobicContact CD2-CB 3.92Å; Y248-A251 HydrophobicContact CE2-CB 3.98Å; Y248-A251 VanDerWaalsContact O-CB 3.28Å; Y248-A251 WeakPolarHBondContact O-CB 3.32Å; Y248-A251 PolarHBondContact O-N 3.29Å
249	R	95.4	Very high	96.4	Very high	170 Å²	170	72.5 Å²	72.5	64%	0.642	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-58.9	-21.8	172.1	-64.4	179.1	-177.7	-92.2	1.1	113.7	M242 P246 Q247	M242-R249 VanDerWaalsContact CB-NH2 3.35Å; M242-R249 HydrophobicContact CE-CG 3.99Å; M242-R249 HydrophobicContact CG-CG 4.28Å; M242-R249 HydrophobicContact SD-CB 4.44Å; M242-R249 HydrophobicContact SD-CG 3.43Å; M242-R249 WeakPolarHBondContact SD-CG 3.33Å; P246-R249 WeakPolarHBondContact O-CB 3.17Å; P246-R249 WeakPolarHBondContact O-CG 3.49Å; P246-R249 PolarHBondContact O-N 3.42Å; Q247-R249 PolarHBondContact O-N 3.33Å; Q247-R249 VanDerWaalsContact O-N 3.08Å
250	L	95.1	Very high	96.5	Very high	71 Å²	71	68.6 Å²	68.6	37%	0.372	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-88.6	-17.6	179.7	-58.9	174.5	0	0	0	112.4	V9 F200 Q247 Y248	V9-L250 HydrophobicContact CG1-CD1 4.03Å; V9-L250 HydrophobicContact CG2-CD1 4.18Å; F200-L250 HydrophobicContact CD1-CB 3.97Å; F200-L250 HydrophobicContact CD1-CD1 4.13Å; F200-L250 HydrophobicContact CD2-CB 3.77Å; F200-L250 HydrophobicContact CE1-CB 3.89Å; F200-L250 HydrophobicContact CE1-CD1 3.73Å; F200-L250 HydrophobicContact CE1-CG 4.48Å; F200-L250 HydrophobicContact CE2-CB 3.62Å; F200-L250 HydrophobicContact CG-CB 3.92Å; F200-L250 HydrophobicContact CZ-CB 3.7Å; F200-L250 HydrophobicContact CZ-CD1 4.1Å; Q247-L250 WeakPolarHBondContact O-CB 3.2Å; Q247-L250 PolarHBondContact O-N 3.06Å; Y248-L250 PolarHBondContact O-N 3.19Å; Y248-L250 VanDerWaalsContact O-N 3.12Å
251	A	95.5	Very high	96.7	Very high	11 Å²	11	67.8 Å²	67.8	9%	0.091	34%	0.343	C	S	.	.			trans	-66.9	146.3	175.5	0	0	0	0	0	110.6	L193 F200 Y248 P253	L193-A251 HydrophobicContact CD2-CB 3.81Å; F200-A251 HydrophobicContact CB-CB 4.09Å; F200-A251 HydrophobicContact CD2-CB 4.3Å; Y248-A251 HydrophobicContact CD2-CB 3.92Å; Y248-A251 HydrophobicContact CE2-CB 3.98Å; Y248-A251 VanDerWaalsContact O-CB 3.28Å; Y248-A251 WeakPolarHBondContact O-CB 3.32Å; Y248-A251 PolarHBondContact O-N 3.29Å; A251-P253 WeakPolarHBondContact O-CD 3.36Å
252	R	95.7	Very high	96.8	Very high	107 Å²	107	65.1 Å²	65.1	40%	0.404	33%	0.328	S	S	.	.			trans	-121.1	83.9	-178.3	-64.3	-178.5	-179.8	178.5	2.4	109.9	D17 D197	D17-R252 IonicContact OD1-NH1 2.74Å; D17-R252 PolarHBondContact OD1-NH1 3.16Å; D197-R252 PolarHBondContact OD2-N 2.86Å
253	P	97	Very high	97	Very high	60 Å²	60	62.9 Å²	62.9	39%	0.39	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-65.3	136.8	-177.5	25.1	-32.7	0	0	0	112	I191 L192 L193 A251	I191-P253 HydrophobicContact CG2-CB 3.76Å; L192-P253 CarbonylContact O-C 3.56Å; L192-P253 WeakPolarHBondContact O-CA 3.37Å; L193-P253 HydrophobicContact CD2-CB 4.02Å; L193-P253 HydrophobicContact CG-CB 4.41Å; A251-P253 WeakPolarHBondContact O-CD 3.36Å
254	L	98.3	Very high	97.1	Very high	14 Å²	14	54.1 Å²	54.1	7%	0.073	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.2	167.7	-59.2	-177.7	0	0	0	109	K22 V24 L192 W270	K22-L254 WeakPolarHBondContact O-CD2 3.32Å; V24-L254 HydrophobicContact CG2-CB 4.3Å; L192-L254 HydrophobicContact CB-CB 4.27Å; L192-L254 PolarHBondContact N-O 2.93Å; L192-L254 PolarHBondContact O-N 3.15Å; L254-W270 HydrophobicContact CD1-CH2 3.96Å; L254-W270 HydrophobicContact CD1-CZ3 3.96Å
255	C	98.4	Very high	97.3	Very high	94 Å²	94	47.3 Å²	47.3	64%	0.635	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	134	174.9	-59.2	0	0	0	0	110.4	F190	F190-C255 WeakPolarHBondContact O-CA 3.17Å
256	C	98.7	Very high	97.5	Very high	16 Å²	16	46 Å²	46	11%	0.108	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.8	171.2	68.6	0	0	0	0	111.5	V24 I48 F190	V24-C256 HydrophobicContact CB-CB 3.91Å; V24-C256 HydrophobicContact CG1-CB 4.43Å; V24-C256 HydrophobicContact CG2-CB 3.74Å; I48-C256 HydrophobicContact CD1-CB 4.06Å; F190-C256 PolarHBondContact N-O 3.47Å; F190-C256 PolarHBondContact O-N 2.72Å
257	T	98.9	Very high	97.6	Very high	53 Å²	53	42.6 Å²	42.6	33%	0.325	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.1	173.2	-62.7	0	0	0	0	107.9	E187 K188 H189 K259	E187-T257 HydrophobicContact CB-CG2 3.98Å; E187-T257 HydrophobicContact CG-CG2 4.43Å; K188-T257 CarbonylContact O-C 3.31Å; K188-T257 VanDerWaalsContact O-CA 3.3Å; K188-T257 WeakPolarHBondContact O-CA 3.46Å; H189-T257 WeakPolarHBondContact ND1-CG2 3.42Å; H189-T257 PolarHBondContact ND1-OG1 3.2Å; T257-K259 HydrophobicContact CG2-CG 4.25Å
258	V	98.9	Very high	97.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.7	177.9	-169.2	0	0	0	0	107.1	I48 V183 E187 K188 F190 E262 L264	I48-V258 HydrophobicContact CD1-CG2 4.32Å; I48-V258 HydrophobicContact CG1-CG2 4.45Å; V183-V258 HydrophobicContact CB-CG1 4.28Å; V183-V258 HydrophobicContact CG2-CB 3.89Å; V183-V258 HydrophobicContact CG2-CG1 3.66Å; E187-V258 CarbonylContact C-O 3.6Å; E187-V258 VanDerWaalsContact CA-O 3.28Å; E187-V258 WeakPolarHBondContact CA-O 3.22Å; K188-V258 PolarHBondContact N-O 2.9Å; K188-V258 PolarHBondContact O-N 3.46Å; F190-V258 HydrophobicContact CD2-CG2 3.83Å; F190-V258 HydrophobicContact CE2-CB 4.41Å; F190-V258 HydrophobicContact CE2-CG2 3.7Å; V258-E262 HydrophobicContact CG1-CB 3.83Å; V258-E262 WeakPolarHBondContact CG1-O 3.36Å; V258-L264 HydrophobicContact CG1-CB 4.42Å; V258-L264 HydrophobicContact CG2-CB 3.64Å; V258-L264 HydrophobicContact CG2-CD2 4.13Å; V258-L264 HydrophobicContact CG2-CG 4.39Å
259	K	98.8	Very high	98	Very high	114 Å²	114	39.1 Å²	39.1	50%	0.496	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	166.3	-176.6	-61.9	-180	177.7	-178.6	0	111.4	V183 E187 T257 G261 E262	V183-K259 WeakPolarHBondContact CB-O 3.38Å; E187-K259 HydrophobicContact CB-CG 4.38Å; T257-K259 HydrophobicContact CG2-CG 4.25Å; K259-G261 PolarHBondContact O-N 2.94Å; K259-E262 HydrophobicContact CB-CG 4.49Å; K259-E262 WeakPolarHBondContact CB-OE2 3.49Å; K259-E262 PolarHBondContact N-OE2 3.21Å; K259-E262 VanDerWaalsContact O-CB 3.3Å; K259-E262 WeakPolarHBondContact O-CB 3.43Å; K259-E262 PolarHBondContact O-N 3.32Å
