A0A077YZV7_TRITR Loading...

Cytosol aminopeptidase

Cytosolic metallopeptidase that catalyzes the removal of unsubstituted N-terminal hydrophobic amino acids from various peptides. The presence of Zn(2+) ions is essential for the peptidase activity, and the association with other cofactors can modulate the substrate spectificity of the enzyme. For instance, in the presence of Mn(2+), it displays a specific Cys-Gly hydrolyzing activity of Cys-Gly-S-conjugates. Involved in the metabolism of glutathione and in the degradation of glutathione S-conjugates, which may play a role in the control of the cell redox status.

AlphaFold DB , UniProt , Accession A0A077YZV7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 511 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	41.1	Very low	80.7	Confident	242 Å²	242	59.5 Å²	59.5	100%	1.192	36%	0.357	S	S	*	.				0	114	0	-71.8	-175.1	-95.5	0	0	106.6	S3	M1-S3 PolarHBondContact O-N 3.09Å
2	A	48.1	Very low	82	Confident	98 Å²	98	55.4 Å²	55.4	81%	0.81	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-57.6	132.7	172.4	0	0	0	0	0	107.5	G4	A2-G4 PolarHBondContact O-N 3.31Å; A2-G4 VanDerWaalsContact O-N 3.11Å
3	S	55.5	Low	83	Confident	113 Å²	113	54.2 Å²	54.2	79%	0.79	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-51.2	123.4	168.2	50	0	0	0	0	107.2	M1 R5	M1-S3 PolarHBondContact O-N 3.09Å; S3-R5 PolarHBondContact O-N 2.95Å
4	G	67.2	Low	83.6	Confident	46 Å²	46	53.8 Å²	53.8	47%	0.474	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-53.3	129.4	-172.3	0	0	0	0	0	110.6	A2 S6 T111	A2-G4 PolarHBondContact O-N 3.31Å; A2-G4 VanDerWaalsContact O-N 3.11Å; G4-S6 PolarHBondContact O-N 2.54Å; G4-T111 WeakPolarHBondContact CA-OG1 3.44Å
5	R	90.2	Very high	83.6	Confident	132 Å²	132	52.3 Å²	52.3	50%	0.498	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.7	175.2	-69.9	179.8	-176.7	169.9	0.3	108.1	S3 A108 V110 T111 E112	S3-R5 PolarHBondContact O-N 2.95Å; R5-A108 PolarHBondContact NH1-O 3.03Å; R5-V110 WeakPolarHBondContact O-CG1 3.49Å; R5-T111 PolarHBondContact N-OG1 3.09Å; R5-T111 PolarHBondContact O-N 3Å; R5-E112 PolarHBondContact O-N 2.88Å
6	S	95.8	Very high	82.9	Confident	23 Å²	23	60.9 Å²	60.9	16%	0.161	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	140.9	174.3	-70.7	0	0	0	0	110.9	G4 S67 E112	G4-S6 PolarHBondContact O-N 2.54Å; S6-S67 PolarHBondContact O-N 3.45Å; S6-E112 CarbonylContact C-O 3.46Å; S6-E112 VanDerWaalsContact CA-O 3.26Å; S6-E112 WeakPolarHBondContact CA-O 3.12Å
7	G	97.8	Very high	82	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	158.3	174	0	0	0	0	0	112.2	F68 E112 A113 F114	G7-F68 CarbonylContact C-O 3.58Å; G7-F68 VanDerWaalsContact CA-O 3.23Å; G7-F68 WeakPolarHBondContact CA-O 3.03Å; G7-E112 PolarHBondContact N-O 3.31Å; G7-A113 WeakPolarHBondContact O-CA 3.22Å; G7-F114 PolarHBondContact O-N 3.46Å
8	L	98.3	Very high	80.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.1	174.2	-179.9	68.4	0	0	0	109.4	L10 F33 Y66 F68 V69 A70 F114 Y154	L8-L10 HydrophobicContact CD1-CD2 4.4Å; L8-L10 HydrophobicContact CD2-CD1 3.8Å; L8-L10 HydrophobicContact CD2-CD2 4.01Å; L8-L10 HydrophobicContact CD2-CG 3.85Å; L8-L10 HydrophobicContact CG-CD1 4.4Å; L8-L10 HydrophobicContact CG-CD2 4.11Å; L8-L10 HydrophobicContact CG-CG 3.93Å; L8-F33 HydrophobicContact CD2-CB 4.48Å; L8-F33 HydrophobicContact CD2-CD1 4.23Å; L8-F33 HydrophobicContact CD2-CD2 3.42Å; L8-F33 VanDerWaalsContact CD2-CD2 3.42Å; L8-F33 HydrophobicContact CD2-CE1 4.32Å; L8-F33 HydrophobicContact CD2-CE2 3.54Å; L8-F33 HydrophobicContact CD2-CG 3.78Å; L8-F33 HydrophobicContact CD2-CZ 3.99Å; L8-Y66 HydrophobicContact CB-CD1 3.93Å; L8-Y66 HydrophobicContact CB-CD2 3.83Å; L8-Y66 HydrophobicContact CB-CE1 4.28Å; L8-Y66 HydrophobicContact CB-CE2 4.19Å; L8-Y66 HydrophobicContact CB-CG 3.69Å; L8-Y66 HydrophobicContact CD1-CE2 4.24Å; L8-Y66 HydrophobicContact CD2-CD2 3.79Å; L8-Y66 HydrophobicContact CD2-CE2 3.79Å; L8-Y66 HydrophobicContact CG-CD2 4.31Å; L8-Y66 HydrophobicContact CG-CE2 4.3Å; L8-F68 PolarHBondContact N-O 3.07Å; L8-V69 HydrophobicContact CB-CG1 4.47Å; L8-V69 HydrophobicContact CB-CG2 4.28Å; L8-V69 HydrophobicContact CD2-CG1 4.45Å; L8-V69 CarbonylContact O-C 3.49Å; L8-V69 VanDerWaalsContact O-CA 3.26Å; L8-V69 WeakPolarHBondContact O-CA 3.41Å; L8-A70 PolarHBondContact O-N 3.19Å; L8-F114 CarbonylContact C-O 3.6Å; L8-F114 WeakPolarHBondContact CA-O 3.48Å; L8-F114 HydrophobicContact CD1-CB 3.84Å; L8-Y154 HydrophobicContact CD1-CD1 3.75Å; L8-Y154 HydrophobicContact CD1-CD2 3.56Å; L8-Y154 HydrophobicContact CD1-CE1 4.02Å; L8-Y154 HydrophobicContact CD1-CE2 3.84Å; L8-Y154 HydrophobicContact CD1-CG 3.51Å
9	V	98.6	Very high	79.9	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.9	172.8	-175.1	0	0	0	0	109.1	A70 V72 I98 A101 L105 F114 I115 D116	V9-A70 WeakPolarHBondContact CA-O 3.32Å; V9-A70 HydrophobicContact CG2-CB 4.28Å; V9-V72 HydrophobicContact CG1-CG1 3.7Å; V9-V72 HydrophobicContact CG1-CG2 4.32Å; V9-I98 HydrophobicContact CB-CD1 4.48Å; V9-I98 HydrophobicContact CG1-CD1 3.51Å; V9-A101 HydrophobicContact CB-CB 4.45Å; V9-A101 HydrophobicContact CG1-CB 3.68Å; V9-A101 HydrophobicContact CG2-CB 3.84Å; V9-L105 HydrophobicContact CG2-CD1 3.45Å; V9-L105 VanDerWaalsContact CG2-CD1 3.45Å; V9-F114 PolarHBondContact N-O 3.02Å; V9-I115 HydrophobicContact CB-CD1 3.88Å; V9-I115 HydrophobicContact CG2-CD1 3.37Å; V9-D116 WeakPolarHBondContact O-CB 3.37Å; V9-D116 PolarHBondContact O-N 3.08Å
10	L	98.2	Very high	79.3	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.6	-173.3	-74.8	-176.2	0	0	0	111.5	L8 A29 S30 F33 F41 V69 A70 A71 V72 D116 Y154	L8-L10 HydrophobicContact CD1-CD2 4.4Å; L8-L10 HydrophobicContact CD2-CD1 3.8Å; L8-L10 HydrophobicContact CD2-CD2 4.01Å; L8-L10 HydrophobicContact CD2-CG 3.85Å; L8-L10 HydrophobicContact CG-CD1 4.4Å; L8-L10 HydrophobicContact CG-CD2 4.11Å; L8-L10 HydrophobicContact CG-CG 3.93Å; L10-A29 HydrophobicContact CD2-CB 4.35Å; L10-S30 WeakPolarHBondContact CB-OG 3.27Å; L10-F33 HydrophobicContact CD1-CB 3.76Å; L10-F33 HydrophobicContact CD1-CD1 3.3Å; L10-F33 HydrophobicContact CD1-CE1 4.04Å; L10-F33 HydrophobicContact CD1-CG 3.64Å; L10-F33 HydrophobicContact CD2-CB 4.36Å; L10-F41 HydrophobicContact CB-CE1 4.31Å; L10-F41 HydrophobicContact CB-CE2 4.47Å; L10-F41 HydrophobicContact CB-CZ 3.77Å; L10-F41 HydrophobicContact CD1-CD1 4.26Å; L10-F41 HydrophobicContact CD1-CD2 4.35Å; L10-F41 HydrophobicContact CD1-CE1 3.88Å; L10-F41 HydrophobicContact CD1-CE2 3.96Å; L10-F41 HydrophobicContact CD1-CG 4.48Å; L10-F41 HydrophobicContact CD1-CZ 3.7Å; L10-F41 HydrophobicContact CG-CZ 4.42Å; L10-V69 HydrophobicContact CB-CG1 4.49Å; L10-V69 HydrophobicContact CD1-CG1 3.75Å; L10-V69 HydrophobicContact CG-CG1 4.14Å; L10-A70 PolarHBondContact N-O 2.92Å; L10-A71 CarbonylContact O-C 3.55Å; L10-A71 WeakPolarHBondContact O-CA 3.38Å; L10-V72 PolarHBondContact O-N 2.66Å; L10-D116 HydrophobicContact CD2-CB 4.4Å; L10-Y154 HydrophobicContact CD2-CD1 4.28Å; L10-Y154 HydrophobicContact CD2-CE1 4.17Å
11	G	97.3	Very high	79.1	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	141.4	-177.5	0	0	0	0	0	114.3	T27 S30 D116	G11-T27 PolarHBondContact O-N 3.19Å; G11-T27 PolarHBondContact O-OG1 3.03Å; G11-S30 PolarHBondContact N-OG 3.21Å; G11-S30 WeakPolarHBondContact O-CB 3.36Å; G11-S30 PolarHBondContact O-OG 3.49Å; G11-D116 PolarHBondContact N-OD2 3.29Å
12	T	96.3	Very high	81.1	Confident	11 Å²	11	67.7 Å²	67.7	7%	0.067	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134	173.3	65.3	0	0	0	0	110	Q25 L26 L45 V72 L74	T12-Q25 CarbonylContact C-O 3.56Å; T12-Q25 WeakPolarHBondContact CA-O 3.48Å; T12-L26 HydrophobicContact CG2-CD2 3.76Å; T12-L45 HydrophobicContact CG2-CD1 3.87Å; T12-V72 PolarHBondContact N-O 3.3Å; T12-V72 PolarHBondContact OG1-O 2.68Å; T12-L74 PolarHBondContact O-N 2.87Å
13	F	95.2	Very high	82.9	Confident	39 Å²	39	66.1 Å²	66.1	17%	0.171	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	156.5	175.3	-62.4	-73.5	0	0	0	111.2	Q25 T27 L74 G75 M77	F13-Q25 VanDerWaalsContact CD2-O 3.28Å; F13-Q25 WeakPolarHBondContact CD2-O 3.24Å; F13-Q25 PolarHBondContact N-O 2.82Å; F13-Q25 WeakPolarHBondContact O-CB 3.44Å; F13-T27 HydrophobicContact CE2-CG2 3.81Å; F13-T27 HydrophobicContact CZ-CG2 4.14Å; F13-L74 HydrophobicContact CD1-CB 3.69Å; F13-L74 HydrophobicContact CD1-CD1 4.26Å; F13-L74 HydrophobicContact CE1-CB 3.72Å; F13-L74 HydrophobicContact CE1-CD1 3.73Å; F13-L74 HydrophobicContact CE1-CG 4.41Å; F13-L74 HydrophobicContact CE2-CD1 4.35Å; F13-L74 HydrophobicContact CZ-CD1 3.78Å; F13-G75 CarbonylContact C-O 3.53Å; F13-G75 WeakPolarHBondContact CA-O 3.47Å; F13-M77 HydrophobicContact CB-CB 4.17Å; F13-M77 HydrophobicContact CD1-CB 4.09Å; F13-M77 HydrophobicContact CD2-CB 4.28Å; F13-M77 HydrophobicContact CD2-CG 4.19Å; F13-M77 HydrophobicContact CD2-SD 4.35Å; F13-M77 HydrophobicContact CE2-CG 4.31Å; F13-M77 HydrophobicContact CG-CB 3.92Å; F13-M77 HydrophobicContact CG-CG 4.31Å
14	L	91	Very high	84.4	Confident	49 Å²	49	67.4 Å²	67.4	26%	0.257	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	145.1	170.8	-65.2	177.2	0	0	0	110.1	T50 G75	L14-T50 HydrophobicContact CD2-CG2 3.57Å; L14-G75 PolarHBondContact N-O 2.91Å
15	P	83	Confident	85.5	Confident	31 Å²	31	66.1 Å²	66.1	20%	0.201	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-67.4	152.7	173.1	24.8	-26	0	0	0	110.7	Q17 Q25	P15-Q17 WeakPolarHBondContact CB-O 3.15Å; P15-Q17 WeakPolarHBondContact CG-O 3.39Å; P15-Q17 PolarHBondContact O-N 2.85Å; P15-Q25 VanDerWaalsContact CG-NE2 3.33Å
16	E	73	Confident	85.6	Confident	190 Å²	190	60 Å²	60	89%	0.888	29%	0.293	S	S	*	.	S	Bend	trans	-70	-20.6	172.5	-66.3	-171.7	163.4	0	0	113.1
17	Q	67.2	Low	85.6	Confident	112 Å²	112	59.4 Å²	59.4	52%	0.523	29%	0.289	S	S	.	.	S	Bend	trans	-133.1	171.1	179.4	-67.3	179.8	-1.4	0	0	109.6	P15 R19	P15-Q17 WeakPolarHBondContact CB-O 3.15Å; P15-Q17 WeakPolarHBondContact CG-O 3.39Å; P15-Q17 PolarHBondContact O-N 2.85Å; Q17-R19 HydrophobicContact CB-CG 4Å; Q17-R19 PolarHBondContact O-N 2.72Å; Q17-R19 VanDerWaalsContact OE1-CZ 3.26Å
18	D	61.1	Low	85.3	Confident	185 Å²	185	66.8 Å²	66.8	99%	0.989	32%	0.321	S	S	*	.	S	Bend	trans	-70.8	52.2	172.3	-72.2	-37.2	0	0	0	112.1
19	R	63.2	Low	85.1	Confident	158 Å²	158	67 Å²	67	60%	0.596	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-94.5	154	177.2	-68.6	-177.8	-171.3	-168	3.2	110.3	Q17	Q17-R19 HydrophobicContact CB-CG 4Å; Q17-R19 PolarHBondContact O-N 2.72Å; Q17-R19 VanDerWaalsContact OE1-CZ 3.26Å
20	E	68.8	Low	85	Confident	147 Å²	147	67 Å²	67	69%	0.687	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-59.3	163.6	169.2	-68.3	-177.2	178.3	0	0	111.7	D22	E20-D22 PolarHBondContact O-N 2.85Å
21	A	74.2	Confident	84.9	Confident	19 Å²	19	70.5 Å²	70.5	16%	0.157	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-57.3	129.4	178.8	0	0	0	0	0	111.5	L42 L45 K46	A21-L42 HydrophobicContact CB-CD1 4.17Å; A21-L45 HydrophobicContact CB-CB 4.4Å; A21-K46 HydrophobicContact CB-CG 4.02Å; A21-K46 WeakPolarHBondContact O-CE 3.41Å
22	D	83.2	Confident	84.7	Confident	68 Å²	68	72.3 Å²	72.3	36%	0.364	35%	0.351	S	S	.	.			trans	-126.8	156.2	-178.6	-159.3	-5.5	0	0	0	110.7	E20 E24 Q25	E20-D22 PolarHBondContact O-N 2.85Å; D22-E24 PolarHBondContact O-N 3Å; D22-E24 VanDerWaalsContact O-N 3.13Å; D22-Q25 WeakPolarHBondContact O-CB 3.47Å; D22-Q25 PolarHBondContact O-N 3.45Å
23	I	85.7	Confident	84.7	Confident	66 Å²	66	71.8 Å²	71.8	34%	0.338	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-56.6	-30.1	178.8	-163	166.5	0	0	0	111.6	Q25 L26 K31 L42	I23-Q25 PolarHBondContact O-N 3.32Å; I23-L26 HydrophobicContact CG1-CD1 4.45Å; I23-L26 WeakPolarHBondContact O-CB 3.45Å; I23-L26 PolarHBondContact O-N 2.97Å; I23-L26 VanDerWaalsContact O-N 3.11Å; I23-K31 HydrophobicContact CG1-CG 4.2Å; I23-K31 WeakPolarHBondContact O-CE 3.44Å; I23-L42 HydrophobicContact CB-CD2 3.99Å
24	E	86.2	Confident	84.8	Confident	139 Å²	139	70.3 Å²	70.3	65%	0.65	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-61.8	-29.5	179	-64.3	-170.9	161.5	0	0	113.2	D22 L26	D22-E24 PolarHBondContact O-N 3Å; D22-E24 VanDerWaalsContact O-N 3.13Å; E24-L26 VanDerWaalsContact C-N 3.29Å; E24-L26 PolarHBondContact O-N 3.01Å
25	Q	90.4	Very high	85	Confident	20 Å²	20	73.1 Å²	73.1	9%	0.093	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-78.1	-13.6	178.3	-63.6	168.8	-38	0	0	113.7	T12 F13 P15 D22 I23	T12-Q25 CarbonylContact C-O 3.56Å; T12-Q25 WeakPolarHBondContact CA-O 3.48Å; F13-Q25 VanDerWaalsContact CD2-O 3.28Å; F13-Q25 WeakPolarHBondContact CD2-O 3.24Å; F13-Q25 PolarHBondContact N-O 2.82Å; F13-Q25 WeakPolarHBondContact O-CB 3.44Å; P15-Q25 VanDerWaalsContact CG-NE2 3.33Å; D22-Q25 WeakPolarHBondContact O-CB 3.47Å; D22-Q25 PolarHBondContact O-N 3.45Å; I23-Q25 PolarHBondContact O-N 3.32Å
26	L	94.1	Very high	85.6	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.016	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-76.8	137.7	-178.9	-61	-170.9	0	0	0	109.6	T12 I23 E24 K31 N34 F41 L42 L45	T12-L26 HydrophobicContact CG2-CD2 3.76Å; I23-L26 HydrophobicContact CG1-CD1 4.45Å; I23-L26 WeakPolarHBondContact O-CB 3.45Å; I23-L26 PolarHBondContact O-N 2.97Å; I23-L26 VanDerWaalsContact O-N 3.11Å; E24-L26 VanDerWaalsContact C-N 3.29Å; E24-L26 PolarHBondContact O-N 3.01Å; L26-K31 HydrophobicContact CB-CG 3.64Å; L26-K31 WeakPolarHBondContact O-CE 3.43Å; L26-K31 PolarHBondContact O-NZ 3.24Å; L26-N34 HydrophobicContact CD1-CB 4.08Å; L26-F41 HydrophobicContact CD1-CD1 4.29Å; L26-F41 HydrophobicContact CD1-CE1 4.44Å; L26-F41 HydrophobicContact CD2-CE1 3.99Å; L26-L42 HydrophobicContact CD1-CB 4.45Å; L26-L42 HydrophobicContact CD1-CD1 4.42Å; L26-L45 HydrophobicContact CD2-CD1 3.96Å
