A0A096MCR2_POEFO Loading...

Tyrosine specific protein phosphatases domain-containing protein

AlphaFold DB , UniProt , Accession A0A096MCR2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 281 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	48.9	Very low	82	Confident	172 Å²	172	88.5 Å²	88.5	85%	0.847	47%	0.467	S	S	*	.				0	123	0	-158.4	162.6	-179.7	0	0	107.2
2	C	62	Low	83	Confident	68 Å²	68	88.2 Å²	88.2	46%	0.459	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-79.9	142.1	169.6	-66.4	0	0	0	0	107.7	F4	C2-F4 PolarHBondContact O-N 3.39Å
3	M	73.6	Confident	83.9	Confident	76 Å²	76	89.5 Å²	89.5	37%	0.374	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-75.6	125.7	178.5	-166	176.2	-67.4	0	0	108.3	D7 L8 H54	M3-D7 HydrophobicContact CG-CB 4.33Å; M3-L8 HydrophobicContact CG-CD1 4.23Å; M3-L8 HydrophobicContact CG-CD2 4.23Å; M3-L8 HydrophobicContact CG-CG 3.92Å; M3-L8 HydrophobicContact SD-CD1 3.89Å; M3-L8 HydrophobicContact SD-CD2 3.28Å; M3-L8 WeakPolarHBondContact SD-CD2 3.35Å; M3-L8 HydrophobicContact SD-CG 3.6Å; M3-H54 WeakPolarHBondContact CB-CE1 3.47Å; M3-H54 VanDerWaalsContact CB-NE2 3.31Å; M3-H54 WeakPolarHBondContact CB-NE2 3.24Å
4	F	85	Confident	84.6	Confident	109 Å²	109	84.9 Å²	84.9	48%	0.478	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-92.5	155.9	175	-60.6	-78.2	0	0	0	109.6	C2 Q6 D7	C2-F4 PolarHBondContact O-N 3.39Å; F4-Q6 PolarHBondContact O-N 3.29Å; F4-Q6 VanDerWaalsContact O-N 3.14Å; F4-D7 WeakPolarHBondContact CB-OD2 3.29Å; F4-D7 PolarHBondContact N-OD2 3.27Å; F4-D7 WeakPolarHBondContact O-CB 3.42Å; F4-D7 PolarHBondContact O-N 3.11Å
5	L	87.6	Confident	85.3	Confident	34 Å²	34	82.9 Å²	82.9	18%	0.178	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-58.2	-30.5	177.5	-65.2	178.4	0	0	0	111.9	D7 L8 C14 Q121 Q124	L5-D7 PolarHBondContact O-N 3.47Å; L5-L8 PolarHBondContact O-N 3.2Å; L5-L8 VanDerWaalsContact O-N 3.1Å; L5-C14 HydrophobicContact CD2-CB 3.75Å; L5-Q121 HydrophobicContact CD1-CB 3.84Å; L5-Q121 HydrophobicContact CD1-CG 4.5Å; L5-Q121 HydrophobicContact CD2-CB 3.89Å; L5-Q124 HydrophobicContact CB-CB 4.4Å; L5-Q124 HydrophobicContact CB-CG 4.06Å; L5-Q124 PolarHBondContact O-N 2.79Å
6	Q	89.1	Confident	85.8	Confident	143 Å²	143	83 Å²	83	67%	0.668	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-64.4	-21.2	176.6	-64	164.2	20.6	0	0	113.2	F4 A125	F4-Q6 PolarHBondContact O-N 3.29Å; F4-Q6 VanDerWaalsContact O-N 3.14Å; Q6-A125 WeakPolarHBondContact O-CA 3.47Å; Q6-A125 VanDerWaalsContact O-CB 3.25Å; Q6-A125 WeakPolarHBondContact O-CB 3.31Å
7	D	89.1	Confident	86.4	Confident	91 Å²	91	80.9 Å²	80.9	49%	0.487	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-89.8	-10.9	177.6	-54.2	-47.4	0	0	0	112.4	M3 F4 L5	M3-D7 HydrophobicContact CG-CB 4.33Å; F4-D7 WeakPolarHBondContact CB-OD2 3.29Å; F4-D7 PolarHBondContact N-OD2 3.27Å; F4-D7 WeakPolarHBondContact O-CB 3.42Å; F4-D7 PolarHBondContact O-N 3.11Å; L5-D7 PolarHBondContact O-N 3.47Å
8	L	89.9	Confident	86.8	Confident	18 Å²	18	85.2 Å²	85.2	9%	0.094	44%	0.441	C	S	.	.	S	Bend	trans	-102.6	131.5	-175.4	-78.2	174.8	0	0	0	111.8	M3 L5 L12 C14 G123 Q124 A125	M3-L8 HydrophobicContact CG-CD1 4.23Å; M3-L8 HydrophobicContact CG-CD2 4.23Å; M3-L8 HydrophobicContact CG-CG 3.92Å; M3-L8 HydrophobicContact SD-CD1 3.89Å; M3-L8 HydrophobicContact SD-CD2 3.28Å; M3-L8 WeakPolarHBondContact SD-CD2 3.35Å; M3-L8 HydrophobicContact SD-CG 3.6Å; L5-L8 PolarHBondContact O-N 3.2Å; L5-L8 VanDerWaalsContact O-N 3.1Å; L8-L12 HydrophobicContact CD2-CD1 4.08Å; L8-C14 HydrophobicContact CD1-CB 3.64Å; L8-G123 CarbonylContact O-C 3.52Å; L8-G123 VanDerWaalsContact O-C 3.27Å; L8-G123 VanDerWaalsContact O-CA 3.24Å; L8-G123 WeakPolarHBondContact O-CA 3.19Å; L8-Q124 PolarHBondContact O-N 2.92Å; L8-A125 VanDerWaalsContact C-CB 3.48Å; L8-A125 WeakPolarHBondContact O-CB 3.38Å; L8-A125 PolarHBondContact O-N 3.44Å
9	P	92.8	Very high	87.1	Confident	57 Å²	57	81.9 Å²	81.9	37%	0.37	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-61.4	148.9	174.5	27.8	-35.5	0	0	0	111.4	S11 L12	P9-S11 PolarHBondContact O-N 3.27Å; P9-L12 HydrophobicContact CG-CB 4.48Å; P9-L12 HydrophobicContact CG-CD1 3.78Å; P9-L12 HydrophobicContact CG-CG 3.93Å; P9-L12 PolarHBondContact O-N 2.9Å
10	Q	92.6	Very high	87.3	Confident	109 Å²	109	80.9 Å²	80.9	51%	0.509	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.3	179.5	-68.6	179.7	-14.3	0	0	114.1	L12 R122 G123	Q10-L12 VanDerWaalsContact C-N 3.28Å; Q10-R122 VanDerWaalsContact O-CD 3.29Å; Q10-R122 WeakPolarHBondContact O-CD 3.28Å; Q10-R122 WeakPolarHBondContact O-CG 3.33Å; Q10-R122 PolarHBondContact O-NH1 3.3Å; Q10-G123 WeakPolarHBondContact CA-O 3.44Å; Q10-G123 VanDerWaalsContact CG-O 3.28Å; Q10-G123 WeakPolarHBondContact CG-O 3.38Å
11	S	91.8	Very high	87.1	Confident	96 Å²	96	78.7 Å²	78.7	67%	0.671	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-14.9	174.7	59	0	0	0	0	113.7	P9	P9-S11 PolarHBondContact O-N 3.27Å
12	L	93.2	Very high	89	Confident	85 Å²	85	76.8 Å²	76.8	45%	0.445	42%	0.415	S	S	.	.			trans	-103.3	144.8	-179.6	-64.4	179.8	0	0	0	111.6	L8 P9 Q10 G123	L8-L12 HydrophobicContact CD2-CD1 4.08Å; P9-L12 HydrophobicContact CG-CB 4.48Å; P9-L12 HydrophobicContact CG-CD1 3.78Å; P9-L12 HydrophobicContact CG-CG 3.93Å; P9-L12 PolarHBondContact O-N 2.9Å; Q10-L12 VanDerWaalsContact C-N 3.28Å; L12-G123 PolarHBondContact O-N 3.4Å
13	L	94.7	Very high	90.5	Very high	105 Å²	105	80.2 Å²	80.2	55%	0.55	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.5	169.7	-61	179.3	0	0	0	109.1	P120 Q121 R122	L13-P120 HydrophobicContact CB-CB 3.82Å; L13-P120 HydrophobicContact CD1-CB 4.28Å; L13-P120 HydrophobicContact CG-CB 4.47Å; L13-Q121 CarbonylContact C-O 3.36Å; L13-Q121 WeakPolarHBondContact CA-O 3.34Å; L13-R122 HydrophobicContact CD2-CB 4.23Å; L13-R122 HydrophobicContact CD2-CG 4.5Å
14	C	94.1	Very high	91.6	Very high	25 Å²	25	78.8 Å²	78.8	17%	0.169	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.5	-174.5	-175.1	0	0	0	0	110.6	L5 L8 Q121	L5-C14 HydrophobicContact CD2-CB 3.75Å; L8-C14 HydrophobicContact CD1-CB 3.64Å; C14-Q121 PolarHBondContact N-O 3.22Å; C14-Q121 PolarHBondContact O-N 3.28Å
15	V	94.7	Very high	92.2	Very high	56 Å²	56	73.8 Å²	73.8	34%	0.339	40%	0.398	S	S	.	.			trans	-118.7	129.7	170.1	178.7	0	0	0	0	107.3	I17 A36 P120	V15-I17 HydrophobicContact CG1-CG1 4.15Å; V15-A36 HydrophobicContact CG1-CB 4.44Å; V15-P120 HydrophobicContact CG2-CB 3.88Å; V15-P120 HydrophobicContact CG2-CG 3.87Å
16	K	94.1	Very high	92.7	Very high	84 Å²	84	75.2 Å²	75.2	37%	0.365	41%	0.411	S	S	.	.			trans	-104.4	105.3	-178	-170.1	173.1	-175	178.6	0	110.5	F18	K16-F18 HydrophobicContact CD-CE1 4.24Å; K16-F18 HydrophobicContact CD-CE2 4.1Å; K16-F18 HydrophobicContact CD-CZ 3.75Å; K16-F18 VanDerWaalsContact CE-CE1 3.44Å; K16-F18 VanDerWaalsContact CE-CZ 3.43Å; K16-F18 HydrophobicContact CG-CE2 4.19Å; K16-F18 HydrophobicContact CG-CZ 4.26Å
17	I	95	Very high	93.1	Very high	47 Å²	47	73.1 Å²	73.1	24%	0.241	40%	0.404	C	S	.	.			trans	-100.8	114.5	174.2	-56.2	173.2	0	0	0	107.9	V15 T19 T29 F33 A36	V15-I17 HydrophobicContact CG1-CG1 4.15Å; I17-T19 PolarHBondContact O-N 2.69Å; I17-T29 HydrophobicContact CG2-CG2 3.75Å; I17-F33 HydrophobicContact CD1-CB 3.98Å; I17-F33 HydrophobicContact CD1-CD2 4.14Å; I17-A36 HydrophobicContact CD1-CB 4.38Å
18	F	93.9	Very high	93.4	Very high	158 Å²	158	73.9 Å²	73.9	69%	0.693	41%	0.405	S	S	*	.			trans	-76	122.8	177.5	-70.3	-86.4	0	0	0	109.7	K16	K16-F18 HydrophobicContact CD-CE1 4.24Å; K16-F18 HydrophobicContact CD-CE2 4.1Å; K16-F18 HydrophobicContact CD-CZ 3.75Å; K16-F18 VanDerWaalsContact CE-CE1 3.44Å; K16-F18 VanDerWaalsContact CE-CZ 3.43Å; K16-F18 HydrophobicContact CG-CE2 4.19Å; K16-F18 HydrophobicContact CG-CZ 4.26Å
19	T	93.5	Very high	93.8	Very high	23 Å²	23	74 Å²	74	14%	0.141	41%	0.407	C	S	.	.			trans	-128.1	117.9	-178.8	-49	0	0	0	0	109.5	I17 P25 T29 R61	I17-T19 PolarHBondContact O-N 2.69Å; T19-P25 HydrophobicContact CG2-CB 3.91Å; T19-P25 HydrophobicContact CG2-CG 3.56Å; T19-T29 HydrophobicContact CG2-CG2 4.13Å; T19-T29 WeakPolarHBondContact OG1-CG2 3.05Å; T19-R61 HydrophobicContact CG2-CG 4.14Å; T19-R61 PolarHBondContact O-NH1 3.38Å
20	A	89.6	Confident	94	Very high	62 Å²	62	71.4 Å²	71.4	51%	0.512	39%	0.39	S	S	.	.			trans	-54.5	144.3	174	0	0	0	0	0	110.6
21	G	83.7	Confident	94.2	Very high	35 Å²	35	67.5 Å²	67.5	36%	0.361	37%	0.372	S	S	.	.	S	Bend	trans	-86	157.2	173.6	0	0	0	0	0	110.9	E23	G21-E23 PolarHBondContact O-N 3.3Å
22	H	88.6	Confident	94.5	Very high	132 Å²	132	63.8 Å²	63.8	61%	0.611	35%	0.346	S	S	*	.	S	Bend	trans	72	-33.1	174.6	-51.5	97.2	0	0	0	115.8	R95 N97	H22-R95 PolarHBondContact CD2-NH1 2.94Å; H22-R95 PolarHBondContact CD2-NH2 3.28Å; H22-R95 PolarHBondContact NE2-NH2 3.05Å; H22-N97 PolarHBondContact O-ND2 3.33Å
23	E	94.5	Very high	94.7	Very high	139 Å²	139	60.6 Å²	60.6	65%	0.65	33%	0.329	S	S	*	.	S	Bend	trans	-92.7	153.3	175.2	-64.3	174.7	174.2	0	0	111.3	G21 P25 Y98	G21-E23 PolarHBondContact O-N 3.3Å; E23-P25 WeakPolarHBondContact O-CD 3.14Å; E23-Y98 WeakPolarHBondContact O-CE1 3.5Å; E23-Y98 PolarHBondContact O-OH 2.86Å
24	V	97.3	Very high	94.9	Very high	46 Å²	46	55.6 Å²	55.6	28%	0.279	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-62.6	127.4	173	176	0	0	0	0	107.5	S26 Y64 Y98 D101	V24-S26 PolarHBondContact O-N 3.39Å; V24-Y64 HydrophobicContact CG1-CE1 4.4Å; V24-Y64 HydrophobicContact CG1-CE2 3.95Å; V24-Y64 WeakPolarHBondContact CG1-OH 3.43Å; V24-Y98 HydrophobicContact CG2-CD1 4.09Å; V24-Y98 HydrophobicContact CG2-CE1 4.4Å; V24-D101 HydrophobicContact CG1-CB 4.29Å; V24-D101 HydrophobicContact CG2-CB 4.05Å
25	P	97.5	Very high	95	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.032	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-51.7	136.2	176.7	-30.2	37.2	0	0	0	112.2	T19 E23 T29 I30 Y64 L65	T19-P25 HydrophobicContact CG2-CB 3.91Å; T19-P25 HydrophobicContact CG2-CG 3.56Å; E23-P25 WeakPolarHBondContact O-CD 3.14Å; P25-T29 HydrophobicContact CB-CG2 4.17Å; P25-I30 HydrophobicContact CB-CG1 4.22Å; P25-I30 VanDerWaalsContact O-CD1 3.31Å; P25-I30 WeakPolarHBondContact O-CD1 3.15Å; P25-Y64 HydrophobicContact CB-CD1 4.21Å; P25-Y64 HydrophobicContact CB-CE1 3.86Å; P25-Y64 VanDerWaalsContact CD-CE1 3.4Å; P25-Y64 HydrophobicContact CG-CD1 3.47Å; P25-Y64 VanDerWaalsContact CG-CD1 3.47Å; P25-Y64 HydrophobicContact CG-CE1 3.57Å; P25-Y64 HydrophobicContact CG-CG 4.39Å; P25-L65 HydrophobicContact CB-CD2 4.17Å; P25-L65 HydrophobicContact CG-CD2 4.37Å
26	S	97.4	Very high	95.1	Very high	64 Å²	64	54.5 Å²	54.5	45%	0.448	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-65	158.7	-179	64.7	0	0	0	0	112.3	V24 Q28 T29 I30	V24-S26 PolarHBondContact O-N 3.39Å; S26-Q28 PolarHBondContact O-N 3.16Å; S26-T29 WeakPolarHBondContact O-CA 3.3Å; S26-T29 WeakPolarHBondContact O-CB 3.42Å; S26-T29 PolarHBondContact O-N 3.26Å; S26-T29 PolarHBondContact OG-N 2.86Å; S26-T29 PolarHBondContact OG-OG1 3.25Å; S26-I30 WeakPolarHBondContact O-CG1 3.49Å; S26-I30 PolarHBondContact O-N 2.98Å
27	D	96.9	Very high	95.2	Very high	98 Å²	98	51.1 Å²	51.1	52%	0.524	28%	0.282	S	S	.	.	H	α-helix	trans	-56.6	-36.6	177	-69.7	-3.6	0	0	0	112.2	I30 L31 R108	D27-I30 PolarHBondContact O-N 3.47Å; D27-L31 VanDerWaalsContact O-CB 3.29Å; D27-L31 WeakPolarHBondContact O-CB 3.29Å; D27-L31 PolarHBondContact O-N 3.24Å; D27-R108 WeakPolarHBondContact OD1-CD 3.17Å; D27-R108 IonicContact OD1-CZ 2.67Å; D27-R108 IonicContact OD1-NE 3.38Å; D27-R108 PolarHBondContact OD1-NE 3.05Å
28	Q	95.9	Very high	95.3	Very high	108 Å²	108	50.9 Å²	50.9	51%	0.505	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-44.6	173.1	-174.1	60.7	40	0	0	111.9	S26 I30 L31 S32 E117	S26-Q28 PolarHBondContact O-N 3.16Å; Q28-I30 VanDerWaalsContact C-N 3.33Å; Q28-I30 PolarHBondContact O-N 2.81Å; Q28-L31 PolarHBondContact O-N 2.83Å; Q28-S32 PolarHBondContact O-N 3.45Å; Q28-S32 PolarHBondContact O-OG 2.89Å; Q28-E117 PolarHBondContact NE2-OE1 2.7Å
29	T	97.3	Very high	95.3	Very high	20 Å²	20	45.5 Å²	45.5	12%	0.123	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-42.3	178.2	-55.2	0	0	0	0	111.1	I17 T19 P25 S26 S32 F33	I17-T29 HydrophobicContact CG2-CG2 3.75Å; T19-T29 HydrophobicContact CG2-CG2 4.13Å; T19-T29 WeakPolarHBondContact OG1-CG2 3.05Å; P25-T29 HydrophobicContact CB-CG2 4.17Å; S26-T29 WeakPolarHBondContact O-CA 3.3Å; S26-T29 WeakPolarHBondContact O-CB 3.42Å; S26-T29 PolarHBondContact O-N 3.26Å; S26-T29 PolarHBondContact OG-N 2.86Å; S26-T29 PolarHBondContact OG-OG1 3.25Å; T29-S32 PolarHBondContact O-N 3.03Å; T29-F33 PolarHBondContact O-N 3.24Å