260	A	98.8	Very high	98.2	Very high	53 Å²	53	31.1 Å²	31.1	44%	0.438	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	125.4	170.9	0	0	0	0	0	112.1	V183 G186	V183-A260 CarbonylContact O-C 3.26Å; V183-A260 WeakPolarHBondContact O-CA 3.35Å; G186-A260 PolarHBondContact O-N 3.37Å
261	G	98.6	Very high	98.4	Very high	17 Å²	17	27.8 Å²	27.8	18%	0.175	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-2.7	-176.2	0	0	0	0	0	115.4	F53 V183 K259	F53-G261 VanDerWaalsContact CZ-C 3.4Å; V183-G261 PolarHBondContact O-N 3.48Å; K259-G261 PolarHBondContact O-N 2.94Å
262	E	98.8	Very high	98.5	Very high	22 Å²	22	27.7 Å²	27.7	10%	0.103	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	147	176.1	-58.6	-174.6	136.4	0	0	111.7	I48 R50 F53 V183 V258 K259	I48-E262 HydrophobicContact CG2-CB 3.95Å; I48-E262 HydrophobicContact CG2-CG 4.35Å; R50-E262 HydrophobicContact CG-CG 4.26Å; R50-E262 IonicContact CZ-OE1 2.75Å; R50-E262 IonicContact NE-OE1 3.92Å; R50-E262 PolarHBondContact NE-OE1 2.86Å; R50-E262 VanDerWaalsContact NE-OE1 3.07Å; R50-E262 IonicContact NH2-OE1 3.79Å; F53-E262 WeakPolarHBondContact CE1-O 3.48Å; F53-E262 WeakPolarHBondContact CZ-O 3.22Å; V183-E262 PolarHBondContact N-O 3.08Å; V183-E262 VanDerWaalsContact N-O 3.11Å; V258-E262 HydrophobicContact CG1-CB 3.83Å; V258-E262 WeakPolarHBondContact CG1-O 3.36Å; K259-E262 HydrophobicContact CB-CG 4.49Å; K259-E262 WeakPolarHBondContact CB-OE2 3.49Å; K259-E262 PolarHBondContact N-OE2 3.21Å; K259-E262 VanDerWaalsContact O-CB 3.3Å; K259-E262 WeakPolarHBondContact O-CB 3.43Å; K259-E262 PolarHBondContact O-N 3.32Å
263	M	98.9	Very high	98.7	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.3	177.4	178.1	-173.3	-74.9	0	0	109.3	I48 I49 A52 F53 V145 W147 L180 Y181 C182	I48-M263 CarbonylContact C-O 3.6Å; I48-M263 WeakPolarHBondContact CA-O 3.31Å; I49-M263 HydrophobicContact CB-CB 4.36Å; I49-M263 HydrophobicContact CD1-SD 4.06Å; I49-M263 PolarHBondContact N-O 3.16Å; I49-M263 PolarHBondContact O-N 3.28Å; A52-M263 HydrophobicContact CB-CB 4.27Å; A52-M263 HydrophobicContact CB-CE 4.06Å; A52-M263 HydrophobicContact CB-SD 4.18Å; F53-M263 HydrophobicContact CD1-CB 4.19Å; F53-M263 HydrophobicContact CD1-CE 4.02Å; F53-M263 HydrophobicContact CE1-CB 3.84Å; V145-M263 HydrophobicContact CG1-CE 4.36Å; V145-M263 HydrophobicContact CG2-CE 3.89Å; W147-M263 HydrophobicContact CH2-SD 3.98Å; W147-M263 HydrophobicContact CZ2-CE 4.35Å; W147-M263 HydrophobicContact CZ2-SD 3.62Å; L180-M263 HydrophobicContact CB-CG 4.32Å; L180-M263 HydrophobicContact CB-SD 4.11Å; L180-M263 HydrophobicContact CD1-CE 4.47Å; L180-M263 HydrophobicContact CD1-SD 3.94Å; L180-M263 HydrophobicContact CD2-CG 4.41Å; L180-M263 HydrophobicContact CD2-SD 3.93Å; L180-M263 HydrophobicContact CG-SD 4.23Å; Y181-M263 CarbonylContact O-C 3.45Å; Y181-M263 WeakPolarHBondContact O-CA 3.3Å; C182-M263 WeakPolarHBondContact SG-CE 3.49Å
264	L	98.9	Very high	98.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.7	167.5	172.2	67.2	0	0	0	109.3	V24 P46 I48 L180 Y181 F190 V258 L266	V24-L264 HydrophobicContact CG1-CD1 4.26Å; P46-L264 HydrophobicContact CB-CD1 4.5Å; I48-L264 HydrophobicContact CG1-CD1 4.12Å; L180-L264 WeakPolarHBondContact CA-O 3.35Å; Y181-L264 PolarHBondContact N-O 3.26Å; Y181-L264 PolarHBondContact O-N 3.34Å; F190-L264 HydrophobicContact CD1-CD2 3.93Å; F190-L264 HydrophobicContact CD2-CD2 3.75Å; F190-L264 HydrophobicContact CE1-CD2 3.97Å; F190-L264 HydrophobicContact CE2-CD2 3.78Å; F190-L264 HydrophobicContact CG-CD2 3.83Å; F190-L264 HydrophobicContact CZ-CD2 3.91Å; V258-L264 HydrophobicContact CG1-CB 4.42Å; V258-L264 HydrophobicContact CG2-CB 3.64Å; V258-L264 HydrophobicContact CG2-CD2 4.13Å; V258-L264 HydrophobicContact CG2-CG 4.39Å; L264-L266 HydrophobicContact CD2-CB 4.25Å; L264-L266 HydrophobicContact CG-CB 4.25Å
265	Y	98.9	Very high	98.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	111.8	155.8	172.8	-129	0	0	0	108.8	F36 W40 I41 K45 P46 C47 M148 E178 L180 P267	F36-Y265 HydrophobicContact CE1-CD1 4.38Å; F36-Y265 HydrophobicContact CE1-CD2 4.37Å; F36-Y265 HydrophobicContact CE1-CG 4.31Å; F36-Y265 HydrophobicContact CE2-CD1 4.19Å; F36-Y265 HydrophobicContact CE2-CG 4.37Å; F36-Y265 AromaticContact CZ-CD1 3.57Å; F36-Y265 HydrophobicContact CZ-CD1 3.57Å; F36-Y265 AromaticContact CZ-CD2 3.98Å; F36-Y265 HydrophobicContact CZ-CD2 3.98Å; F36-Y265 HydrophobicContact CZ-CE1 4.09Å; F36-Y265 HydrophobicContact CZ-CE2 4.48Å; F36-Y265 AromaticContact CZ-CG 3.51Å; F36-Y265 HydrophobicContact CZ-CG 3.51Å; W40-Y265 HydrophobicContact CB-CD1 3.91Å; W40-Y265 HydrophobicContact CB-CE1 3.77Å; I41-Y265 WeakPolarHBondContact CA-OH 3.04Å; I41-Y265 HydrophobicContact CG1-CE1 4.4Å; K45-Y265 WeakPolarHBondContact O-CD1 3.47Å; K45-Y265 VanDerWaalsContact O-CE1 3.29Å; K45-Y265 WeakPolarHBondContact O-CE1 3.5Å; P46-Y265 VanDerWaalsContact CA-O 3.26Å; P46-Y265 WeakPolarHBondContact CA-O 3.39Å; P46-Y265 WeakPolarHBondContact CB-O 3.45Å; C47-Y265 PolarHBondContact N-O 3.25Å; C47-Y265 PolarHBondContact O-N 2.98Å; M148-Y265 HydrophobicContact CE-CD2 4.4Å; M148-Y265 HydrophobicContact CE-CE2 4.07Å; E178-Y265 HydrophobicContact CB-CE2 4.28Å; E178-Y265 WeakPolarHBondContact OE2-CE2 3.45Å; E178-Y265 PolarHBondContact OE2-OH 2.95Å; L180-Y265 HydrophobicContact CD2-CD2 3.89Å; L180-Y265 HydrophobicContact CD2-CG 4.32Å; Y265-P267 HydrophobicContact CD1-CG 4.17Å; Y265-P267 HydrophobicContact CE1-CB 4.09Å; Y265-P267 HydrophobicContact CE1-CG 3.69Å; Y265-P267 HydrophobicContact CE2-CB 4.39Å; Y265-P267 WeakPolarHBondContact OH-CB 3.22Å