27	T	94.3	Very high	86.7	Confident	10 Å²	10	69.2 Å²	69.2	6%	0.061	34%	0.337	C	S	.	.			trans	-58.9	166	165.6	60.1	0	0	0	0	110.5	G11 F13 A29 S30 K31 L74 D116	G11-T27 PolarHBondContact O-N 3.19Å; G11-T27 PolarHBondContact O-OG1 3.03Å; F13-T27 HydrophobicContact CE2-CG2 3.81Å; F13-T27 HydrophobicContact CZ-CG2 4.14Å; T27-A29 VanDerWaalsContact C-N 3.27Å; T27-A29 PolarHBondContact O-N 3.29Å; T27-S30 PolarHBondContact O-N 3.21Å; T27-S30 VanDerWaalsContact O-N 3.17Å; T27-S30 VanDerWaalsContact OG1-CB 3.26Å; T27-S30 WeakPolarHBondContact OG1-CB 3.48Å; T27-S30 PolarHBondContact OG1-N 3.14Å; T27-S30 VanDerWaalsContact OG1-N 3.14Å; T27-S30 PolarHBondContact OG1-OG 3.05Å; T27-K31 WeakPolarHBondContact O-CG 3.3Å; T27-K31 PolarHBondContact O-N 2.75Å; T27-L74 HydrophobicContact CG2-CD1 3.57Å; T27-D116 WeakPolarHBondContact CB-OD2 3.17Å; T27-D116 PolarHBondContact OG1-OD2 2.98Å
28	F	92.6	Very high	88	Confident	155 Å²	155	67.3 Å²	67.3	68%	0.68	35%	0.348	S	S	*	.	H	α-helix	trans	-54.7	-44.2	175.4	-179.3	-100.5	0	0	0	112.3	K31 S32 V156	F28-K31 PolarHBondContact O-N 2.87Å; F28-S32 PolarHBondContact O-N 3.39Å; F28-S32 VanDerWaalsContact O-N 3.08Å; F28-V156 HydrophobicContact CD1-CB 4.3Å; F28-V156 HydrophobicContact CD1-CG1 4.44Å; F28-V156 HydrophobicContact CE1-CB 3.87Å; F28-V156 HydrophobicContact CE1-CG1 3.71Å; F28-V156 HydrophobicContact CZ-CG1 4.31Å
29	A	93.7	Very high	89.6	Confident	5 Å²	5	59.8 Å²	59.8	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-42.9	177.1	0	0	0	0	0	112.6	L10 T27 K31 S32 F33 D116 Y154 V156	L10-A29 HydrophobicContact CD2-CB 4.35Å; T27-A29 VanDerWaalsContact C-N 3.27Å; T27-A29 PolarHBondContact O-N 3.29Å; A29-K31 VanDerWaalsContact C-N 3.35Å; A29-K31 PolarHBondContact O-N 3.34Å; A29-S32 PolarHBondContact O-N 3.35Å; A29-F33 PolarHBondContact O-N 3.17Å; A29-D116 HydrophobicContact CB-CB 4.15Å; A29-Y154 HydrophobicContact CB-CD1 3.87Å; A29-Y154 HydrophobicContact CB-CE1 4.07Å; A29-V156 HydrophobicContact CB-CG2 4.1Å
30	S	95.9	Very high	91.1	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.3	-39	175.8	-68.9	0	0	0	0	113	L10 G11 T27 N34	L10-S30 WeakPolarHBondContact CB-OG 3.27Å; G11-S30 PolarHBondContact N-OG 3.21Å; G11-S30 WeakPolarHBondContact O-CB 3.36Å; G11-S30 PolarHBondContact O-OG 3.49Å; T27-S30 PolarHBondContact O-N 3.21Å; T27-S30 VanDerWaalsContact O-N 3.17Å; T27-S30 VanDerWaalsContact OG1-CB 3.26Å; T27-S30 WeakPolarHBondContact OG1-CB 3.48Å; T27-S30 PolarHBondContact OG1-N 3.14Å; T27-S30 VanDerWaalsContact OG1-N 3.14Å; T27-S30 PolarHBondContact OG1-OG 3.05Å; S30-N34 VanDerWaalsContact O-CB 3.26Å; S30-N34 WeakPolarHBondContact O-CB 3.35Å; S30-N34 PolarHBondContact O-N 3.31Å
31	K	95.6	Very high	92.4	Very high	73 Å²	73	50 Å²	50	32%	0.317	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-49.1	174.5	-72.2	173.1	176.4	159.9	0	110.8	I23 L26 T27 F28 A29 F33 N34 D35	I23-K31 HydrophobicContact CG1-CG 4.2Å; I23-K31 WeakPolarHBondContact O-CE 3.44Å; L26-K31 HydrophobicContact CB-CG 3.64Å; L26-K31 WeakPolarHBondContact O-CE 3.43Å; L26-K31 PolarHBondContact O-NZ 3.24Å; T27-K31 WeakPolarHBondContact O-CG 3.3Å; T27-K31 PolarHBondContact O-N 2.75Å; F28-K31 PolarHBondContact O-N 2.87Å; A29-K31 VanDerWaalsContact C-N 3.35Å; A29-K31 PolarHBondContact O-N 3.34Å; K31-F33 VanDerWaalsContact C-N 3.35Å; K31-F33 PolarHBondContact O-N 3.26Å; K31-N34 WeakPolarHBondContact O-CB 3.46Å; K31-N34 PolarHBondContact O-N 2.66Å; K31-N34 VanDerWaalsContact O-N 3.16Å; K31-D35 PolarHBondContact O-N 2.74Å
32	S	94.9	Very high	93.4	Very high	39 Å²	39	49.9 Å²	49.9	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-61.1	-42.3	178.8	-173.7	0	0	0	0	112.8	F28 A29 N34 D35 E36 V156	F28-S32 PolarHBondContact O-N 3.39Å; F28-S32 VanDerWaalsContact O-N 3.08Å; A29-S32 PolarHBondContact O-N 3.35Å; S32-N34 VanDerWaalsContact C-N 3.34Å; S32-D35 PolarHBondContact O-N 3.2Å; S32-E36 PolarHBondContact O-N 2.71Å; S32-V156 VanDerWaalsContact CB-CG1 3.45Å; S32-V156 WeakPolarHBondContact OG-CG1 3.32Å
33	F	96.1	Very high	93.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.2	-35.9	176.8	-178	-99.5	0	0	0	112.1	L8 L10 A29 K31 D35 E36 T37 F41 L62 N63 Y66 V69	L8-F33 HydrophobicContact CD2-CB 4.48Å; L8-F33 HydrophobicContact CD2-CD1 4.23Å; L8-F33 HydrophobicContact CD2-CD2 3.42Å; L8-F33 VanDerWaalsContact CD2-CD2 3.42Å; L8-F33 HydrophobicContact CD2-CE1 4.32Å; L8-F33 HydrophobicContact CD2-CE2 3.54Å; L8-F33 HydrophobicContact CD2-CG 3.78Å; L8-F33 HydrophobicContact CD2-CZ 3.99Å; L10-F33 HydrophobicContact CD1-CB 3.76Å; L10-F33 HydrophobicContact CD1-CD1 3.3Å; L10-F33 HydrophobicContact CD1-CE1 4.04Å; L10-F33 HydrophobicContact CD1-CG 3.64Å; L10-F33 HydrophobicContact CD2-CB 4.36Å; A29-F33 PolarHBondContact O-N 3.17Å; K31-F33 VanDerWaalsContact C-N 3.35Å; K31-F33 PolarHBondContact O-N 3.26Å; F33-D35 VanDerWaalsContact C-N 3.31Å; F33-D35 PolarHBondContact O-N 3.47Å; F33-E36 PolarHBondContact O-N 3.18Å; F33-T37 HydrophobicContact CD1-CG2 4.26Å; F33-T37 HydrophobicContact CE1-CG2 3.76Å; F33-T37 HydrophobicContact CE2-CG2 4.02Å; F33-T37 HydrophobicContact CZ-CG2 3.63Å; F33-T37 WeakPolarHBondContact O-CG2 3.26Å; F33-T37 PolarHBondContact O-N 3.18Å; F33-T37 PolarHBondContact O-OG1 3.12Å; F33-F41 HydrophobicContact CD1-CB 4.08Å; F33-F41 HydrophobicContact CD1-CD2 4.43Å; F33-F41 HydrophobicContact CD1-CG 4.11Å; F33-F41 HydrophobicContact CE1-CB 4.24Å; F33-F41 HydrophobicContact CE1-CD2 4.42Å; F33-F41 HydrophobicContact CE1-CG 4.41Å; F33-L62 HydrophobicContact CE1-CB 4.3Å; F33-L62 HydrophobicContact CE1-CD1 4.19Å; F33-L62 HydrophobicContact CZ-CB 4.27Å; F33-N63 HydrophobicContact CZ-CB 4.41Å; F33-Y66 AromaticContact CE2-CD2 3.89Å; F33-Y66 HydrophobicContact CE2-CD2 3.89Å; F33-Y66 HydrophobicContact CE2-CE2 4.18Å; F33-V69 HydrophobicContact CE1-CG1 4.37Å; F33-V69 HydrophobicContact CE1-CG2 4.03Å; F33-V69 HydrophobicContact CZ-CG2 3.82Å
34	N	96.8	Very high	94.3	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-43.4	173.5	-179.1	73.8	0	0	0	111.4	L26 S30 K31 S32 T37 G38 G39 F41 L42	L26-N34 HydrophobicContact CD1-CB 4.08Å; S30-N34 VanDerWaalsContact O-CB 3.26Å; S30-N34 WeakPolarHBondContact O-CB 3.35Å; S30-N34 PolarHBondContact O-N 3.31Å; K31-N34 WeakPolarHBondContact O-CB 3.46Å; K31-N34 PolarHBondContact O-N 2.66Å; K31-N34 VanDerWaalsContact O-N 3.16Å; S32-N34 VanDerWaalsContact C-N 3.34Å; N34-T37 CarbonylContact O-C 3.59Å; N34-T37 PolarHBondContact O-N 2.85Å; N34-T37 PolarHBondContact O-OG1 2.86Å; N34-T37 VanDerWaalsContact O-OG1 3.14Å; N34-G38 PolarHBondContact O-N 2.99Å; N34-G39 PolarHBondContact O-N 2.78Å; N34-G39 WeakPolarHBondContact OD1-CA 3.32Å; N34-G39 PolarHBondContact OD1-O 3.25Å; N34-F41 HydrophobicContact CB-CB 4.28Å; N34-F41 HydrophobicContact CB-CD1 4.26Å; N34-L42 WeakPolarHBondContact OD1-CB 3.35Å; N34-L42 PolarHBondContact OD1-N 3.49Å
35	D	95.5	Very high	94.5	Very high	108 Å²	108	42.6 Å²	42.6	58%	0.578	24%	0.243	S	C	*	.	H	α-helix	trans	-67.4	-42	178	-63.9	-15.5	0	0	0	111.5	K31 S32 F33 T37 G38	K31-D35 PolarHBondContact O-N 2.74Å; S32-D35 PolarHBondContact O-N 3.2Å; F33-D35 VanDerWaalsContact C-N 3.31Å; F33-D35 PolarHBondContact O-N 3.47Å; D35-T37 PolarHBondContact O-N 3.01Å; D35-G38 PolarHBondContact O-N 3.45Å
36	E	94.3	Very high	94.5	Very high	116 Å²	116	46.2 Å²	46.2	54%	0.542	26%	0.259	S	S	.	.	H	α-helix	trans	-57	-35.4	173.5	-173.1	-171.1	147.3	0	0	112	S32 F33	S32-E36 PolarHBondContact O-N 2.71Å; F33-E36 PolarHBondContact O-N 3.18Å
37	T	95.9	Very high	94.3	Very high	23 Å²	23	52 Å²	52	14%	0.141	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	12	179.6	58.6	0	0	0	0	113.8	F33 N34 D35 G39 K40 N63	F33-T37 HydrophobicContact CD1-CG2 4.26Å; F33-T37 HydrophobicContact CE1-CG2 3.76Å; F33-T37 HydrophobicContact CE2-CG2 4.02Å; F33-T37 HydrophobicContact CZ-CG2 3.63Å; F33-T37 WeakPolarHBondContact O-CG2 3.26Å; F33-T37 PolarHBondContact O-N 3.18Å; F33-T37 PolarHBondContact O-OG1 3.12Å; N34-T37 CarbonylContact O-C 3.59Å; N34-T37 PolarHBondContact O-N 2.85Å; N34-T37 PolarHBondContact O-OG1 2.86Å; N34-T37 VanDerWaalsContact O-OG1 3.14Å; D35-T37 PolarHBondContact O-N 3.01Å; T37-G39 VanDerWaalsContact C-N 3.29Å; T37-G39 PolarHBondContact O-N 2.91Å; T37-K40 VanDerWaalsContact O-CB 3.25Å; T37-K40 WeakPolarHBondContact O-CB 3.39Å; T37-K40 PolarHBondContact O-N 3.49Å; T37-N63 HydrophobicContact CG2-CB 4.11Å
38	G	94.9	Very high	93.8	Very high	73 Å²	73	56.5 Å²	56.5	75%	0.753	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	33.1	178	0	0	0	0	0	113.9	N34 D35	N34-G38 PolarHBondContact O-N 2.99Å; D35-G38 PolarHBondContact O-N 3.45Å
39	G	95	Very high	93.5	Very high	27 Å²	27	53.1 Å²	53.1	28%	0.278	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	0.1	-179.2	0	0	0	0	0	115.2	N34 T37 F41 L42 S43	N34-G39 PolarHBondContact O-N 2.78Å; N34-G39 WeakPolarHBondContact OD1-CA 3.32Å; N34-G39 PolarHBondContact OD1-O 3.25Å; T37-G39 VanDerWaalsContact C-N 3.29Å; T37-G39 PolarHBondContact O-N 2.91Å; G39-F41 VanDerWaalsContact C-N 3.33Å; G39-F41 PolarHBondContact O-N 2.79Å; G39-L42 PolarHBondContact O-N 3.18Å; G39-S43 WeakPolarHBondContact O-CB 3.26Å; G39-S43 PolarHBondContact O-N 3.17Å
40	K	95.4	Very high	93.2	Very high	99 Å²	99	56.2 Å²	56.2	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-38	-175.4	-168.5	180	-175.8	179.2	0	112.5	T37 S43 V44 G61 L62	T37-K40 VanDerWaalsContact O-CB 3.25Å; T37-K40 WeakPolarHBondContact O-CB 3.39Å; T37-K40 PolarHBondContact O-N 3.49Å; K40-S43 PolarHBondContact O-N 2.72Å; K40-V44 HydrophobicContact CG-CG2 4.47Å; K40-V44 WeakPolarHBondContact O-CG2 3.47Å; K40-V44 PolarHBondContact O-N 3.24Å; K40-G61 PolarHBondContact NZ-O 3.41Å; K40-L62 HydrophobicContact CD-CD2 4.15Å; K40-L62 HydrophobicContact CG-CD2 4Å
41	F	95.7	Very high	93.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-58.8	-54.9	178.6	177.2	-120.3	0	0	0	111.9	L10 L26 F33 N34 G39 S43 V44 L45 L59 L62 V69 A71	L10-F41 HydrophobicContact CB-CE1 4.31Å; L10-F41 HydrophobicContact CB-CE2 4.47Å; L10-F41 HydrophobicContact CB-CZ 3.77Å; L10-F41 HydrophobicContact CD1-CD1 4.26Å; L10-F41 HydrophobicContact CD1-CD2 4.35Å; L10-F41 HydrophobicContact CD1-CE1 3.88Å; L10-F41 HydrophobicContact CD1-CE2 3.96Å; L10-F41 HydrophobicContact CD1-CG 4.48Å; L10-F41 HydrophobicContact CD1-CZ 3.7Å; L10-F41 HydrophobicContact CG-CZ 4.42Å; L26-F41 HydrophobicContact CD1-CD1 4.29Å; L26-F41 HydrophobicContact CD1-CE1 4.44Å; L26-F41 HydrophobicContact CD2-CE1 3.99Å; F33-F41 HydrophobicContact CD1-CB 4.08Å; F33-F41 HydrophobicContact CD1-CD2 4.43Å; F33-F41 HydrophobicContact CD1-CG 4.11Å; F33-F41 HydrophobicContact CE1-CB 4.24Å; F33-F41 HydrophobicContact CE1-CD2 4.42Å; F33-F41 HydrophobicContact CE1-CG 4.41Å; N34-F41 HydrophobicContact CB-CB 4.28Å; N34-F41 HydrophobicContact CB-CD1 4.26Å; G39-F41 VanDerWaalsContact C-N 3.33Å; G39-F41 PolarHBondContact O-N 2.79Å; F41-S43 VanDerWaalsContact C-N 3.34Å; F41-S43 PolarHBondContact O-N 3.2Å; F41-V44 PolarHBondContact O-N 2.9Å; F41-L45 HydrophobicContact CD1-CD1 4.1Å; F41-L45 HydrophobicContact CD2-CD1 4.46Å; F41-L45 HydrophobicContact CD2-CG 4.49Å; F41-L45 HydrophobicContact CE1-CD1 3.63Å; F41-L45 HydrophobicContact CE2-CD1 4.04Å; F41-L45 HydrophobicContact CE2-CD2 4.4Å; F41-L45 HydrophobicContact CE2-CG 4.22Å; F41-L45 HydrophobicContact CZ-CD1 3.61Å; F41-L45 HydrophobicContact CZ-CG 4.27Å; F41-L45 WeakPolarHBondContact O-CG 3.17Å; F41-L45 PolarHBondContact O-N 3.14Å; F41-L59 HydrophobicContact CD2-CD1 3.94Å; F41-L59 HydrophobicContact CE2-CD1 3.79Å; F41-L62 HydrophobicContact CB-CD1 4.45Å; F41-L62 HydrophobicContact CD2-CD1 3.69Å; F41-V69 HydrophobicContact CD2-CG1 4.4Å; F41-V69 HydrophobicContact CE2-CG1 3.98Å; F41-A71 HydrophobicContact CE2-CB 4.04Å; F41-A71 HydrophobicContact CZ-CB 4.01Å
42	L	94.7	Very high	92.9	Very high	17 Å²	17	60.4 Å²	60.4	9%	0.089	35%	0.347	C	S	.	.	H	α-helix	trans	-63.4	-40	178.2	-178.3	61.1	0	0	0	111.9	A21 I23 L26 N34 G39 V44 L45 K46	A21-L42 HydrophobicContact CB-CD1 4.17Å; I23-L42 HydrophobicContact CB-CD2 3.99Å; L26-L42 HydrophobicContact CD1-CB 4.45Å; L26-L42 HydrophobicContact CD1-CD1 4.42Å; N34-L42 WeakPolarHBondContact OD1-CB 3.35Å; N34-L42 PolarHBondContact OD1-N 3.49Å; G39-L42 PolarHBondContact O-N 3.18Å; L42-V44 VanDerWaalsContact C-N 3.26Å; L42-V44 PolarHBondContact O-N 3.39Å; L42-L45 PolarHBondContact O-N 2.89Å; L42-K46 WeakPolarHBondContact O-CG 3.44Å; L42-K46 PolarHBondContact O-N 3.22Å
43	S	93.8	Very high	92.9	Very high	72 Å²	72	61 Å²	61	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-58.7	-38.8	176.1	178.7	0	0	0	0	112.3	G39 K40 F41 N47	G39-S43 WeakPolarHBondContact O-CB 3.26Å; G39-S43 PolarHBondContact O-N 3.17Å; K40-S43 PolarHBondContact O-N 2.72Å; F41-S43 VanDerWaalsContact C-N 3.34Å; F41-S43 PolarHBondContact O-N 3.2Å; S43-N47 PolarHBondContact O-ND2 3.31Å
44	V	93.5	Very high	92.8	Very high	34 Å²	34	61.3 Å²	61.3	21%	0.206	35%	0.352	C	S	.	.	H	α-helix	trans	-72.7	-40.1	176.9	170	0	0	0	0	111	K40 F41 L42 K46 N47 F48 L59 L62	K40-V44 HydrophobicContact CG-CG2 4.47Å; K40-V44 WeakPolarHBondContact O-CG2 3.47Å; K40-V44 PolarHBondContact O-N 3.24Å; F41-V44 PolarHBondContact O-N 2.9Å; L42-V44 VanDerWaalsContact C-N 3.26Å; L42-V44 PolarHBondContact O-N 3.39Å; V44-K46 VanDerWaalsContact C-N 3.29Å; V44-K46 PolarHBondContact O-N 3.1Å; V44-N47 WeakPolarHBondContact O-CB 3.28Å; V44-N47 PolarHBondContact O-N 3.17Å; V44-N47 VanDerWaalsContact O-N 3.09Å; V44-F48 HydrophobicContact CG1-CE2 3.8Å; V44-F48 WeakPolarHBondContact O-CD2 3.35Å; V44-F48 WeakPolarHBondContact O-CE2 3.39Å; V44-L59 HydrophobicContact CG1-CD1 4.03Å; V44-L59 HydrophobicContact CG1-CD2 3.75Å; V44-L59 HydrophobicContact CG1-CG 4.38Å; V44-L62 HydrophobicContact CB-CD2 4.39Å; V44-L62 HydrophobicContact CG2-CD2 3.92Å
45	L	91.6	Very high	92.7	Very high	14 Å²	14	64.4 Å²	64.4	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-59.2	-38.4	176.6	-72.9	177.8	0	0	0	112.9	T12 A21 L26 F41 L42 N47 F48 I51 L59 A71	T12-L45 HydrophobicContact CG2-CD1 3.87Å; A21-L45 HydrophobicContact CB-CB 4.4Å; L26-L45 HydrophobicContact CD2-CD1 3.96Å; F41-L45 HydrophobicContact CD1-CD1 4.1Å; F41-L45 HydrophobicContact CD2-CD1 4.46Å; F41-L45 HydrophobicContact CD2-CG 4.49Å; F41-L45 HydrophobicContact CE1-CD1 3.63Å; F41-L45 HydrophobicContact CE2-CD1 4.04Å; F41-L45 HydrophobicContact CE2-CD2 4.4Å; F41-L45 HydrophobicContact CE2-CG 4.22Å; F41-L45 HydrophobicContact CZ-CD1 3.61Å; F41-L45 HydrophobicContact CZ-CG 4.27Å; F41-L45 WeakPolarHBondContact O-CG 3.17Å; F41-L45 PolarHBondContact O-N 3.14Å; L42-L45 PolarHBondContact O-N 2.89Å; L45-N47 PolarHBondContact O-N 2.96Å; L45-N47 VanDerWaalsContact O-N 3.16Å; L45-F48 PolarHBondContact O-N 3.44Å; L45-I51 HydrophobicContact CD2-CD1 4.15Å; L45-L59 HydrophobicContact CD2-CD1 4.11Å; L45-A71 HydrophobicContact CD2-CB 3.63Å