30	I	98	Very high	95.4	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-44.4	177.1	-66.5	166.8	0	0	0	109.8	P25 S26 D27 Q28 F33 K34 Y64 L65 R68 R108	P25-I30 HydrophobicContact CB-CG1 4.22Å; P25-I30 VanDerWaalsContact O-CD1 3.31Å; P25-I30 WeakPolarHBondContact O-CD1 3.15Å; S26-I30 WeakPolarHBondContact O-CG1 3.49Å; S26-I30 PolarHBondContact O-N 2.98Å; D27-I30 PolarHBondContact O-N 3.47Å; Q28-I30 VanDerWaalsContact C-N 3.33Å; Q28-I30 PolarHBondContact O-N 2.81Å; I30-F33 WeakPolarHBondContact O-CB 3.47Å; I30-F33 PolarHBondContact O-N 3.43Å; I30-K34 HydrophobicContact CG2-CD 4.27Å; I30-K34 WeakPolarHBondContact O-CG 3.36Å; I30-K34 PolarHBondContact O-N 3.01Å; I30-Y64 HydrophobicContact CD1-CE1 4.04Å; I30-Y64 WeakPolarHBondContact CD1-OH 3.44Å; I30-Y64 HydrophobicContact CG1-CE1 4.2Å; I30-L65 HydrophobicContact CG1-CD2 4.16Å; I30-R68 HydrophobicContact CD1-CG 4.2Å; I30-R68 HydrophobicContact CG1-CG 4.38Å; I30-R68 HydrophobicContact CG2-CG 3.76Å; I30-R108 HydrophobicContact CD1-CG 3.89Å; I30-R108 HydrophobicContact CG2-CB 4.27Å; I30-R108 HydrophobicContact CG2-CG 4.35Å
31	L	97.6	Very high	95.7	Very high	26 Å²	26	47.4 Å²	47.4	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-45.3	177.5	-177.7	59.8	0	0	0	111.8	D27 Q28 F33 K34 R35	D27-L31 VanDerWaalsContact O-CB 3.29Å; D27-L31 WeakPolarHBondContact O-CB 3.29Å; D27-L31 PolarHBondContact O-N 3.24Å; Q28-L31 PolarHBondContact O-N 2.83Å; L31-F33 PolarHBondContact O-N 2.88Å; L31-K34 WeakPolarHBondContact O-CB 3.36Å; L31-K34 PolarHBondContact O-N 3.05Å; L31-K34 VanDerWaalsContact O-N 3.14Å; L31-R35 HydrophobicContact CD1-CG 4.39Å; L31-R35 HydrophobicContact CG-CG 4.47Å; L31-R35 WeakPolarHBondContact O-CB 3.34Å; L31-R35 WeakPolarHBondContact O-CG 3.25Å; L31-R35 PolarHBondContact O-N 3.15Å
32	S	97.4	Very high	96.2	Very high	19 Å²	19	50.2 Å²	50.2	13%	0.133	25%	0.252	C	S	.	.	H	α-helix	trans	-57.5	-39	174.2	-65	0	0	0	0	111.9	Q28 T29 A36 E117	Q28-S32 PolarHBondContact O-N 3.45Å; Q28-S32 PolarHBondContact O-OG 2.89Å; T29-S32 PolarHBondContact O-N 3.03Å; S32-A36 WeakPolarHBondContact O-CB 3.17Å; S32-A36 PolarHBondContact O-N 3.1Å; S32-E117 VanDerWaalsContact CB-OE2 3.28Å; S32-E117 WeakPolarHBondContact CB-OE2 3.49Å; S32-E117 PolarHBondContact OG-OE2 3.4Å
33	F	97.7	Very high	96.5	Very high	17 Å²	17	47.7 Å²	47.7	8%	0.075	24%	0.243	C	C	.	.	H	α-helix	trans	-66.1	-46.9	174.6	-176.9	-99.9	0	0	0	111.9	I17 T29 I30 L31 R35 A36 V37 V53 L65 I66 Y69	I17-F33 HydrophobicContact CD1-CB 3.98Å; I17-F33 HydrophobicContact CD1-CD2 4.14Å; T29-F33 PolarHBondContact O-N 3.24Å; I30-F33 WeakPolarHBondContact O-CB 3.47Å; I30-F33 PolarHBondContact O-N 3.43Å; L31-F33 PolarHBondContact O-N 2.88Å; F33-R35 VanDerWaalsContact C-N 3.35Å; F33-R35 PolarHBondContact O-N 3.04Å; F33-A36 PolarHBondContact O-N 2.98Å; F33-V37 HydrophobicContact CD1-CG2 4.21Å; F33-V37 HydrophobicContact CE1-CG2 3.81Å; F33-V37 HydrophobicContact CE2-CG2 4.15Å; F33-V37 HydrophobicContact CZ-CG2 3.77Å; F33-V37 WeakPolarHBondContact O-CG2 3.45Å; F33-V37 PolarHBondContact O-N 2.84Å; F33-V53 HydrophobicContact CE2-CG1 3.86Å; F33-V53 HydrophobicContact CE2-CG2 3.87Å; F33-V53 HydrophobicContact CZ-CG1 4.35Å; F33-V53 HydrophobicContact CZ-CG2 3.96Å; F33-L65 HydrophobicContact CB-CD2 4.27Å; F33-L65 HydrophobicContact CD1-CB 3.99Å; F33-L65 HydrophobicContact CD2-CB 4.23Å; F33-L65 HydrophobicContact CD2-CD1 4.14Å; F33-L65 HydrophobicContact CE1-CB 4.02Å; F33-L65 VanDerWaalsContact CE1-O 3.28Å; F33-L65 WeakPolarHBondContact CE1-O 3.17Å; F33-L65 HydrophobicContact CE2-CB 4.26Å; F33-L65 HydrophobicContact CG-CB 4.09Å; F33-L65 HydrophobicContact CG-CD1 4.33Å; F33-L65 HydrophobicContact CG-CD2 4.4Å; F33-L65 HydrophobicContact CZ-CB 4.16Å; F33-I66 HydrophobicContact CZ-CG1 4.34Å; F33-Y69 HydrophobicContact CE1-CD2 4.5Å; F33-Y69 HydrophobicContact CE1-CG 4.46Å
34	K	97.7	Very high	96.5	Very high	1 Å²	1	42.3 Å²	42.3	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-56.8	-46.3	175.3	-71.4	175	-179.5	-178.2	0	111.8	I30 L31 V37 H38 Y69 D72 V73 R108 S109 N110	I30-K34 HydrophobicContact CG2-CD 4.27Å; I30-K34 WeakPolarHBondContact O-CG 3.36Å; I30-K34 PolarHBondContact O-N 3.01Å; L31-K34 WeakPolarHBondContact O-CB 3.36Å; L31-K34 PolarHBondContact O-N 3.05Å; L31-K34 VanDerWaalsContact O-N 3.14Å; K34-V37 PolarHBondContact O-N 3.06Å; K34-H38 WeakPolarHBondContact O-CB 3.24Å; K34-H38 PolarHBondContact O-N 3.23Å; K34-Y69 HydrophobicContact CB-CD2 4.34Å; K34-Y69 HydrophobicContact CB-CE2 4.46Å; K34-Y69 HydrophobicContact CG-CD2 3.92Å; K34-Y69 HydrophobicContact CG-CE2 4.42Å; K34-D72 VanDerWaalsContact CE-OD2 3.32Å; K34-D72 WeakPolarHBondContact CE-OD2 3.19Å; K34-D72 VanDerWaalsContact NZ-CB 3.28Å; K34-D72 IonicContact NZ-OD2 2.76Å; K34-D72 PolarHBondContact NZ-OD2 3.49Å; K34-V73 HydrophobicContact CD-CG2 4.1Å; K34-V73 HydrophobicContact CG-CG2 4.11Å; K34-R108 PolarHBondContact NZ-O 3.19Å; K34-S109 PolarHBondContact NZ-O 3.33Å; K34-N110 WeakPolarHBondContact CE-OD1 3.4Å; K34-N110 PolarHBondContact NZ-OD1 2.82Å
35	R	97	Very high	96.4	Very high	26 Å²	26	47.2 Å²	47.2	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-57.3	-49.3	176.4	-74.1	173	177.8	-168.3	-12.3	111.4	L31 F33 V37 H38 R39 G112 E115 E117	L31-R35 HydrophobicContact CD1-CG 4.39Å; L31-R35 HydrophobicContact CG-CG 4.47Å; L31-R35 WeakPolarHBondContact O-CB 3.34Å; L31-R35 WeakPolarHBondContact O-CG 3.25Å; L31-R35 PolarHBondContact O-N 3.15Å; F33-R35 VanDerWaalsContact C-N 3.35Å; F33-R35 PolarHBondContact O-N 3.04Å; R35-V37 PolarHBondContact O-N 3.02Å; R35-H38 PolarHBondContact O-N 3.14Å; R35-R39 VanDerWaalsContact O-CB 3.24Å; R35-R39 WeakPolarHBondContact O-CB 3.39Å; R35-R39 PolarHBondContact O-N 3.3Å; R35-G112 PolarHBondContact NE-O 2.81Å; R35-G112 PolarHBondContact NH2-O 3.22Å; R35-E115 IonicContact CZ-OE2 3.91Å; R35-E115 IonicContact NH1-OE2 3.51Å; R35-E115 PolarHBondContact NH1-OE2 3Å; R35-E115 IonicContact NH2-OE1 3.92Å; R35-E115 PolarHBondContact NH2-OE1 2.97Å; R35-E115 IonicContact NH2-OE2 4Å; R35-E115 PolarHBondContact NH2-OE2 2.67Å; R35-E117 IonicContact CZ-OE1 3.38Å; R35-E117 IonicContact NE-OE1 2.78Å; R35-E117 VanDerWaalsContact NH1-CD 3.3Å; R35-E117 VanDerWaalsContact NH1-CG 3.26Å; R35-E117 IonicContact NH1-OE1 3.4Å; R35-E117 PolarHBondContact NH1-OE1 3.38Å
36	A	96.8	Very high	96.3	Very high	31 Å²	31	53.8 Å²	53.8	26%	0.256	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-44.5	179.9	0	0	0	0	0	112.4	V15 I17 S32 F33 F40	V15-A36 HydrophobicContact CG1-CB 4.44Å; I17-A36 HydrophobicContact CD1-CB 4.38Å; S32-A36 WeakPolarHBondContact O-CB 3.17Å; S32-A36 PolarHBondContact O-N 3.1Å; F33-A36 PolarHBondContact O-N 2.98Å; A36-F40 WeakPolarHBondContact O-CB 3.28Å; A36-F40 PolarHBondContact O-N 2.77Å; A36-F40 VanDerWaalsContact O-N 3.13Å
37	V	97	Very high	96.2	Very high	13 Å²	13	52.9 Å²	52.9	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-50	177.9	174.9	0	0	0	0	111	F33 K34 R35 R39 F40 L41 I51 Y69	F33-V37 HydrophobicContact CD1-CG2 4.21Å; F33-V37 HydrophobicContact CE1-CG2 3.81Å; F33-V37 HydrophobicContact CE2-CG2 4.15Å; F33-V37 HydrophobicContact CZ-CG2 3.77Å; F33-V37 WeakPolarHBondContact O-CG2 3.45Å; F33-V37 PolarHBondContact O-N 2.84Å; K34-V37 PolarHBondContact O-N 3.06Å; R35-V37 PolarHBondContact O-N 3.02Å; V37-R39 PolarHBondContact O-N 2.77Å; V37-F40 PolarHBondContact O-N 2.94Å; V37-L41 HydrophobicContact CG1-CD1 3.85Å; V37-L41 HydrophobicContact CG1-CG 4.29Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 2.97Å; V37-I51 HydrophobicContact CB-CD1 4.16Å; V37-I51 HydrophobicContact CG1-CD1 3.8Å; V37-I51 HydrophobicContact CG2-CD1 4.13Å; V37-Y69 HydrophobicContact CB-CD2 4.08Å; V37-Y69 HydrophobicContact CB-CE2 3.65Å; V37-Y69 HydrophobicContact CG1-CD1 4.43Å; V37-Y69 HydrophobicContact CG1-CD2 4.07Å; V37-Y69 HydrophobicContact CG1-CE1 3.9Å; V37-Y69 HydrophobicContact CG1-CE2 3.48Å; V37-Y69 VanDerWaalsContact CG1-CE2 3.48Å; V37-Y69 HydrophobicContact CG2-CD2 4.42Å; V37-Y69 HydrophobicContact CG2-CE2 4.46Å
38	H	95.4	Very high	96.1	Very high	43 Å²	43	55.9 Å²	55.9	20%	0.199	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-45.2	-178.9	179.1	-111.6	0	0	0	112	K34 R35 F40 L41 R42 M113	K34-H38 WeakPolarHBondContact O-CB 3.24Å; K34-H38 PolarHBondContact O-N 3.23Å; R35-H38 PolarHBondContact O-N 3.14Å; H38-F40 PolarHBondContact O-N 3.25Å; H38-L41 PolarHBondContact O-N 3.36Å; H38-R42 WeakPolarHBondContact O-CB 3.41Å; H38-R42 PolarHBondContact O-N 2.93Å; H38-M113 HydrophobicContact CB-CE 3.91Å; H38-M113 PolarHBondContact ND1-O 3.21Å
39	R	94.9	Very high	96	Very high	44 Å²	44	56.8 Å²	56.8	17%	0.166	28%	0.282	C	S	.	.	H	α-helix	trans	-57.5	-49.5	174.1	177.6	-179.3	174.3	171.3	4.3	111.5	R35 V37 L41 R42 D43 F116 Q118 E119	R35-R39 VanDerWaalsContact O-CB 3.24Å; R35-R39 WeakPolarHBondContact O-CB 3.39Å; R35-R39 PolarHBondContact O-N 3.3Å; V37-R39 PolarHBondContact O-N 2.77Å; R39-L41 VanDerWaalsContact C-N 3.35Å; R39-L41 PolarHBondContact O-N 2.77Å; R39-R42 PolarHBondContact O-N 3.26Å; R39-D43 WeakPolarHBondContact CG-OD2 3.33Å; R39-D43 IonicContact NE-OD2 2.7Å; R39-D43 WeakPolarHBondContact O-CB 3.47Å; R39-D43 PolarHBondContact O-N 3.14Å; R39-F116 HydrophobicContact CG-CE1 4.13Å; R39-Q118 PolarHBondContact NH1-O 3.08Å; R39-E119 IonicContact CZ-OE1 3.63Å; R39-E119 VanDerWaalsContact CZ-OE1 3.23Å; R39-E119 IonicContact CZ-OE2 3.58Å; R39-E119 IonicContact NH1-OE1 3.53Å; R39-E119 PolarHBondContact NH1-OE1 3.37Å; R39-E119 IonicContact NH1-OE2 2.8Å; R39-E119 IonicContact NH2-OE1 2.86Å; R39-E119 PolarHBondContact NH2-OE1 3.47Å; R39-E119 IonicContact NH2-OE2 3.23Å; R39-E119 PolarHBondContact NH2-OE2 2.88Å
40	F	95.8	Very high	96	Very high	57 Å²	57	63.3 Å²	63.3	25%	0.25	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-46.3	-179	179.5	-85.7	0	0	0	111.7	A36 V37 H38 D43 N44 K49 I51	A36-F40 WeakPolarHBondContact O-CB 3.28Å; A36-F40 PolarHBondContact O-N 2.77Å; A36-F40 VanDerWaalsContact O-N 3.13Å; V37-F40 PolarHBondContact O-N 2.94Å; H38-F40 PolarHBondContact O-N 3.25Å; F40-D43 PolarHBondContact O-N 3.31Å; F40-N44 HydrophobicContact CE1-CB 4.3Å; F40-N44 WeakPolarHBondContact O-CB 3.16Å; F40-N44 PolarHBondContact O-N 2.78Å; F40-N44 VanDerWaalsContact O-N 3.08Å; F40-N44 PolarHBondContact O-ND2 2.95Å; F40-K49 HydrophobicContact CE1-CB 4.39Å; F40-K49 HydrophobicContact CZ-CB 3.79Å; F40-I51 HydrophobicContact CB-CD1 3.91Å; F40-I51 HydrophobicContact CB-CG1 4.22Å; F40-I51 HydrophobicContact CD1-CD1 3.53Å; F40-I51 HydrophobicContact CD1-CG1 3.25Å; F40-I51 HydrophobicContact CD2-CG1 4.3Å; F40-I51 HydrophobicContact CE1-CD1 4.28Å; F40-I51 HydrophobicContact CE1-CG1 3.55Å; F40-I51 HydrophobicContact CG-CD1 3.87Å; F40-I51 HydrophobicContact CG-CG1 3.66Å; F40-I51 HydrophobicContact CZ-CG1 4.18Å
41	L	95.3	Very high	96	Very high	69 Å²	69	66.4 Å²	66.4	36%	0.361	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-44.1	179.4	-68.5	175.8	0	0	0	111.4	V37 H38 R39 D43 N44 Q45	V37-L41 HydrophobicContact CG1-CD1 3.85Å; V37-L41 HydrophobicContact CG1-CG 4.29Å; V37-L41 WeakPolarHBondContact O-CG 3.46Å; V37-L41 PolarHBondContact O-N 2.97Å; H38-L41 PolarHBondContact O-N 3.36Å; R39-L41 VanDerWaalsContact C-N 3.35Å; R39-L41 PolarHBondContact O-N 2.77Å; L41-D43 PolarHBondContact O-N 3.06Å; L41-N44 CarbonylContact O-C 3.56Å; L41-N44 PolarHBondContact O-N 3.04Å; L41-Q45 WeakPolarHBondContact O-CG 3.5Å; L41-Q45 PolarHBondContact O-N 2.93Å
42	R	94.3	Very high	96	Very high	93 Å²	93	68.9 Å²	68.9	35%	0.351	36%	0.363	S	S	.	.	H	α-helix	trans	-59.3	-44.6	174.9	-175.7	-162.3	67.6	-157.8	-5.5	112.1	H38 R39 N44 Q45 F116	H38-R42 WeakPolarHBondContact O-CB 3.41Å; H38-R42 PolarHBondContact O-N 2.93Å; R39-R42 PolarHBondContact O-N 3.26Å; R42-N44 PolarHBondContact O-N 3.48Å; R42-Q45 WeakPolarHBondContact O-CG 3.27Å; R42-F116 VanDerWaalsContact NH1-CZ 3.34Å
43	D	94	Very high	96	Very high	79 Å²	79	70 Å²	70	42%	0.422	37%	0.369	S	S	.	.	H	α-helix	trans	-78.9	-7.3	-175.7	-62.7	-9.8	0	0	0	112.7	R39 F40 L41	R39-D43 WeakPolarHBondContact CG-OD2 3.33Å; R39-D43 IonicContact NE-OD2 2.7Å; R39-D43 WeakPolarHBondContact O-CB 3.47Å; R39-D43 PolarHBondContact O-N 3.14Å; F40-D43 PolarHBondContact O-N 3.31Å; L41-D43 PolarHBondContact O-N 3.06Å
44	N	95.1	Very high	95.8	Very high	27 Å²	27	73.5 Å²	73.5	14%	0.144	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	31.2	-175.9	-65.9	-89	0	0	0	112.8	F40 L41 R42 D46 N47 K49	F40-N44 HydrophobicContact CE1-CB 4.3Å; F40-N44 WeakPolarHBondContact O-CB 3.16Å; F40-N44 PolarHBondContact O-N 2.78Å; F40-N44 VanDerWaalsContact O-N 3.08Å; F40-N44 PolarHBondContact O-ND2 2.95Å; L41-N44 CarbonylContact O-C 3.56Å; L41-N44 PolarHBondContact O-N 3.04Å; R42-N44 PolarHBondContact O-N 3.48Å; N44-D46 PolarHBondContact O-N 3.49Å; N44-D46 VanDerWaalsContact O-N 3.15Å; N44-N47 WeakPolarHBondContact CA-ND2 3.49Å; N44-N47 WeakPolarHBondContact CB-ND2 3.43Å; N44-N47 PolarHBondContact O-N 2.83Å; N44-N47 PolarHBondContact OD1-ND2 3.06Å; N44-K49 PolarHBondContact OD1-NZ 2.76Å
45	Q	94.9	Very high	95.6	Very high	148 Å²	148	74.5 Å²	74.5	69%	0.692	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.1	-179.8	-67.6	-179	-21.9	0	0	114.1	L41 R42	L41-Q45 WeakPolarHBondContact O-CG 3.5Å; L41-Q45 PolarHBondContact O-N 2.93Å; R42-Q45 WeakPolarHBondContact O-CG 3.27Å