266	L	98.9	Very high	98.8	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.021	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	105	173.6	172.1	60.1	0	0	0	107.6	N179 L192 L264 W270 H272	N179-L266 HydrophobicContact CB-CB 4.11Å; N179-L266 HydrophobicContact CB-CG 4.45Å; N179-L266 PolarHBondContact N-O 2.8Å; N179-L266 PolarHBondContact O-N 2.84Å; L192-L266 HydrophobicContact CD2-CD1 3.78Å; L264-L266 HydrophobicContact CD2-CB 4.25Å; L264-L266 HydrophobicContact CG-CB 4.25Å; L266-W270 HydrophobicContact CD1-CB 3.74Å; L266-H272 HydrophobicContact CD1-CB 4.3Å; L266-H272 HydrophobicContact CD2-CB 4.23Å
267	P	98.8	Very high	98.8	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.013	11%	0.114	C	C	.	.			trans	-68.5	155.1	-174	-15.2	27.5	0	0	0	112.2	N44 K45 P46 E178 Y265 W270	N44-P267 WeakPolarHBondContact ND2-CB 3.22Å; K45-P267 WeakPolarHBondContact O-CG 3.29Å; P46-P267 HydrophobicContact CB-CG 4.31Å; E178-P267 WeakPolarHBondContact OE2-CA 3.39Å; Y265-P267 HydrophobicContact CD1-CG 4.17Å; Y265-P267 HydrophobicContact CE1-CB 4.09Å; Y265-P267 HydrophobicContact CE1-CG 3.69Å; Y265-P267 HydrophobicContact CE2-CB 4.39Å; Y265-P267 WeakPolarHBondContact OH-CB 3.22Å; P267-W270 HydrophobicContact CB-CG 4.4Å; P267-W270 HydrophobicContact CG-CG 4.38Å; P267-W270 WeakPolarHBondContact O-CB 3.41Å; P267-W270 PolarHBondContact O-N 3.23Å
268	S	98.6	Very high	98.7	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.028	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	144.3	176	69.2	0	0	0	0	112.3	N44 Y177 E178 W270	N44-S268 PolarHBondContact ND2-O 2.8Å; Y177-S268 WeakPolarHBondContact O-CA 3.44Å; Y177-S268 PolarHBondContact O-N 3Å; E178-S268 PolarHBondContact OE2-N 2.86Å; S268-W270 PolarHBondContact O-N 2.87Å
269	L	98.7	Very high	98.7	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.042	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-1.2	178.3	-50.5	178.7	0	0	0	116	K174 D175 P195 F271 M289 Y295 F298	K174-L269 HydrophobicContact CD-CD2 4.46Å; D175-L269 PolarHBondContact O-N 3.2Å; P195-L269 HydrophobicContact CB-CB 4.23Å; P195-L269 HydrophobicContact CG-CB 3.89Å; L269-F271 PolarHBondContact O-N 2.89Å; L269-M289 HydrophobicContact CD1-CE 3.89Å; L269-M289 HydrophobicContact CD1-SD 4.28Å; L269-M289 HydrophobicContact CD2-SD 3.94Å; L269-M289 HydrophobicContact CG-CE 4.07Å; L269-M289 HydrophobicContact CG-SD 3.97Å; L269-Y295 HydrophobicContact CD1-CD2 4.37Å; L269-F298 HydrophobicContact CD1-CB 3.91Å; L269-F298 HydrophobicContact CD1-CD1 3.97Å; L269-F298 HydrophobicContact CD1-CD2 4.39Å; L269-F298 HydrophobicContact CD1-CG 3.8Å
270	W	98.8	Very high	98.7	Very high	3 Å²	3	18.8 Å²	18.8	1%	0.011	11%	0.105	C	C	.	.			trans	-66.1	128.7	172.4	-84.1	65	0	0	0	110.4	L20 N44 P46 L192 P194 L254 L266 P267 S268 H272	L20-W270 HydrophobicContact CD2-CH2 4.07Å; L20-W270 HydrophobicContact CD2-CZ2 3.78Å; N44-W270 PolarHBondContact O-NE1 3.46Å; N44-W270 VanDerWaalsContact OD1-CD1 3.32Å; N44-W270 PolarHBondContact OD1-NE1 3.19Å; P46-W270 VanDerWaalsContact CD-CH2 3.48Å; P46-W270 HydrophobicContact CG-CE3 4.32Å; P46-W270 HydrophobicContact CG-CH2 3.79Å; P46-W270 HydrophobicContact CG-CZ2 4.09Å; P46-W270 HydrophobicContact CG-CZ3 3.92Å; L192-W270 HydrophobicContact CB-CE3 3.9Å; L192-W270 HydrophobicContact CB-CZ3 4.08Å; P194-W270 HydrophobicContact CB-CE3 4.44Å; P194-W270 HydrophobicContact CB-CH2 3.76Å; P194-W270 HydrophobicContact CB-CZ2 3.83Å; P194-W270 HydrophobicContact CB-CZ3 4.07Å; L254-W270 HydrophobicContact CD1-CH2 3.96Å; L254-W270 HydrophobicContact CD1-CZ3 3.96Å; L266-W270 HydrophobicContact CD1-CB 3.74Å; P267-W270 HydrophobicContact CB-CG 4.4Å; P267-W270 HydrophobicContact CG-CG 4.38Å; P267-W270 WeakPolarHBondContact O-CB 3.41Å; P267-W270 PolarHBondContact O-N 3.23Å; S268-W270 PolarHBondContact O-N 2.87Å; W270-H272 PolarHBondContact O-ND1 2.92Å
271	F	98.8	Very high	98.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	133.3	172.5	-56.4	-88.2	0	0	0	108.6	M172 H173 K174 L192 L193 R198 I201 Y203 I233 L269 F298	M172-F271 HydrophobicContact CG-CB 4.4Å; M172-F271 HydrophobicContact SD-CB 3.69Å; H173-F271 CarbonylContact O-C 3.57Å; H173-F271 WeakPolarHBondContact O-CA 3.06Å; K174-F271 HydrophobicContact CB-CD1 3.93Å; K174-F271 HydrophobicContact CB-CE1 4.18Å; K174-F271 HydrophobicContact CB-CG 4.42Å; K174-F271 HydrophobicContact CD-CD1 4.33Å; K174-F271 HydrophobicContact CD-CE1 3.7Å; K174-F271 HydrophobicContact CD-CZ 3.93Å; K174-F271 HydrophobicContact CG-CD1 4.27Å; K174-F271 HydrophobicContact CG-CE1 4.05Å; L192-F271 CarbonylContact C-O 3.58Å; L192-F271 VanDerWaalsContact CA-O 3.32Å; L192-F271 WeakPolarHBondContact CA-O 3.39Å; L193-F271 HydrophobicContact CB-CB 4.08Å; L193-F271 HydrophobicContact CB-CD2 4.43Å; L193-F271 PolarHBondContact N-O 3.09Å; L193-F271 PolarHBondContact O-N 3.13Å; R198-F271 HydrophobicContact CB-CE2 4.23Å; R198-F271 HydrophobicContact CB-CZ 4.19Å; I201-F271 HydrophobicContact CD1-CB 4.14Å; I201-F271 HydrophobicContact CD1-CD1 4.03Å; I201-F271 HydrophobicContact CD1-CD2 3.24Å; I201-F271 HydrophobicContact CD1-CE1 4.23Å; I201-F271 HydrophobicContact CD1-CE2 3.49Å; I201-F271 VanDerWaalsContact CD1-CE2 3.49Å; I201-F271 HydrophobicContact CD1-CG 3.53Å; I201-F271 HydrophobicContact CD1-CZ 3.99Å; I201-F271 HydrophobicContact CG2-CD1 4.46Å; I201-F271 HydrophobicContact CG2-CE1 4.41Å; Y203-F271 AromaticContact CE2-CE1 3.93Å; Y203-F271 HydrophobicContact CE2-CE1 3.93Å; Y203-F271 WeakPolarHBondContact OH-CE1 3.45Å; I233-F271 HydrophobicContact CD1-CD1 3.68Å; I233-F271 HydrophobicContact CD1-CE1 4.02Å; L269-F271 PolarHBondContact O-N 2.89Å; F271-F298 HydrophobicContact CE2-CE2 4.35Å; F271-F298 HydrophobicContact CZ-CE2 4.19Å; F271-F298 HydrophobicContact CZ-CZ 4.1Å