46	K	90.5	Very high	92.7	Very high	95 Å²	95	60 Å²	60	41%	0.413	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.6	176	-74.6	178.8	172.6	-175.5	0	114	A21 L42 V44 F48	A21-K46 HydrophobicContact CB-CG 4.02Å; A21-K46 WeakPolarHBondContact O-CE 3.41Å; L42-K46 WeakPolarHBondContact O-CG 3.44Å; L42-K46 PolarHBondContact O-N 3.22Å; V44-K46 VanDerWaalsContact C-N 3.29Å; V44-K46 PolarHBondContact O-N 3.1Å; K46-F48 VanDerWaalsContact C-N 3.26Å; K46-F48 PolarHBondContact O-N 3.05Å
47	N	88.6	Confident	92.8	Very high	126 Å²	126	60.1 Å²	60.1	67%	0.674	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-7	177.3	-62.6	-35.7	0	0	0	113.4	S43 V44 L45	S43-N47 PolarHBondContact O-ND2 3.31Å; V44-N47 WeakPolarHBondContact O-CB 3.28Å; V44-N47 PolarHBondContact O-N 3.17Å; V44-N47 VanDerWaalsContact O-N 3.09Å; L45-N47 PolarHBondContact O-N 2.96Å; L45-N47 VanDerWaalsContact O-N 3.16Å
48	F	84.9	Confident	92.8	Very high	104 Å²	104	62.2 Å²	62.2	46%	0.456	35%	0.35	S	S	.	.	S	Bend	trans	-112.6	155	179.9	-62.8	-79	0	0	0	111.1	V44 L45 K46 L59	V44-F48 HydrophobicContact CG1-CE2 3.8Å; V44-F48 WeakPolarHBondContact O-CD2 3.35Å; V44-F48 WeakPolarHBondContact O-CE2 3.39Å; L45-F48 PolarHBondContact O-N 3.44Å; K46-F48 VanDerWaalsContact C-N 3.26Å; K46-F48 PolarHBondContact O-N 3.05Å; F48-L59 HydrophobicContact CD2-CD2 4.37Å; F48-L59 HydrophobicContact CE2-CD2 3.64Å; F48-L59 HydrophobicContact CZ-CD2 4.16Å
49	A	86.1	Confident	92.9	Very high	84 Å²	84	59.1 Å²	59.1	69%	0.694	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-61.1	146.6	162.5	0	0	0	0	0	110.1	I51	A49-I51 PolarHBondContact O-N 3.33Å
50	T	88.3	Confident	92.9	Very high	70 Å²	70	62 Å²	62	43%	0.429	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-46	132.1	177.9	-52.5	0	0	0	0	111.7	L14 K52	L14-T50 HydrophobicContact CD2-CG2 3.57Å; T50-K52 PolarHBondContact O-N 2.9Å
51	I	92.1	Very high	92.7	Very high	9 Å²	9	59.7 Å²	59.7	5%	0.046	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-70.2	117.4	-179.9	-50.4	-178.3	0	0	0	108.2	L45 A49 H55 R57 A71	L45-I51 HydrophobicContact CD2-CD1 4.15Å; A49-I51 PolarHBondContact O-N 3.33Å; I51-H55 HydrophobicContact CG2-CB 4.24Å; I51-H55 WeakPolarHBondContact CG2-O 3.28Å; I51-R57 HydrophobicContact CD1-CB 3.9Å; I51-R57 HydrophobicContact CD1-CG 3.82Å; I51-R57 HydrophobicContact CG1-CB 4.44Å; I51-R57 HydrophobicContact CG1-CG 3.8Å; I51-R57 HydrophobicContact CG2-CG 4.36Å; I51-A71 HydrophobicContact CD1-CB 3.5Å; I51-A71 VanDerWaalsContact CD1-CB 3.5Å; I51-A71 WeakPolarHBondContact CD1-O 3.21Å
52	K	92.9	Very high	92.6	Very high	152 Å²	152	60.2 Å²	60.2	66%	0.661	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-60.9	148.1	176.9	-67.9	-178.1	176.9	-177.7	0	110.4	T50 G54 H55	T50-K52 PolarHBondContact O-N 2.9Å; K52-G54 PolarHBondContact O-N 2.84Å; K52-H55 HydrophobicContact CB-CB 4.41Å; K52-H55 WeakPolarHBondContact O-CB 3.14Å; K52-H55 PolarHBondContact O-N 3.17Å
53	T	94.5	Very high	92.4	Very high	50 Å²	50	60.9 Å²	60.9	31%	0.307	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-49.7	134.5	174.4	-51	0	0	0	0	111.2	H55 G73 G75 N93	T53-H55 PolarHBondContact O-N 3.36Å; T53-H55 PolarHBondContact O-ND1 2.95Å; T53-G73 CarbonylContact C-O 3.45Å; T53-G73 WeakPolarHBondContact CA-O 3.5Å; T53-G75 VanDerWaalsContact OG1-CA 3.26Å; T53-G75 WeakPolarHBondContact OG1-CA 3.37Å; T53-N93 HydrophobicContact CG2-CB 3.93Å; T53-N93 VanDerWaalsContact CG2-OD1 3.31Å; T53-N93 WeakPolarHBondContact CG2-OD1 3.49Å
54	G	93.8	Very high	92.2	Very high	8 Å²	8	67.2 Å²	67.2	8%	0.082	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	1.4	179.6	0	0	0	0	0	115.1	K52 G73 A100	K52-G54 PolarHBondContact O-N 2.84Å; G54-G73 PolarHBondContact N-O 3.48Å; G54-A100 WeakPolarHBondContact O-CB 3.49Å
55	H	94.9	Very high	92.2	Very high	71 Å²	71	71.4 Å²	71.4	33%	0.329	38%	0.379	S	S	.	.			trans	-104.1	158.2	177.8	-64.5	63.5	0	0	0	111.5	I51 K52 T53 V72 G73	I51-H55 HydrophobicContact CG2-CB 4.24Å; I51-H55 WeakPolarHBondContact CG2-O 3.28Å; K52-H55 HydrophobicContact CB-CB 4.41Å; K52-H55 WeakPolarHBondContact O-CB 3.14Å; K52-H55 PolarHBondContact O-N 3.17Å; T53-H55 PolarHBondContact O-N 3.36Å; T53-H55 PolarHBondContact O-ND1 2.95Å; H55-V72 WeakPolarHBondContact O-CA 3.06Å; H55-G73 PolarHBondContact O-N 2.68Å
56	A	96.2	Very high	92.4	Very high	17 Å²	17	70.9 Å²	70.9	14%	0.14	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.6	176.1	0	0	0	0	0	112	A71 V72 A100 A101	A56-A71 CarbonylContact C-O 3.51Å; A56-A71 WeakPolarHBondContact CA-O 3.41Å; A56-V72 HydrophobicContact CB-CG1 3.99Å; A56-A100 HydrophobicContact CB-CB 4.22Å; A56-A101 HydrophobicContact CB-CB 3.97Å
57	R	95.9	Very high	92.6	Very high	117 Å²	117	68.9 Å²	68.9	44%	0.442	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.4	169.6	-68.1	-65.8	-175.8	-124.4	6	109.4	I51 A70 A71	I51-R57 HydrophobicContact CD1-CB 3.9Å; I51-R57 HydrophobicContact CD1-CG 3.82Å; I51-R57 HydrophobicContact CG1-CB 4.44Å; I51-R57 HydrophobicContact CG1-CG 3.8Å; I51-R57 HydrophobicContact CG2-CG 4.36Å; R57-A70 CarbonylContact O-C 3.55Å; R57-A70 WeakPolarHBondContact O-CA 3.46Å; R57-A71 PolarHBondContact N-O 3.3Å; R57-A71 PolarHBondContact O-N 2.8Å
58	L	96.3	Very high	93	Very high	67 Å²	67	64.8 Å²	64.8	35%	0.351	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.3	-179.7	-162.3	71.7	0	0	0	110.4	F68 A70 L105 A108	L58-F68 HydrophobicContact CD1-CB 3.75Å; L58-F68 HydrophobicContact CD1-CD1 4.32Å; L58-F68 HydrophobicContact CD1-CG 4.27Å; L58-F68 HydrophobicContact CD2-CD1 3.64Å; L58-F68 HydrophobicContact CD2-CE1 4.04Å; L58-F68 HydrophobicContact CD2-CG 4.15Å; L58-F68 HydrophobicContact CG-CB 4.18Å; L58-F68 HydrophobicContact CG-CD1 3.82Å; L58-F68 HydrophobicContact CG-CG 4.28Å; L58-A70 HydrophobicContact CD1-CB 4.21Å; L58-L105 HydrophobicContact CD1-CD2 3.62Å; L58-L105 HydrophobicContact CD1-CG 4.3Å; L58-A108 HydrophobicContact CD2-CB 3.59Å
59	L	96.3	Very high	93.7	Very high	9 Å²	9	59.9 Å²	59.9	5%	0.047	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	148.2	177.9	-49.6	178.4	0	0	0	108.8	F41 V44 L45 F48 L62 F68 V69 A71	F41-L59 HydrophobicContact CD2-CD1 3.94Å; F41-L59 HydrophobicContact CE2-CD1 3.79Å; V44-L59 HydrophobicContact CG1-CD1 4.03Å; V44-L59 HydrophobicContact CG1-CD2 3.75Å; V44-L59 HydrophobicContact CG1-CG 4.38Å; L45-L59 HydrophobicContact CD2-CD1 4.11Å; F48-L59 HydrophobicContact CD2-CD2 4.37Å; F48-L59 HydrophobicContact CE2-CD2 3.64Å; F48-L59 HydrophobicContact CZ-CD2 4.16Å; L59-L62 HydrophobicContact CB-CD1 3.91Å; L59-L62 HydrophobicContact CB-CG 4.35Å; L59-L62 HydrophobicContact CD1-CD1 3.92Å; L59-F68 CarbonylContact O-C 3.49Å; L59-F68 VanDerWaalsContact O-CA 3.31Å; L59-F68 WeakPolarHBondContact O-CA 3.45Å; L59-V69 HydrophobicContact CB-CB 4.49Å; L59-V69 WeakPolarHBondContact CB-O 3.04Å; L59-V69 PolarHBondContact N-O 2.86Å; L59-V69 PolarHBondContact O-N 3.32Å; L59-A71 HydrophobicContact CD1-CB 4.45Å
60	C	94.2	Very high	94.2	Very high	88 Å²	88	55.9 Å²	55.9	60%	0.595	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	160	178.8	63.2	0	0	0	0	111.4	L62 F68	C60-L62 VanDerWaalsContact C-N 3.28Å; C60-L62 PolarHBondContact O-N 2.73Å; C60-F68 HydrophobicContact CB-CD1 3.87Å; C60-F68 HydrophobicContact CB-CE1 3.93Å
61	G	91.3	Very high	94.7	Very high	49 Å²	49	52.6 Å²	52.6	51%	0.505	28%	0.275	S	S	.	.	S	Bend	trans	66.7	25.4	174.9	0	0	0	0	0	114.6	K40	K40-G61 PolarHBondContact NZ-O 3.41Å
62	L	94.2	Very high	95	Very high	11 Å²	11	52.1 Å²	52.1	6%	0.058	27%	0.273	C	S	.	.	S	Bend	trans	-81.2	-38	177.9	-64	-173.6	0	0	0	112.5	F33 K40 F41 V44 L59 C60 V69	F33-L62 HydrophobicContact CE1-CB 4.3Å; F33-L62 HydrophobicContact CE1-CD1 4.19Å; F33-L62 HydrophobicContact CZ-CB 4.27Å; K40-L62 HydrophobicContact CD-CD2 4.15Å; K40-L62 HydrophobicContact CG-CD2 4Å; F41-L62 HydrophobicContact CB-CD1 4.45Å; F41-L62 HydrophobicContact CD2-CD1 3.69Å; V44-L62 HydrophobicContact CB-CD2 4.39Å; V44-L62 HydrophobicContact CG2-CD2 3.92Å; L59-L62 HydrophobicContact CB-CD1 3.91Å; L59-L62 HydrophobicContact CB-CG 4.35Å; L59-L62 HydrophobicContact CD1-CD1 3.92Å; C60-L62 VanDerWaalsContact C-N 3.28Å; C60-L62 PolarHBondContact O-N 2.73Å; L62-V69 HydrophobicContact CB-CG2 4.33Å; L62-V69 HydrophobicContact CD1-CB 3.96Å; L62-V69 HydrophobicContact CD1-CG1 4.36Å; L62-V69 HydrophobicContact CD1-CG2 3.96Å
63	N	91.1	Very high	95.1	Very high	32 Å²	32	45 Å²	45	17%	0.171	24%	0.242	C	C	.	.			trans	-146.9	175.4	171.2	80.3	-18.6	0	0	0	111.2	F33 T37 K65 Y66	F33-N63 HydrophobicContact CZ-CB 4.41Å; T37-N63 HydrophobicContact CG2-CB 4.11Å; N63-K65 PolarHBondContact OD1-N 3.45Å; N63-Y66 WeakPolarHBondContact ND2-CD2 3.27Å; N63-Y66 WeakPolarHBondContact OD1-CB 3.4Å; N63-Y66 PolarHBondContact OD1-N 2.76Å; N63-Y66 PolarHBondContact OD1-O 2.82Å
64	E	89.6	Confident	95.2	Very high	204 Å²	204	42.8 Å²	42.8	95%	0.953	23%	0.229	S	C	*	.	S	Bend	trans	-80.9	-24.6	-179.6	-62.8	-175.3	172.1	0	0	113.1
65	K	92.7	Very high	95.3	Very high	123 Å²	123	42.4 Å²	42.4	54%	0.535	23%	0.225	S	C	.	.	S	Bend	trans	-75.8	-40.4	-175.6	-173.1	-179.5	178.4	-169.7	0	112.8	N63	N63-K65 PolarHBondContact OD1-N 3.45Å
66	Y	95.5	Very high	95.2	Very high	3 Å²	3	45.7 Å²	45.7	1%	0.012	24%	0.238	C	C	.	.			trans	-113.2	117.5	-176	-54.4	-65.9	0	0	0	109.8	L8 F33 N63 F68 F114 Y154	L8-Y66 HydrophobicContact CB-CD1 3.93Å; L8-Y66 HydrophobicContact CB-CD2 3.83Å; L8-Y66 HydrophobicContact CB-CE1 4.28Å; L8-Y66 HydrophobicContact CB-CE2 4.19Å; L8-Y66 HydrophobicContact CB-CG 3.69Å; L8-Y66 HydrophobicContact CD1-CE2 4.24Å; L8-Y66 HydrophobicContact CD2-CD2 3.79Å; L8-Y66 HydrophobicContact CD2-CE2 3.79Å; L8-Y66 HydrophobicContact CG-CD2 4.31Å; L8-Y66 HydrophobicContact CG-CE2 4.3Å; F33-Y66 AromaticContact CE2-CD2 3.89Å; F33-Y66 HydrophobicContact CE2-CD2 3.89Å; F33-Y66 HydrophobicContact CE2-CE2 4.18Å; N63-Y66 WeakPolarHBondContact ND2-CD2 3.27Å; N63-Y66 WeakPolarHBondContact OD1-CB 3.4Å; N63-Y66 PolarHBondContact OD1-N 2.76Å; N63-Y66 PolarHBondContact OD1-O 2.82Å; Y66-F68 PolarHBondContact O-N 3.28Å; Y66-F114 HydrophobicContact CD1-CD2 4.23Å; Y66-F114 HydrophobicContact CE1-CB 4.24Å; Y66-F114 AromaticContact CE1-CD2 3.44Å; Y66-F114 HydrophobicContact CE1-CD2 3.44Å; Y66-F114 VanDerWaalsContact CE1-CD2 3.44Å; Y66-F114 AromaticContact CE1-CE2 3.96Å; Y66-F114 HydrophobicContact CE1-CE2 3.96Å; Y66-F114 AromaticContact CE1-CG 3.93Å; Y66-F114 HydrophobicContact CE1-CG 3.93Å; Y66-Y154 WeakPolarHBondContact OH-CE2 3.36Å
67	S	95.5	Very high	94.9	Very high	52 Å²	52	50.6 Å²	50.6	36%	0.364	26%	0.26	S	S	.	.	S	Bend	trans	-62.9	-34.6	178	-55.3	0	0	0	0	111.6	S6	S6-S67 PolarHBondContact O-N 3.45Å
68	F	97.4	Very high	94.5	Very high	41 Å²	41	48.8 Å²	48.8	18%	0.18	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.8	177.2	-63.1	-79.4	0	0	0	111.6	G7 L8 L58 L59 C60 Y66 L105 A108 V110	G7-F68 CarbonylContact C-O 3.58Å; G7-F68 VanDerWaalsContact CA-O 3.23Å; G7-F68 WeakPolarHBondContact CA-O 3.03Å; L8-F68 PolarHBondContact N-O 3.07Å; L58-F68 HydrophobicContact CD1-CB 3.75Å; L58-F68 HydrophobicContact CD1-CD1 4.32Å; L58-F68 HydrophobicContact CD1-CG 4.27Å; L58-F68 HydrophobicContact CD2-CD1 3.64Å; L58-F68 HydrophobicContact CD2-CE1 4.04Å; L58-F68 HydrophobicContact CD2-CG 4.15Å; L58-F68 HydrophobicContact CG-CB 4.18Å; L58-F68 HydrophobicContact CG-CD1 3.82Å; L58-F68 HydrophobicContact CG-CG 4.28Å; L59-F68 CarbonylContact O-C 3.49Å; L59-F68 VanDerWaalsContact O-CA 3.31Å; L59-F68 WeakPolarHBondContact O-CA 3.45Å; C60-F68 HydrophobicContact CB-CD1 3.87Å; C60-F68 HydrophobicContact CB-CE1 3.93Å; Y66-F68 PolarHBondContact O-N 3.28Å; F68-L105 HydrophobicContact CB-CD2 3.89Å; F68-A108 HydrophobicContact CD1-CB 4.46Å; F68-A108 HydrophobicContact CD2-CB 3.92Å; F68-A108 HydrophobicContact CE1-CB 4.31Å; F68-A108 HydrophobicContact CE2-CB 3.76Å; F68-A108 HydrophobicContact CG-CB 4.27Å; F68-A108 HydrophobicContact CZ-CB 3.97Å; F68-V110 HydrophobicContact CB-CG2 4.34Å; F68-V110 HydrophobicContact CD2-CG2 3.73Å; F68-V110 HydrophobicContact CG-CG2 4.46Å
69	V	98	Very high	94.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.7	171.5	-177.8	0	0	0	0	108.1	L8 L10 F33 F41 L59 L62	L8-V69 HydrophobicContact CB-CG1 4.47Å; L8-V69 HydrophobicContact CB-CG2 4.28Å; L8-V69 HydrophobicContact CD2-CG1 4.45Å; L8-V69 CarbonylContact O-C 3.49Å; L8-V69 VanDerWaalsContact O-CA 3.26Å; L8-V69 WeakPolarHBondContact O-CA 3.41Å; L10-V69 HydrophobicContact CB-CG1 4.49Å; L10-V69 HydrophobicContact CD1-CG1 3.75Å; L10-V69 HydrophobicContact CG-CG1 4.14Å; F33-V69 HydrophobicContact CE1-CG1 4.37Å; F33-V69 HydrophobicContact CE1-CG2 4.03Å; F33-V69 HydrophobicContact CZ-CG2 3.82Å; F41-V69 HydrophobicContact CD2-CG1 4.4Å; F41-V69 HydrophobicContact CE2-CG1 3.98Å; L59-V69 HydrophobicContact CB-CB 4.49Å; L59-V69 WeakPolarHBondContact CB-O 3.04Å; L59-V69 PolarHBondContact N-O 2.86Å; L59-V69 PolarHBondContact O-N 3.32Å; L62-V69 HydrophobicContact CB-CG2 4.33Å; L62-V69 HydrophobicContact CD1-CB 3.96Å; L62-V69 HydrophobicContact CD1-CG1 4.36Å; L62-V69 HydrophobicContact CD1-CG2 3.96Å
70	A	98.2	Very high	93.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	109.3	173.1	0	0	0	0	0	109.6	L8 V9 L10 R57 L58 A101 L105	L8-A70 PolarHBondContact O-N 3.19Å; V9-A70 WeakPolarHBondContact CA-O 3.32Å; V9-A70 HydrophobicContact CG2-CB 4.28Å; L10-A70 PolarHBondContact N-O 2.92Å; R57-A70 CarbonylContact O-C 3.55Å; R57-A70 WeakPolarHBondContact O-CA 3.46Å; L58-A70 HydrophobicContact CD1-CB 4.21Å; A70-A101 HydrophobicContact CB-CB 3.73Å; A70-L105 HydrophobicContact CB-CD1 4.28Å; A70-L105 HydrophobicContact CB-CD2 4.23Å; A70-L105 HydrophobicContact CB-CG 4.09Å