46	D	95.9	Very high	95.4	Very high	144 Å²	144	76.3 Å²	76.3	77%	0.77	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	6.1	-175.2	68.6	-26.6	0	0	0	113.7	N44	N44-D46 PolarHBondContact O-N 3.49Å; N44-D46 VanDerWaalsContact O-N 3.15Å
47	N	95.5	Very high	95.1	Very high	44 Å²	44	81.2 Å²	81.2	24%	0.235	42%	0.423	C	S	.	.	S	Bend	trans	-148.8	163.9	-175.8	66.5	79.1	0	0	0	113.1	N44 K49	N44-N47 WeakPolarHBondContact CA-ND2 3.49Å; N44-N47 WeakPolarHBondContact CB-ND2 3.43Å; N44-N47 PolarHBondContact O-N 2.83Å; N44-N47 PolarHBondContact OD1-ND2 3.06Å; N47-K49 VanDerWaalsContact C-N 3.35Å; N47-K49 PolarHBondContact O-N 3.29Å; N47-K49 WeakPolarHBondContact OD1-CB 3.39Å; N47-K49 VanDerWaalsContact OD1-CD 3.3Å; N47-K49 WeakPolarHBondContact OD1-CD 3.36Å; N47-K49 WeakPolarHBondContact OD1-CG 3.35Å; N47-K49 PolarHBondContact OD1-N 3.42Å
48	D	93.9	Very high	95	Very high	162 Å²	162	81.1 Å²	81.1	87%	0.866	43%	0.425	S	S	*	.			trans	-96.6	29.3	-178.7	-57.1	-45.7	0	0	0	112.9
49	K	95.7	Very high	95	Very high	127 Å²	127	79.7 Å²	79.7	55%	0.552	42%	0.419	S	S	*	.			trans	-67.1	146.4	177.1	-69.2	172	-157.7	146.9	0	110.2	F40 N44 N47	F40-K49 HydrophobicContact CE1-CB 4.39Å; F40-K49 HydrophobicContact CZ-CB 3.79Å; N44-K49 PolarHBondContact OD1-NZ 2.76Å; N47-K49 VanDerWaalsContact C-N 3.35Å; N47-K49 PolarHBondContact O-N 3.29Å; N47-K49 WeakPolarHBondContact OD1-CB 3.39Å; N47-K49 VanDerWaalsContact OD1-CD 3.3Å; N47-K49 WeakPolarHBondContact OD1-CD 3.36Å; N47-K49 WeakPolarHBondContact OD1-CG 3.35Å; N47-K49 PolarHBondContact OD1-N 3.42Å
50	L	96.6	Very high	95.1	Very high	157 Å²	157	78.4 Å²	78.4	82%	0.822	42%	0.416	S	S	*	.			trans	-106.4	150.7	-176	-57.8	178.1	0	0	0	112
51	I	97.6	Very high	95.2	Very high	68 Å²	68	78.6 Å²	78.6	35%	0.349	41%	0.414	S	S	.	.			trans	-92.2	115.7	168.7	-55.5	171.7	0	0	0	108.3	V37 F40 V53	V37-I51 HydrophobicContact CB-CD1 4.16Å; V37-I51 HydrophobicContact CG1-CD1 3.8Å; V37-I51 HydrophobicContact CG2-CD1 4.13Å; F40-I51 HydrophobicContact CB-CD1 3.91Å; F40-I51 HydrophobicContact CB-CG1 4.22Å; F40-I51 HydrophobicContact CD1-CD1 3.53Å; F40-I51 HydrophobicContact CD1-CG1 3.25Å; F40-I51 HydrophobicContact CD2-CG1 4.3Å; F40-I51 HydrophobicContact CE1-CD1 4.28Å; F40-I51 HydrophobicContact CE1-CG1 3.55Å; F40-I51 HydrophobicContact CG-CD1 3.87Å; F40-I51 HydrophobicContact CG-CG1 3.66Å; F40-I51 HydrophobicContact CZ-CG1 4.18Å; I51-V53 HydrophobicContact CG2-CG2 4.04Å
52	G	96.9	Very high	95.4	Very high	77 Å²	77	75.6 Å²	75.6	79%	0.794	40%	0.399	S	S	*	.			trans	-83	119	169.8	0	0	0	0	0	111
53	V	97.1	Very high	95.6	Very high	44 Å²	44	71.2 Å²	71.2	27%	0.267	38%	0.383	S	S	.	.			trans	-112.1	129.3	175.1	-171.4	0	0	0	0	109.3	F33 I51 T62 I66	F33-V53 HydrophobicContact CE2-CG1 3.86Å; F33-V53 HydrophobicContact CE2-CG2 3.87Å; F33-V53 HydrophobicContact CZ-CG1 4.35Å; F33-V53 HydrophobicContact CZ-CG2 3.96Å; I51-V53 HydrophobicContact CG2-CG2 4.04Å; V53-T62 HydrophobicContact CB-CG2 4.12Å; V53-T62 HydrophobicContact CG1-CG2 3.95Å; V53-T62 WeakPolarHBondContact O-CG2 3.31Å; V53-I66 HydrophobicContact CB-CD1 4.17Å; V53-I66 HydrophobicContact CB-CG1 4.46Å; V53-I66 HydrophobicContact CG2-CD1 4.38Å; V53-I66 HydrophobicContact CG2-CG1 4.34Å
54	H	94.3	Very high	95.8	Very high	89 Å²	89	67.4 Å²	67.4	41%	0.412	36%	0.362	S	S	.	.			trans	-142.3	156.1	178.1	83.6	89.8	0	0	0	112	M3	M3-H54 WeakPolarHBondContact CB-CE1 3.47Å; M3-H54 VanDerWaalsContact CB-NE2 3.31Å; M3-H54 WeakPolarHBondContact CB-NE2 3.24Å
55	C	93.6	Very high	95.9	Very high	22 Å²	22	66.7 Å²	66.7	15%	0.149	36%	0.358	C	S	.	.			trans	-125.8	-149.7	165	62.5	0	0	0	0	108.3	G58 R61 T62	C55-G58 PolarHBondContact SG-N 2.76Å; C55-R61 HydrophobicContact CB-CB 4.09Å; C55-T62 PolarHBondContact N-OG1 3.32Å; C55-T62 VanDerWaalsContact N-OG1 3.14Å; C55-T62 PolarHBondContact SG-OG1 3.25Å
56	T	92.3	Very high	96.1	Very high	64 Å²	64	61.8 Å²	61.8	39%	0.393	34%	0.337	S	S	.	.	S	Bend	trans	-62.6	-43.9	173.7	-52.2	0	0	0	0	112.1	R61	T56-R61 PolarHBondContact OG1-NH2 3.06Å
57	H	91.9	Very high	96.2	Very high	134 Å²	134	55 Å²	55	62%	0.62	30%	0.3	S	S	*	.	S	Bend	trans	-114.6	-6.2	-175.8	-55.5	-66.7	0	0	0	113	L59 R89	H57-L59 HydrophobicContact CB-CB 4.47Å; H57-L59 PolarHBondContact O-N 3.07Å; H57-R89 PolarHBondContact O-NH2 3.43Å
58	G	93.9	Very high	96.4	Very high	11 Å²	11	53 Å²	53	11%	0.113	29%	0.289	C	S	.	.	S	Bend	trans	60.9	30.5	-175.4	0	0	0	0	0	113.2	C55 T62 R89	C55-G58 PolarHBondContact SG-N 2.76Å; G58-T62 WeakPolarHBondContact CA-OG1 3.28Å; G58-R89 PolarHBondContact O-NE 2.84Å
59	L	96.2	Very high	96.6	Very high	13 Å²	13	45.8 Å²	45.8	7%	0.068	25%	0.25	C	S	.	.	S	Bend	trans	-120	-83.3	-175.2	-170.9	60.6	0	0	0	111	H57 G63 F85 R89 Y91 A92 E94	H57-L59 HydrophobicContact CB-CB 4.47Å; H57-L59 PolarHBondContact O-N 3.07Å; L59-G63 WeakPolarHBondContact O-CA 3.32Å; L59-G63 PolarHBondContact O-N 3.17Å; L59-F85 HydrophobicContact CD1-CE1 4.28Å; L59-R89 HydrophobicContact CD1-CG 4.26Å; L59-Y91 WeakPolarHBondContact CD1-O 3.38Å; L59-A92 WeakPolarHBondContact CD1-O 3.48Å; L59-E94 HydrophobicContact CD2-CG 4.04Å
60	N	97.3	Very high	96.8	Very high	18 Å²	18	40.6 Å²	40.6	10%	0.096	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-63.3	-168.7	-67.9	-58.9	0	0	0	114.7	T62 G63 Y64 E94 R95 Y98	N60-T62 VanDerWaalsContact C-N 3.3Å; N60-T62 PolarHBondContact O-N 2.9Å; N60-G63 PolarHBondContact O-N 3.18Å; N60-Y64 WeakPolarHBondContact O-CB 3.44Å; N60-Y64 PolarHBondContact O-N 2.95Å; N60-E94 PolarHBondContact ND2-OE2 3.04Å; N60-E94 PolarHBondContact OD1-N 2.89Å; N60-R95 HydrophobicContact CB-CB 4.48Å; N60-R95 HydrophobicContact CB-CG 3.74Å; N60-R95 VanDerWaalsContact CG-CG 3.47Å; N60-R95 WeakPolarHBondContact OD1-CG 3.46Å; N60-R95 PolarHBondContact OD1-N 3.2Å; N60-Y98 HydrophobicContact CB-CD2 4.18Å; N60-Y98 HydrophobicContact CB-CE2 4.01Å
61	R	97.7	Very high	96.9	Very high	60 Å²	60	34 Å²	34	23%	0.226	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-37.2	179.9	-73.5	171.5	-70.4	172.3	0.1	112.4	T19 C55 T56 L65 Y98	T19-R61 HydrophobicContact CG2-CG 4.14Å; T19-R61 PolarHBondContact O-NH1 3.38Å; C55-R61 HydrophobicContact CB-CB 4.09Å; T56-R61 PolarHBondContact OG1-NH2 3.06Å; R61-L65 WeakPolarHBondContact O-CG 3.32Å; R61-L65 PolarHBondContact O-N 3.4Å; R61-L65 VanDerWaalsContact O-N 3.09Å; R61-Y98 HydrophobicContact CG-CE2 4.23Å
62	T	97.9	Very high	96.9	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-63	-53.4	177.4	-62	0	0	0	0	110.9	V53 C55 G58 N60 Y64 L65 I66 F85	V53-T62 HydrophobicContact CB-CG2 4.12Å; V53-T62 HydrophobicContact CG1-CG2 3.95Å; V53-T62 WeakPolarHBondContact O-CG2 3.31Å; C55-T62 PolarHBondContact N-OG1 3.32Å; C55-T62 VanDerWaalsContact N-OG1 3.14Å; C55-T62 PolarHBondContact SG-OG1 3.25Å; G58-T62 WeakPolarHBondContact CA-OG1 3.28Å; N60-T62 VanDerWaalsContact C-N 3.3Å; N60-T62 PolarHBondContact O-N 2.9Å; T62-Y64 VanDerWaalsContact C-N 3.35Å; T62-Y64 PolarHBondContact O-N 2.95Å; T62-L65 PolarHBondContact O-N 3.43Å; T62-I66 HydrophobicContact CG2-CD1 3.76Å; T62-I66 VanDerWaalsContact O-CG1 3.31Å; T62-I66 WeakPolarHBondContact O-CG1 3.35Å; T62-I66 PolarHBondContact O-N 3.45Å; T62-F85 HydrophobicContact CG2-CE2 4.13Å; T62-F85 HydrophobicContact CG2-CZ 4.35Å
63	G	98.3	Very high	96.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-43.8	178.7	0	0	0	0	0	111.9	L59 N60 L65 I66 C67	L59-G63 WeakPolarHBondContact O-CA 3.32Å; L59-G63 PolarHBondContact O-N 3.17Å; N60-G63 PolarHBondContact O-N 3.18Å; G63-L65 PolarHBondContact O-N 3.42Å; G63-I66 PolarHBondContact O-N 3.48Å; G63-C67 VanDerWaalsContact O-CB 3.3Å; G63-C67 WeakPolarHBondContact O-CB 3.39Å; G63-C67 PolarHBondContact O-N 2.86Å; G63-C67 PolarHBondContact O-SG 2.78Å
64	Y	98.6	Very high	96.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-57.1	-52.7	176.4	176.7	-87.7	0	0	0	112.4	V24 P25 I30 N60 T62 I66 C67 R68 Y98 D101 L102	V24-Y64 HydrophobicContact CG1-CE1 4.4Å; V24-Y64 HydrophobicContact CG1-CE2 3.95Å; V24-Y64 WeakPolarHBondContact CG1-OH 3.43Å; P25-Y64 HydrophobicContact CB-CD1 4.21Å; P25-Y64 HydrophobicContact CB-CE1 3.86Å; P25-Y64 VanDerWaalsContact CD-CE1 3.4Å; P25-Y64 HydrophobicContact CG-CD1 3.47Å; P25-Y64 VanDerWaalsContact CG-CD1 3.47Å; P25-Y64 HydrophobicContact CG-CE1 3.57Å; P25-Y64 HydrophobicContact CG-CG 4.39Å; I30-Y64 HydrophobicContact CD1-CE1 4.04Å; I30-Y64 WeakPolarHBondContact CD1-OH 3.44Å; I30-Y64 HydrophobicContact CG1-CE1 4.2Å; N60-Y64 WeakPolarHBondContact O-CB 3.44Å; N60-Y64 PolarHBondContact O-N 2.95Å; T62-Y64 VanDerWaalsContact C-N 3.35Å; T62-Y64 PolarHBondContact O-N 2.95Å; Y64-I66 PolarHBondContact O-N 3.13Å; Y64-C67 PolarHBondContact O-N 2.8Å; Y64-R68 HydrophobicContact CE1-CB 4.31Å; Y64-R68 HydrophobicContact CE1-CG 4.49Å; Y64-R68 WeakPolarHBondContact O-CB 3.39Å; Y64-R68 PolarHBondContact O-N 3.35Å; Y64-Y98 HydrophobicContact CD2-CD1 4.43Å; Y64-Y98 HydrophobicContact CD2-CD2 4.45Å; Y64-Y98 AromaticContact CD2-CG 3.99Å; Y64-Y98 HydrophobicContact CD2-CG 3.99Å; Y64-Y98 HydrophobicContact CG-CD2 4.31Å; Y64-Y98 HydrophobicContact CG-CG 4.29Å; Y64-D101 HydrophobicContact CE2-CB 4.42Å; Y64-D101 WeakPolarHBondContact CE2-OD2 3.48Å; Y64-D101 PolarHBondContact OH-OD2 2.86Å; Y64-L102 HydrophobicContact CD2-CD1 4.1Å; Y64-L102 HydrophobicContact CD2-CD2 4.01Å; Y64-L102 HydrophobicContact CD2-CG 3.83Å; Y64-L102 HydrophobicContact CE2-CD2 4.05Å; Y64-L102 HydrophobicContact CE2-CG 4.03Å
65	L	98.6	Very high	97	Very high	11 Å²	11	26.5 Å²	26.5	6%	0.058	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-38.5	-177.3	-71.9	174.2	0	0	0	112.4	P25 I30 F33 R61 T62 G63 Y69	P25-L65 HydrophobicContact CB-CD2 4.17Å; P25-L65 HydrophobicContact CG-CD2 4.37Å; I30-L65 HydrophobicContact CG1-CD2 4.16Å; F33-L65 HydrophobicContact CB-CD2 4.27Å; F33-L65 HydrophobicContact CD1-CB 3.99Å; F33-L65 HydrophobicContact CD2-CB 4.23Å; F33-L65 HydrophobicContact CD2-CD1 4.14Å; F33-L65 HydrophobicContact CE1-CB 4.02Å; F33-L65 VanDerWaalsContact CE1-O 3.28Å; F33-L65 WeakPolarHBondContact CE1-O 3.17Å; F33-L65 HydrophobicContact CE2-CB 4.26Å; F33-L65 HydrophobicContact CG-CB 4.09Å; F33-L65 HydrophobicContact CG-CD1 4.33Å; F33-L65 HydrophobicContact CG-CD2 4.4Å; F33-L65 HydrophobicContact CZ-CB 4.16Å; R61-L65 WeakPolarHBondContact O-CG 3.32Å; R61-L65 PolarHBondContact O-N 3.4Å; R61-L65 VanDerWaalsContact O-N 3.09Å; T62-L65 PolarHBondContact O-N 3.43Å; G63-L65 PolarHBondContact O-N 3.42Å; L65-Y69 PolarHBondContact O-N 2.85Å
66	I	98.6	Very high	97.2	Very high	46 Å²	46	26.4 Å²	26.4	24%	0.236	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-52.9	175.3	-68.6	168.9	0	0	0	110.3	F33 V53 T62 G63 Y64 R68 Y69 L70 F85	F33-I66 HydrophobicContact CZ-CG1 4.34Å; V53-I66 HydrophobicContact CB-CD1 4.17Å; V53-I66 HydrophobicContact CB-CG1 4.46Å; V53-I66 HydrophobicContact CG2-CD1 4.38Å; V53-I66 HydrophobicContact CG2-CG1 4.34Å; T62-I66 HydrophobicContact CG2-CD1 3.76Å; T62-I66 VanDerWaalsContact O-CG1 3.31Å; T62-I66 WeakPolarHBondContact O-CG1 3.35Å; T62-I66 PolarHBondContact O-N 3.45Å; G63-I66 PolarHBondContact O-N 3.48Å; Y64-I66 PolarHBondContact O-N 3.13Å; I66-R68 VanDerWaalsContact C-N 3.3Å; I66-R68 PolarHBondContact O-N 2.92Å; I66-Y69 WeakPolarHBondContact O-CB 3.45Å; I66-Y69 PolarHBondContact O-N 3.49Å; I66-Y69 VanDerWaalsContact O-N 3.16Å; I66-L70 HydrophobicContact CG2-CD1 4.1Å; I66-L70 HydrophobicContact CG2-CG 4.49Å; I66-L70 WeakPolarHBondContact O-CG 3.42Å; I66-L70 PolarHBondContact O-N 2.79Å; I66-F85 HydrophobicContact CB-CD2 4.46Å; I66-F85 HydrophobicContact CD1-CD2 4.02Å; I66-F85 HydrophobicContact CD1-CE2 3.86Å; I66-F85 HydrophobicContact CG2-CD2 4.39Å
67	C	98.8	Very high	97.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-42.6	-179.3	-63.6	0	0	0	0	110.9	G63 Y64 Y69 L70 I71 A81 L102	G63-C67 VanDerWaalsContact O-CB 3.3Å; G63-C67 WeakPolarHBondContact O-CB 3.39Å; G63-C67 PolarHBondContact O-N 2.86Å; G63-C67 PolarHBondContact O-SG 2.78Å; Y64-C67 PolarHBondContact O-N 2.8Å; C67-Y69 VanDerWaalsContact C-N 3.3Å; C67-Y69 PolarHBondContact O-N 3.49Å; C67-L70 PolarHBondContact O-N 3.42Å; C67-I71 WeakPolarHBondContact O-CD1 3.16Å; C67-I71 WeakPolarHBondContact O-CG1 3.47Å; C67-I71 PolarHBondContact O-N 3.4Å; C67-A81 HydrophobicContact CB-CB 4.14Å; C67-A81 PolarHBondContact SG-O 3.16Å; C67-L102 HydrophobicContact CB-CD1 3.87Å; C67-L102 HydrophobicContact CB-CD2 3.77Å; C67-L102 HydrophobicContact CB-CG 4.48Å