272	H	98.8	Very high	98.7	Very high	10 Å²	10	15.8 Å²	15.8	5%	0.046	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	144.5	-177.6	61.2	-76.6	0	0	0	112.1	M172 H173 D175 I191 L192 L266 W270	M172-H272 WeakPolarHBondContact CA-O 3.42Å; M172-H272 PolarHBondContact SD-N 3.41Å; M172-H272 VanDerWaalsContact SD-N 3.37Å; H173-H272 AromaticContact CD2-CE1 3.92Å; H173-H272 AromaticContact CE1-CD2 3.67Å; H173-H272 AromaticContact CE1-CE1 3.65Å; H173-H272 AromaticContact CE1-NE2 3.17Å; H173-H272 PolarHBondContact CE1-NE2 3.27Å; H173-H272 PolarHBondContact N-O 3.13Å; H173-H272 VanDerWaalsContact N-O 3.12Å; H173-H272 PolarHBondContact ND1-O 2.8Å; H173-H272 AromaticContact NE2-CE1 3.44Å; H173-H272 PolarHBondContact NE2-CE1 3.36Å; H173-H272 AromaticContact NE2-NE2 3.2Å; H173-H272 PolarHBondContact NE2-NE2 3.05Å; H173-H272 PolarHBondContact O-N 3.47Å; H173-H272 PolarHBondContact O-ND1 2.6Å; D175-H272 IonicContact OD2-CE1 3.42Å; D175-H272 PolarHBondContact OD2-CE1 2.96Å; D175-H272 IonicContact OD2-NE2 3.57Å; I191-H272 CarbonylContact O-C 3.54Å; I191-H272 VanDerWaalsContact O-CA 3.24Å; I191-H272 WeakPolarHBondContact O-CA 3.49Å; L192-H272 HydrophobicContact CD2-CB 3.49Å; L192-H272 VanDerWaalsContact CD2-CB 3.49Å; L266-H272 HydrophobicContact CD1-CB 4.3Å; L266-H272 HydrophobicContact CD2-CB 4.23Å; W270-H272 PolarHBondContact O-ND1 2.92Å
273	H	98.8	Very high	98.7	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.009	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.7	172.9	161.5	-77.6	0	0	0	108.3	V169 T170 M172 F190 I191 P237	V169-H273 WeakPolarHBondContact CG1-NE2 3.14Å; T170-H273 PolarHBondContact O-CD2 3.23Å; M172-H273 HydrophobicContact CB-CB 4.32Å; M172-H273 HydrophobicContact CE-CB 3.79Å; M172-H273 HydrophobicContact SD-CB 4.19Å; F190-H273 WeakPolarHBondContact CA-O 3.28Å; I191-H273 HydrophobicContact CB-CB 4.33Å; I191-H273 PolarHBondContact N-O 2.97Å; I191-H273 PolarHBondContact O-N 3.07Å; P237-H273 HydrophobicContact CG-CB 3.66Å
274	V	98.7	Very high	98.6	Very high	7 Å²	7	14.7 Å²	14.7	4%	0.042	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.5	-167.2	-164.3	0	0	0	0	111.6	T170 K188 H189 F190	T170-V274 PolarHBondContact N-O 3.35Å; T170-V274 PolarHBondContact O-N 3.17Å; T170-V274 VanDerWaalsContact O-N 3.09Å; K188-V274 HydrophobicContact CD-CG1 3.74Å; H189-V274 WeakPolarHBondContact O-CA 3.24Å; F190-V274 HydrophobicContact CD1-CB 4.47Å; F190-V274 HydrophobicContact CD1-CG1 4.24Å; F190-V274 HydrophobicContact CD1-CG2 3.65Å; F190-V274 HydrophobicContact CE1-CB 4.32Å; F190-V274 HydrophobicContact CE1-CG1 3.87Å; F190-V274 HydrophobicContact CE1-CG2 3.49Å; F190-V274 VanDerWaalsContact CE1-CG2 3.49Å; F190-V274 HydrophobicContact CE2-CG1 4.4Å; F190-V274 HydrophobicContact CZ-CG1 3.95Å; F190-V274 HydrophobicContact CZ-CG2 4.37Å
275	R	98.6	Very high	98.6	Very high	111 Å²	111	14.7 Å²	14.7	42%	0.419	7%	0.073	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	166.4	163.7	-69.8	177.2	30.6	-175.4	-9	110.4	V169 K188 H189	V169-R275 HydrophobicContact CG1-CG 4.42Å; V169-R275 HydrophobicContact CG2-CG 4.14Å; K188-R275 CarbonylContact C-O 3.46Å; K188-R275 WeakPolarHBondContact CA-O 3.14Å; H189-R275 HydrophobicContact CB-CB 4.31Å; H189-R275 PolarHBondContact N-O 3.29Å; H189-R275 PolarHBondContact O-N 2.74Å
276	Q	98.6	Very high	98.6	Very high	7 Å²	7	15.6 Å²	15.6	3%	0.033	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.2	-179.1	63.2	-156.6	-34	0	0	112.3	E165 A166 A168 E187 K188 C280	E165-Q276 PolarHBondContact O-NE2 3.06Å; A166-Q276 WeakPolarHBondContact CA-O 3.23Å; A168-Q276 PolarHBondContact O-NE2 3.2Å; E187-Q276 CarbonylContact O-C 3.58Å; E187-Q276 WeakPolarHBondContact O-CA 3.31Å; K188-Q276 HydrophobicContact CD-CB 3.88Å; K188-Q276 VanDerWaalsContact CE-OE1 3.27Å; Q276-C280 HydrophobicContact CB-CB 3.85Å; Q276-C280 HydrophobicContact CG-CB 4.4Å
277	S	98.6	Very high	98.6	Very high	28 Å²	28	15.4 Å²	15.4	20%	0.196	8%	0.075	C	C	.	.			trans	-66.3	158.5	162.7	64.6	0	0	0	0	110.6	G186 E187 G279 C280	G186-S277 VanDerWaalsContact CA-OG 3.31Å; G186-S277 WeakPolarHBondContact CA-OG 3.32Å; E187-S277 PolarHBondContact N-OG 3.43Å; E187-S277 PolarHBondContact O-N 3.25Å; S277-G279 PolarHBondContact O-N 2.95Å; S277-C280 VanDerWaalsContact O-CB 3.26Å; S277-C280 WeakPolarHBondContact O-CB 3.4Å; S277-C280 PolarHBondContact O-N 2.93Å
278	H	98.2	Very high	98.6	Very high	99 Å²	99	17.3 Å²	17.3	46%	0.458	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	131	178.4	-165.1	83.5	0	0	0	111.2	I111 E165 A166 C280	I111-H278 PolarHBondContact O-NE2 2.85Å; E165-H278 IonicContact OE1-CE1 3.17Å; A166-H278 HydrophobicContact CB-CB 3.85Å; A166-H278 PolarHBondContact N-ND1 3.08Å; H278-C280 PolarHBondContact O-N 2.95Å
279	G	97.7	Very high	98.5	Very high	17 Å²	17	17.3 Å²	17.3	18%	0.175	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	21.6	-178.9	0	0	0	0	0	114.1	G164 S277 I281	G164-G279 WeakPolarHBondContact O-CA 3.48Å; G164-G279 PolarHBondContact O-N 3.09Å; S277-G279 PolarHBondContact O-N 2.95Å; G279-I281 PolarHBondContact O-N 3.43Å
280	C	98.5	Very high	98.5	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	132.6	177.2	-178.2	0	0	0	0	110.4	L163 S185 Q276 S277 H278	L163-C280 WeakPolarHBondContact CA-O 3.25Å; S185-C280 WeakPolarHBondContact O-CA 3.37Å; S185-C280 PolarHBondContact O-SG 3.29Å; Q276-C280 HydrophobicContact CB-CB 3.85Å; Q276-C280 HydrophobicContact CG-CB 4.4Å; S277-C280 VanDerWaalsContact O-CB 3.26Å; S277-C280 WeakPolarHBondContact O-CB 3.4Å; S277-C280 PolarHBondContact O-N 2.93Å; H278-C280 PolarHBondContact O-N 2.95Å
281	I	98.7	Very high	98.4	Very high	7 Å²	7	26.6 Å²	26.6	4%	0.036	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.7	173.2	-56.1	162	0	0	0	109	W62 L67 F161 W162 L163 I184 S185 G279	W62-I281 HydrophobicContact CB-CD1 4.43Å; W62-I281 HydrophobicContact CE3-CG2 3.54Å; W62-I281 HydrophobicContact CZ3-CG2 3.8Å; W62-I281 WeakPolarHBondContact O-CD1 3.36Å; L67-I281 HydrophobicContact CD1-CD1 3.82Å; F161-I281 HydrophobicContact CE2-CG2 3.68Å; F161-I281 HydrophobicContact CZ-CG2 3.94Å; W162-I281 WeakPolarHBondContact O-CA 3.49Å; L163-I281 HydrophobicContact CD1-CG1 3.88Å; I184-I281 HydrophobicContact CB-CB 4.4Å; I184-I281 HydrophobicContact CB-CG2 4.23Å; I184-I281 PolarHBondContact N-O 2.81Å; S185-I281 PolarHBondContact N-O 3.08Å; S185-I281 VanDerWaalsContact N-O 3.09Å; S185-I281 PolarHBondContact O-N 3.12Å; G279-I281 PolarHBondContact O-N 3.43Å