71	A	97.9	Very high	93.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	134.3	169.4	0	0	0	0	0	109.6	L10 F41 L45 I51 A56 R57 L59	L10-A71 CarbonylContact O-C 3.55Å; L10-A71 WeakPolarHBondContact O-CA 3.38Å; F41-A71 HydrophobicContact CE2-CB 4.04Å; F41-A71 HydrophobicContact CZ-CB 4.01Å; L45-A71 HydrophobicContact CD2-CB 3.63Å; I51-A71 HydrophobicContact CD1-CB 3.5Å; I51-A71 VanDerWaalsContact CD1-CB 3.5Å; I51-A71 WeakPolarHBondContact CD1-O 3.21Å; A56-A71 CarbonylContact C-O 3.51Å; A56-A71 WeakPolarHBondContact CA-O 3.41Å; R57-A71 PolarHBondContact N-O 3.3Å; R57-A71 PolarHBondContact O-N 2.8Å; L59-A71 HydrophobicContact CD1-CB 4.45Å
72	V	97.8	Very high	93.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.7	-175.5	-56.1	0	0	0	0	113.2	V9 L10 T12 H55 A56 L74 A97 I98 A101	V9-V72 HydrophobicContact CG1-CG1 3.7Å; V9-V72 HydrophobicContact CG1-CG2 4.32Å; L10-V72 PolarHBondContact O-N 2.66Å; T12-V72 PolarHBondContact N-O 3.3Å; T12-V72 PolarHBondContact OG1-O 2.68Å; H55-V72 WeakPolarHBondContact O-CA 3.06Å; A56-V72 HydrophobicContact CB-CG1 3.99Å; V72-L74 HydrophobicContact CG2-CD2 3.94Å; V72-L74 HydrophobicContact CG2-CG 4.46Å; V72-A97 HydrophobicContact CB-CB 3.9Å; V72-A97 WeakPolarHBondContact CG1-O 3.42Å; V72-A97 HydrophobicContact CG2-CB 3.98Å; V72-I98 HydrophobicContact CG2-CD1 4.26Å; V72-A101 HydrophobicContact CG1-CB 3.51Å
73	G	96.5	Very high	93.7	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116	177.2	0	0	0	0	0	111.8	T53 G54 H55	T53-G73 CarbonylContact C-O 3.45Å; T53-G73 WeakPolarHBondContact CA-O 3.5Å; G54-G73 PolarHBondContact N-O 3.48Å; H55-G73 PolarHBondContact O-N 2.68Å
74	L	96.7	Very high	93.7	Very high	4 Å²	4	62.2 Å²	62.2	2%	0.021	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-0.5	-176.2	-62	-177.8	0	0	0	114.4	T12 F13 T27 V72 N93 V94 A97 C118	T12-L74 PolarHBondContact O-N 2.87Å; F13-L74 HydrophobicContact CD1-CB 3.69Å; F13-L74 HydrophobicContact CD1-CD1 4.26Å; F13-L74 HydrophobicContact CE1-CB 3.72Å; F13-L74 HydrophobicContact CE1-CD1 3.73Å; F13-L74 HydrophobicContact CE1-CG 4.41Å; F13-L74 HydrophobicContact CE2-CD1 4.35Å; F13-L74 HydrophobicContact CZ-CD1 3.78Å; T27-L74 HydrophobicContact CG2-CD1 3.57Å; V72-L74 HydrophobicContact CG2-CD2 3.94Å; V72-L74 HydrophobicContact CG2-CG 4.46Å; L74-N93 WeakPolarHBondContact O-CB 3.46Å; L74-N93 PolarHBondContact O-ND2 2.68Å; L74-V94 HydrophobicContact CD2-CG2 4Å; L74-A97 HydrophobicContact CD2-CB 4.03Å; L74-C118 HydrophobicContact CD1-CB 3.79Å; L74-C118 HydrophobicContact CD2-CB 4.11Å
75	G	94.8	Very high	93.9	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.4	-157.6	-171.8	0	0	0	0	0	112.3	F13 L14 T53	F13-G75 CarbonylContact C-O 3.53Å; F13-G75 WeakPolarHBondContact CA-O 3.47Å; L14-G75 PolarHBondContact N-O 2.91Å; T53-G75 VanDerWaalsContact OG1-CA 3.26Å; T53-G75 WeakPolarHBondContact OG1-CA 3.37Å
76	K	92.9	Very high	93.9	Very high	139 Å²	139	53.3 Å²	53.3	60%	0.604	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.5	-178.3	-63.7	176.1	180	179.2	0	109.8	Q79	K76-Q79 HydrophobicContact CB-CG 3.84Å; K76-Q79 WeakPolarHBondContact O-CB 3.31Å; K76-Q79 WeakPolarHBondContact O-CG 3.33Å; K76-Q79 PolarHBondContact O-N 2.9Å
77	M	90.7	Very high	93.9	Very high	121 Å²	121	53.3 Å²	53.3	60%	0.596	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	140.7	174.4	-169.7	169.6	65	0	0	110.3	F13 Q79	F13-M77 HydrophobicContact CB-CB 4.17Å; F13-M77 HydrophobicContact CD1-CB 4.09Å; F13-M77 HydrophobicContact CD2-CB 4.28Å; F13-M77 HydrophobicContact CD2-CG 4.19Å; F13-M77 HydrophobicContact CD2-SD 4.35Å; F13-M77 HydrophobicContact CE2-CG 4.31Å; F13-M77 HydrophobicContact CG-CB 3.92Å; F13-M77 HydrophobicContact CG-CG 4.31Å; M77-Q79 VanDerWaalsContact C-N 3.27Å; M77-Q79 PolarHBondContact O-N 3.26Å
78	G	87.2	Confident	93.8	Very high	78 Å²	78	52.3 Å²	52.3	80%	0.804	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	5.1	-179.4	0	0	0	0	0	115.4	G80	G78-G80 PolarHBondContact O-N 3.43Å
79	Q	89.3	Confident	93.7	Very high	62 Å²	62	52.6 Å²	52.6	29%	0.29	28%	0.28	S	S	.	.			trans	-59.4	122.3	170.3	-78.8	-175.3	-53.8	0	0	110.4	K76 M77 G90 N93	K76-Q79 HydrophobicContact CB-CG 3.84Å; K76-Q79 WeakPolarHBondContact O-CB 3.31Å; K76-Q79 WeakPolarHBondContact O-CG 3.33Å; K76-Q79 PolarHBondContact O-N 2.9Å; M77-Q79 VanDerWaalsContact C-N 3.27Å; M77-Q79 PolarHBondContact O-N 3.26Å; Q79-G90 VanDerWaalsContact O-CA 3.22Å; Q79-G90 WeakPolarHBondContact O-CA 3.39Å; Q79-G90 PolarHBondContact O-N 3.41Å; Q79-N93 PolarHBondContact OE1-ND2 2.75Å
80	G	88.8	Confident	93.6	Very high	27 Å²	27	52.8 Å²	52.8	28%	0.278	28%	0.283	S	S	.	.			trans	-127.6	-121.8	179.6	0	0	0	0	0	110.2	G78 N88 Q89	G78-G80 PolarHBondContact O-N 3.43Å; G80-N88 CarbonylContact O-C 3.47Å; G80-N88 WeakPolarHBondContact O-CA 3.47Å; G80-Q89 PolarHBondContact O-N 3.13Å
81	W	90.6	Very high	93.5	Very high	124 Å²	124	55 Å²	55	47%	0.47	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	129.3	177	175.9	-113.1	0	0	0	111.8	Q86 L87 K408	W81-Q86 HydrophobicContact CH2-CB 4.19Å; W81-L87 VanDerWaalsContact CE3-C 3.5Å; W81-L87 VanDerWaalsContact CE3-O 3.29Å; W81-L87 VanDerWaalsContact CZ3-CA 3.46Å; W81-K408 HydrophobicContact CH2-CB 4.13Å; W81-K408 HydrophobicContact CH2-CD 3.27Å; W81-K408 HydrophobicContact CH2-CG 3.42Å; W81-K408 VanDerWaalsContact CH2-CG 3.42Å; W81-K408 HydrophobicContact CZ2-CD 4.15Å; W81-K408 HydrophobicContact CZ3-CB 3.59Å; W81-K408 HydrophobicContact CZ3-CD 3.56Å; W81-K408 HydrophobicContact CZ3-CG 3.43Å; W81-K408 VanDerWaalsContact CZ3-CG 3.43Å
82	E	93.6	Very high	93.4	Very high	79 Å²	79	55.9 Å²	55.9	37%	0.369	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	110.2	171.6	-176.2	59.7	-107.1	0	0	108.8	S84 E85 Q86 L87 Q89	E82-S84 PolarHBondContact OE1-OG 3.38Å; E82-E85 HydrophobicContact CB-CB 4.11Å; E82-E85 HydrophobicContact CB-CG 4.42Å; E82-E85 HydrophobicContact CG-CB 3.81Å; E82-E85 HydrophobicContact CG-CG 3.66Å; E82-E85 PolarHBondContact O-N 3.34Å; E82-Q86 PolarHBondContact O-N 3.36Å; E82-L87 PolarHBondContact N-O 2.85Å; E82-L87 PolarHBondContact O-N 3.22Å; E82-Q89 HydrophobicContact CB-CB 4.22Å
83	E	92.1	Very high	93.3	Very high	150 Å²	150	56.2 Å²	56.2	70%	0.701	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-39.9	-170.4	-175	172.8	-165.2	0	0	112.2	E85 Q86	E83-E85 PolarHBondContact O-N 3.11Å; E83-Q86 WeakPolarHBondContact O-CG 3.08Å; E83-Q86 PolarHBondContact O-N 3.18Å
84	S	93	Very high	93.4	Very high	97 Å²	97	56.3 Å²	56.3	68%	0.678	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-30.8	179	61.7	0	0	0	0	112.4	E82	E82-S84 PolarHBondContact OE1-OG 3.38Å
85	E	92.8	Very high	93.4	Very high	81 Å²	81	56.2 Å²	56.2	38%	0.379	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-11.5	179	-67.2	-60.2	145.1	0	0	112.9	E82 E83 L87 R413	E82-E85 HydrophobicContact CB-CB 4.11Å; E82-E85 HydrophobicContact CB-CG 4.42Å; E82-E85 HydrophobicContact CG-CB 3.81Å; E82-E85 HydrophobicContact CG-CG 3.66Å; E82-E85 PolarHBondContact O-N 3.34Å; E83-E85 PolarHBondContact O-N 3.11Å; E85-L87 HydrophobicContact CB-CD1 4.28Å; E85-L87 HydrophobicContact CB-CG 3.99Å; E85-L87 PolarHBondContact O-N 3.43Å; E85-R413 PolarHBondContact O-NE 3.28Å; E85-R413 IonicContact OE2-CZ 2.8Å; E85-R413 IonicContact OE2-NH2 2.81Å; E85-R413 PolarHBondContact OE2-NH2 2.98Å
86	Q	92.8	Very high	93.5	Very high	58 Å²	58	58.7 Å²	58.7	27%	0.271	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	40.5	-173.6	-59.3	-168	-11.5	0	0	113.9	W81 E82 E83 K408	W81-Q86 HydrophobicContact CH2-CB 4.19Å; E82-Q86 PolarHBondContact O-N 3.36Å; E83-Q86 WeakPolarHBondContact O-CG 3.08Å; E83-Q86 PolarHBondContact O-N 3.18Å; Q86-K408 WeakPolarHBondContact O-CG 3.26Å
87	L	94.6	Very high	93.7	Very high	3 Å²	3	52 Å²	52	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	166.2	175.5	58.7	72.6	0	0	0	113.6	W81 E82 E85 Q89 E92	W81-L87 VanDerWaalsContact CE3-C 3.5Å; W81-L87 VanDerWaalsContact CE3-O 3.29Å; W81-L87 VanDerWaalsContact CZ3-CA 3.46Å; E82-L87 PolarHBondContact N-O 2.85Å; E82-L87 PolarHBondContact O-N 3.22Å; E85-L87 HydrophobicContact CB-CD1 4.28Å; E85-L87 HydrophobicContact CB-CG 3.99Å; E85-L87 PolarHBondContact O-N 3.43Å; L87-Q89 HydrophobicContact CD1-CB 4.12Å; L87-Q89 PolarHBondContact O-N 3.45Å; L87-E92 HydrophobicContact CD1-CB 4.37Å; L87-E92 HydrophobicContact CD1-CG 3.72Å; L87-E92 HydrophobicContact CD2-CG 3.74Å; L87-E92 HydrophobicContact CG-CG 4.24Å
88	N	94.9	Very high	94.1	Very high	31 Å²	31	46.3 Å²	46.3	17%	0.166	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	100.3	167.2	-172.7	-48	0	0	0	110.1	G80 G90 R91 E92 K408	G80-N88 CarbonylContact O-C 3.47Å; G80-N88 WeakPolarHBondContact O-CA 3.47Å; N88-G90 VanDerWaalsContact C-N 3.31Å; N88-G90 PolarHBondContact O-N 3.04Å; N88-G90 PolarHBondContact OD1-N 2.96Å; N88-R91 HydrophobicContact CB-CB 4.24Å; N88-R91 HydrophobicContact CB-CG 4.22Å; N88-R91 PolarHBondContact O-N 3.26Å; N88-R91 PolarHBondContact OD1-N 2.94Å; N88-E92 PolarHBondContact O-N 2.79Å; N88-E92 VanDerWaalsContact O-N 3.12Å; N88-K408 PolarHBondContact N-O 3.4Å
89	Q	95.1	Very high	94.6	Very high	47 Å²	47	42.7 Å²	42.7	22%	0.22	22%	0.215	C	C	.	.	H	α-helix	trans	-62.6	-36.8	-176.1	-169.8	62.4	58.2	0	0	112.4	G80 E82 L87 R91 E92 N93	G80-Q89 PolarHBondContact O-N 3.13Å; E82-Q89 HydrophobicContact CB-CB 4.22Å; L87-Q89 HydrophobicContact CD1-CB 4.12Å; L87-Q89 PolarHBondContact O-N 3.45Å; Q89-R91 PolarHBondContact O-N 3.12Å; Q89-E92 PolarHBondContact O-N 3.45Å; Q89-N93 PolarHBondContact NE2-OD1 3.36Å; Q89-N93 WeakPolarHBondContact O-CB 3.38Å; Q89-N93 PolarHBondContact O-N 2.79Å; Q89-N93 PolarHBondContact O-ND2 3.17Å; Q89-N93 PolarHBondContact O-OD1 3.15Å
90	G	95.1	Very high	94.9	Very high	6 Å²	6	40.8 Å²	40.8	6%	0.062	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-45.6	176.8	0	0	0	0	0	112.2	Q79 N88 N93 V94	Q79-G90 VanDerWaalsContact O-CA 3.22Å; Q79-G90 WeakPolarHBondContact O-CA 3.39Å; Q79-G90 PolarHBondContact O-N 3.41Å; N88-G90 VanDerWaalsContact C-N 3.31Å; N88-G90 PolarHBondContact O-N 3.04Å; N88-G90 PolarHBondContact OD1-N 2.96Å; G90-N93 PolarHBondContact O-N 2.76Å; G90-V94 WeakPolarHBondContact O-CG2 3.15Å; G90-V94 PolarHBondContact O-N 2.79Å; G90-V94 VanDerWaalsContact O-N 3.12Å
91	R	96.5	Very high	95.4	Very high	45 Å²	45	39.5 Å²	39.5	17%	0.17	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-42.4	176.8	-69	177.7	123.2	159.6	2.3	112.4	N88 Q89 N93 V94 R95 F120 D122 A123	N88-R91 HydrophobicContact CB-CB 4.24Å; N88-R91 HydrophobicContact CB-CG 4.22Å; N88-R91 PolarHBondContact O-N 3.26Å; N88-R91 PolarHBondContact OD1-N 2.94Å; Q89-R91 PolarHBondContact O-N 3.12Å; R91-N93 VanDerWaalsContact C-N 3.33Å; R91-N93 PolarHBondContact O-N 3.39Å; R91-V94 PolarHBondContact O-N 3.4Å; R91-R95 WeakPolarHBondContact O-CG 3.27Å; R91-R95 PolarHBondContact O-N 2.75Å; R91-F120 HydrophobicContact CG-CB 4.17Å; R91-F120 HydrophobicContact CG-CD1 3.61Å; R91-F120 HydrophobicContact CG-CD2 4.06Å; R91-F120 HydrophobicContact CG-CE1 3.93Å; R91-F120 HydrophobicContact CG-CE2 4.35Å; R91-F120 HydrophobicContact CG-CG 3.68Å; R91-F120 HydrophobicContact CG-CZ 4.28Å; R91-D122 IonicContact CZ-OD2 3.64Å; R91-D122 IonicContact NE-OD1 2.88Å; R91-D122 IonicContact NH2-OD1 3.56Å; R91-D122 PolarHBondContact NH2-OD1 3.27Å; R91-D122 IonicContact NH2-OD2 2.58Å; R91-D122 PolarHBondContact NH2-OD2 3.11Å; R91-A123 HydrophobicContact CB-CB 4.05Å; R91-A123 HydrophobicContact CG-CB 4.29Å
92	E	96	Very high	95.7	Very high	20 Å²	20	33.6 Å²	33.6	9%	0.093	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-40	176.3	-73.2	-49.3	94.8	0	0	112.7	L87 N88 Q89 V94 R95 N96 G411	L87-E92 HydrophobicContact CD1-CB 4.37Å; L87-E92 HydrophobicContact CD1-CG 3.72Å; L87-E92 HydrophobicContact CD2-CG 3.74Å; L87-E92 HydrophobicContact CG-CG 4.24Å; N88-E92 PolarHBondContact O-N 2.79Å; N88-E92 VanDerWaalsContact O-N 3.12Å; Q89-E92 PolarHBondContact O-N 3.45Å; E92-V94 VanDerWaalsContact C-N 3.31Å; E92-V94 PolarHBondContact O-N 3.39Å; E92-R95 PolarHBondContact O-N 2.85Å; E92-R95 VanDerWaalsContact OE1-CD 3.28Å; E92-R95 WeakPolarHBondContact OE1-CD 3.33Å; E92-R95 IonicContact OE1-CZ 3.27Å; E92-R95 IonicContact OE1-NE 3.23Å; E92-R95 IonicContact OE1-NH1 3.95Å; E92-R95 PolarHBondContact OE1-NH1 2.95Å; E92-N96 PolarHBondContact O-N 2.93Å; E92-N96 PolarHBondContact O-ND2 2.92Å; E92-G411 WeakPolarHBondContact OE1-CA 3.24Å
93	N	96.2	Very high	95.8	Very high	7 Å²	7	31.5 Å²	31.5	4%	0.037	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-45.1	175.8	-67.2	-10.6	0	0	0	110.4	T53 L74 Q79 Q89 G90 R91 A97	T53-N93 HydrophobicContact CG2-CB 3.93Å; T53-N93 VanDerWaalsContact CG2-OD1 3.31Å; T53-N93 WeakPolarHBondContact CG2-OD1 3.49Å; L74-N93 WeakPolarHBondContact O-CB 3.46Å; L74-N93 PolarHBondContact O-ND2 2.68Å; Q79-N93 PolarHBondContact OE1-ND2 2.75Å; Q89-N93 PolarHBondContact NE2-OD1 3.36Å; Q89-N93 WeakPolarHBondContact O-CB 3.38Å; Q89-N93 PolarHBondContact O-N 2.79Å; Q89-N93 PolarHBondContact O-ND2 3.17Å; Q89-N93 PolarHBondContact O-OD1 3.15Å; G90-N93 PolarHBondContact O-N 2.76Å; R91-N93 VanDerWaalsContact C-N 3.33Å; R91-N93 PolarHBondContact O-N 3.39Å; N93-A97 WeakPolarHBondContact O-CB 3.29Å; N93-A97 PolarHBondContact O-N 3.03Å
94	V	97.5	Very high	96	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-51.2	176.1	172.6	0	0	0	0	111.1	L74 G90 R91 E92 N96 A97 I98 C118 F120 A123 A124	L74-V94 HydrophobicContact CD2-CG2 4Å; G90-V94 WeakPolarHBondContact O-CG2 3.15Å; G90-V94 PolarHBondContact O-N 2.79Å; G90-V94 VanDerWaalsContact O-N 3.12Å; R91-V94 PolarHBondContact O-N 3.4Å; E92-V94 VanDerWaalsContact C-N 3.31Å; E92-V94 PolarHBondContact O-N 3.39Å; V94-N96 PolarHBondContact O-N 3.39Å; V94-A97 PolarHBondContact O-N 3.46Å; V94-I98 HydrophobicContact CG1-CG1 4.01Å; V94-I98 WeakPolarHBondContact O-CB 3.18Å; V94-I98 VanDerWaalsContact O-CG1 3.27Å; V94-I98 WeakPolarHBondContact O-CG1 3.45Å; V94-I98 PolarHBondContact O-N 3.46Å; V94-C118 HydrophobicContact CG1-CB 4.08Å; V94-C118 HydrophobicContact CG2-CB 3.65Å; V94-F120 HydrophobicContact CG2-CD2 4Å; V94-A123 HydrophobicContact CB-CB 4.33Å; V94-A123 HydrophobicContact CG1-CB 4.15Å; V94-A124 HydrophobicContact CG1-CB 3.78Å