68	R	98.8	Very high	97.8	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-60.5	-38.8	177.3	-178.5	54	63.8	-161.4	4.9	112.2	I30 Y64 I66 D72 D101 L102	I30-R68 HydrophobicContact CD1-CG 4.2Å; I30-R68 HydrophobicContact CG1-CG 4.38Å; I30-R68 HydrophobicContact CG2-CG 3.76Å; Y64-R68 HydrophobicContact CE1-CB 4.31Å; Y64-R68 HydrophobicContact CE1-CG 4.49Å; Y64-R68 WeakPolarHBondContact O-CB 3.39Å; Y64-R68 PolarHBondContact O-N 3.35Å; I66-R68 VanDerWaalsContact C-N 3.3Å; I66-R68 PolarHBondContact O-N 2.92Å; R68-D72 VanDerWaalsContact CD-CG 3.43Å; R68-D72 WeakPolarHBondContact CD-OD1 3.36Å; R68-D72 WeakPolarHBondContact CD-OD2 3.36Å; R68-D72 IonicContact NH1-OD1 3.58Å; R68-D72 PolarHBondContact NH1-OD1 3.33Å; R68-D72 VanDerWaalsContact O-CB 3.31Å; R68-D72 WeakPolarHBondContact O-CB 3.28Å; R68-D72 VanDerWaalsContact O-CG 3.3Å; R68-D72 PolarHBondContact O-N 3.34Å; R68-D101 IonicContact CZ-OD2 3.29Å; R68-D101 IonicContact NE-OD2 3.51Å; R68-D101 VanDerWaalsContact NH2-C 3.28Å; R68-D101 PolarHBondContact NH2-O 3.41Å; R68-D101 IonicContact NH2-OD2 2.79Å; R68-D101 PolarHBondContact NH2-OD2 3.37Å; R68-L102 HydrophobicContact CB-CD2 4.08Å
69	Y	98.6	Very high	98	Very high	12 Å²	12	24 Å²	24	5%	0.047	14%	0.144	C	C	.	.	H	α-helix	trans	-64	-50.1	173.4	-177.2	-82.8	0	0	0	111.6	F33 K34 V37 L65 I66 C67 I71 D72 V73	F33-Y69 HydrophobicContact CE1-CD2 4.5Å; F33-Y69 HydrophobicContact CE1-CG 4.46Å; K34-Y69 HydrophobicContact CB-CD2 4.34Å; K34-Y69 HydrophobicContact CB-CE2 4.46Å; K34-Y69 HydrophobicContact CG-CD2 3.92Å; K34-Y69 HydrophobicContact CG-CE2 4.42Å; V37-Y69 HydrophobicContact CB-CD2 4.08Å; V37-Y69 HydrophobicContact CB-CE2 3.65Å; V37-Y69 HydrophobicContact CG1-CD1 4.43Å; V37-Y69 HydrophobicContact CG1-CD2 4.07Å; V37-Y69 HydrophobicContact CG1-CE1 3.9Å; V37-Y69 HydrophobicContact CG1-CE2 3.48Å; V37-Y69 VanDerWaalsContact CG1-CE2 3.48Å; V37-Y69 HydrophobicContact CG2-CD2 4.42Å; V37-Y69 HydrophobicContact CG2-CE2 4.46Å; L65-Y69 PolarHBondContact O-N 2.85Å; I66-Y69 WeakPolarHBondContact O-CB 3.45Å; I66-Y69 PolarHBondContact O-N 3.49Å; I66-Y69 VanDerWaalsContact O-N 3.16Å; C67-Y69 VanDerWaalsContact C-N 3.3Å; C67-Y69 PolarHBondContact O-N 3.49Å; Y69-I71 VanDerWaalsContact C-N 3.26Å; Y69-I71 PolarHBondContact O-N 2.92Å; Y69-D72 PolarHBondContact O-N 2.93Å; Y69-V73 HydrophobicContact CD1-CB 4.32Å; Y69-V73 HydrophobicContact CD2-CB 4.42Å; Y69-V73 HydrophobicContact CD2-CG2 3.83Å; Y69-V73 HydrophobicContact CE1-CB 4.08Å; Y69-V73 HydrophobicContact CE1-CG1 4.23Å; Y69-V73 HydrophobicContact CE1-CG2 4.5Å; Y69-V73 HydrophobicContact CE2-CB 4.19Å; Y69-V73 HydrophobicContact CE2-CG1 4.28Å; Y69-V73 HydrophobicContact CE2-CG2 3.78Å; Y69-V73 HydrophobicContact CG-CB 4.48Å; Y69-V73 HydrophobicContact CG-CG2 4.21Å; Y69-V73 WeakPolarHBondContact O-CA 3.33Å; Y69-V73 VanDerWaalsContact O-CB 3.26Å; Y69-V73 WeakPolarHBondContact O-CB 3.41Å; Y69-V73 PolarHBondContact O-N 3.37Å
70	L	98.5	Very high	98.1	Very high	17 Å²	17	28.6 Å²	28.6	9%	0.089	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-39	179.3	-64	173.9	0	0	0	111.8	I66 C67 D74 G75 M76 A81 L84 Y241	I66-L70 HydrophobicContact CG2-CD1 4.1Å; I66-L70 HydrophobicContact CG2-CG 4.49Å; I66-L70 WeakPolarHBondContact O-CG 3.42Å; I66-L70 PolarHBondContact O-N 2.79Å; C67-L70 PolarHBondContact O-N 3.42Å; L70-D74 WeakPolarHBondContact CD2-OD2 3.31Å; L70-D74 CarbonylContact O-C 3.27Å; L70-D74 WeakPolarHBondContact O-CA 3.49Å; L70-D74 WeakPolarHBondContact O-CB 3.32Å; L70-D74 PolarHBondContact O-N 3.08Å; L70-G75 PolarHBondContact O-N 3.41Å; L70-M76 HydrophobicContact CB-CB 4.1Å; L70-M76 HydrophobicContact CB-CE 4.34Å; L70-M76 HydrophobicContact CB-SD 4.14Å; L70-M76 HydrophobicContact CD1-CE 4.23Å; L70-M76 HydrophobicContact CD1-SD 4.04Å; L70-M76 HydrophobicContact CD2-CE 4.22Å; L70-M76 HydrophobicContact CG-CE 4.5Å; L70-M76 WeakPolarHBondContact O-CB 3.38Å; L70-M76 PolarHBondContact O-N 3Å; L70-A81 HydrophobicContact CB-CB 4.23Å; L70-A81 HydrophobicContact CD1-CB 4.33Å; L70-L84 HydrophobicContact CD1-CD2 4.28Å; L70-Y241 HydrophobicContact CD2-CE1 4Å; L70-Y241 HydrophobicContact CD2-CE2 4.5Å
71	I	98.4	Very high	98.1	Very high	20 Å²	20	27.8 Å²	27.8	10%	0.103	16%	0.161	C	C	.	.	H	α-helix	trans	-71.4	-53.5	178.3	-65.3	159.9	0	0	0	111.1	C67 Y69 G75 M76 P78 A81 L102	C67-I71 WeakPolarHBondContact O-CD1 3.16Å; C67-I71 WeakPolarHBondContact O-CG1 3.47Å; C67-I71 PolarHBondContact O-N 3.4Å; Y69-I71 VanDerWaalsContact C-N 3.26Å; Y69-I71 PolarHBondContact O-N 2.92Å; I71-G75 VanDerWaalsContact O-CA 3.28Å; I71-G75 WeakPolarHBondContact O-CA 3.45Å; I71-G75 PolarHBondContact O-N 2.89Å; I71-M76 WeakPolarHBondContact CA-O 3.38Å; I71-P78 HydrophobicContact CD1-CB 3.88Å; I71-P78 HydrophobicContact CD1-CG 4.09Å; I71-P78 HydrophobicContact CG1-CB 4.4Å; I71-P78 HydrophobicContact CG1-CG 4.28Å; I71-P78 HydrophobicContact CG2-CG 4.41Å; I71-A81 HydrophobicContact CD1-CB 4.34Å; I71-A81 HydrophobicContact CG1-CB 4.01Å; I71-L102 HydrophobicContact CD1-CB 4.37Å; I71-L102 HydrophobicContact CD1-CD2 3.79Å
72	D	98.1	Very high	98.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-76.5	-34.3	-170	-69.5	-7	0	0	0	112.6	K34 R68 Y69 K107 R108 N110	K34-D72 VanDerWaalsContact CE-OD2 3.32Å; K34-D72 WeakPolarHBondContact CE-OD2 3.19Å; K34-D72 VanDerWaalsContact NZ-CB 3.28Å; K34-D72 IonicContact NZ-OD2 2.76Å; K34-D72 PolarHBondContact NZ-OD2 3.49Å; R68-D72 VanDerWaalsContact CD-CG 3.43Å; R68-D72 WeakPolarHBondContact CD-OD1 3.36Å; R68-D72 WeakPolarHBondContact CD-OD2 3.36Å; R68-D72 IonicContact NH1-OD1 3.58Å; R68-D72 PolarHBondContact NH1-OD1 3.33Å; R68-D72 VanDerWaalsContact O-CB 3.31Å; R68-D72 WeakPolarHBondContact O-CB 3.28Å; R68-D72 VanDerWaalsContact O-CG 3.3Å; R68-D72 PolarHBondContact O-N 3.34Å; Y69-D72 PolarHBondContact O-N 2.93Å; D72-K107 HydrophobicContact CB-CG 4.36Å; D72-K107 WeakPolarHBondContact O-CE 3.38Å; D72-K107 PolarHBondContact O-NZ 3.14Å; D72-R108 PolarHBondContact OD1-N 3.25Å; D72-R108 WeakPolarHBondContact OD2-CB 3.47Å; D72-R108 PolarHBondContact OD2-N 3.19Å; D72-N110 PolarHBondContact O-ND2 3.31Å
73	V	97.4	Very high	98.2	Very high	24 Å²	24	32.1 Å²	32.1	15%	0.145	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-53.8	-172.9	-172.3	0	0	0	0	110.3	K34 Y69 G75 M113 W245	K34-V73 HydrophobicContact CD-CG2 4.1Å; K34-V73 HydrophobicContact CG-CG2 4.11Å; Y69-V73 HydrophobicContact CD1-CB 4.32Å; Y69-V73 HydrophobicContact CD2-CB 4.42Å; Y69-V73 HydrophobicContact CD2-CG2 3.83Å; Y69-V73 HydrophobicContact CE1-CB 4.08Å; Y69-V73 HydrophobicContact CE1-CG1 4.23Å; Y69-V73 HydrophobicContact CE1-CG2 4.5Å; Y69-V73 HydrophobicContact CE2-CB 4.19Å; Y69-V73 HydrophobicContact CE2-CG1 4.28Å; Y69-V73 HydrophobicContact CE2-CG2 3.78Å; Y69-V73 HydrophobicContact CG-CB 4.48Å; Y69-V73 HydrophobicContact CG-CG2 4.21Å; Y69-V73 WeakPolarHBondContact O-CA 3.33Å; Y69-V73 VanDerWaalsContact O-CB 3.26Å; Y69-V73 WeakPolarHBondContact O-CB 3.41Å; Y69-V73 PolarHBondContact O-N 3.37Å; V73-G75 VanDerWaalsContact C-N 3.31Å; V73-G75 PolarHBondContact O-N 3.39Å; V73-M113 HydrophobicContact CG1-CE 4.21Å; V73-W245 HydrophobicContact CG1-CH2 3.46Å; V73-W245 VanDerWaalsContact CG1-CH2 3.46Å; V73-W245 HydrophobicContact CG1-CZ2 3.53Å
74	D	95.8	Very high	98.2	Very high	39 Å²	39	33.4 Å²	33.4	21%	0.209	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.2	-177.1	-58	-28.3	0	0	0	112.8	L70 M76 Y241 W245	L70-D74 WeakPolarHBondContact CD2-OD2 3.31Å; L70-D74 CarbonylContact O-C 3.27Å; L70-D74 WeakPolarHBondContact O-CA 3.49Å; L70-D74 WeakPolarHBondContact O-CB 3.32Å; L70-D74 PolarHBondContact O-N 3.08Å; D74-M76 PolarHBondContact O-N 3.4Å; D74-Y241 WeakPolarHBondContact CB-OH 3.08Å; D74-Y241 PolarHBondContact OD2-OH 3.16Å; D74-W245 WeakPolarHBondContact OD1-CZ2 3.17Å; D74-W245 PolarHBondContact OD1-NE1 3.23Å
75	G	97.1	Very high	98.2	Very high	56 Å²	56	34.2 Å²	34.2	58%	0.577	20%	0.195	S	C	*	.			trans	70.7	19.2	178.3	0	0	0	0	0	114	L70 I71 V73	L70-G75 PolarHBondContact O-N 3.41Å; I71-G75 VanDerWaalsContact O-CA 3.28Å; I71-G75 WeakPolarHBondContact O-CA 3.45Å; I71-G75 PolarHBondContact O-N 2.89Å; V73-G75 VanDerWaalsContact C-N 3.31Å; V73-G75 PolarHBondContact O-N 3.39Å
76	M	98.1	Very high	98.2	Very high	21 Å²	21	35.5 Å²	35.5	10%	0.103	20%	0.202	C	C	.	.			trans	-66.1	142.9	-180	-169.5	176.6	-67.3	0	0	111.2	L70 I71 D74 Q80 A81 L84 Y241	L70-M76 HydrophobicContact CB-CB 4.1Å; L70-M76 HydrophobicContact CB-CE 4.34Å; L70-M76 HydrophobicContact CB-SD 4.14Å; L70-M76 HydrophobicContact CD1-CE 4.23Å; L70-M76 HydrophobicContact CD1-SD 4.04Å; L70-M76 HydrophobicContact CD2-CE 4.22Å; L70-M76 HydrophobicContact CG-CE 4.5Å; L70-M76 WeakPolarHBondContact O-CB 3.38Å; L70-M76 PolarHBondContact O-N 3Å; I71-M76 WeakPolarHBondContact CA-O 3.38Å; D74-M76 PolarHBondContact O-N 3.4Å; M76-Q80 HydrophobicContact CG-CB 4.14Å; M76-Q80 HydrophobicContact CG-CG 4.18Å; M76-Q80 HydrophobicContact SD-CB 4.48Å; M76-Q80 HydrophobicContact SD-CG 4.18Å; M76-A81 HydrophobicContact CG-CB 4.15Å; M76-A81 WeakPolarHBondContact SD-CA 3.16Å; M76-A81 HydrophobicContact SD-CB 3.72Å; M76-L84 HydrophobicContact CE-CD2 3.89Å; M76-L84 HydrophobicContact SD-CD2 4.14Å; M76-Y241 HydrophobicContact CE-CD2 3.62Å; M76-Y241 HydrophobicContact CE-CE2 3.2Å
77	D	98.1	Very high	98.1	Very high	84 Å²	84	36.1 Å²	36.1	45%	0.449	21%	0.21	S	C	.	.			trans	-59	136.7	171.2	172.2	-94.5	0	0	0	110.8	A79 Q80 A81	D77-A79 PolarHBondContact O-N 3.38Å; D77-A79 WeakPolarHBondContact OD1-CA 3.28Å; D77-A79 VanDerWaalsContact OD1-CB 3.32Å; D77-A79 WeakPolarHBondContact OD1-CB 3.5Å; D77-A79 PolarHBondContact OD1-N 2.97Å; D77-Q80 HydrophobicContact CB-CB 4.04Å; D77-Q80 WeakPolarHBondContact O-CB 3.3Å; D77-Q80 PolarHBondContact O-N 2.78Å; D77-Q80 PolarHBondContact OD1-N 3.44Å; D77-A81 PolarHBondContact O-N 2.85Å
78	P	98.4	Very high	98.1	Very high	24 Å²	24	39.5 Å²	39.5	16%	0.156	23%	0.234	C	C	.	.	H	α-helix	trans	-57.2	-41.7	-178	-28.9	36	0	0	0	115.2	I71 Q80 A81 V82 L102	I71-P78 HydrophobicContact CD1-CB 3.88Å; I71-P78 HydrophobicContact CD1-CG 4.09Å; I71-P78 HydrophobicContact CG1-CB 4.4Å; I71-P78 HydrophobicContact CG1-CG 4.28Å; I71-P78 HydrophobicContact CG2-CG 4.41Å; P78-Q80 VanDerWaalsContact C-N 3.34Å; P78-A81 PolarHBondContact O-N 3.47Å; P78-V82 WeakPolarHBondContact O-CG2 3.21Å; P78-V82 PolarHBondContact O-N 2.62Å; P78-L102 WeakPolarHBondContact CB-O 3.3Å; P78-L102 WeakPolarHBondContact CG-O 3.49Å
79	A	97.9	Very high	98	Very high	50 Å²	50	43 Å²	43	41%	0.413	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-40	-179.9	0	0	0	0	0	110.3	D77 V82 Q83	D77-A79 PolarHBondContact O-N 3.38Å; D77-A79 WeakPolarHBondContact OD1-CA 3.28Å; D77-A79 VanDerWaalsContact OD1-CB 3.32Å; D77-A79 WeakPolarHBondContact OD1-CB 3.5Å; D77-A79 PolarHBondContact OD1-N 2.97Å; A79-V82 PolarHBondContact O-N 2.79Å; A79-Q83 VanDerWaalsContact O-CB 3.32Å; A79-Q83 WeakPolarHBondContact O-CB 3.37Å; A79-Q83 PolarHBondContact O-N 3.38Å
80	Q	98.5	Very high	97.9	Very high	110 Å²	110	45.2 Å²	45.2	51%	0.514	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-44.6	173.8	-171.2	-179	19	0	0	112.1	M76 D77 P78 V82 Q83 L84	M76-Q80 HydrophobicContact CG-CB 4.14Å; M76-Q80 HydrophobicContact CG-CG 4.18Å; M76-Q80 HydrophobicContact SD-CB 4.48Å; M76-Q80 HydrophobicContact SD-CG 4.18Å; D77-Q80 HydrophobicContact CB-CB 4.04Å; D77-Q80 WeakPolarHBondContact O-CB 3.3Å; D77-Q80 PolarHBondContact O-N 2.78Å; D77-Q80 PolarHBondContact OD1-N 3.44Å; P78-Q80 VanDerWaalsContact C-N 3.34Å; Q80-V82 PolarHBondContact O-N 3.42Å; Q80-Q83 PolarHBondContact O-N 3.03Å; Q80-L84 VanDerWaalsContact O-CB 3.28Å; Q80-L84 WeakPolarHBondContact O-CB 3.31Å; Q80-L84 PolarHBondContact O-N 3.05Å
81	A	98.6	Very high	97.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-45.6	179.2	0	0	0	0	0	111.9	C67 L70 I71 M76 D77 P78 L84 F85	C67-A81 HydrophobicContact CB-CB 4.14Å; C67-A81 PolarHBondContact SG-O 3.16Å; L70-A81 HydrophobicContact CB-CB 4.23Å; L70-A81 HydrophobicContact CD1-CB 4.33Å; I71-A81 HydrophobicContact CD1-CB 4.34Å; I71-A81 HydrophobicContact CG1-CB 4.01Å; M76-A81 HydrophobicContact CG-CB 4.15Å; M76-A81 WeakPolarHBondContact SD-CA 3.16Å; M76-A81 HydrophobicContact SD-CB 3.72Å; D77-A81 PolarHBondContact O-N 2.85Å; P78-A81 PolarHBondContact O-N 3.47Å; A81-L84 PolarHBondContact O-N 3.21Å; A81-F85 PolarHBondContact O-N 3.14Å
82	V	98.5	Very high	97.8	Very high	20 Å²	20	53.2 Å²	53.2	12%	0.121	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-44.7	176.8	171.9	0	0	0	0	111	P78 A79 Q80 L84 F85 N86 L99 L102	P78-V82 WeakPolarHBondContact O-CG2 3.21Å; P78-V82 PolarHBondContact O-N 2.62Å; A79-V82 PolarHBondContact O-N 2.79Å; Q80-V82 PolarHBondContact O-N 3.42Å; V82-L84 PolarHBondContact O-N 3.25Å; V82-F85 PolarHBondContact O-N 3.4Å; V82-N86 WeakPolarHBondContact CG1-ND2 3.49Å; V82-N86 VanDerWaalsContact O-CB 3.32Å; V82-N86 WeakPolarHBondContact O-CB 3.49Å; V82-N86 PolarHBondContact O-N 3.39Å; V82-N86 PolarHBondContact O-ND2 3.38Å; V82-N86 PolarHBondContact O-OD1 2.83Å; V82-L99 HydrophobicContact CG1-CD2 3.94Å; V82-L99 HydrophobicContact CG2-CD2 4.29Å; V82-L102 HydrophobicContact CG2-CD1 3.89Å
83	Q	98.4	Very high	97.8	Very high	138 Å²	138	53.6 Å²	53.6	65%	0.645	32%	0.316	S	S	*	.	H	α-helix	trans	-62.2	-43.4	177.7	-176	-176.2	-3.2	0	0	111.9	A79 Q80 N86 S87	A79-Q83 VanDerWaalsContact O-CB 3.32Å; A79-Q83 WeakPolarHBondContact O-CB 3.37Å; A79-Q83 PolarHBondContact O-N 3.38Å; Q80-Q83 PolarHBondContact O-N 3.03Å; Q83-N86 PolarHBondContact O-N 3.46Å; Q83-S87 WeakPolarHBondContact O-CB 2.92Å; Q83-S87 PolarHBondContact O-N 3.43Å; Q83-S87 PolarHBondContact O-OG 3.48Å