282	A	98.7	Very high	98.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	157.5	176.2	0	0	0	0	0	111.7	W162 Y181 C182 V183	W162-A282 HydrophobicContact CB-CB 4.19Å; W162-A282 PolarHBondContact N-O 3.41Å; W162-A282 PolarHBondContact O-N 3.5Å; Y181-A282 HydrophobicContact CD1-CB 4.21Å; Y181-A282 HydrophobicContact CE1-CB 3.49Å; Y181-A282 VanDerWaalsContact CE1-CB 3.49Å; C182-A282 CarbonylContact O-C 3.5Å; C182-A282 VanDerWaalsContact O-CA 3.25Å; C182-A282 WeakPolarHBondContact O-CA 3.46Å; C182-A282 WeakPolarHBondContact O-CB 3.24Å; V183-A282 HydrophobicContact CG2-CB 4.49Å
283	V	98.6	Very high	98.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.9	171.8	177	0	0	0	0	108	W62 L130 L141 V159 N160 C182 I184 F285	W62-V283 HydrophobicContact CH2-CG2 3.62Å; W62-V283 HydrophobicContact CZ3-CG2 3.58Å; L130-V283 HydrophobicContact CD2-CG1 3.94Å; L130-V283 HydrophobicContact CD2-CG2 4.43Å; L141-V283 HydrophobicContact CD2-CG1 4.33Å; L141-V283 HydrophobicContact CD2-CG2 3.88Å; V159-V283 HydrophobicContact CG1-CG1 3.74Å; N160-V283 CarbonylContact O-C 3.55Å; N160-V283 VanDerWaalsContact O-CA 3.23Å; N160-V283 WeakPolarHBondContact O-CA 3.25Å; C182-V283 WeakPolarHBondContact CA-O 3.41Å; C182-V283 VanDerWaalsContact CB-O 3.29Å; C182-V283 WeakPolarHBondContact CB-O 3.26Å; C182-V283 PolarHBondContact N-O 3.03Å; C182-V283 PolarHBondContact O-N 2.98Å; I184-V283 HydrophobicContact CG1-CG2 4.25Å; V283-F285 HydrophobicContact CG1-CE2 3.89Å; V283-F285 HydrophobicContact CG1-CZ 4.03Å
284	N	98.6	Very high	98.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.8	173.9	93.3	-75.7	0	0	0	112.5	V159 N160 W162 N179 L180 Y181 W286	V159-N284 CarbonylContact C-O 3.41Å; V159-N284 WeakPolarHBondContact CA-O 3.35Å; N160-N284 VanDerWaalsContact CB-OD1 3.26Å; N160-N284 WeakPolarHBondContact CB-OD1 3.44Å; N160-N284 PolarHBondContact N-O 3.14Å; N160-N284 PolarHBondContact ND2-OD1 3.35Å; N160-N284 PolarHBondContact O-N 2.88Å; W162-N284 PolarHBondContact NE1-OD1 2.72Å; N179-N284 WeakPolarHBondContact OD1-CB 3.49Å; N179-N284 PolarHBondContact OD1-ND2 2.7Å; L180-N284 CarbonylContact O-C 3.48Å; L180-N284 WeakPolarHBondContact O-CA 3.47Å; Y181-N284 HydrophobicContact CD2-CB 3.7Å; Y181-N284 HydrophobicContact CE2-CB 4.1Å; Y181-N284 HydrophobicContact CG-CB 4.14Å; N284-W286 PolarHBondContact ND2-NE1 3.31Å
285	F	98.6	Very high	98.3	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.7	177.6	-56.7	-99.9	0	0	0	108.3	W56 E142 V145 P156 V159 N179 L180 V283 Y287	W56-F285 AromaticContact CH2-CE2 3.49Å; W56-F285 HydrophobicContact CH2-CE2 3.49Å; W56-F285 VanDerWaalsContact CH2-CE2 3.49Å; W56-F285 AromaticContact CH2-CZ 3.46Å; W56-F285 HydrophobicContact CH2-CZ 3.46Å; W56-F285 VanDerWaalsContact CH2-CZ 3.46Å; W56-F285 HydrophobicContact CZ2-CE2 4.34Å; W56-F285 HydrophobicContact CZ2-CZ 4.02Å; W56-F285 HydrophobicContact CZ3-CE2 4.29Å; W56-F285 HydrophobicContact CZ3-CZ 4.35Å; E142-F285 WeakPolarHBondContact O-CE1 3.34Å; E142-F285 WeakPolarHBondContact O-CZ 3.21Å; V145-F285 HydrophobicContact CG2-CD2 3.98Å; V145-F285 HydrophobicContact CG2-CE2 4.16Å; V145-F285 HydrophobicContact CG2-CG 4.21Å; V145-F285 HydrophobicContact CG2-CZ 4.44Å; P156-F285 HydrophobicContact CB-CB 4.3Å; P156-F285 HydrophobicContact CG-CD1 4.28Å; V159-F285 HydrophobicContact CB-CD1 4.39Å; V159-F285 HydrophobicContact CB-CE1 4.44Å; V159-F285 HydrophobicContact CG1-CD1 3.86Å; V159-F285 HydrophobicContact CG1-CE1 3.58Å; V159-F285 HydrophobicContact CG1-CG 4.5Å; V159-F285 HydrophobicContact CG1-CZ 3.97Å; V159-F285 HydrophobicContact CG2-CD1 3.73Å; V159-F285 HydrophobicContact CG2-CE1 3.95Å; N179-F285 WeakPolarHBondContact CA-O 3.29Å; L180-F285 HydrophobicContact CB-CB 4.38Å; L180-F285 HydrophobicContact CB-CD2 4.42Å; L180-F285 PolarHBondContact N-O 3.05Å; L180-F285 PolarHBondContact O-N 3.12Å; V283-F285 HydrophobicContact CG1-CE2 3.89Å; V283-F285 HydrophobicContact CG1-CZ 4.03Å; F285-Y287 HydrophobicContact CB-CD2 4.32Å; F285-Y287 HydrophobicContact CB-CE2 3.67Å
286	W	98.6	Very high	98.2	Very high	18 Å²	18	38.4 Å²	38.4	7%	0.068	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.7	175	-82.2	-11.1	0	0	0	110.2	Q126 P156 D157 A158 Y177 N179 N284	Q126-W286 HydrophobicContact CB-CH2 3.71Å; Q126-W286 HydrophobicContact CB-CZ2 4.5Å; Q126-W286 HydrophobicContact CB-CZ3 3.85Å; Q126-W286 HydrophobicContact CG-CH2 4.37Å; P156-W286 CarbonylContact C-O 3Å; P156-W286 WeakPolarHBondContact CA-O 3.18Å; P156-W286 VanDerWaalsContact CB-O 3.32Å; P156-W286 WeakPolarHBondContact CB-O 3.44Å; D157-W286 PolarHBondContact N-O 3.27Å; A158-W286 HydrophobicContact CB-CB 4.36Å; A158-W286 HydrophobicContact CB-CE3 4.28Å; A158-W286 PolarHBondContact N-O 2.8Å; A158-W286 PolarHBondContact O-N 2.68Å; Y177-W286 HydrophobicContact CD1-CB 3.77Å; Y177-W286 HydrophobicContact CD1-CG 4.25Å; Y177-W286 AromaticContact CD2-CD2 3.81Å; Y177-W286 HydrophobicContact CD2-CD2 3.81Å; Y177-W286 AromaticContact CD2-CE3 3.82Å; Y177-W286 HydrophobicContact CD2-CE3 3.82Å; Y177-W286 HydrophobicContact CD2-CG 4.17Å; Y177-W286 HydrophobicContact CD2-CH2 4.46Å; Y177-W286 HydrophobicContact CD2-CZ3 4.17Å; Y177-W286 HydrophobicContact CE1-CB 4.36Å; Y177-W286 HydrophobicContact CE2-CD2 4.26Å; Y177-W286 AromaticContact CE2-CE3 3.78Å; Y177-W286 HydrophobicContact CE2-CE3 3.78Å; Y177-W286 AromaticContact CE2-CZ3 3.94Å; Y177-W286 HydrophobicContact CE2-CZ3 3.94Å; Y177-W286 HydrophobicContact CG-CB 3.87Å; Y177-W286 HydrophobicContact CG-CD2 4Å; Y177-W286 HydrophobicContact CG-CE3 4.3Å; Y177-W286 AromaticContact CG-CG 3.85Å; Y177-W286 HydrophobicContact CG-CG 3.85Å; N179-W286 VanDerWaalsContact CG-CD1 3.48Å; N179-W286 PolarHBondContact ND2-NE1 3.44Å; N179-W286 VanDerWaalsContact ND2-NE1 3.19Å; N284-W286 PolarHBondContact ND2-NE1 3.31Å