95	R	97.6	Very high	96.2	Very high	2 Å²	2	21 Å²	21	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-53.6	-51.4	179.6	-74.4	166.6	-177	127.5	1.8	112.1	R91 E92 S99 A123 E126 G127 V409 T410 M481	R91-R95 WeakPolarHBondContact O-CG 3.27Å; R91-R95 PolarHBondContact O-N 2.75Å; E92-R95 PolarHBondContact O-N 2.85Å; E92-R95 VanDerWaalsContact OE1-CD 3.28Å; E92-R95 WeakPolarHBondContact OE1-CD 3.33Å; E92-R95 IonicContact OE1-CZ 3.27Å; E92-R95 IonicContact OE1-NE 3.23Å; E92-R95 IonicContact OE1-NH1 3.95Å; E92-R95 PolarHBondContact OE1-NH1 2.95Å; R95-S99 VanDerWaalsContact O-CB 3.26Å; R95-S99 WeakPolarHBondContact O-CB 3.41Å; R95-S99 PolarHBondContact O-N 3.23Å; R95-A123 HydrophobicContact CG-CB 4.01Å; R95-A123 VanDerWaalsContact CG-O 3.3Å; R95-A123 WeakPolarHBondContact CG-O 3.24Å; R95-E126 HydrophobicContact CG-CB 4.36Å; R95-E126 IonicContact CZ-OE2 3.64Å; R95-E126 IonicContact NE-OE2 2.79Å; R95-E126 PolarHBondContact NE-OE2 2.78Å; R95-E126 IonicContact NH2-OE1 2.57Å; R95-E126 IonicContact NH2-OE2 3.27Å; R95-E126 PolarHBondContact NH2-OE2 3.43Å; R95-G127 VanDerWaalsContact O-CA 3.29Å; R95-G127 WeakPolarHBondContact O-CA 3.48Å; R95-V409 PolarHBondContact NH1-O 2.93Å; R95-V409 VanDerWaalsContact NH1-O 3.11Å; R95-V409 PolarHBondContact NH2-O 3.26Å; R95-T410 VanDerWaalsContact CZ-O 3.27Å; R95-T410 PolarHBondContact NH1-O 3.18Å; R95-M481 HydrophobicContact CB-SD 4.01Å
96	N	96.4	Very high	96.3	Very high	52 Å²	52	18 Å²	18	28%	0.278	10%	0.097	S	C	.	.	H	α-helix	trans	-66.3	-44.4	-178.3	-71.9	-56.7	0	0	0	112	E92 V94 S99 A100	E92-N96 PolarHBondContact O-N 2.93Å; E92-N96 PolarHBondContact O-ND2 2.92Å; V94-N96 PolarHBondContact O-N 3.39Å; N96-S99 PolarHBondContact O-N 3.32Å; N96-A100 WeakPolarHBondContact O-CB 3.32Å; N96-A100 PolarHBondContact O-N 2.76Å
97	A	97.5	Very high	96.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.4	-48.4	179.5	0	0	0	0	0	112.3	V72 L74 N93 V94 A100 A101	V72-A97 HydrophobicContact CB-CB 3.9Å; V72-A97 WeakPolarHBondContact CG1-O 3.42Å; V72-A97 HydrophobicContact CG2-CB 3.98Å; L74-A97 HydrophobicContact CD2-CB 4.03Å; N93-A97 WeakPolarHBondContact O-CB 3.29Å; N93-A97 PolarHBondContact O-N 3.03Å; V94-A97 PolarHBondContact O-N 3.46Å; A97-A100 PolarHBondContact O-N 3.39Å; A97-A101 PolarHBondContact O-N 3.25Å
98	I	98.2	Very high	96.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.4	-40.5	178.3	-60.2	-53.5	0	0	0	110.8	V9 V72 V94 A100 A101 V102 I115 A124 A128	V9-I98 HydrophobicContact CB-CD1 4.48Å; V9-I98 HydrophobicContact CG1-CD1 3.51Å; V72-I98 HydrophobicContact CG2-CD1 4.26Å; V94-I98 HydrophobicContact CG1-CG1 4.01Å; V94-I98 WeakPolarHBondContact O-CB 3.18Å; V94-I98 VanDerWaalsContact O-CG1 3.27Å; V94-I98 WeakPolarHBondContact O-CG1 3.45Å; V94-I98 PolarHBondContact O-N 3.46Å; I98-A100 VanDerWaalsContact C-N 3.34Å; I98-A100 PolarHBondContact O-N 2.65Å; I98-A101 PolarHBondContact O-N 3.45Å; I98-V102 HydrophobicContact CG2-CG2 4.34Å; I98-V102 WeakPolarHBondContact O-CG2 3.38Å; I98-V102 PolarHBondContact O-N 3.34Å; I98-I115 HydrophobicContact CD1-CG2 3.89Å; I98-I115 HydrophobicContact CG1-CG2 4.25Å; I98-I115 HydrophobicContact CG2-CG2 3.77Å; I98-A124 HydrophobicContact CG1-CB 4.18Å; I98-A124 WeakPolarHBondContact CG2-O 3.3Å; I98-A128 HydrophobicContact CG2-CB 3.81Å
99	S	97.6	Very high	96.3	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-57.6	-46.7	174.5	178	0	0	0	0	111.8	R95 N96 A101 V102 V103 G127 G131 M481	R95-S99 VanDerWaalsContact O-CB 3.26Å; R95-S99 WeakPolarHBondContact O-CB 3.41Å; R95-S99 PolarHBondContact O-N 3.23Å; N96-S99 PolarHBondContact O-N 3.32Å; S99-A101 VanDerWaalsContact C-N 3.34Å; S99-A101 PolarHBondContact O-N 2.85Å; S99-V102 PolarHBondContact O-N 2.86Å; S99-V103 WeakPolarHBondContact O-CG2 3.34Å; S99-V103 PolarHBondContact O-N 2.94Å; S99-V103 VanDerWaalsContact O-N 3.09Å; S99-G127 VanDerWaalsContact CA-O 3.31Å; S99-G127 WeakPolarHBondContact CA-O 3.44Å; S99-G127 WeakPolarHBondContact CB-O 3.27Å; S99-G131 WeakPolarHBondContact OG-CA 3.42Å; S99-M481 WeakPolarHBondContact OG-CA 3.43Å
100	A	96.8	Very high	96.3	Very high	23 Å²	23	21.5 Å²	21.5	19%	0.19	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-41.1	177.1	0	0	0	0	0	112.2	G54 A56 N96 A97 I98 V103 A104	G54-A100 WeakPolarHBondContact O-CB 3.49Å; A56-A100 HydrophobicContact CB-CB 4.22Å; N96-A100 WeakPolarHBondContact O-CB 3.32Å; N96-A100 PolarHBondContact O-N 2.76Å; A97-A100 PolarHBondContact O-N 3.39Å; I98-A100 VanDerWaalsContact C-N 3.34Å; I98-A100 PolarHBondContact O-N 2.65Å; A100-V103 PolarHBondContact O-N 3.03Å; A100-A104 PolarHBondContact O-N 3.07Å; A100-A104 VanDerWaalsContact O-N 3.1Å
101	A	98.1	Very high	96.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.5	-42.6	176.1	0	0	0	0	0	112.8	V9 A56 A70 V72 A97 I98 S99 V103 A104 L105	V9-A101 HydrophobicContact CB-CB 4.45Å; V9-A101 HydrophobicContact CG1-CB 3.68Å; V9-A101 HydrophobicContact CG2-CB 3.84Å; A56-A101 HydrophobicContact CB-CB 3.97Å; A70-A101 HydrophobicContact CB-CB 3.73Å; V72-A101 HydrophobicContact CG1-CB 3.51Å; A97-A101 PolarHBondContact O-N 3.25Å; I98-A101 PolarHBondContact O-N 3.45Å; S99-A101 VanDerWaalsContact C-N 3.34Å; S99-A101 PolarHBondContact O-N 2.85Å; A101-V103 VanDerWaalsContact C-N 3.32Å; A101-V103 PolarHBondContact O-N 3.14Å; A101-A104 PolarHBondContact O-N 3.18Å; A101-L105 WeakPolarHBondContact O-CB 3.44Å; A101-L105 VanDerWaalsContact O-CG 3.27Å; A101-L105 WeakPolarHBondContact O-CG 3.49Å; A101-L105 PolarHBondContact O-N 2.8Å
102	V	97.6	Very high	96.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-41.2	178.3	164.7	0	0	0	0	111.3	I98 S99 L105 R106 I115 A128 M149 F151	I98-V102 HydrophobicContact CG2-CG2 4.34Å; I98-V102 WeakPolarHBondContact O-CG2 3.38Å; I98-V102 PolarHBondContact O-N 3.34Å; S99-V102 PolarHBondContact O-N 2.86Å; V102-L105 PolarHBondContact O-N 2.65Å; V102-R106 WeakPolarHBondContact O-CB 3.27Å; V102-R106 PolarHBondContact O-N 3.39Å; V102-I115 HydrophobicContact CG2-CD1 4.45Å; V102-A128 HydrophobicContact CG2-CB 4.02Å; V102-M149 HydrophobicContact CG1-SD 4.18Å; V102-F151 HydrophobicContact CB-CE1 4.33Å; V102-F151 HydrophobicContact CB-CZ 4.47Å; V102-F151 HydrophobicContact CG1-CE1 3.8Å; V102-F151 HydrophobicContact CG1-CZ 3.52Å; V102-F151 HydrophobicContact CG2-CD1 4.28Å; V102-F151 HydrophobicContact CG2-CE1 3.57Å; V102-F151 HydrophobicContact CG2-CZ 4.06Å
103	V	95.4	Very high	96.4	Very high	35 Å²	35	23.5 Å²	23.5	21%	0.212	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-49.6	174.5	173.6	0	0	0	0	110.8	S99 A100 A101 L105 R106 E107	S99-V103 WeakPolarHBondContact O-CG2 3.34Å; S99-V103 PolarHBondContact O-N 2.94Å; S99-V103 VanDerWaalsContact O-N 3.09Å; A100-V103 PolarHBondContact O-N 3.03Å; A101-V103 VanDerWaalsContact C-N 3.32Å; A101-V103 PolarHBondContact O-N 3.14Å; V103-L105 PolarHBondContact O-N 2.87Å; V103-R106 PolarHBondContact O-N 2.9Å; V103-E107 WeakPolarHBondContact O-CG 3.35Å; V103-E107 PolarHBondContact O-N 2.66Å
104	A	96.1	Very high	96.5	Very high	26 Å²	26	25.1 Å²	25.1	22%	0.215	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-40.4	179.8	0	0	0	0	0	113	A100 A101 E107 A108	A100-A104 PolarHBondContact O-N 3.07Å; A100-A104 VanDerWaalsContact O-N 3.1Å; A101-A104 PolarHBondContact O-N 3.18Å; A104-E107 PolarHBondContact O-N 3.01Å; A104-A108 PolarHBondContact O-N 2.9Å; A104-A108 VanDerWaalsContact O-N 3.16Å
105	L	97.4	Very high	96.5	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-43.3	176.5	-73.8	171.9	0	0	0	111.4	V9 L58 F68 A70 A101 V102 V103 E107 A108 G109 V110 A113 M149	V9-L105 HydrophobicContact CG2-CD1 3.45Å; V9-L105 VanDerWaalsContact CG2-CD1 3.45Å; L58-L105 HydrophobicContact CD1-CD2 3.62Å; L58-L105 HydrophobicContact CD1-CG 4.3Å; F68-L105 HydrophobicContact CB-CD2 3.89Å; A70-L105 HydrophobicContact CB-CD1 4.28Å; A70-L105 HydrophobicContact CB-CD2 4.23Å; A70-L105 HydrophobicContact CB-CG 4.09Å; A101-L105 WeakPolarHBondContact O-CB 3.44Å; A101-L105 VanDerWaalsContact O-CG 3.27Å; A101-L105 WeakPolarHBondContact O-CG 3.49Å; A101-L105 PolarHBondContact O-N 2.8Å; V102-L105 PolarHBondContact O-N 2.65Å; V103-L105 PolarHBondContact O-N 2.87Å; L105-E107 VanDerWaalsContact C-N 3.35Å; L105-E107 PolarHBondContact O-N 2.64Å; L105-A108 PolarHBondContact O-N 2.73Å; L105-A108 VanDerWaalsContact O-N 3.17Å; L105-G109 PolarHBondContact O-N 2.9Å; L105-V110 HydrophobicContact CB-CB 4.03Å; L105-V110 HydrophobicContact CB-CG1 4.34Å; L105-V110 HydrophobicContact CB-CG2 4.18Å; L105-V110 HydrophobicContact CD2-CG2 3.91Å; L105-V110 VanDerWaalsContact O-CB 3.24Å; L105-V110 WeakPolarHBondContact O-CB 3.36Å; L105-V110 WeakPolarHBondContact O-CG2 3.39Å; L105-V110 PolarHBondContact O-N 2.79Å; L105-A113 HydrophobicContact CD1-CB 4.01Å; L105-M149 HydrophobicContact CB-CE 3.96Å
106	R	95.2	Very high	96.5	Very high	19 Å²	19	25.1 Å²	25.1	7%	0.072	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-45.2	177	-170	171.1	56.8	-170.9	-9.7	111.7	V102 V103 A108 G109 S132 P147 M149 N483	V102-R106 WeakPolarHBondContact O-CB 3.27Å; V102-R106 PolarHBondContact O-N 3.39Å; V103-R106 PolarHBondContact O-N 2.9Å; R106-A108 PolarHBondContact O-N 3.43Å; R106-G109 PolarHBondContact O-N 3.11Å; R106-S132 PolarHBondContact NH1-O 2.89Å; R106-P147 HydrophobicContact CG-CG 4.09Å; R106-M149 HydrophobicContact CB-SD 3.52Å; R106-M149 VanDerWaalsContact CB-SD 3.52Å; R106-M149 HydrophobicContact CG-CG 4.44Å; R106-M149 HydrophobicContact CG-SD 3.98Å; R106-N483 PolarHBondContact NH2-ND2 3.35Å
107	E	93.5	Very high	96.4	Very high	157 Å²	157	23.5 Å²	23.5	73%	0.734	14%	0.138	S	C	*	.	H	α-helix	trans	-63.4	-29.6	177.8	-72.3	175.3	178.4	0	0	112.5	V103 A104 L105 G109	V103-E107 WeakPolarHBondContact O-CG 3.35Å; V103-E107 PolarHBondContact O-N 2.66Å; A104-E107 PolarHBondContact O-N 3.01Å; L105-E107 VanDerWaalsContact C-N 3.35Å; L105-E107 PolarHBondContact O-N 2.64Å; E107-G109 PolarHBondContact O-N 3.38Å
108	A	94.6	Very high	96.3	Very high	21 Å²	21	23.8 Å²	23.8	17%	0.174	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-0.6	173	0	0	0	0	0	114.3	R5 L58 F68 A104 L105 R106	R5-A108 PolarHBondContact NH1-O 3.03Å; L58-A108 HydrophobicContact CD2-CB 3.59Å; F68-A108 HydrophobicContact CD1-CB 4.46Å; F68-A108 HydrophobicContact CD2-CB 3.92Å; F68-A108 HydrophobicContact CE1-CB 4.31Å; F68-A108 HydrophobicContact CE2-CB 3.76Å; F68-A108 HydrophobicContact CG-CB 4.27Å; F68-A108 HydrophobicContact CZ-CB 3.97Å; A104-A108 PolarHBondContact O-N 2.9Å; A104-A108 VanDerWaalsContact O-N 3.16Å; L105-A108 PolarHBondContact O-N 2.73Å; L105-A108 VanDerWaalsContact O-N 3.17Å; R106-A108 PolarHBondContact O-N 3.43Å
109	G	93.5	Very high	95.9	Very high	34 Å²	34	27.2 Å²	27.2	35%	0.351	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	24	179.7	0	0	0	0	0	114.2	L105 R106 E107	L105-G109 PolarHBondContact O-N 2.9Å; R106-G109 PolarHBondContact O-N 3.11Å; E107-G109 PolarHBondContact O-N 3.38Å
110	V	95.6	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	133	171.3	175.5	0	0	0	0	109.5	R5 F68 L105 E112 A113 M149	R5-V110 WeakPolarHBondContact O-CG1 3.49Å; F68-V110 HydrophobicContact CB-CG2 4.34Å; F68-V110 HydrophobicContact CD2-CG2 3.73Å; F68-V110 HydrophobicContact CG-CG2 4.46Å; L105-V110 HydrophobicContact CB-CB 4.03Å; L105-V110 HydrophobicContact CB-CG1 4.34Å; L105-V110 HydrophobicContact CB-CG2 4.18Å; L105-V110 HydrophobicContact CD2-CG2 3.91Å; L105-V110 VanDerWaalsContact O-CB 3.24Å; L105-V110 WeakPolarHBondContact O-CB 3.36Å; L105-V110 WeakPolarHBondContact O-CG2 3.39Å; L105-V110 PolarHBondContact O-N 2.79Å; V110-E112 WeakPolarHBondContact CG1-O 3.28Å; V110-A113 HydrophobicContact CG1-CB 4.44Å; V110-M149 HydrophobicContact CB-CE 4.11Å; V110-M149 HydrophobicContact CG1-CE 3.8Å
111	T	95.2	Very high	95.7	Very high	53 Å²	53	29.1 Å²	29.1	33%	0.325	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-15.5	179.2	54.7	0	0	0	0	112.9	G4 R5 M149 K150	G4-T111 WeakPolarHBondContact CA-OG1 3.44Å; R5-T111 PolarHBondContact N-OG1 3.09Å; R5-T111 PolarHBondContact O-N 3Å; T111-M149 WeakPolarHBondContact O-CA 3.44Å; T111-K150 PolarHBondContact O-N 3.46Å
112	E	97.1	Very high	95.7	Very high	59 Å²	59	29.7 Å²	29.7	28%	0.276	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	128.2	179.7	-173.4	166.8	-119.1	0	0	109	R5 S6 G7 V110 F114 K150 H152	R5-E112 PolarHBondContact O-N 2.88Å; S6-E112 CarbonylContact C-O 3.46Å; S6-E112 VanDerWaalsContact CA-O 3.26Å; S6-E112 WeakPolarHBondContact CA-O 3.12Å; G7-E112 PolarHBondContact N-O 3.31Å; V110-E112 WeakPolarHBondContact CG1-O 3.28Å; E112-F114 HydrophobicContact CG-CE2 4.15Å; E112-K150 CarbonylContact C-O 3.58Å; E112-K150 WeakPolarHBondContact CA-O 3.37Å; E112-K150 HydrophobicContact CG-CB 4.26Å; E112-H152 IonicContact OE1-CD2 2.74Å; E112-H152 IonicContact OE1-NE2 3.42Å; E112-H152 PolarHBondContact OE1-NE2 2.92Å
113	A	97.9	Very high	95.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	136.3	-177.4	0	0	0	0	0	111.8	G7 L105 V110 I115 M149 K150 F151 H152	G7-A113 WeakPolarHBondContact O-CA 3.22Å; L105-A113 HydrophobicContact CD1-CB 4.01Å; V110-A113 HydrophobicContact CG1-CB 4.44Å; A113-I115 HydrophobicContact CB-CD1 3.96Å; A113-M149 HydrophobicContact CB-CE 3.94Å; A113-K150 PolarHBondContact N-O 2.99Å; A113-F151 HydrophobicContact CB-CD1 3.98Å; A113-F151 HydrophobicContact CB-CE1 4.18Å; A113-F151 WeakPolarHBondContact O-CA 3.34Å; A113-H152 PolarHBondContact O-N 2.82Å
114	F	97.5	Very high	95.8	Very high	42 Å²	42	28 Å²	28	18%	0.184	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	124.2	174.9	-64.7	-99.8	0	0	0	108.2	G7 L8 V9 Y66 E112 H152 Y154	G7-F114 PolarHBondContact O-N 3.46Å; L8-F114 CarbonylContact C-O 3.6Å; L8-F114 WeakPolarHBondContact CA-O 3.48Å; L8-F114 HydrophobicContact CD1-CB 3.84Å; V9-F114 PolarHBondContact N-O 3.02Å; Y66-F114 HydrophobicContact CD1-CD2 4.23Å; Y66-F114 HydrophobicContact CE1-CB 4.24Å; Y66-F114 AromaticContact CE1-CD2 3.44Å; Y66-F114 HydrophobicContact CE1-CD2 3.44Å; Y66-F114 VanDerWaalsContact CE1-CD2 3.44Å; Y66-F114 AromaticContact CE1-CE2 3.96Å; Y66-F114 HydrophobicContact CE1-CE2 3.96Å; Y66-F114 AromaticContact CE1-CG 3.93Å; Y66-F114 HydrophobicContact CE1-CG 3.93Å; E112-F114 HydrophobicContact CG-CE2 4.15Å; F114-H152 CarbonylContact C-O 3.59Å; F114-H152 WeakPolarHBondContact CA-O 3.47Å; F114-H152 HydrophobicContact CD1-CB 3.83Å; F114-H152 HydrophobicContact CE1-CB 4Å; F114-H152 HydrophobicContact CG-CB 4.47Å; F114-Y154 HydrophobicContact CB-CD2 4.1Å; F114-Y154 HydrophobicContact CB-CG 4.44Å