84	L	98.4	Very high	97.8	Very high	28 Å²	28	59 Å²	59	15%	0.147	34%	0.34	C	S	.	.	H	α-helix	trans	-61	-46.7	177.8	178.2	59.5	0	0	0	111	L70 M76 Q80 A81 V82 S87 S88 P239 Y241	L70-L84 HydrophobicContact CD1-CD2 4.28Å; M76-L84 HydrophobicContact CE-CD2 3.89Å; M76-L84 HydrophobicContact SD-CD2 4.14Å; Q80-L84 VanDerWaalsContact O-CB 3.28Å; Q80-L84 WeakPolarHBondContact O-CB 3.31Å; Q80-L84 PolarHBondContact O-N 3.05Å; A81-L84 PolarHBondContact O-N 3.21Å; V82-L84 PolarHBondContact O-N 3.25Å; L84-S87 PolarHBondContact O-OG 2.95Å; L84-S87 VanDerWaalsContact O-OG 3.04Å; L84-S88 VanDerWaalsContact O-CB 3.27Å; L84-S88 WeakPolarHBondContact O-CB 3.48Å; L84-S88 PolarHBondContact O-N 3Å; L84-S88 PolarHBondContact O-OG 3.27Å; L84-P239 HydrophobicContact CD1-CB 4.15Å; L84-P239 HydrophobicContact CD1-CG 3.58Å; L84-Y241 HydrophobicContact CD2-CD2 4.08Å; L84-Y241 HydrophobicContact CD2-CG 4.19Å
85	F	98.6	Very high	97.8	Very high	17 Å²	17	60.5 Å²	60.5	8%	0.075	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-50	175.9	176.3	-97.3	0	0	0	111.8	L59 T62 I66 A81 V82 S87 S88 R89 I93	L59-F85 HydrophobicContact CD1-CE1 4.28Å; T62-F85 HydrophobicContact CG2-CE2 4.13Å; T62-F85 HydrophobicContact CG2-CZ 4.35Å; I66-F85 HydrophobicContact CB-CD2 4.46Å; I66-F85 HydrophobicContact CD1-CD2 4.02Å; I66-F85 HydrophobicContact CD1-CE2 3.86Å; I66-F85 HydrophobicContact CG2-CD2 4.39Å; A81-F85 PolarHBondContact O-N 3.14Å; V82-F85 PolarHBondContact O-N 3.4Å; F85-S87 PolarHBondContact O-N 3.48Å; F85-S88 PolarHBondContact O-N 3.48Å; F85-R89 HydrophobicContact CE1-CB 4.17Å; F85-R89 HydrophobicContact CE1-CG 4.22Å; F85-R89 HydrophobicContact CE2-CB 4.33Å; F85-R89 HydrophobicContact CZ-CB 4.04Å; F85-R89 HydrophobicContact CZ-CG 3.94Å; F85-R89 WeakPolarHBondContact O-CB 3.26Å; F85-R89 PolarHBondContact O-N 3.06Å; F85-I93 HydrophobicContact CD1-CD1 3.88Å; F85-I93 HydrophobicContact CD1-CG1 3.78Å; F85-I93 HydrophobicContact CE1-CD1 4.24Å; F85-I93 HydrophobicContact CE1-CG1 3.78Å
86	N	98.2	Very high	97.9	Very high	37 Å²	37	63.2 Å²	63.2	20%	0.198	34%	0.34	C	S	.	.	H	α-helix	trans	-60.9	-44.9	-176.4	-69.9	-11.5	0	0	0	111.9	V82 Q83 R89 G90 Y91 A92 I93	V82-N86 WeakPolarHBondContact CG1-ND2 3.49Å; V82-N86 VanDerWaalsContact O-CB 3.32Å; V82-N86 WeakPolarHBondContact O-CB 3.49Å; V82-N86 PolarHBondContact O-N 3.39Å; V82-N86 PolarHBondContact O-ND2 3.38Å; V82-N86 PolarHBondContact O-OD1 2.83Å; Q83-N86 PolarHBondContact O-N 3.46Å; N86-R89 PolarHBondContact O-N 3.43Å; N86-G90 PolarHBondContact O-N 2.91Å; N86-Y91 PolarHBondContact O-N 3.34Å; N86-A92 WeakPolarHBondContact OD1-CA 3.5Å; N86-I93 PolarHBondContact OD1-N 3.35Å; N86-I93 VanDerWaalsContact OD1-N 3.08Å
87	S	97.8	Very high	97.9	Very high	60 Å²	60	65 Å²	65	42%	0.42	35%	0.35	S	S	.	.	H	α-helix	trans	-66	-41.6	178.1	56.4	0	0	0	0	112.3	Q83 L84 F85	Q83-S87 WeakPolarHBondContact O-CB 2.92Å; Q83-S87 PolarHBondContact O-N 3.43Å; Q83-S87 PolarHBondContact O-OG 3.48Å; L84-S87 PolarHBondContact O-OG 2.95Å; L84-S87 VanDerWaalsContact O-OG 3.04Å; F85-S87 PolarHBondContact O-N 3.48Å
88	S	97.3	Very high	97.9	Very high	71 Å²	71	61 Å²	61	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-70.5	-35.1	178.2	-56.6	0	0	0	0	112.5	L84 F85	L84-S88 VanDerWaalsContact O-CB 3.27Å; L84-S88 WeakPolarHBondContact O-CB 3.48Å; L84-S88 PolarHBondContact O-N 3Å; L84-S88 PolarHBondContact O-OG 3.27Å; F85-S88 PolarHBondContact O-N 3.48Å
89	R	97.4	Very high	97.9	Very high	76 Å²	76	61.8 Å²	61.8	29%	0.287	33%	0.332	S	S	.	.	H	α-helix	trans	-81.6	-28	-178.2	-178.2	58.9	-172.9	89	-0.5	113.1	H57 G58 L59 F85 N86 Y91 Y192	H57-R89 PolarHBondContact O-NH2 3.43Å; G58-R89 PolarHBondContact O-NE 2.84Å; L59-R89 HydrophobicContact CD1-CG 4.26Å; F85-R89 HydrophobicContact CE1-CB 4.17Å; F85-R89 HydrophobicContact CE1-CG 4.22Å; F85-R89 HydrophobicContact CE2-CB 4.33Å; F85-R89 HydrophobicContact CZ-CB 4.04Å; F85-R89 HydrophobicContact CZ-CG 3.94Å; F85-R89 WeakPolarHBondContact O-CB 3.26Å; F85-R89 PolarHBondContact O-N 3.06Å; N86-R89 PolarHBondContact O-N 3.43Å; R89-Y91 VanDerWaalsContact C-N 3.32Å; R89-Y192 PolarHBondContact NH2-OH 3.49Å
90	G	96.6	Very high	97.9	Very high	57 Å²	57	63 Å²	63	59%	0.588	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	4.4	-173.8	0	0	0	0	0	114.8	N86	N86-G90 PolarHBondContact O-N 2.91Å
91	Y	96.8	Very high	97.9	Very high	149 Å²	149	58.9 Å²	58.9	58%	0.584	31%	0.313	S	S	*	.	S	Bend	trans	-143.1	141.3	178.9	-66	-89.3	0	0	0	109.3	L59 N86 R89	L59-Y91 WeakPolarHBondContact CD1-O 3.38Å; N86-Y91 PolarHBondContact O-N 3.34Å; R89-Y91 VanDerWaalsContact C-N 3.32Å
92	A	97.7	Very high	97.9	Very high	57 Å²	57	59 Å²	59	47%	0.471	31%	0.313	S	S	.	.			trans	-80.3	145.4	179.5	0	0	0	0	0	112.1	L59 N86 E94	L59-A92 WeakPolarHBondContact CD1-O 3.48Å; N86-A92 WeakPolarHBondContact OD1-CA 3.5Å; A92-E94 PolarHBondContact O-N 3.05Å
93	I	97.8	Very high	97.9	Very high	8 Å²	8	62.3 Å²	62.3	4%	0.041	33%	0.327	C	S	.	.			trans	-58.5	129.6	165.4	-61.1	170.8	0	0	0	108.6	F85 N86 L99 L102	F85-I93 HydrophobicContact CD1-CD1 3.88Å; F85-I93 HydrophobicContact CD1-CG1 3.78Å; F85-I93 HydrophobicContact CE1-CD1 4.24Å; F85-I93 HydrophobicContact CE1-CG1 3.78Å; N86-I93 PolarHBondContact OD1-N 3.35Å; N86-I93 VanDerWaalsContact OD1-N 3.08Å; I93-L99 HydrophobicContact CB-CD2 4Å; I93-L99 HydrophobicContact CG2-CD2 4Å; I93-L99 HydrophobicContact CG2-CG 4.21Å; I93-L102 HydrophobicContact CD1-CD1 4.43Å
94	E	97.2	Very high	97.9	Very high	138 Å²	138	62.9 Å²	62.9	65%	0.645	33%	0.33	S	S	*	.			trans	-102.1	-21.7	-172.6	-59.3	168.2	153	0	0	112.5	L59 N60 A92 Q96	L59-E94 HydrophobicContact CD2-CG 4.04Å; N60-E94 PolarHBondContact ND2-OE2 3.04Å; N60-E94 PolarHBondContact OD1-N 2.89Å; A92-E94 PolarHBondContact O-N 3.05Å; E94-Q96 PolarHBondContact O-N 3.49Å
95	R	96.9	Very high	97.8	Very high	69 Å²	69	62.5 Å²	62.5	26%	0.26	33%	0.333	S	S	.	.			trans	-78.4	107.2	-174.6	-68.3	-63.9	173.7	93.3	-9.9	110.5	H22 N60 N97 Y98 L99	H22-R95 PolarHBondContact CD2-NH1 2.94Å; H22-R95 PolarHBondContact CD2-NH2 3.28Å; H22-R95 PolarHBondContact NE2-NH2 3.05Å; N60-R95 HydrophobicContact CB-CB 4.48Å; N60-R95 HydrophobicContact CB-CG 3.74Å; N60-R95 VanDerWaalsContact CG-CG 3.47Å; N60-R95 WeakPolarHBondContact OD1-CG 3.46Å; N60-R95 PolarHBondContact OD1-N 3.2Å; R95-N97 VanDerWaalsContact C-N 3.32Å; R95-N97 PolarHBondContact O-N 3.09Å; R95-Y98 HydrophobicContact CB-CD1 4.23Å; R95-Y98 HydrophobicContact CB-CD2 3.67Å; R95-Y98 HydrophobicContact CB-CE2 4.17Å; R95-Y98 HydrophobicContact CB-CG 3.71Å; R95-Y98 HydrophobicContact CG-CD2 4.14Å; R95-Y98 HydrophobicContact CG-CE2 4.18Å; R95-Y98 WeakPolarHBondContact O-CB 3.34Å; R95-Y98 PolarHBondContact O-N 2.91Å; R95-L99 PolarHBondContact O-N 2.84Å; R95-L99 VanDerWaalsContact O-N 3.13Å
96	Q	97.9	Very high	97.7	Very high	114 Å²	114	66.1 Å²	66.1	53%	0.533	36%	0.358	S	S	.	.	H	α-helix	trans	-59.2	-42.4	-177.6	-166.4	58	46.5	0	0	112.6	E94 Y98 L99 D100	E94-Q96 PolarHBondContact O-N 3.49Å; Q96-Y98 PolarHBondContact O-N 3.18Å; Q96-Y98 VanDerWaalsContact O-N 3.15Å; Q96-L99 WeakPolarHBondContact O-CB 3.35Å; Q96-L99 PolarHBondContact O-N 3.47Å; Q96-D100 PolarHBondContact NE2-OD1 3.24Å; Q96-D100 WeakPolarHBondContact O-CB 3.49Å; Q96-D100 PolarHBondContact O-N 3.49Å
97	N	98.1	Very high	97.5	Very high	59 Å²	59	70.8 Å²	70.8	32%	0.316	38%	0.376	S	S	.	.	H	α-helix	trans	-61.5	-26	176.5	65.9	-45.5	0	0	0	113.7	H22 R95 D101	H22-N97 PolarHBondContact O-ND2 3.33Å; R95-N97 VanDerWaalsContact C-N 3.32Å; R95-N97 PolarHBondContact O-N 3.09Å; N97-D101 WeakPolarHBondContact O-CB 3.3Å; N97-D101 PolarHBondContact O-N 3.29Å
98	Y	98.3	Very high	97.5	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-76.3	-43.6	174.2	-67.6	2.1	0	0	0	110.4	E23 V24 N60 R61 Y64 R95 Q96 D100 D101 L102	E23-Y98 WeakPolarHBondContact O-CE1 3.5Å; E23-Y98 PolarHBondContact O-OH 2.86Å; V24-Y98 HydrophobicContact CG2-CD1 4.09Å; V24-Y98 HydrophobicContact CG2-CE1 4.4Å; N60-Y98 HydrophobicContact CB-CD2 4.18Å; N60-Y98 HydrophobicContact CB-CE2 4.01Å; R61-Y98 HydrophobicContact CG-CE2 4.23Å; Y64-Y98 HydrophobicContact CD2-CD1 4.43Å; Y64-Y98 HydrophobicContact CD2-CD2 4.45Å; Y64-Y98 AromaticContact CD2-CG 3.99Å; Y64-Y98 HydrophobicContact CD2-CG 3.99Å; Y64-Y98 HydrophobicContact CG-CD2 4.31Å; Y64-Y98 HydrophobicContact CG-CG 4.29Å; R95-Y98 HydrophobicContact CB-CD1 4.23Å; R95-Y98 HydrophobicContact CB-CD2 3.67Å; R95-Y98 HydrophobicContact CB-CE2 4.17Å; R95-Y98 HydrophobicContact CB-CG 3.71Å; R95-Y98 HydrophobicContact CG-CD2 4.14Å; R95-Y98 HydrophobicContact CG-CE2 4.18Å; R95-Y98 WeakPolarHBondContact O-CB 3.34Å; R95-Y98 PolarHBondContact O-N 2.91Å; Q96-Y98 PolarHBondContact O-N 3.18Å; Q96-Y98 VanDerWaalsContact O-N 3.15Å; Y98-D100 VanDerWaalsContact C-N 3.35Å; Y98-D101 PolarHBondContact O-N 3.37Å; Y98-L102 WeakPolarHBondContact O-CB 3.49Å; Y98-L102 WeakPolarHBondContact O-CG 3.38Å; Y98-L102 PolarHBondContact O-N 2.95Å
99	L	98.5	Very high	97.4	Very high	40 Å²	40	69.5 Å²	69.5	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-44.4	176.2	-64.9	175.3	0	0	0	111.2	V82 I93 R95 Q96 L102 Q103	V82-L99 HydrophobicContact CG1-CD2 3.94Å; V82-L99 HydrophobicContact CG2-CD2 4.29Å; I93-L99 HydrophobicContact CB-CD2 4Å; I93-L99 HydrophobicContact CG2-CD2 4Å; I93-L99 HydrophobicContact CG2-CG 4.21Å; R95-L99 PolarHBondContact O-N 2.84Å; R95-L99 VanDerWaalsContact O-N 3.13Å; Q96-L99 WeakPolarHBondContact O-CB 3.35Å; Q96-L99 PolarHBondContact O-N 3.47Å; L99-L102 PolarHBondContact O-N 2.93Å; L99-Q103 VanDerWaalsContact O-CB 3.3Å; L99-Q103 WeakPolarHBondContact O-CB 3.33Å; L99-Q103 PolarHBondContact O-N 2.78Å
100	D	98.5	Very high	97.4	Very high	75 Å²	75	68 Å²	68	40%	0.401	36%	0.361	S	S	.	.	H	α-helix	trans	-63.2	-44.3	179.5	-64.3	-20	0	0	0	111.5	Q96 Y98 Q103 H104	Q96-D100 PolarHBondContact NE2-OD1 3.24Å; Q96-D100 WeakPolarHBondContact O-CB 3.49Å; Q96-D100 PolarHBondContact O-N 3.49Å; Y98-D100 VanDerWaalsContact C-N 3.35Å; D100-Q103 PolarHBondContact O-N 2.99Å; D100-H104 WeakPolarHBondContact O-CB 3.35Å; D100-H104 PolarHBondContact O-N 3.16Å; D100-H104 PolarHBondContact O-ND1 3.09Å
101	D	98.6	Very high	97.4	Very high	24 Å²	24	70.8 Å²	70.8	13%	0.128	37%	0.366	C	S	.	.	H	α-helix	trans	-68.4	-38.6	176	178.5	86.4	0	0	0	112	V24 Y64 R68 N97 Y98 Q103 G105 R108	V24-D101 HydrophobicContact CG1-CB 4.29Å; V24-D101 HydrophobicContact CG2-CB 4.05Å; Y64-D101 HydrophobicContact CE2-CB 4.42Å; Y64-D101 WeakPolarHBondContact CE2-OD2 3.48Å; Y64-D101 PolarHBondContact OH-OD2 2.86Å; R68-D101 IonicContact CZ-OD2 3.29Å; R68-D101 IonicContact NE-OD2 3.51Å; R68-D101 VanDerWaalsContact NH2-C 3.28Å; R68-D101 PolarHBondContact NH2-O 3.41Å; R68-D101 IonicContact NH2-OD2 2.79Å; R68-D101 PolarHBondContact NH2-OD2 3.37Å; N97-D101 WeakPolarHBondContact O-CB 3.3Å; N97-D101 PolarHBondContact O-N 3.29Å; Y98-D101 PolarHBondContact O-N 3.37Å; D101-Q103 VanDerWaalsContact C-N 3.31Å; D101-Q103 PolarHBondContact O-N 2.92Å; D101-G105 WeakPolarHBondContact O-CA 3.28Å; D101-G105 PolarHBondContact O-N 2.9Å; D101-R108 IonicContact OD1-CZ 3.31Å; D101-R108 IonicContact OD1-NH1 2.84Å; D101-R108 PolarHBondContact OD1-NH1 3.37Å; D101-R108 IonicContact OD1-NH2 3.93Å; D101-R108 PolarHBondContact OD1-NH2 3.03Å; D101-R108 IonicContact OD2-CZ 2.69Å; D101-R108 IonicContact OD2-NH1 3.68Å; D101-R108 IonicContact OD2-NH2 3.88Å
102	L	98.5	Very high	97.2	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-60.8	-43.5	174.6	-72.8	168.9	0	0	0	111.4	Y64 C67 R68 I71 P78 V82 I93 Y98 L99	Y64-L102 HydrophobicContact CD2-CD1 4.1Å; Y64-L102 HydrophobicContact CD2-CD2 4.01Å; Y64-L102 HydrophobicContact CD2-CG 3.83Å; Y64-L102 HydrophobicContact CE2-CD2 4.05Å; Y64-L102 HydrophobicContact CE2-CG 4.03Å; C67-L102 HydrophobicContact CB-CD1 3.87Å; C67-L102 HydrophobicContact CB-CD2 3.77Å; C67-L102 HydrophobicContact CB-CG 4.48Å; R68-L102 HydrophobicContact CB-CD2 4.08Å; I71-L102 HydrophobicContact CD1-CB 4.37Å; I71-L102 HydrophobicContact CD1-CD2 3.79Å; P78-L102 WeakPolarHBondContact CB-O 3.3Å; P78-L102 WeakPolarHBondContact CG-O 3.49Å; V82-L102 HydrophobicContact CG2-CD1 3.89Å; I93-L102 HydrophobicContact CD1-CD1 4.43Å; Y98-L102 WeakPolarHBondContact O-CB 3.49Å; Y98-L102 WeakPolarHBondContact O-CG 3.38Å; Y98-L102 PolarHBondContact O-N 2.95Å; L99-L102 PolarHBondContact O-N 2.93Å
103	Q	98.3	Very high	97	Very high	89 Å²	89	62.3 Å²	62.3	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-77.3	-40.3	-175.3	-171.3	65.6	36.4	0	0	113.3	L99 D100 D101	L99-Q103 VanDerWaalsContact O-CB 3.3Å; L99-Q103 WeakPolarHBondContact O-CB 3.33Å; L99-Q103 PolarHBondContact O-N 2.78Å; D100-Q103 PolarHBondContact O-N 2.99Å; D101-Q103 VanDerWaalsContact C-N 3.31Å; D101-Q103 PolarHBondContact O-N 2.92Å