287	Y	98.6	Very high	98.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.9	171.3	-62.8	-100.5	0	0	0	107.7	V145 M148 S149 L152 K154 P156 Y177 E178 L180 F285 M289	V145-Y287 PolarHBondContact N-OH 3.36Å; V145-Y287 VanDerWaalsContact N-OH 3.11Å; V145-Y287 PolarHBondContact O-OH 3.32Å; M148-Y287 HydrophobicContact CB-CE2 4.41Å; M148-Y287 HydrophobicContact CE-CD2 4.35Å; M148-Y287 HydrophobicContact CG-CD2 4.03Å; M148-Y287 HydrophobicContact CG-CE1 4.29Å; M148-Y287 HydrophobicContact CG-CE2 3.64Å; S149-Y287 WeakPolarHBondContact OG-CE1 3.29Å; S149-Y287 PolarHBondContact OG-OH 2.87Å; L152-Y287 VanDerWaalsContact CD1-CB 3.48Å; L152-Y287 HydrophobicContact CD1-CD1 3.88Å; L152-Y287 HydrophobicContact CD1-CD2 4.41Å; L152-Y287 HydrophobicContact CD1-CG 3.69Å; K154-Y287 HydrophobicContact CG-CD1 4.17Å; P156-Y287 HydrophobicContact CB-CD1 4.2Å; P156-Y287 HydrophobicContact CB-CD2 4.31Å; P156-Y287 HydrophobicContact CB-CE1 3.98Å; P156-Y287 HydrophobicContact CB-CE2 4.06Å; P156-Y287 HydrophobicContact CB-CG 4.36Å; P156-Y287 HydrophobicContact CG-CE1 4.28Å; P156-Y287 VanDerWaalsContact N-CE1 3.31Å; Y177-Y287 CarbonylContact C-O 3.56Å; Y177-Y287 WeakPolarHBondContact CA-O 3.43Å; E178-Y287 PolarHBondContact N-O 3.32Å; E178-Y287 PolarHBondContact O-N 3.36Å; E178-Y287 VanDerWaalsContact O-N 3.07Å; L180-Y287 HydrophobicContact CD1-CE2 4.39Å; F285-Y287 HydrophobicContact CB-CD2 4.32Å; F285-Y287 HydrophobicContact CB-CE2 3.67Å; Y287-M289 PolarHBondContact O-N 2.99Å
288	D	98.1	Very high	98.2	Very high	43 Å²	43	44.2 Å²	44.2	23%	0.23	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55	134.5	179	-169.7	29.1	0	0	0	110.3	K154 D157 Y177	K154-D288 PolarHBondContact NZ-O 2.88Å; D157-D288 WeakPolarHBondContact OD2-CB 3.46Å; Y177-D288 HydrophobicContact CD1-CB 4.45Å; Y177-D288 HydrophobicContact CE1-CB 4.28Å
289	M	97.8	Very high	98.2	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.02	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-66	158.5	-177.3	72.3	175.7	-68	0	0	111	P176 L269 Y287 Y291 Y295	P176-M289 HydrophobicContact CB-CG 4.42Å; P176-M289 HydrophobicContact CB-SD 4.11Å; P176-M289 WeakPolarHBondContact O-CB 3.48Å; P176-M289 VanDerWaalsContact O-CG 3.24Å; P176-M289 WeakPolarHBondContact O-CG 3.17Å; P176-M289 PolarHBondContact O-N 3.38Å; P176-M289 VanDerWaalsContact O-N 3.13Å; L269-M289 HydrophobicContact CD1-CE 3.89Å; L269-M289 HydrophobicContact CD1-SD 4.28Å; L269-M289 HydrophobicContact CD2-SD 3.94Å; L269-M289 HydrophobicContact CG-CE 4.07Å; L269-M289 HydrophobicContact CG-SD 3.97Å; Y287-M289 PolarHBondContact O-N 2.99Å; M289-Y291 HydrophobicContact CG-CE1 4.41Å; M289-Y291 HydrophobicContact CG-CE2 4.34Å; M289-Y291 PolarHBondContact O-N 3.46Å; M289-Y295 HydrophobicContact CE-CD2 4.2Å; M289-Y295 HydrophobicContact SD-CD2 4.18Å
290	E	97.5	Very high	98.2	Very high	86 Å²	86	45.9 Å²	45.9	40%	0.402	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-77.2	122.6	164.6	-70.4	-59.7	139.8	0	0	109.2	K154 D292	K154-E290 WeakPolarHBondContact CE-OE1 3.47Å; K154-E290 IonicContact NZ-OE1 2.68Å; K154-E290 PolarHBondContact NZ-OE1 2.91Å; E290-D292 HydrophobicContact CB-CB 4.48Å; E290-D292 PolarHBondContact O-N 3.14Å
291	Y	97.5	Very high	98.1	Very high	120 Å²	120	46.6 Å²	46.6	47%	0.471	22%	0.216	S	C	.	.			trans	-78.3	64.2	174.6	-68.4	-87.4	0	0	0	110.7	M289 Y295	M289-Y291 HydrophobicContact CG-CE1 4.41Å; M289-Y291 HydrophobicContact CG-CE2 4.34Å; M289-Y291 PolarHBondContact O-N 3.46Å; Y291-Y295 AromaticContact CD1-CD1 3.88Å; Y291-Y295 HydrophobicContact CD1-CD1 3.88Å; Y291-Y295 AromaticContact CD1-CD2 3.89Å; Y291-Y295 HydrophobicContact CD1-CD2 3.89Å; Y291-Y295 AromaticContact CD1-CE1 3.92Å; Y291-Y295 HydrophobicContact CD1-CE1 3.92Å; Y291-Y295 AromaticContact CD1-CE2 3.94Å; Y291-Y295 HydrophobicContact CD1-CE2 3.94Å; Y291-Y295 AromaticContact CD1-CG 3.86Å; Y291-Y295 HydrophobicContact CD1-CG 3.86Å; Y291-Y295 AromaticContact CD1-CZ 3.94Å; Y291-Y295 HydrophobicContact CE1-CD2 4.17Å; Y291-Y295 HydrophobicContact CE1-CE1 4.46Å; Y291-Y295 AromaticContact CE1-CE2 3.88Å; Y291-Y295 HydrophobicContact CE1-CE2 3.88Å
292	D	97.7	Very high	98	Very high	49 Å²	49	47.5 Å²	47.5	26%	0.262	22%	0.22	S	C	.	.	S	Bend	trans	-94.7	-162	-175.1	72.9	10.2	0	0	0	112.7	E290 K294 Y295 N296	E290-D292 HydrophobicContact CB-CB 4.48Å; E290-D292 PolarHBondContact O-N 3.14Å; D292-K294 PolarHBondContact O-N 3.06Å; D292-K294 WeakPolarHBondContact OD1-CA 3.48Å; D292-K294 VanDerWaalsContact OD1-CB 3.23Å; D292-K294 WeakPolarHBondContact OD1-CB 3.37Å; D292-K294 PolarHBondContact OD1-N 3.45Å; D292-K294 WeakPolarHBondContact OD2-CE 3.26Å; D292-Y295 PolarHBondContact O-N 3.48Å; D292-N296 PolarHBondContact O-N 2.9Å
293	I	98.1	Very high	97.8	Very high	105 Å²	105	50.2 Å²	50.2	54%	0.538	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-29.4	179.4	-161.4	171.5	0	0	0	113.2	Y295 N296 Y297	I293-Y295 VanDerWaalsContact C-N 3.34Å; I293-N296 PolarHBondContact O-N 3.39Å; I293-Y297 HydrophobicContact CD1-CD2 4.41Å; I293-Y297 HydrophobicContact CD1-CE2 3.67Å; I293-Y297 HydrophobicContact CG1-CD2 3.79Å; I293-Y297 HydrophobicContact CG1-CE2 3.53Å; I293-Y297 VanDerWaalsContact O-CD2 3.26Å; I293-Y297 WeakPolarHBondContact O-CD2 3.38Å; I293-Y297 PolarHBondContact O-N 3.38Å
294	K	97.9	Very high	97.6	Very high	62 Å²	62	53.1 Å²	53.1	27%	0.27	25%	0.254	S	S	.	.	H	α-helix	trans	-65.3	-41.3	177.9	-63.2	178.4	-72.3	-178.3	0	110.5	I41 G42 N44 D292 Y297 F298	I41-K294 PolarHBondContact O-NZ 3.27Å; G42-K294 PolarHBondContact O-NZ 3.08Å; G42-K294 VanDerWaalsContact O-NZ 3.09Å; N44-K294 HydrophobicContact CB-CD 4.46Å; D292-K294 PolarHBondContact O-N 3.06Å; D292-K294 WeakPolarHBondContact OD1-CA 3.48Å; D292-K294 VanDerWaalsContact OD1-CB 3.23Å; D292-K294 WeakPolarHBondContact OD1-CB 3.37Å; D292-K294 PolarHBondContact OD1-N 3.45Å; D292-K294 WeakPolarHBondContact OD2-CE 3.26Å; K294-Y297 PolarHBondContact O-N 2.92Å; K294-F298 WeakPolarHBondContact O-CB 3.4Å; K294-F298 PolarHBondContact O-N 2.93Å