115	I	98.2	Very high	95.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.2	-165.9	-51.9	-58.1	0	0	0	110.1	V9 I98 V102 A113 A124 A128 F151 H152 Y154 W167	V9-I115 HydrophobicContact CB-CD1 3.88Å; V9-I115 HydrophobicContact CG2-CD1 3.37Å; I98-I115 HydrophobicContact CD1-CG2 3.89Å; I98-I115 HydrophobicContact CG1-CG2 4.25Å; I98-I115 HydrophobicContact CG2-CG2 3.77Å; V102-I115 HydrophobicContact CG2-CD1 4.45Å; A113-I115 HydrophobicContact CB-CD1 3.96Å; I115-A124 HydrophobicContact CG2-CB 4.27Å; I115-A128 HydrophobicContact CG1-CB 4.48Å; I115-F151 HydrophobicContact CD1-CD1 4.29Å; I115-F151 HydrophobicContact CG1-CD1 4.36Å; I115-H152 PolarHBondContact N-O 2.95Å; I115-Y154 WeakPolarHBondContact O-CB 3.28Å; I115-Y154 PolarHBondContact O-N 3.49Å; I115-W167 HydrophobicContact CB-CH2 3.7Å; I115-W167 HydrophobicContact CB-CZ3 3.87Å; I115-W167 HydrophobicContact CG1-CH2 3.76Å; I115-W167 HydrophobicContact CG1-CZ3 4.43Å; I115-W167 HydrophobicContact CG2-CH2 4.16Å; I115-W167 HydrophobicContact CG2-CZ3 4.01Å
116	D	96.9	Very high	96	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	16%	0.163	C	C	.	.			trans	-55.9	124.9	167.8	177.2	-0.3	0	0	0	110.2	V9 L10 G11 T27 A29 C118	V9-D116 WeakPolarHBondContact O-CB 3.37Å; V9-D116 PolarHBondContact O-N 3.08Å; L10-D116 HydrophobicContact CD2-CB 4.4Å; G11-D116 PolarHBondContact N-OD2 3.29Å; T27-D116 WeakPolarHBondContact CB-OD2 3.17Å; T27-D116 PolarHBondContact OG1-OD2 2.98Å; A29-D116 HydrophobicContact CB-CB 4.15Å; D116-C118 VanDerWaalsContact CG-SG 3.53Å; D116-C118 PolarHBondContact O-N 3.28Å; D116-C118 VanDerWaalsContact O-N 3.15Å; D116-C118 PolarHBondContact O-SG 3.05Å; D116-C118 PolarHBondContact OD1-N 3.48Å
117	P	94.9	Very high	96.1	Very high	19 Å²	19	26.2 Å²	26.2	12%	0.123	16%	0.16	C	C	.	.			trans	-63.7	-16.7	177.7	27.1	-36.1	0	0	0	113.5	G119 F120 A121 V153 L163	P117-G119 PolarHBondContact O-N 3.45Å; P117-F120 CarbonylContact O-C 3.47Å; P117-F120 PolarHBondContact O-N 2.89Å; P117-A121 HydrophobicContact CB-CB 3.82Å; P117-A121 PolarHBondContact O-N 2.68Å; P117-V153 HydrophobicContact CB-CG2 4.43Å; P117-L163 HydrophobicContact CB-CD1 3.78Å; P117-L163 HydrophobicContact CG-CD1 4.04Å; P117-L163 HydrophobicContact CG-CD2 4.43Å
118	C	94.5	Very high	96.4	Very high	6 Å²	6	18.7 Å²	18.7	4%	0.041	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	27.2	175.4	-59.8	0	0	0	0	114.1	L74 V94 D116 F120	L74-C118 HydrophobicContact CD1-CB 3.79Å; L74-C118 HydrophobicContact CD2-CB 4.11Å; V94-C118 HydrophobicContact CG1-CB 4.08Å; V94-C118 HydrophobicContact CG2-CB 3.65Å; D116-C118 VanDerWaalsContact CG-SG 3.53Å; D116-C118 PolarHBondContact O-N 3.28Å; D116-C118 VanDerWaalsContact O-N 3.15Å; D116-C118 PolarHBondContact O-SG 3.05Å; D116-C118 PolarHBondContact OD1-N 3.48Å; C118-F120 VanDerWaalsContact C-N 3.27Å; C118-F120 PolarHBondContact O-N 3.46Å
119	G	90.9	Very high	96.5	Very high	71 Å²	71	18.9 Å²	18.9	73%	0.732	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	-9.6	-174.8	0	0	0	0	0	115.5	P117	P117-G119 PolarHBondContact O-N 3.45Å
120	F	94.3	Very high	96.7	Very high	62 Å²	62	17.2 Å²	17.2	27%	0.272	11%	0.105	S	C	.	.			trans	-137.9	76.8	-179.4	-58.7	-69.2	0	0	0	110.2	R91 V94 P117 C118 D122 A123 A124	R91-F120 HydrophobicContact CG-CB 4.17Å; R91-F120 HydrophobicContact CG-CD1 3.61Å; R91-F120 HydrophobicContact CG-CD2 4.06Å; R91-F120 HydrophobicContact CG-CE1 3.93Å; R91-F120 HydrophobicContact CG-CE2 4.35Å; R91-F120 HydrophobicContact CG-CG 3.68Å; R91-F120 HydrophobicContact CG-CZ 4.28Å; V94-F120 HydrophobicContact CG2-CD2 4Å; P117-F120 CarbonylContact O-C 3.47Å; P117-F120 PolarHBondContact O-N 2.89Å; C118-F120 VanDerWaalsContact C-N 3.27Å; C118-F120 PolarHBondContact O-N 3.46Å; F120-D122 VanDerWaalsContact C-N 3.27Å; F120-D122 PolarHBondContact O-N 2.81Å; F120-A123 HydrophobicContact CB-CB 3.76Å; F120-A123 PolarHBondContact O-N 3.23Å; F120-A123 VanDerWaalsContact O-N 3.11Å; F120-A124 PolarHBondContact O-N 3.36Å
121	A	95.6	Very high	96.8	Very high	3 Å²	3	17.2 Å²	17.2	3%	0.025	11%	0.105	C	C	.	.	H	α-helix	trans	-60	-33.5	-172.4	0	0	0	0	0	114.2	P117 A124 A125 L163 L166	P117-A121 HydrophobicContact CB-CB 3.82Å; P117-A121 PolarHBondContact O-N 2.68Å; A121-A124 PolarHBondContact O-N 2.88Å; A121-A125 WeakPolarHBondContact O-CB 3.4Å; A121-A125 PolarHBondContact O-N 3.2Å; A121-L163 HydrophobicContact CB-CD1 3.58Å; A121-L163 HydrophobicContact CB-CG 4.28Å; A121-L166 HydrophobicContact CB-CB 4.02Å
122	D	97.2	Very high	96.8	Very high	13 Å²	13	16.1 Å²	16.1	7%	0.07	10%	0.099	C	C	.	.	H	α-helix	trans	-66.8	-46.9	174.4	59.9	-19.3	0	0	0	111.7	R91 F120 A124 A125 E126 L166 G170	R91-D122 IonicContact CZ-OD2 3.64Å; R91-D122 IonicContact NE-OD1 2.88Å; R91-D122 IonicContact NH2-OD1 3.56Å; R91-D122 PolarHBondContact NH2-OD1 3.27Å; R91-D122 IonicContact NH2-OD2 2.58Å; R91-D122 PolarHBondContact NH2-OD2 3.11Å; F120-D122 VanDerWaalsContact C-N 3.27Å; F120-D122 PolarHBondContact O-N 2.81Å; D122-A124 VanDerWaalsContact C-N 3.31Å; D122-A124 PolarHBondContact O-N 3.34Å; D122-A125 PolarHBondContact O-N 3.39Å; D122-E126 VanDerWaalsContact O-CG 3.29Å; D122-E126 WeakPolarHBondContact O-CG 3.21Å; D122-E126 PolarHBondContact O-N 2.9Å; D122-L166 VanDerWaalsContact CA-O 3.26Å; D122-L166 WeakPolarHBondContact CA-O 3.41Å; D122-L166 HydrophobicContact CB-CB 4.37Å; D122-L166 VanDerWaalsContact CB-O 3.25Å; D122-L166 WeakPolarHBondContact CB-O 3.36Å; D122-G170 WeakPolarHBondContact O-CA 3.21Å
123	A	97.7	Very high	96.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.2	-36.5	175	0	0	0	0	0	112.3	R91 V94 R95 F120 E126 G127	R91-A123 HydrophobicContact CB-CB 4.05Å; R91-A123 HydrophobicContact CG-CB 4.29Å; V94-A123 HydrophobicContact CB-CB 4.33Å; V94-A123 HydrophobicContact CG1-CB 4.15Å; R95-A123 HydrophobicContact CG-CB 4.01Å; R95-A123 VanDerWaalsContact CG-O 3.3Å; R95-A123 WeakPolarHBondContact CG-O 3.24Å; F120-A123 HydrophobicContact CB-CB 3.76Å; F120-A123 PolarHBondContact O-N 3.23Å; F120-A123 VanDerWaalsContact O-N 3.11Å; A123-E126 PolarHBondContact O-N 2.67Å; A123-G127 PolarHBondContact O-N 3.13Å
124	A	98.3	Very high	96.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-66.4	-45.5	175.2	0	0	0	0	0	111.5	V94 I98 I115 F120 A121 D122 E126 G127 A128 W167	V94-A124 HydrophobicContact CG1-CB 3.78Å; I98-A124 HydrophobicContact CG1-CB 4.18Å; I98-A124 WeakPolarHBondContact CG2-O 3.3Å; I115-A124 HydrophobicContact CG2-CB 4.27Å; F120-A124 PolarHBondContact O-N 3.36Å; A121-A124 PolarHBondContact O-N 2.88Å; D122-A124 VanDerWaalsContact C-N 3.31Å; D122-A124 PolarHBondContact O-N 3.34Å; A124-E126 VanDerWaalsContact C-N 3.34Å; A124-E126 PolarHBondContact O-N 3Å; A124-G127 PolarHBondContact O-N 2.84Å; A124-A128 WeakPolarHBondContact O-CB 3.49Å; A124-A128 PolarHBondContact O-N 3.25Å; A124-W167 HydrophobicContact CB-CZ3 4.27Å
125	A	98.6	Very high	96.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.2	-47.2	173	0	0	0	0	0	110.6	A121 D122 G127 A128 F129 W167	A121-A125 WeakPolarHBondContact O-CB 3.4Å; A121-A125 PolarHBondContact O-N 3.2Å; D122-A125 PolarHBondContact O-N 3.39Å; A125-G127 PolarHBondContact O-N 2.9Å; A125-A128 PolarHBondContact O-N 2.84Å; A125-A128 VanDerWaalsContact O-N 3.13Å; A125-F129 VanDerWaalsContact O-CD2 3.24Å; A125-F129 WeakPolarHBondContact O-CD2 3.49Å; A125-F129 PolarHBondContact O-N 2.62Å; A125-W167 HydrophobicContact CB-CD2 3.74Å; A125-W167 HydrophobicContact CB-CE3 3.61Å; A125-W167 HydrophobicContact CB-CG 4.3Å; A125-W167 HydrophobicContact CB-CH2 4.22Å; A125-W167 HydrophobicContact CB-CZ2 4.37Å; A125-W167 HydrophobicContact CB-CZ3 3.87Å; A125-W167 VanDerWaalsContact CB-O 3.3Å; A125-W167 WeakPolarHBondContact CB-O 3.32Å
126	E	98.5	Very high	96.4	Very high	6 Å²	6	17.1 Å²	17.1	3%	0.028	11%	0.108	C	C	.	.	H	α-helix	trans	-57.6	-49.1	178.6	-73.1	171.5	142.9	0	0	112.1	R95 D122 A123 A124 A128 F129 L130 G170 F173 A174 R492	R95-E126 HydrophobicContact CG-CB 4.36Å; R95-E126 IonicContact CZ-OE2 3.64Å; R95-E126 IonicContact NE-OE2 2.79Å; R95-E126 PolarHBondContact NE-OE2 2.78Å; R95-E126 IonicContact NH2-OE1 2.57Å; R95-E126 IonicContact NH2-OE2 3.27Å; R95-E126 PolarHBondContact NH2-OE2 3.43Å; D122-E126 VanDerWaalsContact O-CG 3.29Å; D122-E126 WeakPolarHBondContact O-CG 3.21Å; D122-E126 PolarHBondContact O-N 2.9Å; A123-E126 PolarHBondContact O-N 2.67Å; A124-E126 VanDerWaalsContact C-N 3.34Å; A124-E126 PolarHBondContact O-N 3Å; E126-A128 VanDerWaalsContact C-N 3.29Å; E126-A128 PolarHBondContact O-N 3.15Å; E126-F129 PolarHBondContact O-N 3.36Å; E126-L130 HydrophobicContact CB-CD1 4.4Å; E126-L130 WeakPolarHBondContact O-CB 3.45Å; E126-L130 WeakPolarHBondContact O-CG 3.47Å; E126-L130 PolarHBondContact O-N 3.1Å; E126-G170 VanDerWaalsContact CG-O 3.32Å; E126-G170 WeakPolarHBondContact CG-O 3.37Å; E126-F173 HydrophobicContact CG-CB 4.36Å; E126-A174 HydrophobicContact CB-CB 4.43Å; E126-A174 HydrophobicContact CG-CB 4.41Å; E126-R492 VanDerWaalsContact OE1-CD 3.28Å; E126-R492 WeakPolarHBondContact OE1-CD 3.21Å; E126-R492 IonicContact OE1-CZ 2.66Å; E126-R492 IonicContact OE1-NE 2.71Å; E126-R492 IonicContact OE1-NH1 2.81Å; E126-R492 PolarHBondContact OE1-NH1 3.4Å; E126-R492 IonicContact OE2-NH1 2.79Å; E126-R492 PolarHBondContact OE2-NH1 2.78Å
127	G	98.2	Very high	96.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.2	-41.8	175.9	0	0	0	0	0	112.6	R95 S99 A123 A124 A125 G131	R95-G127 VanDerWaalsContact O-CA 3.29Å; R95-G127 WeakPolarHBondContact O-CA 3.48Å; S99-G127 VanDerWaalsContact CA-O 3.31Å; S99-G127 WeakPolarHBondContact CA-O 3.44Å; S99-G127 WeakPolarHBondContact CB-O 3.27Å; A123-G127 PolarHBondContact O-N 3.13Å; A124-G127 PolarHBondContact O-N 2.84Å; A125-G127 PolarHBondContact O-N 2.9Å; G127-G131 PolarHBondContact O-N 2.8Å
128	A	98.5	Very high	96.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-52	180	0	0	0	0	0	112.3	I98 V102 I115 A124 A125 E126 S132 F151 W167	I98-A128 HydrophobicContact CG2-CB 3.81Å; V102-A128 HydrophobicContact CG2-CB 4.02Å; I115-A128 HydrophobicContact CG1-CB 4.48Å; A124-A128 WeakPolarHBondContact O-CB 3.49Å; A124-A128 PolarHBondContact O-N 3.25Å; A125-A128 PolarHBondContact O-N 2.84Å; A125-A128 VanDerWaalsContact O-N 3.13Å; E126-A128 VanDerWaalsContact C-N 3.29Å; E126-A128 PolarHBondContact O-N 3.15Å; A128-S132 VanDerWaalsContact O-CB 3.28Å; A128-S132 WeakPolarHBondContact O-CB 3.27Å; A128-S132 PolarHBondContact O-N 3.13Å; A128-S132 PolarHBondContact O-OG 3.44Å; A128-F151 HydrophobicContact CB-CD1 4.2Å; A128-F151 HydrophobicContact CB-CD2 4.31Å; A128-F151 HydrophobicContact CB-CG 4.1Å; A128-W167 HydrophobicContact CB-CH2 4.42Å
129	F	98.3	Very high	96.4	Very high	24 Å²	24	27.6 Å²	27.6	11%	0.105	16%	0.156	C	C	.	.	H	α-helix	trans	-74.9	-34.6	-176.1	-74.4	-82.3	0	0	0	112.8	A125 E126 S132 F133 F151 W167 K171 A174 L175 N178	A125-F129 VanDerWaalsContact O-CD2 3.24Å; A125-F129 WeakPolarHBondContact O-CD2 3.49Å; A125-F129 PolarHBondContact O-N 2.62Å; E126-F129 PolarHBondContact O-N 3.36Å; F129-S132 WeakPolarHBondContact CA-OG 3.46Å; F129-S132 PolarHBondContact O-OG 2.85Å; F129-F133 PolarHBondContact O-N 3.18Å; F129-F151 HydrophobicContact CD1-CD2 4.04Å; F129-F151 HydrophobicContact CD1-CE2 4.47Å; F129-F151 HydrophobicContact CD2-CD2 4.49Å; F129-F151 AromaticContact CE1-CD2 3.83Å; F129-F151 HydrophobicContact CE1-CD2 3.83Å; F129-F151 HydrophobicContact CE2-CB 4.23Å; F129-F151 HydrophobicContact CE2-CD2 4.26Å; F129-F151 HydrophobicContact CG-CD2 4.36Å; F129-F151 HydrophobicContact CZ-CB 4.08Å; F129-F151 AromaticContact CZ-CD2 3.92Å; F129-F151 HydrophobicContact CZ-CD2 3.92Å; F129-F151 HydrophobicContact CZ-CG 4.5Å; F129-W167 HydrophobicContact CE2-CZ2 4.09Å; F129-K171 HydrophobicContact CD1-CG 4.44Å; F129-K171 HydrophobicContact CD2-CB 3.9Å; F129-K171 HydrophobicContact CD2-CG 3.95Å; F129-K171 HydrophobicContact CE1-CD 4.3Å; F129-K171 HydrophobicContact CE1-CG 4.05Å; F129-K171 HydrophobicContact CE2-CB 3.63Å; F129-K171 HydrophobicContact CE2-CD 3.92Å; F129-K171 HydrophobicContact CE2-CG 3.55Å; F129-K171 HydrophobicContact CG-CG 4.41Å; F129-K171 HydrophobicContact CZ-CB 4.21Å; F129-K171 HydrophobicContact CZ-CD 3.64Å; F129-K171 HydrophobicContact CZ-CG 3.61Å; F129-A174 HydrophobicContact CB-CB 3.6Å; F129-L175 HydrophobicContact CD1-CD2 3.97Å; F129-L175 HydrophobicContact CD1-CG 4.41Å; F129-N178 PolarHBondContact O-ND2 3.12Å
130	L	97.8	Very high	96.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.1	-44.9	174.2	-68	173.7	0	0	0	111.2	E126 S132 F133 A174 Q177 R181 M481	E126-L130 HydrophobicContact CB-CD1 4.4Å; E126-L130 WeakPolarHBondContact O-CB 3.45Å; E126-L130 WeakPolarHBondContact O-CG 3.47Å; E126-L130 PolarHBondContact O-N 3.1Å; L130-S132 VanDerWaalsContact C-N 3.29Å; L130-S132 PolarHBondContact O-N 3.17Å; L130-F133 WeakPolarHBondContact O-CB 3.44Å; L130-F133 PolarHBondContact O-N 3Å; L130-A174 HydrophobicContact CD2-CB 4.06Å; L130-A174 HydrophobicContact CG-CB 3.81Å; L130-Q177 HydrophobicContact CD2-CB 3.95Å; L130-Q177 HydrophobicContact CD2-CG 3.93Å; L130-R181 PolarHBondContact O-NH1 3.26Å; L130-M481 HydrophobicContact CB-CG 3.9Å; L130-M481 HydrophobicContact CB-SD 4.16Å; L130-M481 HydrophobicContact CD1-CE 3.78Å; L130-M481 HydrophobicContact CD1-CG 4.34Å; L130-M481 HydrophobicContact CD1-SD 3.56Å; L130-M481 VanDerWaalsContact CD1-SD 3.56Å
131	G	96.2	Very high	96.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.8	-24.3	178.6	0	0	0	0	0	114	S99 G127 N483	S99-G131 WeakPolarHBondContact OG-CA 3.42Å; G127-G131 PolarHBondContact O-N 2.8Å; G131-N483 PolarHBondContact O-ND2 3.32Å
132	S	95.7	Very high	96.5	Very high	30 Å²	30	36 Å²	36	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-81.5	-17	176.8	71.6	0	0	0	0	114.4	R106 A128 F129 L130 F151	R106-S132 PolarHBondContact NH1-O 2.89Å; A128-S132 VanDerWaalsContact O-CB 3.28Å; A128-S132 WeakPolarHBondContact O-CB 3.27Å; A128-S132 PolarHBondContact O-N 3.13Å; A128-S132 PolarHBondContact O-OG 3.44Å; F129-S132 WeakPolarHBondContact CA-OG 3.46Å; F129-S132 PolarHBondContact O-OG 2.85Å; L130-S132 VanDerWaalsContact C-N 3.29Å; L130-S132 PolarHBondContact O-N 3.17Å; S132-F151 VanDerWaalsContact CB-CE2 3.49Å; S132-F151 WeakPolarHBondContact OG-CE2 3.29Å