104	H	97.9	Very high	96.7	Very high	149 Å²	149	67.4 Å²	67.4	69%	0.69	35%	0.348	S	S	*	.	H	α-helix	trans	-124.5	-10.8	-168.9	-49	106.3	0	0	0	113.9	D100	D100-H104 WeakPolarHBondContact O-CB 3.35Å; D100-H104 PolarHBondContact O-N 3.16Å; D100-H104 PolarHBondContact O-ND1 3.09Å
105	G	96.6	Very high	96.4	Very high	21 Å²	21	66.2 Å²	66.2	22%	0.216	34%	0.343	C	S	.	.	S	Bend	trans	-71	154.6	-179.9	0	0	0	0	0	112.2	D101	D101-G105 WeakPolarHBondContact O-CA 3.28Å; D101-G105 PolarHBondContact O-N 2.9Å
106	P	96.6	Very high	95.7	Very high	93 Å²	93	68.7 Å²	68.7	60%	0.604	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-65.4	149.6	-179.6	27	-34.4	0	0	0	111.4	R108	P106-R108 VanDerWaalsContact CD-NH1 3.29Å; P106-R108 PolarHBondContact O-N 3.35Å; P106-R108 PolarHBondContact O-NH1 3.47Å
107	K	94.6	Very high	94.7	Very high	134 Å²	134	67.5 Å²	67.5	58%	0.583	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-58.3	127.6	169.5	-177.7	168.4	179.2	154.8	0	109.5	D72	D72-K107 HydrophobicContact CB-CG 4.36Å; D72-K107 WeakPolarHBondContact O-CE 3.38Å; D72-K107 PolarHBondContact O-NZ 3.14Å
108	R	96.9	Very high	93.9	Very high	28 Å²	28	69.3 Å²	69.3	11%	0.106	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-81	146.6	177.6	-49.4	-54.2	-156.8	-103.7	-1.1	110.1	D27 I30 K34 D72 D101 P106	D27-R108 WeakPolarHBondContact OD1-CD 3.17Å; D27-R108 IonicContact OD1-CZ 2.67Å; D27-R108 IonicContact OD1-NE 3.38Å; D27-R108 PolarHBondContact OD1-NE 3.05Å; I30-R108 HydrophobicContact CD1-CG 3.89Å; I30-R108 HydrophobicContact CG2-CB 4.27Å; I30-R108 HydrophobicContact CG2-CG 4.35Å; K34-R108 PolarHBondContact NZ-O 3.19Å; D72-R108 PolarHBondContact OD1-N 3.25Å; D72-R108 WeakPolarHBondContact OD2-CB 3.47Å; D72-R108 PolarHBondContact OD2-N 3.19Å; D101-R108 IonicContact OD1-CZ 3.31Å; D101-R108 IonicContact OD1-NH1 2.84Å; D101-R108 PolarHBondContact OD1-NH1 3.37Å; D101-R108 IonicContact OD1-NH2 3.93Å; D101-R108 PolarHBondContact OD1-NH2 3.03Å; D101-R108 IonicContact OD2-CZ 2.69Å; D101-R108 IonicContact OD2-NH1 3.68Å; D101-R108 IonicContact OD2-NH2 3.88Å; P106-R108 VanDerWaalsContact CD-NH1 3.29Å; P106-R108 PolarHBondContact O-N 3.35Å; P106-R108 PolarHBondContact O-NH1 3.47Å
109	S	96.4	Very high	93.4	Very high	76 Å²	76	75.1 Å²	75.1	53%	0.531	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-56.3	145.5	-179.6	-172.4	0	0	0	0	111.8	K34 V111	K34-S109 PolarHBondContact NZ-O 3.33Å; S109-V111 WeakPolarHBondContact OG-CB 3.38Å; S109-V111 WeakPolarHBondContact OG-CG2 3.08Å; S109-V111 PolarHBondContact OG-N 2.73Å; S109-V111 VanDerWaalsContact OG-N 3.09Å
110	N	96.5	Very high	93.1	Very high	44 Å²	44	75 Å²	75	24%	0.235	39%	0.386	C	S	.	.			trans	-103.4	0.7	169.3	-66.6	-16.6	0	0	0	111.5	K34 D72 G112 M113	K34-N110 WeakPolarHBondContact CE-OD1 3.4Å; K34-N110 PolarHBondContact NZ-OD1 2.82Å; D72-N110 PolarHBondContact O-ND2 3.31Å; N110-G112 PolarHBondContact O-N 3.31Å; N110-M113 HydrophobicContact CB-SD 3.93Å; N110-M113 WeakPolarHBondContact O-CB 3.32Å; N110-M113 VanDerWaalsContact O-CG 3.3Å; N110-M113 WeakPolarHBondContact O-CG 3.12Å; N110-M113 PolarHBondContact O-N 2.89Å
111	V	96.2	Very high	92.9	Very high	117 Å²	117	76.1 Å²	76.1	71%	0.709	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	129.8	178.6	175.4	0	0	0	0	109.9	S109	S109-V111 WeakPolarHBondContact OG-CB 3.38Å; S109-V111 WeakPolarHBondContact OG-CG2 3.08Å; S109-V111 PolarHBondContact OG-N 2.73Å; S109-V111 VanDerWaalsContact OG-N 3.09Å
112	G	93.4	Very high	92.7	Very high	8 Å²	8	82.1 Å²	82.1	8%	0.082	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	14.2	179.5	0	0	0	0	0	113.7	R35 N110 E114 E115	R35-G112 PolarHBondContact NE-O 2.81Å; R35-G112 PolarHBondContact NH2-O 3.22Å; N110-G112 PolarHBondContact O-N 3.31Å; G112-E114 PolarHBondContact O-N 3.22Å; G112-E115 WeakPolarHBondContact O-CB 3.18Å; G112-E115 PolarHBondContact O-N 2.63Å
113	M	94.2	Very high	92.5	Very high	20 Å²	20	82.1 Å²	82.1	10%	0.099	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.3	177	67.3	-174.6	-65.3	0	0	113.9	H38 V73 N110	H38-M113 HydrophobicContact CB-CE 3.91Å; H38-M113 PolarHBondContact ND1-O 3.21Å; V73-M113 HydrophobicContact CG1-CE 4.21Å; N110-M113 HydrophobicContact CB-SD 3.93Å; N110-M113 WeakPolarHBondContact O-CB 3.32Å; N110-M113 VanDerWaalsContact O-CG 3.3Å; N110-M113 WeakPolarHBondContact O-CG 3.12Å; N110-M113 PolarHBondContact O-N 2.89Å
114	E	91.7	Very high	92.2	Very high	115 Å²	115	82.7 Å²	82.7	54%	0.537	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-12.9	177.8	-55.5	81.3	-178.5	0	0	113.2	G112	G112-E114 PolarHBondContact O-N 3.22Å
115	E	90.5	Very high	91.8	Very high	112 Å²	112	77.1 Å²	77.1	52%	0.523	39%	0.392	S	S	.	.			trans	-73.6	148.1	-178.9	-67.8	172.7	-145.5	0	0	112.7	R35 G112	R35-E115 IonicContact CZ-OE2 3.91Å; R35-E115 IonicContact NH1-OE2 3.51Å; R35-E115 PolarHBondContact NH1-OE2 3Å; R35-E115 IonicContact NH2-OE1 3.92Å; R35-E115 PolarHBondContact NH2-OE1 2.97Å; R35-E115 IonicContact NH2-OE2 4Å; R35-E115 PolarHBondContact NH2-OE2 2.67Å; G112-E115 WeakPolarHBondContact O-CB 3.18Å; G112-E115 PolarHBondContact O-N 2.63Å
116	F	80.9	Confident	90.7	Very high	122 Å²	122	81.8 Å²	81.8	54%	0.535	42%	0.416	S	S	.	.			trans	-99	111.6	177.6	-67.8	-92.2	0	0	0	110.8	R39 R42	R39-F116 HydrophobicContact CG-CE1 4.13Å; R42-F116 VanDerWaalsContact NH1-CZ 3.34Å
117	E	78.5	Confident	88.9	Confident	88 Å²	88	85.8 Å²	85.8	41%	0.411	43%	0.427	S	S	.	.			trans	-93	-44.5	175.5	-70.2	-176.6	163.2	0	0	113	Q28 S32 R35	Q28-E117 PolarHBondContact NE2-OE1 2.7Å; S32-E117 VanDerWaalsContact CB-OE2 3.28Å; S32-E117 WeakPolarHBondContact CB-OE2 3.49Å; S32-E117 PolarHBondContact OG-OE2 3.4Å; R35-E117 IonicContact CZ-OE1 3.38Å; R35-E117 IonicContact NE-OE1 2.78Å; R35-E117 VanDerWaalsContact NH1-CD 3.3Å; R35-E117 VanDerWaalsContact NH1-CG 3.26Å; R35-E117 IonicContact NH1-OE1 3.4Å; R35-E117 PolarHBondContact NH1-OE1 3.38Å
118	Q	80.3	Confident	86.9	Confident	98 Å²	98	85.3 Å²	85.3	46%	0.458	42%	0.421	S	S	.	.			trans	-146.3	134.8	-169.7	-173.4	168.8	82	0	0	111.3	R39	R39-Q118 PolarHBondContact NH1-O 3.08Å
119	E	88.3	Confident	84.3	Confident	121 Å²	121	88.7 Å²	88.7	57%	0.565	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-74.8	131.1	169.1	-78.9	-57.8	129	0	0	110.7	R39 Q121	R39-E119 IonicContact CZ-OE1 3.63Å; R39-E119 VanDerWaalsContact CZ-OE1 3.23Å; R39-E119 IonicContact CZ-OE2 3.58Å; R39-E119 IonicContact NH1-OE1 3.53Å; R39-E119 PolarHBondContact NH1-OE1 3.37Å; R39-E119 IonicContact NH1-OE2 2.8Å; R39-E119 IonicContact NH2-OE1 2.86Å; R39-E119 PolarHBondContact NH2-OE1 3.47Å; R39-E119 IonicContact NH2-OE2 3.23Å; R39-E119 PolarHBondContact NH2-OE2 2.88Å; E119-Q121 PolarHBondContact O-N 2.81Å
120	P	92.4	Very high	81.8	Confident	39 Å²	39	89.9 Å²	89.9	25%	0.253	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-58.2	133.1	173.6	-22.7	32.6	0	0	0	112	L13 V15	L13-P120 HydrophobicContact CB-CB 3.82Å; L13-P120 HydrophobicContact CD1-CB 4.28Å; L13-P120 HydrophobicContact CG-CB 4.47Å; V15-P120 HydrophobicContact CG2-CB 3.88Å; V15-P120 HydrophobicContact CG2-CG 3.87Å
121	Q	93.8	Very high	79.9	Confident	98 Å²	98	90.7 Å²	90.7	46%	0.458	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	135.6	178.9	-60	-175.2	-59	0	0	110.5	L5 L13 C14 E119	L5-Q121 HydrophobicContact CD1-CB 3.84Å; L5-Q121 HydrophobicContact CD1-CG 4.5Å; L5-Q121 HydrophobicContact CD2-CB 3.89Å; L13-Q121 CarbonylContact C-O 3.36Å; L13-Q121 WeakPolarHBondContact CA-O 3.34Å; C14-Q121 PolarHBondContact N-O 3.22Å; C14-Q121 PolarHBondContact O-N 3.28Å; E119-Q121 PolarHBondContact O-N 2.81Å
122	R	95.1	Very high	77.6	Confident	149 Å²	149	88.9 Å²	88.9	56%	0.562	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	139.1	177	-168.9	167.6	-70.6	-89.9	1.8	110.9	Q10 L13	Q10-R122 VanDerWaalsContact O-CD 3.29Å; Q10-R122 WeakPolarHBondContact O-CD 3.28Å; Q10-R122 WeakPolarHBondContact O-CG 3.33Å; Q10-R122 PolarHBondContact O-NH1 3.3Å; L13-R122 HydrophobicContact CD2-CB 4.23Å; L13-R122 HydrophobicContact CD2-CG 4.5Å
123	G	93.4	Very high	75.3	Confident	3 Å²	3	90.9 Å²	90.9	3%	0.031	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-55.9	152.3	170.6	0	0	0	0	0	112.1	L8 Q10 L12	L8-G123 CarbonylContact O-C 3.52Å; L8-G123 VanDerWaalsContact O-C 3.27Å; L8-G123 VanDerWaalsContact O-CA 3.24Å; L8-G123 WeakPolarHBondContact O-CA 3.19Å; Q10-G123 WeakPolarHBondContact CA-O 3.44Å; Q10-G123 VanDerWaalsContact CG-O 3.28Å; Q10-G123 WeakPolarHBondContact CG-O 3.38Å; L12-G123 PolarHBondContact O-N 3.4Å
124	Q	92.9	Very high	73	Confident	102 Å²	102	93.5 Å²	93.5	48%	0.477	49%	0.493	S	S	.	.			trans	-121.5	5.4	-172.7	-65.5	179.7	-23.2	0	0	112.9	L5 L8 V126	L5-Q124 HydrophobicContact CB-CB 4.4Å; L5-Q124 HydrophobicContact CB-CG 4.06Å; L5-Q124 PolarHBondContact O-N 2.79Å; L8-Q124 PolarHBondContact O-N 2.92Å; Q124-V126 WeakPolarHBondContact O-CG2 3.36Å; Q124-V126 PolarHBondContact O-N 3.45Å
125	A	89.4	Confident	70.9	Confident	31 Å²	31	95.4 Å²	95.4	26%	0.256	50%	0.499	S	S	.	.	B	Isolated β-bridge	trans	-65.8	106.3	179.3	0	0	0	0	0	110.5	Q6 L8 Q127	Q6-A125 WeakPolarHBondContact O-CA 3.47Å; Q6-A125 VanDerWaalsContact O-CB 3.25Å; Q6-A125 WeakPolarHBondContact O-CB 3.31Å; L8-A125 VanDerWaalsContact C-CB 3.48Å; L8-A125 WeakPolarHBondContact O-CB 3.38Å; L8-A125 PolarHBondContact O-N 3.44Å; A125-Q127 PolarHBondContact O-N 3.31Å
126	V	72.8	Confident	68.8	Low	119 Å²	119	94 Å²	94	72%	0.721	50%	0.502	S	S	*	.			trans	-88.8	83.7	176.5	-168.9	0	0	0	0	108.3	Q124	Q124-V126 WeakPolarHBondContact O-CG2 3.36Å; Q124-V126 PolarHBondContact O-N 3.45Å
127	Q	59.5	Low	67.1	Low	178 Å²	178	97.4 Å²	97.4	83%	0.832	51%	0.512	S	S	*	.			trans	64.7	142.2	177.1	-54.8	-166	19.3	0	0	117.7	A125	A125-Q127 PolarHBondContact O-N 3.31Å
128	R	51.5	Low	65.7	Low	124 Å²	124	98.5 Å²	98.5	47%	0.468	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-74.3	130.6	173.8	-175.6	178.8	-178.7	158.6	-6.2	109	R193 W194	R128-R193 VanDerWaalsContact NH2-CD 3.3Å; R128-R193 VanDerWaalsContact NH2-CZ 3.32Å; R128-W194 PolarHBondContact NH1-O 2.92Å
129	P	42.6	Very low	64.1	Low	99 Å²	99	99.7 Å²	99.7	64%	0.643	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-55.8	132.4	169.5	-20.8	29.7	0	0	0	109.7	V131	P129-V131 PolarHBondContact O-N 2.89Å
130	P	44.4	Very low	62	Low	101 Å²	101	102 Å²	102	66%	0.656	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-58.4	132.2	178.9	19.4	-28.1	0	0	0	109.9	A132 A133	P130-A132 PolarHBondContact O-N 3.2Å; P130-A133 PolarHBondContact O-N 3.06Å
131	V	55.7	Low	59.8	Low	61 Å²	61	105.1 Å²	105.1	37%	0.37	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-15.7	-169.7	-176.5	0	0	0	0	113.3	P129 F135	P129-V131 PolarHBondContact O-N 2.89Å; V131-F135 HydrophobicContact CG1-CE2 3.95Å; V131-F135 VanDerWaalsContact O-CD2 3.29Å; V131-F135 WeakPolarHBondContact O-CD2 3.38Å; V131-F135 WeakPolarHBondContact O-CE2 3.36Å
132	A	49	Very low	57.5	Low	79 Å²	79	108.1 Å²	108.1	65%	0.653	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-23	-178.1	0	0	0	0	0	115.2	P130	P130-A132 PolarHBondContact O-N 3.2Å
133	A	45.2	Very low	55	Low	50 Å²	50	108.9 Å²	108.9	41%	0.413	56%	0.559	S	S	.	*	H	α-helix	trans	-82.3	-21.2	-172.2	0	0	0	0	0	114.2	P130	P130-A133 PolarHBondContact O-N 3.06Å
134	S	45.3	Very low	52.5	Low	75 Å²	75	116.6 Å²	116.6	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-84.9	-26.8	-173.3	-48.3	0	0	0	0	113.7	S136	S134-S136 VanDerWaalsContact C-N 3.35Å
135	F	46.6	Very low	50.1	Low	154 Å²	154	115.5 Å²	115.5	68%	0.675	59%	0.592	S	S	*	*	H	α-helix	trans	-75.6	-24.9	177.9	-64.7	-74.6	0	0	0	112.9	V131	V131-F135 HydrophobicContact CG1-CE2 3.95Å; V131-F135 VanDerWaalsContact O-CD2 3.29Å; V131-F135 WeakPolarHBondContact O-CD2 3.38Å; V131-F135 WeakPolarHBondContact O-CE2 3.36Å
136	S	46.2	Very low	48.1	Very low	84 Å²	84	120.7 Å²	120.7	59%	0.587	61%	0.61	S	S	*	*	H	α-helix	trans	-85.3	-26.1	-176.9	-57.6	0	0	0	0	113.6	S134	S134-S136 VanDerWaalsContact C-N 3.35Å
137	R	46.5	Very low	46.8	Very low	193 Å²	193	126.1 Å²	126.1	73%	0.728	62%	0.618	S	S	*	*	H	α-helix	trans	-77.5	-42.7	-178.8	-72.1	-173.7	-176.8	-162.5	1.2	112.1	H139 R140	R137-H139 PolarHBondContact O-N 3.13Å; R137-R140 PolarHBondContact O-N 3.15Å
138	V	48.9	Very low	46.1	Very low	111 Å²	111	129.2 Å²	129.2	67%	0.673	62%	0.622	S	S	*	*	H	α-helix	trans	-67.6	-35.2	-176.7	-172.6	0	0	0	0	112.2
139	H	46.3	Very low	45.5	Very low	123 Å²	123	127 Å²	127	57%	0.569	64%	0.637	S	S	*	*	H	α-helix	trans	-73.7	-27.2	178.5	-163.5	-37	0	0	0	112.9	R137 Y143	R137-H139 PolarHBondContact O-N 3.13Å; H139-Y143 AromaticContact CE1-CD2 3.47Å; H139-Y143 VanDerWaalsContact CE1-CD2 3.47Å; H139-Y143 WeakPolarHBondContact CE1-CD2 3.46Å; H139-Y143 AromaticContact CE1-CE2 3.35Å; H139-Y143 WeakPolarHBondContact CE1-CE2 3.29Å; H139-Y143 AromaticContact ND1-CD2 3.64Å; H139-Y143 AromaticContact ND1-CE2 3.98Å