295	Y	98.3	Very high	97.3	Very high	62 Å²	62	53.2 Å²	53.2	24%	0.243	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-46.8	175.3	176.8	-98.8	0	0	0	111.6	L269 M289 Y291 D292 I293 Y297 F298 Q299	L269-Y295 HydrophobicContact CD1-CD2 4.37Å; M289-Y295 HydrophobicContact CE-CD2 4.2Å; M289-Y295 HydrophobicContact SD-CD2 4.18Å; Y291-Y295 AromaticContact CD1-CD1 3.88Å; Y291-Y295 HydrophobicContact CD1-CD1 3.88Å; Y291-Y295 AromaticContact CD1-CD2 3.89Å; Y291-Y295 HydrophobicContact CD1-CD2 3.89Å; Y291-Y295 AromaticContact CD1-CE1 3.92Å; Y291-Y295 HydrophobicContact CD1-CE1 3.92Å; Y291-Y295 AromaticContact CD1-CE2 3.94Å; Y291-Y295 HydrophobicContact CD1-CE2 3.94Å; Y291-Y295 AromaticContact CD1-CG 3.86Å; Y291-Y295 HydrophobicContact CD1-CG 3.86Å; Y291-Y295 AromaticContact CD1-CZ 3.94Å; Y291-Y295 HydrophobicContact CE1-CD2 4.17Å; Y291-Y295 HydrophobicContact CE1-CE1 4.46Å; Y291-Y295 AromaticContact CE1-CE2 3.88Å; Y291-Y295 HydrophobicContact CE1-CE2 3.88Å; D292-Y295 PolarHBondContact O-N 3.48Å; I293-Y295 VanDerWaalsContact C-N 3.34Å; Y295-Y297 VanDerWaalsContact C-N 3.33Å; Y295-Y297 PolarHBondContact O-N 3.5Å; Y295-F298 WeakPolarHBondContact O-CB 3.31Å; Y295-F298 PolarHBondContact O-N 3.4Å; Y295-F298 VanDerWaalsContact O-N 3.14Å; Y295-Q299 HydrophobicContact CD1-CG 4.16Å; Y295-Q299 HydrophobicContact CE1-CG 3.69Å; Y295-Q299 HydrophobicContact CE2-CG 4.08Å; Y295-Q299 VanDerWaalsContact CZ-NE2 3.31Å; Y295-Q299 WeakPolarHBondContact O-CG 3.41Å; Y295-Q299 PolarHBondContact O-N 3.42Å; Y295-Q299 PolarHBondContact OH-NE2 3.38Å
296	N	98.3	Very high	96.8	Very high	100 Å²	100	57.2 Å²	57.2	54%	0.535	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-40.8	178.2	-68.8	-33.9	0	0	0	112.3	D292 I293 Q299 L300	D292-N296 PolarHBondContact O-N 2.9Å; I293-N296 PolarHBondContact O-N 3.39Å; N296-Q299 PolarHBondContact O-N 2.89Å; N296-L300 PolarHBondContact O-N 2.84Å
297	Y	98.2	Very high	96.2	Very high	148 Å²	148	61.3 Å²	61.3	58%	0.58	30%	0.295	S	S	*	.	H	α-helix	trans	-67	-37.7	174.5	-81.4	-55.6	0	0	0	112.7	I293 K294 Y295 L300 L301	I293-Y297 HydrophobicContact CD1-CD2 4.41Å; I293-Y297 HydrophobicContact CD1-CE2 3.67Å; I293-Y297 HydrophobicContact CG1-CD2 3.79Å; I293-Y297 HydrophobicContact CG1-CE2 3.53Å; I293-Y297 VanDerWaalsContact O-CD2 3.26Å; I293-Y297 WeakPolarHBondContact O-CD2 3.38Å; I293-Y297 PolarHBondContact O-N 3.38Å; K294-Y297 PolarHBondContact O-N 2.92Å; Y295-Y297 VanDerWaalsContact C-N 3.33Å; Y295-Y297 PolarHBondContact O-N 3.5Å; Y297-L300 PolarHBondContact O-N 2.68Å; Y297-L301 WeakPolarHBondContact O-CB 3.15Å; Y297-L301 PolarHBondContact O-N 3.16Å
298	F	98.3	Very high	95.4	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-44.6	174.9	179.7	-94.4	0	0	0	111.7	K174 P195 R198 L269 F271 K294 Y295 L300 L301 E302	K174-F298 HydrophobicContact CD-CE1 4.05Å; K174-F298 HydrophobicContact CD-CZ 3.65Å; K174-F298 VanDerWaalsContact CE-CE1 3.49Å; K174-F298 VanDerWaalsContact CE-CZ 3.42Å; P195-F298 HydrophobicContact CB-CD2 3.62Å; P195-F298 HydrophobicContact CB-CE2 3.86Å; R198-F298 HydrophobicContact CB-CE2 4.08Å; R198-F298 HydrophobicContact CG-CE2 4.33Å; R198-F298 HydrophobicContact CG-CZ 4.42Å; L269-F298 HydrophobicContact CD1-CB 3.91Å; L269-F298 HydrophobicContact CD1-CD1 3.97Å; L269-F298 HydrophobicContact CD1-CD2 4.39Å; L269-F298 HydrophobicContact CD1-CG 3.8Å; F271-F298 HydrophobicContact CE2-CE2 4.35Å; F271-F298 HydrophobicContact CZ-CE2 4.19Å; F271-F298 HydrophobicContact CZ-CZ 4.1Å; K294-F298 WeakPolarHBondContact O-CB 3.4Å; K294-F298 PolarHBondContact O-N 2.93Å; Y295-F298 WeakPolarHBondContact O-CB 3.31Å; Y295-F298 PolarHBondContact O-N 3.4Å; Y295-F298 VanDerWaalsContact O-N 3.14Å; F298-L300 VanDerWaalsContact C-N 3.32Å; F298-L300 PolarHBondContact O-N 3.21Å; F298-L301 WeakPolarHBondContact O-CB 3.4Å; F298-L301 PolarHBondContact O-N 2.95Å; F298-L301 VanDerWaalsContact O-N 3.16Å; F298-E302 HydrophobicContact CE1-CB 4.47Å; F298-E302 WeakPolarHBondContact O-CB 3.44Å; F298-E302 PolarHBondContact O-N 3.3Å
299	Q	98	Very high	94.2	Very high	59 Å²	59	62.5 Å²	62.5	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-40	176.5	-71.5	-63.4	-20.8	0	0	112.4	Y295 N296 S303	Y295-Q299 HydrophobicContact CD1-CG 4.16Å; Y295-Q299 HydrophobicContact CE1-CG 3.69Å; Y295-Q299 HydrophobicContact CE2-CG 4.08Å; Y295-Q299 VanDerWaalsContact CZ-NE2 3.31Å; Y295-Q299 WeakPolarHBondContact O-CG 3.41Å; Y295-Q299 PolarHBondContact O-N 3.42Å; Y295-Q299 PolarHBondContact OH-NE2 3.38Å; N296-Q299 PolarHBondContact O-N 2.89Å; Q299-S303 WeakPolarHBondContact O-CB 3.42Å; Q299-S303 PolarHBondContact O-N 3Å; Q299-S303 PolarHBondContact O-OG 3.03Å
300	L	97.6	Very high	92.5	Very high	92 Å²	92	65 Å²	65	48%	0.482	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-46.2	172.7	177.5	62.7	0	0	0	111.4	N296 Y297 F298 E302 S303 L304	N296-L300 PolarHBondContact O-N 2.84Å; Y297-L300 PolarHBondContact O-N 2.68Å; F298-L300 VanDerWaalsContact C-N 3.32Å; F298-L300 PolarHBondContact O-N 3.21Å; L300-E302 VanDerWaalsContact C-N 3.34Å; L300-E302 PolarHBondContact O-N 3.46Å; L300-S303 PolarHBondContact O-N 3.15Å; L300-L304 HydrophobicContact CD1-CD1 3.94Å; L300-L304 HydrophobicContact CD1-CG 4.05Å; L300-L304 HydrophobicContact CG-CD1 3.93Å; L300-L304 HydrophobicContact CG-CG 4.42Å; L300-L304 WeakPolarHBondContact O-CB 3.37Å; L300-L304 VanDerWaalsContact O-CG 3.26Å; L300-L304 WeakPolarHBondContact O-CG 3.26Å; L300-L304 PolarHBondContact O-N 3.05Å
301	L	96.9	Very high	90.3	Very high	15 Å²	15	64.8 Å²	64.8	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-60.1	-44	178.4	-178	68.4	0	0	0	111.6	L8 F11 R198 P199 Y297 F298 L304 S305	L8-L301 HydrophobicContact CD2-CD1 3.59Å; F11-L301 HydrophobicContact CD1-CD1 3.81Å; F11-L301 HydrophobicContact CD1-CD2 4.37Å; F11-L301 HydrophobicContact CE1-CD1 3.84Å; F11-L301 HydrophobicContact CE1-CD2 3.69Å; F11-L301 HydrophobicContact CE1-CG 4.4Å; R198-L301 HydrophobicContact CB-CD2 3.98Å; R198-L301 HydrophobicContact CB-CG 4.34Å; P199-L301 HydrophobicContact CG-CD1 3.86Å; P199-L301 HydrophobicContact CG-CG 4.34Å; Y297-L301 WeakPolarHBondContact O-CB 3.15Å; Y297-L301 PolarHBondContact O-N 3.16Å; F298-L301 WeakPolarHBondContact O-CB 3.4Å; F298-L301 PolarHBondContact O-N 2.95Å; F298-L301 VanDerWaalsContact O-N 3.16Å; L301-L304 PolarHBondContact O-N 3.49Å; L301-S305 VanDerWaalsContact O-CB 3.31Å; L301-S305 WeakPolarHBondContact O-CB 3.44Å; L301-S305 PolarHBondContact O-N 2.92Å; L301-S305 PolarHBondContact O-OG 3.02Å