133	F	96.1	Very high	96.2	Very high	27 Å²	27	42 Å²	42	12%	0.118	22%	0.222	C	C	.	.			trans	-55.6	153.8	-175.7	-175.1	-101.9	0	0	0	111.9	F129 L130 F135 N178 R181 R182 N483 S484	F129-F133 PolarHBondContact O-N 3.18Å; L130-F133 WeakPolarHBondContact O-CB 3.44Å; L130-F133 PolarHBondContact O-N 3Å; F133-F135 HydrophobicContact CE1-CB 4.12Å; F133-F135 HydrophobicContact CZ-CB 4.48Å; F133-N178 WeakPolarHBondContact CB-OD1 3.23Å; F133-N178 HydrophobicContact CD2-CB 3.53Å; F133-N178 VanDerWaalsContact CD2-CG 3.45Å; F133-N178 HydrophobicContact CE2-CB 3.87Å; F133-N178 VanDerWaalsContact CE2-O 3.31Å; F133-N178 WeakPolarHBondContact CE2-O 3.32Å; F133-N178 HydrophobicContact CG-CB 4.34Å; F133-R181 HydrophobicContact CD1-CB 4.42Å; F133-R181 HydrophobicContact CE1-CB 3.77Å; F133-R181 HydrophobicContact CE2-CB 4.45Å; F133-R181 HydrophobicContact CZ-CB 3.79Å; F133-R182 HydrophobicContact CE2-CB 4.22Å; F133-R182 HydrophobicContact CZ-CB 4Å; F133-N483 PolarHBondContact O-ND2 2.9Å; F133-N483 PolarHBondContact O-OD1 2.79Å; F133-S484 WeakPolarHBondContact CE1-OG 3.06Å
134	A	94.5	Very high	96	Very high	25 Å²	25	46 Å²	46	21%	0.207	24%	0.243	C	C	.	.			trans	-155.8	130.3	169.1	0	0	0	0	0	107.8	D136 K146	A134-D136 WeakPolarHBondContact CB-OD2 3.4Å; A134-D136 PolarHBondContact O-N 2.88Å; A134-K146 HydrophobicContact CB-CB 4.04Å; A134-K146 HydrophobicContact CB-CD 3.83Å; A134-K146 HydrophobicContact CB-CG 4.09Å
135	F	95.5	Very high	95.8	Very high	48 Å²	48	50.9 Å²	50.9	21%	0.211	26%	0.262	C	S	.	.			trans	-93.7	87.2	167.6	-171.9	-98.7	0	0	0	108.8	F133 E137 L138 R182 D185 M186	F133-F135 HydrophobicContact CE1-CB 4.12Å; F133-F135 HydrophobicContact CZ-CB 4.48Å; F135-E137 HydrophobicContact CE2-CG 4.09Å; F135-E137 HydrophobicContact CZ-CG 4.46Å; F135-L138 HydrophobicContact CE1-CD1 3.93Å; F135-L138 HydrophobicContact CE1-CG 4.29Å; F135-L138 HydrophobicContact CZ-CD1 3.83Å; F135-L138 HydrophobicContact CZ-CG 4.07Å; F135-R182 HydrophobicContact CD2-CG 4.47Å; F135-R182 HydrophobicContact CE2-CG 4.42Å; F135-D185 HydrophobicContact CB-CB 4.03Å; F135-D185 HydrophobicContact CD1-CB 3.83Å; F135-D185 HydrophobicContact CD2-CB 3.73Å; F135-D185 HydrophobicContact CE1-CB 4.23Å; F135-D185 HydrophobicContact CE2-CB 4.15Å; F135-D185 HydrophobicContact CG-CB 3.56Å; F135-D185 HydrophobicContact CZ-CB 4.39Å; F135-M186 HydrophobicContact CE2-CE 4.08Å; F135-M186 HydrophobicContact CE2-SD 4.25Å; F135-M186 HydrophobicContact CZ-CB 4.48Å; F135-M186 HydrophobicContact CZ-CE 4.36Å; F135-M186 HydrophobicContact CZ-SD 3.92Å
136	D	95.4	Very high	95.5	Very high	21 Å²	21	55 Å²	55	11%	0.112	28%	0.28	C	S	.	.			trans	-137	11.6	178.7	56.5	24.4	0	0	0	113.2	A134 L138 K139 R145 K146	A134-D136 WeakPolarHBondContact CB-OD2 3.4Å; A134-D136 PolarHBondContact O-N 2.88Å; D136-L138 PolarHBondContact O-N 3.29Å; D136-L138 VanDerWaalsContact O-N 3.13Å; D136-K139 HydrophobicContact CB-CD 3.92Å; D136-K139 HydrophobicContact CB-CG 4.09Å; D136-K139 VanDerWaalsContact O-CB 3.32Å; D136-K139 WeakPolarHBondContact O-CB 3.3Å; D136-K139 WeakPolarHBondContact O-CG 3.48Å; D136-K139 PolarHBondContact O-N 3.06Å; D136-R145 HydrophobicContact CB-CG 4.49Å; D136-R145 WeakPolarHBondContact OD2-CA 3.42Å; D136-K146 WeakPolarHBondContact OD2-CG 3.27Å; D136-K146 PolarHBondContact OD2-N 2.87Å
137	E	94.5	Very high	95.1	Very high	73 Å²	73	58 Å²	58	34%	0.341	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.8	179.2	61.2	-177.6	-134.5	0	0	113.3	F135 K139 R145 R182 M186	F135-E137 HydrophobicContact CE2-CG 4.09Å; F135-E137 HydrophobicContact CZ-CG 4.46Å; E137-K139 VanDerWaalsContact C-N 3.34Å; E137-R145 PolarHBondContact O-NH2 2.8Å; E137-R182 IonicContact OE1-CZ 3.56Å; E137-R182 IonicContact OE1-NE 2.76Å; E137-R182 PolarHBondContact OE1-NE 2.98Å; E137-R182 IonicContact OE1-NH2 3.78Å; E137-R182 PolarHBondContact OE1-NH2 3.21Å; E137-R182 IonicContact OE2-CZ 3.55Å; E137-R182 IonicContact OE2-NE 3.18Å; E137-R182 PolarHBondContact OE2-NE 3.23Å; E137-R182 IonicContact OE2-NH2 2.7Å; E137-R182 PolarHBondContact OE2-NH2 2.86Å; E137-M186 WeakPolarHBondContact OE1-CE 2.93Å
138	L	96.3	Very high	94.7	Very high	82 Å²	82	64.1 Å²	64.1	43%	0.429	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.4	177.1	-56.3	-175.4	0	0	0	113.8	F135 D136 S140 M186 P187 L190	F135-L138 HydrophobicContact CE1-CD1 3.93Å; F135-L138 HydrophobicContact CE1-CG 4.29Å; F135-L138 HydrophobicContact CZ-CD1 3.83Å; F135-L138 HydrophobicContact CZ-CG 4.07Å; D136-L138 PolarHBondContact O-N 3.29Å; D136-L138 VanDerWaalsContact O-N 3.13Å; L138-S140 PolarHBondContact O-N 2.93Å; L138-M186 HydrophobicContact CD1-SD 4.33Å; L138-M186 HydrophobicContact CD2-SD 4.4Å; L138-P187 VanDerWaalsContact CD1-CD 3.45Å; L138-P187 HydrophobicContact CD1-CG 3.61Å; L138-L190 HydrophobicContact CD1-CD1 3.92Å; L138-L190 HydrophobicContact CD2-CD1 3.62Å; L138-L190 HydrophobicContact CG-CD1 4.45Å
139	K	96.9	Very high	94.6	Very high	94 Å²	94	64.9 Å²	64.9	41%	0.409	34%	0.341	S	S	.	.			trans	-70.5	127.9	173.4	-61.6	-168.6	-173.8	-178.6	0	109.3	D136 E137 D144 R145	D136-K139 HydrophobicContact CB-CD 3.92Å; D136-K139 HydrophobicContact CB-CG 4.09Å; D136-K139 VanDerWaalsContact O-CB 3.32Å; D136-K139 WeakPolarHBondContact O-CB 3.3Å; D136-K139 WeakPolarHBondContact O-CG 3.48Å; D136-K139 PolarHBondContact O-N 3.06Å; E137-K139 VanDerWaalsContact C-N 3.34Å; K139-D144 HydrophobicContact CB-CB 4.46Å; K139-D144 HydrophobicContact CD-CB 3.71Å; K139-D144 VanDerWaalsContact CD-O 3.26Å; K139-D144 WeakPolarHBondContact CD-O 3.49Å; K139-D144 PolarHBondContact NZ-O 3.26Å; K139-R145 HydrophobicContact CB-CG 4.24Å; K139-R145 VanDerWaalsContact O-CZ 3.28Å; K139-R145 PolarHBondContact O-NE 2.77Å; K139-R145 PolarHBondContact O-NH2 2.82Å
140	S	96.3	Very high	94.5	Very high	110 Å²	110	70.3 Å²	70.3	77%	0.769	37%	0.365	S	S	*	.	S	Bend	trans	-71.5	-30.9	-175.6	55.2	0	0	0	0	113.5	L138	L138-S140 PolarHBondContact O-N 2.93Å
141	K	96.2	Very high	94.5	Very high	112 Å²	112	71 Å²	71	49%	0.487	37%	0.368	S	S	.	.	S	Bend	trans	-89.9	118.9	179.3	-71.6	-177.9	-178.2	-177.5	0	110.9	E143 D144	K141-E143 HydrophobicContact CB-CG 4.25Å; K141-E143 PolarHBondContact O-N 2.97Å; K141-D144 HydrophobicContact CB-CB 4.29Å; K141-D144 WeakPolarHBondContact CB-OD2 3.48Å; K141-D144 WeakPolarHBondContact CD-OD2 3.41Å; K141-D144 PolarHBondContact O-N 3.08Å; K141-D144 VanDerWaalsContact O-N 3.1Å
142	P	90.6	Very high	94.5	Very high	91 Å²	91	74.4 Å²	74.4	59%	0.591	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-57.3	-33.1	177.7	-26.7	35.9	0	0	0	113.9	D144 R145	P142-D144 PolarHBondContact O-N 2.89Å; P142-R145 WeakPolarHBondContact O-CB 3.43Å; P142-R145 PolarHBondContact O-N 2.92Å; P142-R145 VanDerWaalsContact O-N 3.12Å
143	E	91.1	Very high	94.4	Very high	139 Å²	139	74.3 Å²	74.3	65%	0.65	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-67.2	-21.3	178.1	64	-89.4	-152.2	0	0	114	K141 R145	K141-E143 HydrophobicContact CB-CG 4.25Å; K141-E143 PolarHBondContact O-N 2.97Å; E143-R145 VanDerWaalsContact C-N 3.3Å
144	D	92.9	Very high	94.3	Very high	83 Å²	83	73.9 Å²	73.9	44%	0.444	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-85.8	-6.4	175.5	-66.4	-31.4	0	0	0	112.3	K139 K141 P142	K139-D144 HydrophobicContact CB-CB 4.46Å; K139-D144 HydrophobicContact CD-CB 3.71Å; K139-D144 VanDerWaalsContact CD-O 3.26Å; K139-D144 WeakPolarHBondContact CD-O 3.49Å; K139-D144 PolarHBondContact NZ-O 3.26Å; K141-D144 HydrophobicContact CB-CB 4.29Å; K141-D144 WeakPolarHBondContact CB-OD2 3.48Å; K141-D144 WeakPolarHBondContact CD-OD2 3.41Å; K141-D144 PolarHBondContact O-N 3.08Å; K141-D144 VanDerWaalsContact O-N 3.1Å; P142-D144 PolarHBondContact O-N 2.89Å
145	R	94	Very high	93.7	Very high	104 Å²	104	75 Å²	75	39%	0.392	38%	0.382	S	S	.	.	S	Bend	trans	-89.2	142.4	176.6	-55.5	-178.4	-173.5	174.2	-3.3	110.1	D136 E137 K139 P142 E143	D136-R145 HydrophobicContact CB-CG 4.49Å; D136-R145 WeakPolarHBondContact OD2-CA 3.42Å; E137-R145 PolarHBondContact O-NH2 2.8Å; K139-R145 HydrophobicContact CB-CG 4.24Å; K139-R145 VanDerWaalsContact O-CZ 3.28Å; K139-R145 PolarHBondContact O-NE 2.77Å; K139-R145 PolarHBondContact O-NH2 2.82Å; P142-R145 WeakPolarHBondContact O-CB 3.43Å; P142-R145 PolarHBondContact O-N 2.92Å; P142-R145 VanDerWaalsContact O-N 3.12Å; E143-R145 VanDerWaalsContact C-N 3.3Å
146	K	91.9	Very high	92.9	Very high	85 Å²	85	74.4 Å²	74.4	37%	0.37	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-70.8	134.9	178	-60.7	-166.3	-166.9	118.6	0	109.2	A134 D136	A134-K146 HydrophobicContact CB-CB 4.04Å; A134-K146 HydrophobicContact CB-CD 3.83Å; A134-K146 HydrophobicContact CB-CG 4.09Å; D136-K146 WeakPolarHBondContact OD2-CG 3.27Å; D136-K146 PolarHBondContact OD2-N 2.87Å
147	P	89.5	Confident	91.8	Very high	71 Å²	71	76.5 Å²	76.5	46%	0.461	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-66.7	142	-179.9	27.2	-34	0	0	0	111	R106	R106-P147 HydrophobicContact CG-CG 4.09Å
148	T	91.3	Very high	90.3	Very high	128 Å²	128	81.5 Å²	81.5	79%	0.785	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-68.8	132.7	173.2	-52	0	0	0	0	110.3
149	M	95	Very high	88.7	Confident	15 Å²	15	84.1 Å²	84.1	7%	0.074	45%	0.445	C	S	.	.			trans	-106.8	146.1	173.4	-67.8	-178.2	74.1	0	0	111	V102 L105 R106 V110 T111 A113 F151	V102-M149 HydrophobicContact CG1-SD 4.18Å; L105-M149 HydrophobicContact CB-CE 3.96Å; R106-M149 HydrophobicContact CB-SD 3.52Å; R106-M149 VanDerWaalsContact CB-SD 3.52Å; R106-M149 HydrophobicContact CG-CG 4.44Å; R106-M149 HydrophobicContact CG-SD 3.98Å; V110-M149 HydrophobicContact CB-CE 4.11Å; V110-M149 HydrophobicContact CG1-CE 3.8Å; T111-M149 WeakPolarHBondContact O-CA 3.44Å; A113-M149 HydrophobicContact CB-CE 3.94Å; M149-F151 HydrophobicContact CB-CE1 3.88Å; M149-F151 HydrophobicContact CB-CE2 4.14Å; M149-F151 HydrophobicContact CB-CZ 3.52Å; M149-F151 HydrophobicContact CE-CE1 3.95Å; M149-F151 HydrophobicContact CE-CZ 4.48Å; M149-F151 HydrophobicContact CG-CZ 4.43Å; M149-F151 HydrophobicContact SD-CE1 4.21Å; M149-F151 HydrophobicContact SD-CZ 4.16Å
150	K	97.4	Very high	87.8	Confident	138 Å²	138	83.8 Å²	83.8	60%	0.6	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.6	167.8	-63.7	179.1	-177.1	177.3	0	109.7	T111 E112 A113	T111-K150 PolarHBondContact O-N 3.46Å; E112-K150 CarbonylContact C-O 3.58Å; E112-K150 WeakPolarHBondContact CA-O 3.37Å; E112-K150 HydrophobicContact CG-CB 4.26Å; A113-K150 PolarHBondContact N-O 2.99Å
151	F	97.8	Very high	87.2	Confident	15 Å²	15	83 Å²	83	7%	0.066	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.4	179.5	-56.2	-65.7	0	0	0	110.7	V102 A113 I115 A128 F129 S132 M149 W167	V102-F151 HydrophobicContact CB-CE1 4.33Å; V102-F151 HydrophobicContact CB-CZ 4.47Å; V102-F151 HydrophobicContact CG1-CE1 3.8Å; V102-F151 HydrophobicContact CG1-CZ 3.52Å; V102-F151 HydrophobicContact CG2-CD1 4.28Å; V102-F151 HydrophobicContact CG2-CE1 3.57Å; V102-F151 HydrophobicContact CG2-CZ 4.06Å; A113-F151 HydrophobicContact CB-CD1 3.98Å; A113-F151 HydrophobicContact CB-CE1 4.18Å; A113-F151 WeakPolarHBondContact O-CA 3.34Å; I115-F151 HydrophobicContact CD1-CD1 4.29Å; I115-F151 HydrophobicContact CG1-CD1 4.36Å; A128-F151 HydrophobicContact CB-CD1 4.2Å; A128-F151 HydrophobicContact CB-CD2 4.31Å; A128-F151 HydrophobicContact CB-CG 4.1Å; F129-F151 HydrophobicContact CD1-CD2 4.04Å; F129-F151 HydrophobicContact CD1-CE2 4.47Å; F129-F151 HydrophobicContact CD2-CD2 4.49Å; F129-F151 AromaticContact CE1-CD2 3.83Å; F129-F151 HydrophobicContact CE1-CD2 3.83Å; F129-F151 HydrophobicContact CE2-CB 4.23Å; F129-F151 HydrophobicContact CE2-CD2 4.26Å; F129-F151 HydrophobicContact CG-CD2 4.36Å; F129-F151 HydrophobicContact CZ-CB 4.08Å; F129-F151 AromaticContact CZ-CD2 3.92Å; F129-F151 HydrophobicContact CZ-CD2 3.92Å; F129-F151 HydrophobicContact CZ-CG 4.5Å; S132-F151 VanDerWaalsContact CB-CE2 3.49Å; S132-F151 WeakPolarHBondContact OG-CE2 3.29Å; M149-F151 HydrophobicContact CB-CE1 3.88Å; M149-F151 HydrophobicContact CB-CE2 4.14Å; M149-F151 HydrophobicContact CB-CZ 3.52Å; M149-F151 HydrophobicContact CE-CE1 3.95Å; M149-F151 HydrophobicContact CE-CZ 4.48Å; M149-F151 HydrophobicContact CG-CZ 4.43Å; M149-F151 HydrophobicContact SD-CE1 4.21Å; M149-F151 HydrophobicContact SD-CZ 4.16Å; F151-W167 HydrophobicContact CB-CH2 4.29Å; F151-W167 HydrophobicContact CB-CZ2 3.83Å
152	H	95.7	Very high	86.8	Confident	71 Å²	71	82.5 Å²	82.5	33%	0.329	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.1	177.2	-57.7	-86.8	0	0	0	108.7	E112 A113 F114 I115 Y154	E112-H152 IonicContact OE1-CD2 2.74Å; E112-H152 IonicContact OE1-NE2 3.42Å; E112-H152 PolarHBondContact OE1-NE2 2.92Å; A113-H152 PolarHBondContact O-N 2.82Å; F114-H152 CarbonylContact C-O 3.59Å; F114-H152 WeakPolarHBondContact CA-O 3.47Å; F114-H152 HydrophobicContact CD1-CB 3.83Å; F114-H152 HydrophobicContact CE1-CB 4Å; F114-H152 HydrophobicContact CG-CB 4.47Å; I115-H152 PolarHBondContact N-O 2.95Å; H152-Y154 PolarHBondContact O-N 2.89Å
153	V	94.6	Very high	86.8	Confident	28 Å²	28	79.6 Å²	79.6	17%	0.17	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	128.8	167.5	63.6	0	0	0	0	108.9	P117 N155 L163 W167	P117-V153 HydrophobicContact CB-CG2 4.43Å; V153-N155 PolarHBondContact O-N 3.12Å; V153-L163 HydrophobicContact CG2-CD2 3.79Å; V153-L163 HydrophobicContact CG2-CG 4.11Å; V153-W167 HydrophobicContact CB-CB 4.46Å; V153-W167 HydrophobicContact CB-CD2 3.85Å; V153-W167 HydrophobicContact CB-CE3 3.93Å; V153-W167 HydrophobicContact CB-CG 4.07Å; V153-W167 HydrophobicContact CG2-CE3 4.25Å
154	Y	93.7	Very high	86.9	Confident	19 Å²	19	75.9 Å²	75.9	8%	0.075	40%	0.404	C	S	.	.			trans	-80.6	103.3	173.6	-177.6	-121.2	0	0	0	108.6	L8 L10 A29 Y66 F114 I115 H152 V156	L8-Y154 HydrophobicContact CD1-CD1 3.75Å; L8-Y154 HydrophobicContact CD1-CD2 3.56Å; L8-Y154 HydrophobicContact CD1-CE1 4.02Å; L8-Y154 HydrophobicContact CD1-CE2 3.84Å; L8-Y154 HydrophobicContact CD1-CG 3.51Å; L10-Y154 HydrophobicContact CD2-CD1 4.28Å; L10-Y154 HydrophobicContact CD2-CE1 4.17Å; A29-Y154 HydrophobicContact CB-CD1 3.87Å; A29-Y154 HydrophobicContact CB-CE1 4.07Å; Y66-Y154 WeakPolarHBondContact OH-CE2 3.36Å; F114-Y154 HydrophobicContact CB-CD2 4.1Å; F114-Y154 HydrophobicContact CB-CG 4.44Å; I115-Y154 WeakPolarHBondContact O-CB 3.28Å; I115-Y154 PolarHBondContact O-N 3.49Å; H152-Y154 PolarHBondContact O-N 2.89Å; Y154-V156 HydrophobicContact CD1-CG2 4.19Å; Y154-V156 HydrophobicContact CE1-CG2 3.67Å