140	R	43.6	Very low	45.2	Very low	170 Å²	170	125.5 Å²	125.5	64%	0.642	64%	0.64	S	S	*	*	H	α-helix	trans	-74.6	-32.9	-176.9	-158.7	175.5	-167.2	172	4.1	112.6	R137 R144	R137-R140 PolarHBondContact O-N 3.15Å; R140-R144 WeakPolarHBondContact O-CB 3.47Å; R140-R144 PolarHBondContact O-N 3.35Å
141	D	46.8	Very low	45.1	Very low	103 Å²	103	126.8 Å²	126.8	55%	0.551	65%	0.648	S	S	*	*	H	α-helix	trans	-78.7	-25.9	-177.5	-65.3	-32.8	0	0	0	112.8	S145	D141-S145 PolarHBondContact O-OG 2.9Å
142	Y	45.9	Very low	44.2	Very low	161 Å²	161	129.6 Å²	129.6	63%	0.631	67%	0.671	S	S	*	*	H	α-helix	trans	-71.9	-37.5	175.8	-159.4	-96.8	0	0	0	112.8	S145	Y142-S145 PolarHBondContact O-OG 2.99Å
143	Y	42.8	Very low	43.8	Very low	165 Å²	165	135 Å²	135	65%	0.647	68%	0.682	S	S	*	*	H	α-helix	trans	-83.5	-23.6	177.9	-90.8	-91.4	0	0	0	114	H139	H139-Y143 AromaticContact CE1-CD2 3.47Å; H139-Y143 VanDerWaalsContact CE1-CD2 3.47Å; H139-Y143 WeakPolarHBondContact CE1-CD2 3.46Å; H139-Y143 AromaticContact CE1-CE2 3.35Å; H139-Y143 WeakPolarHBondContact CE1-CE2 3.29Å; H139-Y143 AromaticContact ND1-CD2 3.64Å; H139-Y143 AromaticContact ND1-CE2 3.98Å
144	R	40	Very low	43.3	Very low	165 Å²	165	143.6 Å²	143.6	62%	0.623	70%	0.703	S	S	*	*	H	α-helix	trans	-76.6	-26.4	-179.4	-175.9	173	-92.6	-174.7	-9.4	112.8	R140 H146	R140-R144 WeakPolarHBondContact O-CB 3.47Å; R140-R144 PolarHBondContact O-N 3.35Å; R144-H146 VanDerWaalsContact C-N 3.32Å; R144-H146 PolarHBondContact O-N 2.87Å
145	S	43.2	Very low	42.8	Very low	80 Å²	80	145.2 Å²	145.2	56%	0.559	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-3.7	-179.5	41.2	0	0	0	0	114.2	D141 Y142	D141-S145 PolarHBondContact O-OG 2.9Å; Y142-S145 PolarHBondContact O-OG 2.99Å
146	H	48.3	Very low	42.4	Very low	139 Å²	139	145.5 Å²	145.5	64%	0.644	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	7.7	179.4	-65.1	-2.5	0	0	0	114.5	R144	R144-H146 VanDerWaalsContact C-N 3.32Å; R144-H146 PolarHBondContact O-N 2.87Å
147	R	44.4	Very low	42.2	Very low	234 Å²	234	147.3 Å²	147.3	88%	0.883	73%	0.728	S	S	*	*	S	Bend	trans	-120.9	0.7	-179.9	-89.1	-162.7	-176.2	-155.8	4	116.9
148	R	45.6	Very low	41.6	Very low	243 Å²	243	147.7 Å²	147.7	92%	0.917	73%	0.731	S	S	*	*	S	Bend	trans	-140.5	103.8	175.4	-76.3	-169.9	-172.4	-113.4	2	111.7
149	G	37.7	Very low	41.1	Very low	77 Å²	77	147.6 Å²	147.6	79%	0.794	73%	0.732	S	S	*	*			trans	164.7	52.4	170.2	0	0	0	0	0	113.9
150	G	37.5	Very low	41.1	Very low	67 Å²	67	147.8 Å²	147.8	69%	0.691	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-69.7	147.8	160.3	0	0	0	0	0	109.9	S152	G150-S152 PolarHBondContact O-N 2.69Å
151	P	41.1	Very low	41	Very low	128 Å²	128	146.9 Å²	146.9	83%	0.831	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-82.7	117.4	-171.2	28.7	-25.5	0	0	0	111.1
152	S	37.2	Very low	40.8	Very low	121 Å²	121	148 Å²	148	85%	0.846	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-88.3	126.1	170.5	-77.9	0	0	0	0	111.2	G150	G150-S152 PolarHBondContact O-N 2.69Å
153	H	40	Very low	40.4	Very low	192 Å²	192	142.9 Å²	142.9	89%	0.889	75%	0.752	S	S	*	*			trans	-42.7	132.4	173.3	-63.7	-98	0	0	0	114.3
154	R	35.2	Very low	40.2	Very low	230 Å²	230	143.3 Å²	143.3	87%	0.868	76%	0.759	S	S	*	*			trans	-128.1	117.4	157.4	-156.5	173.9	-142.9	-151.1	3.3	109.4
155	S	35.9	Very low	40.5	Very low	109 Å²	109	142.3 Å²	142.3	76%	0.762	77%	0.771	S	S	*	*			trans	-77	127.4	-177.6	37.7	0	0	0	0	112.3
156	H	37.2	Very low	40.5	Very low	161 Å²	161	144.3 Å²	144.3	75%	0.745	78%	0.782	S	S	*	*			trans	-140.4	149.6	158.5	-80.2	-66.6	0	0	0	110.3
157	P	41.6	Very low	40.5	Very low	122 Å²	122	149.4 Å²	149.4	79%	0.792	80%	0.796	S	S	*	*			trans	-92.3	147.3	-161.1	20	-3.7	0	0	0	113.6
158	Y	34.3	Very low	40.5	Very low	201 Å²	201	143.7 Å²	143.7	79%	0.788	79%	0.789	S	S	*	*			trans	-79.5	158.7	178.7	-97	-91	0	0	0	113.7
159	P	38.6	Very low	40.6	Very low	109 Å²	109	138 Å²	138	71%	0.708	78%	0.784	S	S	*	*			trans	-121.4	166	133.2	22	-3	0	0	0	112.3
160	P	45.5	Very low	41.3	Very low	127 Å²	127	142.8 Å²	142.8	83%	0.825	79%	0.79	S	S	*	*			trans	-88	157.6	-144.3	34.3	-35	0	0	0	116
161	Q	41.7	Very low	41.7	Very low	151 Å²	151	147.9 Å²	147.9	71%	0.706	80%	0.801	S	S	*	*			trans	-67.1	167.2	177.5	-68.6	-99.1	1.5	0	0	113.8
162	P	42.4	Very low	42	Very low	125 Å²	125	146.5 Å²	146.5	81%	0.812	80%	0.8	S	S	*	*				-131.4	109	117.7	29.8	-14.8	0	0	0	113.2
163	A	38.5	Very low	42.7	Very low	55 Å²	55	151.1 Å²	151.1	46%	0.455	80%	0.799	S	S	.	*				62.7	133.7	118.8	0	0	0	0	0	122.9
164	H	38.9	Very low	42.9	Very low	174 Å²	174	147.3 Å²	147.3	81%	0.806	79%	0.791	S	S	*	*			trans	86.3	107.2	152.9	-39.6	-63	0	0	0	118.5
165	T	45.3	Very low	43.6	Very low	143 Å²	143	142.4 Å²	142.4	88%	0.877	79%	0.789	S	S	*	*				-173.3	151.8	117.8	33.8	0	0	0	0	111.1
166	P	42.9	Very low	44.2	Very low	122 Å²	122	144.7 Å²	144.7	79%	0.792	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-90.7	145	-167.4	8.9	10.4	0	0	0	113.6
167	R	48.6	Very low	44.6	Very low	246 Å²	246	144.9 Å²	144.9	93%	0.928	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-62.6	140.5	169.8	-96.8	174.3	153.3	-179.6	-5.9	112.3
168	P	45.2	Very low	45.1	Very low	114 Å²	114	143.9 Å²	143.9	74%	0.74	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-88.4	160.3	161.2	34	-27.9	0	0	0	111.8
169	P	48.4	Very low	45.7	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.6	158.6	-164.7	32.5	-32.8	0	0	0	113.7	L171	P169-L171 PolarHBondContact O-N 3.48Å
170	L	51.5	Low	46	Very low	178 Å²	178	142.4 Å²	142.4	93%	0.932	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62	116.6	179.4	-62.6	167.7	0	0	0	111.4
171	L	46.7	Very low	46.1	Very low	174 Å²	174	142.6 Å²	142.6	91%	0.911	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-76.4	126.6	161.8	-76.5	171	0	0	0	109.5	P169	P169-L171 PolarHBondContact O-N 3.48Å
172	A	47.6	Very low	46.4	Very low	98 Å²	98	143 Å²	143	81%	0.81	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.5	133.4	178.7	0	0	0	0	0	111.6
173	R	51.3	Low	46.6	Very low	218 Å²	218	141 Å²	141	82%	0.823	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-65.6	134.2	168.9	-91.6	162.8	63	173.4	-0.8	109.7
174	P	44.7	Very low	47	Very low	113 Å²	113	143.8 Å²	143.8	73%	0.734	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-70.9	157.9	169.3	11.7	-1.7	0	0	0	111.2
175	P	49.1	Very low	47.2	Very low	127 Å²	127	141 Å²	141	83%	0.825	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-70.6	145.1	-174.7	29.9	-32.4	0	0	0	111.3	L177	P175-L177 PolarHBondContact O-N 2.74Å
176	L	47.9	Very low	47.1	Very low	156 Å²	156	140 Å²	140	82%	0.817	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.4	116.6	178.8	-66.4	165.4	0	0	0	110.2	A178	L176-A178 PolarHBondContact O-N 3.29Å
177	L	47	Very low	47	Very low	166 Å²	166	138.6 Å²	138.6	87%	0.869	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-64.5	128.2	157.8	-81.6	165.8	0	0	0	108.3	P175 Q179	P175-L177 PolarHBondContact O-N 2.74Å; L177-Q179 PolarHBondContact O-N 3.07Å
178	A	50.7	Low	46.5	Very low	101 Å²	101	134 Å²	134	84%	0.835	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.6	120.7	177.3	0	0	0	0	0	110.1	L176	L176-A178 PolarHBondContact O-N 3.29Å
179	Q	47.9	Very low	46	Very low	169 Å²	169	138.3 Å²	138.3	79%	0.79	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.7	138.8	172.2	-59.8	-171.6	16.9	0	0	109.4	L177	L177-Q179 PolarHBondContact O-N 3.07Å
180	P	45.1	Very low	45.6	Very low	110 Å²	110	138.6 Å²	138.6	71%	0.714	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.3	156.4	171.6	30.7	-32.7	0	0	0	110.1	L182	P180-L182 PolarHBondContact O-N 3.22Å
181	P	47	Very low	44.9	Very low	130 Å²	130	135.3 Å²	135.3	84%	0.844	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-62.6	124.2	-175.8	24.5	-31.2	0	0	0	110.4	A183	P181-A183 PolarHBondContact O-N 3.4Å; P181-A183 VanDerWaalsContact O-N 3.11Å
182	L	46.9	Very low	44.4	Very low	160 Å²	160	135.5 Å²	135.5	84%	0.838	78%	0.777	S	S	*	*			trans	-55.4	113.1	172.5	-78.9	154.6	0	0	0	109.4	P180	P180-L182 PolarHBondContact O-N 3.22Å
183	A	48.5	Very low	43.9	Very low	83 Å²	83	137.5 Å²	137.5	69%	0.686	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-60.1	141.1	164.7	0	0	0	0	0	109.3	P181	P181-A183 PolarHBondContact O-N 3.4Å; P181-A183 VanDerWaalsContact O-N 3.11Å
184	P	46.9	Very low	43	Very low	114 Å²	114	138 Å²	138	74%	0.74	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-62.2	144.6	176.2	26.2	-32.4	0	0	0	109.9
185	P	42.5	Very low	42.6	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-60.7	145.7	178.9	25.6	-33	0	0	0	110.2	A187	P185-A187 PolarHBondContact O-N 2.79Å
186	P	42.5	Very low	41.9	Very low	121 Å²	121	134.4 Å²	134.4	79%	0.786	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-59.6	137.5	177.2	25.6	-32.3	0	0	0	109.2	L188	P186-L188 PolarHBondContact O-N 3.3Å; P186-L188 VanDerWaalsContact O-N 3.16Å
187	A	40.8	Very low	41.3	Very low	93 Å²	93	135.3 Å²	135.3	77%	0.769	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-51.4	123.5	177.9	0	0	0	0	0	109.6	P185 F189	P185-A187 PolarHBondContact O-N 2.79Å; A187-F189 PolarHBondContact O-N 2.95Å
188	L	38.7	Very low	40.7	Very low	148 Å²	148	132.4 Å²	132.4	78%	0.775	74%	0.738	S	S	*	*			trans	-51.1	106	172.1	-72.1	166	0	0	0	109.1	P186 H190	P186-L188 PolarHBondContact O-N 3.3Å; P186-L188 VanDerWaalsContact O-N 3.16Å; L188-H190 VanDerWaalsContact CB-CE1 3.49Å; L188-H190 WeakPolarHBondContact CB-CE1 3.42Å; L188-H190 PolarHBondContact O-N 2.79Å; L188-H190 PolarHBondContact O-ND1 2.79Å
189	F	34.8	Very low	39.9	Very low	206 Å²	206	133.5 Å²	133.5	90%	0.904	74%	0.737	S	S	*	*			trans	-58.1	109	166.1	-113.3	-99.9	0	0	0	107.5	A187 P191	A187-F189 PolarHBondContact O-N 2.95Å; F189-P191 WeakPolarHBondContact O-CD 3.45Å
190	H	38.7	Very low	39.4	Very low	130 Å²	130	128.7 Å²	128.7	60%	0.602	73%	0.725	S	S	*	*			trans	-94.6	105.8	172.3	-74.6	40.2	0	0	0	107.2	L188 Y192	L188-H190 VanDerWaalsContact CB-CE1 3.49Å; L188-H190 WeakPolarHBondContact CB-CE1 3.42Å; L188-H190 PolarHBondContact O-N 2.79Å; L188-H190 PolarHBondContact O-ND1 2.79Å; H190-Y192 PolarHBondContact O-N 3.04Å
191	P	36.9	Very low	38.8	Very low	108 Å²	108	132.6 Å²	132.6	70%	0.701	73%	0.734	S	S	*	*	S	Bend	trans	-74.6	6.1	-172.4	28.5	-33.1	0	0	0	114.5	F189	F189-P191 WeakPolarHBondContact O-CD 3.45Å
192	Y	37.6	Very low	38.2	Very low	178 Å²	178	137.6 Å²	137.6	70%	0.698	74%	0.737	S	S	*	*			trans	-136.9	79.3	176.3	-62.7	-78.5	0	0	0	110.2	R89 H190	R89-Y192 PolarHBondContact NH2-OH 3.49Å; H190-Y192 PolarHBondContact O-N 3.04Å
193	R	36.2	Very low	37.3	Very low	140 Å²	140	141.6 Å²	141.6	53%	0.528	74%	0.74	S	S	.	*			trans	-137.9	95.1	168.7	-160.9	178.1	-150.5	-155	2.3	108.8	R128 A195	R128-R193 VanDerWaalsContact NH2-CD 3.3Å; R128-R193 VanDerWaalsContact NH2-CZ 3.32Å; R193-A195 PolarHBondContact O-N 3.09Å
194	W	33.6	Very low	36.3	Very low	228 Å²	228	142 Å²	142	86%	0.864	74%	0.744	S	S	*	*			trans	-61.5	123.1	173	-169.9	-120	0	0	0	109.6	R128	R128-W194 PolarHBondContact NH1-O 2.92Å
195	A	35.3	Very low	35.7	Very low	54 Å²	54	142.5 Å²	142.5	45%	0.446	75%	0.747	S	S	.	*			trans	-146.3	124.3	170.3	0	0	0	0	0	107.5	R193	R193-A195 PolarHBondContact O-N 3.09Å
196	P	34	Very low	35	Very low	112 Å²	112	146 Å²	146	73%	0.727	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-72.2	131.5	174.7	25.7	-27	0	0	0	110
197	Q	35.8	Very low	34.3	Very low	174 Å²	174	145 Å²	145	81%	0.813	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.6	137	171.4	-64.6	-71.3	-7.5	0	0	109.3
198	P	33.7	Very low	33.8	Very low	105 Å²	105	148.5 Å²	148.5	68%	0.682	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-71.4	149.1	173.5	29	-31.9	0	0	0	111.1	A200	P198-A200 PolarHBondContact O-N 3.41Å
199	P	35	Very low	33.4	Very low	125 Å²	125	147.7 Å²	147.7	81%	0.812	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-71.7	120.2	-174.4	27.1	-31.6	0	0	0	111.2
200	A	36	Very low	33.2	Very low	67 Å²	67	145.9 Å²	145.9	55%	0.554	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-82.2	124.9	175.4	0	0	0	0	0	110.7	P198 W202	P198-A200 PolarHBondContact O-N 3.41Å; A200-W202 HydrophobicContact CB-CZ2 4.47Å; A200-W202 VanDerWaalsContact CB-NE1 3.28Å; A200-W202 PolarHBondContact O-N 2.9Å
201	Q	33.8	Very low	32.7	Very low	193 Å²	193	150.3 Å²	150.3	90%	0.902	77%	0.768	S	S	*	*			trans	-84.2	99.7	178.2	-41.4	174.6	32.5	0	0	107.8
202	W	33.7	Very low	32.4	Very low	235 Å²	235	149.8 Å²	149.8	89%	0.89	77%	0.767	S	S	*	*			trans	-101.9	111.6	178.8	-68	110.7	0	0	0	111.2	A200	A200-W202 HydrophobicContact CB-CZ2 4.47Å; A200-W202 VanDerWaalsContact CB-NE1 3.28Å; A200-W202 PolarHBondContact O-N 2.9Å
203	R	28.3	Very low	32.1	Very low	243 Å²	243	153 Å²	153	92%	0.917	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.1	166.6	-126.6	-174.9	-74.1	-128.6	0.5	108.5
204	A	28.2	Very low	31.9	Very low	93 Å²	93	155.3 Å²	155.3	77%	0.769	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-75.7	140.5	178	0	0	0	0	0	112.1
205	P	33	Very low	32.1	Very low	123 Å²	123	150.4 Å²	150.4	80%	0.799	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-99.8	155.4	163.1	12.9	6.6	0	0	0	112.9