302	E	95.1	Very high	87.4	Confident	27 Å²	27	67.8 Å²	67.8	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-60.3	-52.4	176.3	178.2	154	-100.2	0	0	111.3	R198 F298 L300 L304 S305 E306	R198-E302 HydrophobicContact CG-CB 4.38Å; R198-E302 IonicContact CZ-OE1 3.94Å; R198-E302 IonicContact NE-OE1 3.52Å; R198-E302 PolarHBondContact NE-OE1 3.02Å; R198-E302 VanDerWaalsContact NE-OE1 3.09Å; R198-E302 IonicContact NH2-OE1 3.09Å; F298-E302 HydrophobicContact CE1-CB 4.47Å; F298-E302 WeakPolarHBondContact O-CB 3.44Å; F298-E302 PolarHBondContact O-N 3.3Å; L300-E302 VanDerWaalsContact C-N 3.34Å; L300-E302 PolarHBondContact O-N 3.46Å; E302-L304 VanDerWaalsContact C-N 3.34Å; E302-L304 PolarHBondContact O-N 3.37Å; E302-S305 WeakPolarHBondContact O-CB 3.48Å; E302-S305 PolarHBondContact O-N 3.22Å; E302-S305 VanDerWaalsContact O-N 3.1Å; E302-E306 WeakPolarHBondContact O-CG 3.29Å; E302-E306 PolarHBondContact O-N 3.19Å
303	S	95.1	Very high	86.9	Confident	56 Å²	56	68.8 Å²	68.8	39%	0.392	38%	0.381	S	S	.	.	H	α-helix	trans	-58.9	-43.5	178.3	-58.9	0	0	0	0	112.3	Q299 L300 S305 E306 I307	Q299-S303 WeakPolarHBondContact O-CB 3.42Å; Q299-S303 PolarHBondContact O-N 3Å; Q299-S303 PolarHBondContact O-OG 3.03Å; L300-S303 PolarHBondContact O-N 3.15Å; S303-S305 VanDerWaalsContact C-N 3.34Å; S303-E306 PolarHBondContact O-N 3.39Å; S303-I307 WeakPolarHBondContact O-CG1 3.14Å; S303-I307 PolarHBondContact O-N 3.1Å
304	L	94.8	Very high	86.3	Confident	62 Å²	62	66.8 Å²	66.8	33%	0.325	37%	0.373	S	S	.	.	H	α-helix	trans	-66.6	-36.5	177.4	-71.3	174.6	0	0	0	111.9	L8 L300 L301 E302 A308	L8-L304 HydrophobicContact CD1-CB 4.37Å; L8-L304 HydrophobicContact CD2-CB 4.15Å; L300-L304 HydrophobicContact CD1-CD1 3.94Å; L300-L304 HydrophobicContact CD1-CG 4.05Å; L300-L304 HydrophobicContact CG-CD1 3.93Å; L300-L304 HydrophobicContact CG-CG 4.42Å; L300-L304 WeakPolarHBondContact O-CB 3.37Å; L300-L304 VanDerWaalsContact O-CG 3.26Å; L300-L304 WeakPolarHBondContact O-CG 3.26Å; L300-L304 PolarHBondContact O-N 3.05Å; L301-L304 PolarHBondContact O-N 3.49Å; E302-L304 VanDerWaalsContact C-N 3.34Å; E302-L304 PolarHBondContact O-N 3.37Å; L304-A308 WeakPolarHBondContact O-CB 3.4Å; L304-A308 PolarHBondContact O-N 3.34Å
305	S	92.1	Very high	85.6	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.007	38%	0.379	C	S	.	.	H	α-helix	trans	-66.6	-38.6	178.1	-59.7	0	0	0	0	111.9	L301 E302 S303 A308 N309	L301-S305 VanDerWaalsContact O-CB 3.31Å; L301-S305 WeakPolarHBondContact O-CB 3.44Å; L301-S305 PolarHBondContact O-N 2.92Å; L301-S305 PolarHBondContact O-OG 3.02Å; E302-S305 WeakPolarHBondContact O-CB 3.48Å; E302-S305 PolarHBondContact O-N 3.22Å; E302-S305 VanDerWaalsContact O-N 3.1Å; S303-S305 VanDerWaalsContact C-N 3.34Å; S305-A308 PolarHBondContact O-N 3.21Å; S305-N309 WeakPolarHBondContact O-CB 3.35Å; S305-N309 PolarHBondContact O-N 2.73Å; S305-N309 PolarHBondContact O-ND2 3.42Å
306	E	87.6	Confident	84.9	Confident	84 Å²	84	67.4 Å²	67.4	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-65.4	-46.7	176.8	-71.4	174.1	-178.5	0	0	112.2	R198 E302 S303 N309 G310 S311	R198-E306 IonicContact NH2-OE1 2.73Å; E302-E306 WeakPolarHBondContact O-CG 3.29Å; E302-E306 PolarHBondContact O-N 3.19Å; S303-E306 PolarHBondContact O-N 3.39Å; E306-N309 PolarHBondContact O-N 3.25Å; E306-G310 PolarHBondContact O-N 3.4Å; E306-S311 PolarHBondContact O-N 3.35Å
307	I	86.6	Confident	84.1	Confident	104 Å²	104	65.4 Å²	65.4	53%	0.533	38%	0.378	S	S	.	.	H	α-helix	trans	-61.6	-46.6	175.8	-65.2	166.5	0	0	0	110	M1 S303 N309 G310	M1-I307 HydrophobicContact CE-CG2 4.4Å; M1-I307 VanDerWaalsContact CE-O 3.29Å; M1-I307 WeakPolarHBondContact CE-O 3.37Å; M1-I307 HydrophobicContact SD-CG2 4.02Å; S303-I307 WeakPolarHBondContact O-CG1 3.14Å; S303-I307 PolarHBondContact O-N 3.1Å; I307-N309 VanDerWaalsContact C-N 3.29Å; I307-N309 PolarHBondContact O-N 3.33Å; I307-G310 PolarHBondContact O-N 2.95Å
308	A	82.6	Confident	83.1	Confident	6 Å²	6	59.9 Å²	59.9	5%	0.05	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-36.2	-179.2	0	0	0	0	0	112.5	Q5 L8 L304 S305 G310	Q5-A308 HydrophobicContact CG-CB 3.78Å; Q5-A308 PolarHBondContact NE2-O 3.27Å; L8-A308 HydrophobicContact CD1-CB 3.79Å; L304-A308 WeakPolarHBondContact O-CB 3.4Å; L304-A308 PolarHBondContact O-N 3.34Å; S305-A308 PolarHBondContact O-N 3.21Å; A308-G310 VanDerWaalsContact C-N 3.28Å; A308-G310 PolarHBondContact O-N 2.98Å
309	N	72.5	Confident	82	Confident	63 Å²	63	63.6 Å²	63.6	34%	0.337	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	9	-179.5	-70	-27.6	0	0	0	113.8	Q247 S305 E306 I307 S311	Q247-N309 PolarHBondContact NE2-OD1 3.11Å; S305-N309 WeakPolarHBondContact O-CB 3.35Å; S305-N309 PolarHBondContact O-N 2.73Å; S305-N309 PolarHBondContact O-ND2 3.42Å; E306-N309 PolarHBondContact O-N 3.25Å; I307-N309 VanDerWaalsContact C-N 3.29Å; I307-N309 PolarHBondContact O-N 3.33Å; N309-S311 VanDerWaalsContact C-N 3.26Å; N309-S311 PolarHBondContact O-N 2.65Å
310	G	62.8	Low	80.8	Confident	56 Å²	56	63.9 Å²	63.9	58%	0.577	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	21.6	174.5	0	0	0	0	0	114.2	E306 I307 A308 S312	E306-G310 PolarHBondContact O-N 3.4Å; I307-G310 PolarHBondContact O-N 2.95Å; A308-G310 VanDerWaalsContact C-N 3.28Å; A308-G310 PolarHBondContact O-N 2.98Å; G310-S312 PolarHBondContact O-N 3.1Å
311	S	51.3	Low	79.4	Confident	81 Å²	81	61.6 Å²	61.6	57%	0.566	39%	0.389	S	S	*	.			trans	-88.6	78.9	177.2	-58.6	0	0	0	0	109.3	E306 N309	E306-S311 PolarHBondContact O-N 3.35Å; N309-S311 VanDerWaalsContact C-N 3.26Å; N309-S311 PolarHBondContact O-N 2.65Å
312	S	35.8	Very low	77.8	Confident	184 Å²	184	65.8 Å²	65.8	100%	1.287	42%	0.417	S	S	*	.			trans	-127.1	0	169.9	66.1	0	0	0	0	111	G310	G310-S312 PolarHBondContact O-N 3.1Å

Retrieved 312 of 312 residues in 142.6 ms (Link to these results)

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