206	H	27.7	Very low	32.6	Very low	189 Å²	189	153.1 Å²	153.1	88%	0.875	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-64.3	156.4	-171	-72.1	-98.3	0	0	0	115.7
207	S	28.9	Very low	32.4	Very low	102 Å²	102	155.7 Å²	155.7	71%	0.713	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-65.6	135.9	172.9	52.1	0	0	0	0	113.1
208	D	29.8	Very low	32.5	Very low	166 Å²	166	153 Å²	153	89%	0.888	81%	0.809	S	S	*	*			trans	-139.2	131.9	149.3	-95.1	-37.1	0	0	0	111.4
209	T	30.8	Very low	32.4	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	82%	0.815	S	S	*	*			trans	-82.1	136.3	-178.7	43.6	0	0	0	0	111.9
210	N	29.9	Very low	32.9	Very low	168 Å²	168	154.6 Å²	154.6	90%	0.898	81%	0.811	S	S	*	*			trans	-161.2	149.4	134.9	-139.6	-17.3	0	0	0	114.8
211	R	28.3	Very low	32.5	Very low	223 Å²	223	159.8 Å²	159.8	84%	0.842	82%	0.824	S	S	*	*			trans	-82.8	143.6	-166.1	-102.1	175.7	165.1	161.8	-4.6	115.6
212	S	31.3	Very low	32.2	Very low	97 Å²	97	162.3 Å²	162.3	68%	0.678	83%	0.825	S	S	*	*				58.5	123.8	126	-53.4	0	0	0	0	122.6
213	R	30.2	Very low	32.1	Very low	246 Å²	246	158.9 Å²	158.9	93%	0.928	82%	0.819	S	S	*	*				-174.2	127.9	114.4	-115.3	172.1	-88.1	-146.7	-2.9	113.1
214	H	32.4	Very low	32.6	Very low	188 Å²	188	152.4 Å²	152.4	87%	0.87	81%	0.808	S	S	*	*			trans	-106.6	162.7	163.1	-79.2	-69.3	0	0	0	109.7
215	P	38	Very low	32.7	Very low	124 Å²	124	153.5 Å²	153.5	81%	0.805	81%	0.81	S	S	*	*				-142.5	170.6	98.2	32.4	-13	0	0	0	114.9
216	P	46.1	Very low	32.7	Very low	112 Å²	112	157 Å²	157	73%	0.727	81%	0.813	S	S	*	*			trans	-105.8	175.5	-163.1	39.9	-31.3	0	0	0	114.8
217	L	30.4	Very low	32.7	Very low	165 Å²	165	152.4 Å²	152.4	86%	0.864	81%	0.807	S	S	*	*			trans	141.8	158.7	147.6	-76	161.9	0	0	0	111.9
218	P	36.8	Very low	32.8	Very low	119 Å²	119	154.8 Å²	154.8	77%	0.773	81%	0.811	S	S	*	*			cis	-122	160.4	-43	35.6	-19.9	0	0	0	112.7
219	D	32	Very low	33.1	Very low	152 Å²	152	153.7 Å²	153.7	81%	0.813	81%	0.805	S	S	*	*			trans	-78.1	161.9	167.1	-130.9	-0.8	0	0	0	109.7
220	P	44.7	Very low	33.4	Very low	110 Å²	110	154.6 Å²	154.6	71%	0.714	81%	0.805	S	S	*	*			cis	-144.9	148.6	32	38.4	-17.3	0	0	0	117.5
221	Q	27.4	Very low	33.5	Very low	177 Å²	177	157.2 Å²	157.2	83%	0.827	80%	0.802	S	S	*	*			trans	-173.3	123.3	139.3	-112.3	168.5	-6.3	0	0	113.6
222	W	28.8	Very low	33.9	Very low	245 Å²	245	151.2 Å²	151.2	93%	0.928	81%	0.809	S	S	*	*			trans	-58.2	126.1	172.2	-99.1	81.1	0	0	0	112.7
223	H	30.4	Very low	33.8	Very low	164 Å²	164	149.6 Å²	149.6	76%	0.759	81%	0.808	S	S	*	*			trans	-143.5	139.9	156.2	-86	-74	0	0	0	112.3
224	P	38.7	Very low	34.1	Very low	107 Å²	107	142.5 Å²	142.5	70%	0.695	80%	0.802	S	S	*	*			trans	-91.7	117.7	-173.3	34.5	-28.7	0	0	0	110.7
225	S	30.2	Very low	34.3	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	80%	0.801	S	S	*	*			trans	-165.4	116.7	167.6	-70.2	0	0	0	0	109.8
226	F	33	Very low	34.4	Very low	198 Å²	198	140.3 Å²	140.3	87%	0.868	80%	0.795	S	S	*	*			trans	-120.6	89.2	158.8	-120	-83.5	0	0	0	108.9
227	A	29.4	Very low	34	Very low	91 Å²	91	142.8 Å²	142.8	75%	0.752	80%	0.802	S	S	*	*			trans	-106.3	125.9	150	0	0	0	0	0	107.4
228	L	31.1	Very low	34.5	Very low	152 Å²	152	140.6 Å²	140.6	80%	0.796	79%	0.791	S	S	*	*			trans	73.6	100	154.6	-138.4	107.7	0	0	0	118.5
229	L	35.2	Very low	34.8	Very low	144 Å²	144	138.4 Å²	138.4	75%	0.754	78%	0.776	S	S	*	*			trans	-134.5	96.8	136.1	-82.6	179.7	0	0	0	110.5	R231	L229-R231 PolarHBondContact O-N 3.48Å
230	D	36.8	Very low	35.5	Very low	150 Å²	150	139.1 Å²	139.1	80%	0.802	77%	0.774	S	S	*	*			trans	-71.7	92.6	151.2	-167	8.2	0	0	0	107.3
231	R	32.6	Very low	36.1	Very low	223 Å²	223	137.9 Å²	137.9	84%	0.842	76%	0.756	S	S	*	*	S	Bend	trans	-171.1	98.7	164.3	-114.8	-177.1	-165.5	-129	2.7	109.7	L229 G233	L229-R231 PolarHBondContact O-N 3.48Å; R231-G233 PolarHBondContact O-N 3.37Å
232	G	37.4	Very low	37.5	Very low	96 Å²	96	133 Å²	133	99%	0.99	74%	0.741	S	S	*	*			trans	34.4	28.6	145.1	0	0	0	0	0	121.7
233	G	29	Very low	38.7	Very low	64 Å²	64	124.8 Å²	124.8	66%	0.66	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-95.2	135.2	176.3	0	0	0	0	0	110.7	R231	R231-G233 PolarHBondContact O-N 3.37Å
234	A	34.8	Very low	39.4	Very low	97 Å²	97	124 Å²	124	80%	0.802	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-48.7	144.7	171.6	0	0	0	0	0	111.2
235	L	37.5	Very low	39.9	Very low	160 Å²	160	125.3 Å²	125.3	84%	0.838	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-47.3	132.7	166.3	-76.9	162.4	0	0	0	108.1	N237	L235-N237 PolarHBondContact O-N 3.3Å
236	P	39.4	Very low	40.2	Very low	105 Å²	105	125.4 Å²	125.4	68%	0.682	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-54.8	133.3	174.8	22.8	-31.1	0	0	0	107.9	L238	P236-L238 PolarHBondContact O-N 2.87Å
237	N	38.1	Very low	40.3	Very low	164 Å²	164	121.5 Å²	121.5	88%	0.877	71%	0.705	S	S	*	*			trans	-49.5	107	174.2	-87.6	-25	0	0	0	107.9	L235	L235-N237 PolarHBondContact O-N 3.3Å
238	L	42.2	Very low	40.4	Very low	120 Å²	120	122.3 Å²	122.3	63%	0.628	70%	0.701	S	S	*	*			trans	-59	133.6	171.1	-70	168.4	0	0	0	106.1	P236 H240	P236-L238 PolarHBondContact O-N 2.87Å; L238-H240 PolarHBondContact O-N 2.93Å
239	P	43.1	Very low	40.4	Very low	72 Å²	72	119.5 Å²	119.5	47%	0.468	70%	0.7	S	S	.	*			trans	-53.6	115.2	175	20.8	-31.3	0	0	0	108.3	L84 Y241	L84-P239 HydrophobicContact CD1-CB 4.15Å; L84-P239 HydrophobicContact CD1-CG 3.58Å; P239-Y241 PolarHBondContact O-N 3.21Å
240	H	46	Very low	40.3	Very low	168 Å²	168	120.7 Å²	120.7	78%	0.778	71%	0.707	S	S	*	*			trans	-71.2	99.4	178.9	-167.2	-76.3	0	0	0	107.4	L238 S242	L238-H240 PolarHBondContact O-N 2.93Å; H240-S242 PolarHBondContact ND1-OG 2.87Å; H240-S242 VanDerWaalsContact ND1-OG 3.14Å; H240-S242 PolarHBondContact O-N 3.31Å
241	Y	56.8	Low	39.9	Very low	84 Å²	84	116.6 Å²	116.6	33%	0.329	70%	0.7	S	S	.	*			trans	-72.3	110.8	170.2	178.2	-113.8	0	0	0	108.2	L70 D74 M76 L84 P239 P243	L70-Y241 HydrophobicContact CD2-CE1 4Å; L70-Y241 HydrophobicContact CD2-CE2 4.5Å; D74-Y241 WeakPolarHBondContact CB-OH 3.08Å; D74-Y241 PolarHBondContact OD2-OH 3.16Å; M76-Y241 HydrophobicContact CE-CD2 3.62Å; M76-Y241 HydrophobicContact CE-CE2 3.2Å; L84-Y241 HydrophobicContact CD2-CD2 4.08Å; L84-Y241 HydrophobicContact CD2-CG 4.19Å; P239-Y241 PolarHBondContact O-N 3.21Å; Y241-P243 HydrophobicContact CE1-CB 3.95Å
242	S	56.2	Low	39.9	Very low	74 Å²	74	112.7 Å²	112.7	52%	0.517	70%	0.696	S	S	.	*			trans	-99.5	116.5	168.9	-63.9	0	0	0	0	107.8	H240	H240-S242 PolarHBondContact ND1-OG 2.87Å; H240-S242 VanDerWaalsContact ND1-OG 3.14Å; H240-S242 PolarHBondContact O-N 3.31Å
243	P	55.3	Low	39.7	Very low	73 Å²	73	120.3 Å²	120.3	47%	0.474	70%	0.695	S	S	.	*			trans	-72.3	139.3	179.3	29.2	-33.4	0	0	0	110.7	Y241 W245	Y241-P243 HydrophobicContact CE1-CB 3.95Å; P243-W245 PolarHBondContact O-N 2.78Å
244	N	45.7	Very low	39.9	Very low	147 Å²	147	122.3 Å²	122.3	79%	0.786	70%	0.699	S	S	*	*			trans	-83	38.3	-178.7	-73.7	-20	0	0	0	113.4	T246	N244-T246 VanDerWaalsContact C-N 3.33Å; N244-T246 PolarHBondContact O-N 2.76Å; N244-T246 VanDerWaalsContact O-N 3.07Å
245	W	48.3	Very low	39.8	Very low	135 Å²	135	121.9 Å²	121.9	51%	0.511	70%	0.695	S	S	.	*			trans	-85.2	74.4	176.7	-61.3	111.8	0	0	0	110.7	V73 D74 P243	V73-W245 HydrophobicContact CG1-CH2 3.46Å; V73-W245 VanDerWaalsContact CG1-CH2 3.46Å; V73-W245 HydrophobicContact CG1-CZ2 3.53Å; D74-W245 WeakPolarHBondContact OD1-CZ2 3.17Å; D74-W245 PolarHBondContact OD1-NE1 3.23Å; P243-W245 PolarHBondContact O-N 2.78Å
246	T	37.1	Very low	39.6	Very low	116 Å²	116	121.8 Å²	121.8	71%	0.712	70%	0.695	S	S	*	*			trans	-80.8	117.4	160.2	51.8	0	0	0	0	108.3	N244 V248	N244-T246 VanDerWaalsContact C-N 3.33Å; N244-T246 PolarHBondContact O-N 2.76Å; N244-T246 VanDerWaalsContact O-N 3.07Å; T246-V248 PolarHBondContact O-N 3.31Å
247	S	35.2	Very low	39.2	Very low	117 Å²	117	124.6 Å²	124.6	82%	0.818	71%	0.705	S	S	*	*			trans	-58.4	84.5	165.3	-78.8	0	0	0	0	109.8
248	V	30.2	Very low	38.8	Very low	107 Å²	107	127.5 Å²	127.5	65%	0.648	70%	0.703	S	S	*	*			trans	-104.4	103.8	157.7	-154.8	0	0	0	0	104.8	T246 N250	T246-V248 PolarHBondContact O-N 3.31Å; V248-N250 PolarHBondContact O-N 2.73Å
249	A	31.8	Very low	38.2	Very low	94 Å²	94	127.4 Å²	127.4	78%	0.777	71%	0.712	S	S	*	*			trans	-52	111.4	166.2	0	0	0	0	0	107.3	G251	A249-G251 PolarHBondContact O-N 2.84Å
250	N	32.7	Very low	37.8	Very low	169 Å²	169	130 Å²	130	90%	0.904	73%	0.727	S	S	*	*			trans	-70.3	74.9	162.6	-86.9	-25.1	0	0	0	107.3	V248	V248-N250 PolarHBondContact O-N 2.73Å
251	G	29	Very low	37.2	Very low	64 Å²	64	127.9 Å²	127.9	66%	0.66	73%	0.728	S	S	*	*			trans	-79.7	106	160.3	0	0	0	0	0	108.2	A249	A249-G251 PolarHBondContact O-N 2.84Å
252	D	32.3	Very low	35.9	Very low	141 Å²	141	131.6 Å²	131.6	75%	0.754	75%	0.754	S	S	*	*			trans	51.9	99.3	137.8	-152.2	9.8	0	0	0	118.3
253	R	32.9	Very low	34.8	Very low	255 Å²	255	135.9 Å²	135.9	96%	0.962	77%	0.77	S	S	*	*			trans	-142.4	78	148.7	-77	-165.7	176.3	170.1	-0.8	110.1
254	S	34	Very low	33.6	Very low	107 Å²	107	143 Å²	143	75%	0.748	79%	0.787	S	S	*	*			trans	-106.1	126.8	155.4	-91.1	0	0	0	0	110.4
255	A	32.3	Very low	32.9	Very low	87 Å²	87	143.2 Å²	143.2	72%	0.719	79%	0.789	S	S	*	*			trans	56.6	105.2	156	0	0	0	0	0	119.1
256	D	34.1	Very low	32.5	Very low	158 Å²	158	141.7 Å²	141.7	85%	0.845	80%	0.796	S	S	*	*				163.8	107.3	114.4	-86.8	-20.3	0	0	0	109.9
257	N	30.8	Very low	32.2	Very low	165 Å²	165	142.3 Å²	142.3	88%	0.882	80%	0.799	S	S	*	*			trans	-151.2	113.8	135.9	-129.9	-8.8	0	0	0	111.9
258	R	29	Very low	32.1	Very low	225 Å²	225	148.4 Å²	148.4	85%	0.849	81%	0.805	S	S	*	*			trans	-78	126.4	174.5	-163.8	-177.3	-158	170.3	5.1	107.5
259	S	30	Very low	32.3	Very low	117 Å²	117	149.2 Å²	149.2	82%	0.818	81%	0.81	S	S	*	*			trans	-159.3	84.2	161.3	-77.5	0	0	0	0	110.4
260	T	33.3	Very low	32.4	Very low	127 Å²	127	150.5 Å²	150.5	78%	0.779	81%	0.813	S	S	*	*			trans	-81.1	138.6	158	28.6	0	0	0	0	109.2
261	P	33.9	Very low	32.4	Very low	123 Å²	123	150.8 Å²	150.8	80%	0.799	81%	0.809	S	S	*	*			trans	-81.1	131.8	176.2	30.3	-28.9	0	0	0	110.8
262	N	29.1	Very low	32.6	Very low	162 Å²	162	158.1 Å²	158.1	87%	0.866	82%	0.817	S	S	*	*			trans	-90.3	105.3	-178.3	-152.3	-16.7	0	0	0	108.9
263	L	33.9	Very low	33.2	Very low	164 Å²	164	157.1 Å²	157.1	86%	0.859	82%	0.818	S	S	*	*			trans	-101.6	111.4	170.2	-97.5	156.5	0	0	0	109.1
264	R	30.1	Very low	33.4	Very low	222 Å²	222	149.8 Å²	149.8	84%	0.838	81%	0.806	S	S	*	*			trans	-61.4	136	165.1	-77.6	174.7	166.2	176.3	-4.8	110.6
265	N	31.4	Very low	33.6	Very low	152 Å²	152	149.6 Å²	149.6	81%	0.813	81%	0.811	S	S	*	*				169	165.2	113.8	-97.6	-7.7	0	0	0	113.5
266	P	40.3	Very low	34.1	Very low	103 Å²	103	152.9 Å²	152.9	67%	0.669	82%	0.816	S	S	*	*			trans	-117.3	174.2	-135.2	43.4	-35.1	0	0	0	116.4
267	V	30.6	Very low	34.3	Very low	129 Å²	129	156.9 Å²	156.9	78%	0.782	82%	0.82	S	S	*	*			trans	53.6	118.7	148.4	175	0	0	0	0	118.8
268	R	32	Very low	34.8	Very low	246 Å²	246	158.8 Å²	158.8	93%	0.928	82%	0.816	S	S	*	*				-162.1	124.7	121.8	-147.4	170.7	174.2	-167.1	-2.7	113.3
269	T	33.7	Very low	35.6	Very low	123 Å²	123	156 Å²	156	76%	0.755	82%	0.818	S	S	*	*			trans	-74.2	140.6	167.5	-14.9	0	0	0	0	110.5
270	S	35	Very low	36.5	Very low	121 Å²	121	153.7 Å²	153.7	85%	0.846	81%	0.812	S	S	*	*			trans	-143.5	134.4	153.3	60.2	0	0	0	0	110.6
271	Q	33.2	Very low	37	Very low	175 Å²	175	157.8 Å²	157.8	82%	0.818	84%	0.844	S	S	*	*			trans	-83.9	150.5	-167.2	-52.2	-178.4	1.8	0	0	113.3
272	R	33.5	Very low	37.2	Very low	218 Å²	218	159.5 Å²	159.5	82%	0.823	85%	0.846	S	S	*	*			trans	42	161.4	130.5	-83.3	-170	179.5	-158.2	0.3	121.1
273	P	44.2	Very low	37.6	Very low	121 Å²	121	159.4 Å²	159.4	79%	0.786	85%	0.845	S	S	*	*			cis	-141.4	177.6	27	33.8	-9.6	0	0	0	119
274	S	36.5	Very low	37.8	Very low	100 Å²	100	159.1 Å²	159.1	70%	0.699	84%	0.844	S	S	*	*			trans	-38.6	154.9	175.3	-47.6	0	0	0	0	120.9
275	A	38.5	Very low	38.3	Very low	103 Å²	103	155.4 Å²	155.4	85%	0.851	84%	0.844	S	S	*	*			trans	-155.4	122.1	132	0	0	0	0	0	111.6
276	N	43.4	Very low	38.7	Very low	157 Å²	157	155.6 Å²	155.6	84%	0.84	85%	0.846	S	S	*	*			trans	-91.2	139.9	159.2	-103.1	-1.6	0	0	0	107.6
277	R	37.9	Very low	38.6	Very low	242 Å²	242	159.1 Å²	159.1	91%	0.913	86%	0.858	S	S	*	*			trans	-175.1	143.2	131.5	-113.1	178.6	-147.1	151.6	7.3	114.1
278	Y	41.5	Very low	39.2	Very low	205 Å²	205	161.3 Å²	161.3	80%	0.804	86%	0.863	S	S	*	*			trans	-55.2	156	162.9	-65.7	-100.2	0	0	0	112.9
279	D	45.3	Very low	39.7	Very low	167 Å²	167	154.8 Å²	154.8	89%	0.893	86%	0.859	S	S	*	*				-166.8	139.7	120.5	-89.6	-32.6	0	0	0	110.8
280	G	48.6	Very low	40.2	Very low	68 Å²	68	157.4 Å²	157.4	70%	0.701	87%	0.867	S	S	*	*			trans	-104.6	161	164.4	0	0	0	0	0	110.6
281	C	45	Very low	40.7	Very low	212 Å²	212	160.7 Å²	160.7	100%	1.432	87%	0.869	S	S	*	*			trans	-153.9	0	148.8	-84.7	0	0	0	0	106.4

Retrieved 281 of 281 residues in 293.2 ms (Link to these results)

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