155	N	82	Confident	86.9	Confident	48 Å²	48	77.5 Å²	77.5	26%	0.257	41%	0.409	S	S	.	.			trans	-97.4	125.1	-179.7	-169.9	-12	0	0	0	110.8	V153 H158 L159	V153-N155 PolarHBondContact O-N 3.12Å; N155-H158 PolarHBondContact ND2-O 3.16Å; N155-H158 PolarHBondContact OD1-O 3.2Å; N155-L159 VanDerWaalsContact ND2-CA 3.34Å; N155-L159 WeakPolarHBondContact ND2-CA 3.45Å
156	V	78.2	Confident	87	Confident	36 Å²	36	75.2 Å²	75.2	22%	0.218	41%	0.405	C	S	.	.	S	Bend	trans	-100.4	99.2	171.1	178.3	0	0	0	0	108.5	F28 A29 S32 Y154	F28-V156 HydrophobicContact CD1-CB 4.3Å; F28-V156 HydrophobicContact CD1-CG1 4.44Å; F28-V156 HydrophobicContact CE1-CB 3.87Å; F28-V156 HydrophobicContact CE1-CG1 3.71Å; F28-V156 HydrophobicContact CZ-CG1 4.31Å; A29-V156 HydrophobicContact CB-CG2 4.1Å; S32-V156 VanDerWaalsContact CB-CG1 3.45Å; S32-V156 WeakPolarHBondContact OG-CG1 3.32Å; Y154-V156 HydrophobicContact CD1-CG2 4.19Å; Y154-V156 HydrophobicContact CE1-CG2 3.67Å
157	G	71.3	Confident	87.2	Confident	64 Å²	64	71.5 Å²	71.5	66%	0.66	39%	0.388	S	S	*	.	S	Bend	trans	110.8	-139.4	178.1	0	0	0	0	0	113.3
158	H	63.8	Low	87.6	Confident	178 Å²	178	71.4 Å²	71.4	82%	0.824	38%	0.382	S	S	*	.	S	Bend	trans	-81.1	152.8	-177.5	-75.3	8.2	0	0	0	112	N155 D160	N155-H158 PolarHBondContact ND2-O 3.16Å; N155-H158 PolarHBondContact OD1-O 3.2Å; H158-D160 PolarHBondContact O-N 2.87Å
159	L	61.6	Low	87.9	Confident	137 Å²	137	68.3 Å²	68.3	72%	0.717	36%	0.356	S	S	*	.			trans	-62	105.3	176.1	-138.1	93.3	0	0	0	109.6	N155 V161	N155-L159 VanDerWaalsContact ND2-CA 3.34Å; N155-L159 WeakPolarHBondContact ND2-CA 3.45Å; L159-V161 PolarHBondContact O-N 3.28Å
160	D	78.9	Confident	88.1	Confident	87 Å²	87	67.6 Å²	67.6	47%	0.465	35%	0.352	S	S	.	.			trans	-80.3	109	168.9	-175.9	-6.3	0	0	0	107.4	H158 L162 L163 D164	H158-D160 PolarHBondContact O-N 2.87Å; D160-L162 PolarHBondContact O-N 2.88Å; D160-L162 WeakPolarHBondContact OD1-CB 3.39Å; D160-L162 PolarHBondContact OD1-N 3.09Å; D160-L162 VanDerWaalsContact OD1-N 3.08Å; D160-L163 HydrophobicContact CB-CB 3.81Å; D160-L163 VanDerWaalsContact O-CB 3.31Å; D160-L163 WeakPolarHBondContact O-CB 3.49Å; D160-L163 PolarHBondContact O-N 2.8Å; D160-D164 PolarHBondContact O-N 2.74Å
161	V	84.3	Confident	88.1	Confident	95 Å²	95	64.3 Å²	64.3	58%	0.576	34%	0.338	S	S	*	.	H	α-helix	trans	-55.5	-38.2	-179.2	176.5	0	0	0	0	110.5	L159 L163 D164 E165	L159-V161 PolarHBondContact O-N 3.28Å; V161-L163 VanDerWaalsContact C-N 3.3Å; V161-L163 PolarHBondContact O-N 2.81Å; V161-D164 PolarHBondContact O-N 2.88Å; V161-E165 HydrophobicContact CG1-CG 4.41Å; V161-E165 WeakPolarHBondContact O-CG 3.48Å; V161-E165 PolarHBondContact O-N 2.58Å
162	L	88.1	Confident	88.2	Confident	100 Å²	100	65 Å²	65	52%	0.524	34%	0.344	S	S	.	.	H	α-helix	trans	-65.6	-36	178.6	-179.4	62	0	0	0	111.7	D160 L166	D160-L162 PolarHBondContact O-N 2.88Å; D160-L162 WeakPolarHBondContact OD1-CB 3.39Å; D160-L162 PolarHBondContact OD1-N 3.09Å; D160-L162 VanDerWaalsContact OD1-N 3.08Å; L162-L166 HydrophobicContact CD1-CD1 4.49Å; L162-L166 HydrophobicContact CD1-CG 4.44Å; L162-L166 HydrophobicContact CG-CD1 4.27Å; L162-L166 WeakPolarHBondContact O-CB 3.13Å; L162-L166 VanDerWaalsContact O-CG 3.28Å; L162-L166 WeakPolarHBondContact O-CG 3.37Å; L162-L166 PolarHBondContact O-N 3.38Å
163	L	90.4	Very high	88.3	Confident	30 Å²	30	62 Å²	62	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-65.8	-43.9	177.7	-170.8	75.6	0	0	0	111.5	P117 A121 V153 D160 V161 W167	P117-L163 HydrophobicContact CB-CD1 3.78Å; P117-L163 HydrophobicContact CG-CD1 4.04Å; P117-L163 HydrophobicContact CG-CD2 4.43Å; A121-L163 HydrophobicContact CB-CD1 3.58Å; A121-L163 HydrophobicContact CB-CG 4.28Å; V153-L163 HydrophobicContact CG2-CD2 3.79Å; V153-L163 HydrophobicContact CG2-CG 4.11Å; D160-L163 HydrophobicContact CB-CB 3.81Å; D160-L163 VanDerWaalsContact O-CB 3.31Å; D160-L163 WeakPolarHBondContact O-CB 3.49Å; D160-L163 PolarHBondContact O-N 2.8Å; V161-L163 VanDerWaalsContact C-N 3.3Å; V161-L163 PolarHBondContact O-N 2.81Å; L163-W167 WeakPolarHBondContact O-CB 2.9Å; L163-W167 PolarHBondContact O-N 2.86Å
164	D	91.6	Very high	88.5	Confident	62 Å²	62	60.6 Å²	60.6	33%	0.332	32%	0.321	S	S	.	.	H	α-helix	trans	-66.7	-42.5	176.6	-173.6	59.7	0	0	0	111.2	D160 V161 L166 W167 Q168	D160-D164 PolarHBondContact O-N 2.74Å; V161-D164 PolarHBondContact O-N 2.88Å; D164-L166 PolarHBondContact O-N 3.46Å; D164-W167 WeakPolarHBondContact O-CB 3.5Å; D164-W167 PolarHBondContact O-N 2.89Å; D164-W167 VanDerWaalsContact O-N 3.17Å; D164-Q168 WeakPolarHBondContact O-CG 3.38Å; D164-Q168 PolarHBondContact O-N 3.28Å; D164-Q168 PolarHBondContact OD1-NE2 3.17Å; D164-Q168 VanDerWaalsContact OD1-NE2 3.14Å
165	E	94	Very high	88.8	Confident	116 Å²	116	63.6 Å²	63.6	54%	0.542	34%	0.338	S	S	.	.	H	α-helix	trans	-57.3	-46.4	175.1	-75.4	176.1	178.4	0	0	112.2	V161 Q168 R169	V161-E165 HydrophobicContact CG1-CG 4.41Å; V161-E165 WeakPolarHBondContact O-CG 3.48Å; V161-E165 PolarHBondContact O-N 2.58Å; E165-Q168 PolarHBondContact O-N 3.18Å; E165-R169 VanDerWaalsContact O-CB 3.23Å; E165-R169 WeakPolarHBondContact O-CB 3.44Å; E165-R169 PolarHBondContact O-N 2.56Å
166	L	95.4	Very high	89.6	Confident	57 Å²	57	61.4 Å²	61.4	30%	0.298	33%	0.327	S	S	.	.	H	α-helix	trans	-63.8	-41.7	175.8	-72.1	173.3	0	0	0	111.9	A121 D122 L162 D164 R169 G170	A121-L166 HydrophobicContact CB-CB 4.02Å; D122-L166 VanDerWaalsContact CA-O 3.26Å; D122-L166 WeakPolarHBondContact CA-O 3.41Å; D122-L166 HydrophobicContact CB-CB 4.37Å; D122-L166 VanDerWaalsContact CB-O 3.25Å; D122-L166 WeakPolarHBondContact CB-O 3.36Å; L162-L166 HydrophobicContact CD1-CD1 4.49Å; L162-L166 HydrophobicContact CD1-CG 4.44Å; L162-L166 HydrophobicContact CG-CD1 4.27Å; L162-L166 WeakPolarHBondContact O-CB 3.13Å; L162-L166 VanDerWaalsContact O-CG 3.28Å; L162-L166 WeakPolarHBondContact O-CG 3.37Å; L162-L166 PolarHBondContact O-N 3.38Å; D164-L166 PolarHBondContact O-N 3.46Å; L166-R169 PolarHBondContact O-N 3.19Å; L166-G170 PolarHBondContact O-N 2.57Å
167	W	97	Very high	90.5	Very high	6 Å²	6	59.7 Å²	59.7	2%	0.023	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-49.4	176.5	176.3	-91.9	0	0	0	112.1	I115 A124 A125 A128 F129 F151 V153 L163 D164 R169 G170 K171	I115-W167 HydrophobicContact CB-CH2 3.7Å; I115-W167 HydrophobicContact CB-CZ3 3.87Å; I115-W167 HydrophobicContact CG1-CH2 3.76Å; I115-W167 HydrophobicContact CG1-CZ3 4.43Å; I115-W167 HydrophobicContact CG2-CH2 4.16Å; I115-W167 HydrophobicContact CG2-CZ3 4.01Å; A124-W167 HydrophobicContact CB-CZ3 4.27Å; A125-W167 HydrophobicContact CB-CD2 3.74Å; A125-W167 HydrophobicContact CB-CE3 3.61Å; A125-W167 HydrophobicContact CB-CG 4.3Å; A125-W167 HydrophobicContact CB-CH2 4.22Å; A125-W167 HydrophobicContact CB-CZ2 4.37Å; A125-W167 HydrophobicContact CB-CZ3 3.87Å; A125-W167 VanDerWaalsContact CB-O 3.3Å; A125-W167 WeakPolarHBondContact CB-O 3.32Å; A128-W167 HydrophobicContact CB-CH2 4.42Å; F129-W167 HydrophobicContact CE2-CZ2 4.09Å; F151-W167 HydrophobicContact CB-CH2 4.29Å; F151-W167 HydrophobicContact CB-CZ2 3.83Å; V153-W167 HydrophobicContact CB-CB 4.46Å; V153-W167 HydrophobicContact CB-CD2 3.85Å; V153-W167 HydrophobicContact CB-CE3 3.93Å; V153-W167 HydrophobicContact CB-CG 4.07Å; V153-W167 HydrophobicContact CG2-CE3 4.25Å; L163-W167 WeakPolarHBondContact O-CB 2.9Å; L163-W167 PolarHBondContact O-N 2.86Å; D164-W167 WeakPolarHBondContact O-CB 3.5Å; D164-W167 PolarHBondContact O-N 2.89Å; D164-W167 VanDerWaalsContact O-N 3.17Å; W167-R169 VanDerWaalsContact C-N 3.28Å; W167-R169 PolarHBondContact O-N 3.35Å; W167-G170 PolarHBondContact O-N 2.98Å; W167-K171 WeakPolarHBondContact O-CB 3.15Å; W167-K171 PolarHBondContact O-N 3.49Å
168	Q	97.4	Very high	91.8	Very high	70 Å²	70	57.2 Å²	57.2	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-39.8	177.7	-64.1	-49.1	-38.5	0	0	110.9	D164 E165 K171 T172	D164-Q168 WeakPolarHBondContact O-CG 3.38Å; D164-Q168 PolarHBondContact O-N 3.28Å; D164-Q168 PolarHBondContact OD1-NE2 3.17Å; D164-Q168 VanDerWaalsContact OD1-NE2 3.14Å; E165-Q168 PolarHBondContact O-N 3.18Å; Q168-K171 WeakPolarHBondContact O-CB 3.38Å; Q168-K171 PolarHBondContact O-N 3.23Å; Q168-T172 PolarHBondContact O-N 3.39Å; Q168-T172 PolarHBondContact O-OG1 2.78Å; Q168-T172 VanDerWaalsContact O-OG1 3.06Å
169	R	97.9	Very high	93.5	Very high	62 Å²	62	49.9 Å²	49.9	23%	0.234	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-51.3	174.7	179.6	180	173.7	73.7	8.2	111.9	E165 L166 W167 K171 T172 F173 L305 H496 E499	E165-R169 VanDerWaalsContact O-CB 3.23Å; E165-R169 WeakPolarHBondContact O-CB 3.44Å; E165-R169 PolarHBondContact O-N 2.56Å; L166-R169 PolarHBondContact O-N 3.19Å; W167-R169 VanDerWaalsContact C-N 3.28Å; W167-R169 PolarHBondContact O-N 3.35Å; R169-K171 VanDerWaalsContact C-N 3.31Å; R169-K171 PolarHBondContact O-N 3.12Å; R169-T172 PolarHBondContact O-N 3.3Å; R169-F173 HydrophobicContact CG-CD2 4.18Å; R169-F173 HydrophobicContact CG-CE2 4.15Å; R169-F173 VanDerWaalsContact NH2-CZ 3.3Å; R169-F173 VanDerWaalsContact O-CD2 3.31Å; R169-F173 WeakPolarHBondContact O-CD2 3.23Å; R169-F173 PolarHBondContact O-N 2.99Å; R169-L305 HydrophobicContact CG-CD2 4.29Å; R169-H496 PolarHBondContact NH2-ND1 2.86Å; R169-E499 IonicContact CZ-OE1 2.96Å; R169-E499 IonicContact CZ-OE2 2.71Å; R169-E499 IonicContact NH1-OE1 2.99Å; R169-E499 PolarHBondContact NH1-OE1 2.97Å; R169-E499 IonicContact NH1-OE2 3.92Å; R169-E499 IonicContact NH2-OE1 3.56Å; R169-E499 PolarHBondContact NH2-OE1 3.27Å; R169-E499 IonicContact NH2-OE2 3.1Å; R169-E499 PolarHBondContact NH2-OE2 3.42Å
170	G	98.5	Very high	95.3	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-38	178.7	0	0	0	0	0	112.8	D122 E126 L166 W167 F173 A174	D122-G170 WeakPolarHBondContact O-CA 3.21Å; E126-G170 VanDerWaalsContact CG-O 3.32Å; E126-G170 WeakPolarHBondContact CG-O 3.37Å; L166-G170 PolarHBondContact O-N 2.57Å; W167-G170 PolarHBondContact O-N 2.98Å; G170-F173 PolarHBondContact O-N 2.89Å; G170-A174 WeakPolarHBondContact O-CB 3.19Å; G170-A174 PolarHBondContact O-N 3Å
171	K	98.6	Very high	96.2	Very high	68 Å²	68	39.2 Å²	39.2	30%	0.296	20%	0.199	S	C	.	.	H	α-helix	trans	-58.6	-50.2	171.3	171.1	-176.5	170.8	-163.9	0	111.5	F129 W167 Q168 R169 F173 A174 L175	F129-K171 HydrophobicContact CD1-CG 4.44Å; F129-K171 HydrophobicContact CD2-CB 3.9Å; F129-K171 HydrophobicContact CD2-CG 3.95Å; F129-K171 HydrophobicContact CE1-CD 4.3Å; F129-K171 HydrophobicContact CE1-CG 4.05Å; F129-K171 HydrophobicContact CE2-CB 3.63Å; F129-K171 HydrophobicContact CE2-CD 3.92Å; F129-K171 HydrophobicContact CE2-CG 3.55Å; F129-K171 HydrophobicContact CG-CG 4.41Å; F129-K171 HydrophobicContact CZ-CB 4.21Å; F129-K171 HydrophobicContact CZ-CD 3.64Å; F129-K171 HydrophobicContact CZ-CG 3.61Å; W167-K171 WeakPolarHBondContact O-CB 3.15Å; W167-K171 PolarHBondContact O-N 3.49Å; Q168-K171 WeakPolarHBondContact O-CB 3.38Å; Q168-K171 PolarHBondContact O-N 3.23Å; R169-K171 VanDerWaalsContact C-N 3.31Å; R169-K171 PolarHBondContact O-N 3.12Å; K171-F173 VanDerWaalsContact C-N 3.32Å; K171-F173 PolarHBondContact O-N 3.34Å; K171-A174 PolarHBondContact O-N 3.35Å; K171-L175 HydrophobicContact CD-CD1 4.49Å; K171-L175 HydrophobicContact CG-CD1 3.81Å; K171-L175 HydrophobicContact CG-CG 4.25Å; K171-L175 WeakPolarHBondContact O-CB 3.14Å; K171-L175 VanDerWaalsContact O-CG 3.3Å; K171-L175 WeakPolarHBondContact O-CG 3.4Å; K171-L175 PolarHBondContact O-N 3.46Å
172	T	98.8	Very high	96.8	Very high	30 Å²	30	38.1 Å²	38.1	18%	0.184	18%	0.184	C	C	.	.	H	α-helix	trans	-59.9	-42.8	179.8	-61.3	0	0	0	0	111.4	Q168 R169 L175 G176 T301 N304 L305	Q168-T172 PolarHBondContact O-N 3.39Å; Q168-T172 PolarHBondContact O-OG1 2.78Å; Q168-T172 VanDerWaalsContact O-OG1 3.06Å; R169-T172 PolarHBondContact O-N 3.3Å; T172-L175 PolarHBondContact O-N 3.43Å; T172-G176 PolarHBondContact O-N 3.48Å; T172-T301 HydrophobicContact CG2-CG2 3.96Å; T172-N304 HydrophobicContact CG2-CB 3.86Å; T172-L305 HydrophobicContact CG2-CD2 3.86Å; T172-L305 HydrophobicContact CG2-CG 3.84Å
173	F	98.8	Very high	97.3	Very high	7 Å²	7	33.4 Å²	33.4	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-46.5	175.3	-91.6	-116.4	0	0	0	113.1	E126 R169 G170 K171 Q177 L305 R492 V495 H496	E126-F173 HydrophobicContact CG-CB 4.36Å; R169-F173 HydrophobicContact CG-CD2 4.18Å; R169-F173 HydrophobicContact CG-CE2 4.15Å; R169-F173 VanDerWaalsContact NH2-CZ 3.3Å; R169-F173 VanDerWaalsContact O-CD2 3.31Å; R169-F173 WeakPolarHBondContact O-CD2 3.23Å; R169-F173 PolarHBondContact O-N 2.99Å; G170-F173 PolarHBondContact O-N 2.89Å; K171-F173 VanDerWaalsContact C-N 3.32Å; K171-F173 PolarHBondContact O-N 3.34Å; F173-Q177 PolarHBondContact O-N 3.05Å; F173-L305 HydrophobicContact CD2-CD1 4.3Å; F173-L305 HydrophobicContact CD2-CD2 4.32Å; F173-L305 HydrophobicContact CE2-CD1 3.62Å; F173-L305 HydrophobicContact CE2-CD2 4.09Å; F173-L305 HydrophobicContact CE2-CG 4.47Å; F173-L305 HydrophobicContact CZ-CD1 4.4Å; F173-R492 HydrophobicContact CB-CG 4.04Å; F173-R492 HydrophobicContact CD1-CB 3.75Å; F173-R492 HydrophobicContact CD1-CG 3.78Å; F173-R492 HydrophobicContact CE1-CB 4.33Å; F173-R492 WeakPolarHBondContact CE1-O 3.46Å; F173-R492 HydrophobicContact CG-CG 4.39Å; F173-V495 HydrophobicContact CE1-CB 4.34Å; F173-V495 HydrophobicContact CE1-CG1 4.25Å; F173-V495 HydrophobicContact CE2-CG1 4.08Å; F173-V495 HydrophobicContact CZ-CB 4.28Å; F173-V495 HydrophobicContact CZ-CG1 3.71Å; F173-H496 HydrophobicContact CE1-CB 4.01Å; F173-H496 HydrophobicContact CZ-CB 4.24Å
174	A	98.7	Very high	97.7	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-71.6	-37.3	179.9	0	0	0	0	0	113.4	E126 F129 L130 G170 K171 G176 Q177 N178	E126-A174 HydrophobicContact CB-CB 4.43Å; E126-A174 HydrophobicContact CG-CB 4.41Å; F129-A174 HydrophobicContact CB-CB 3.6Å; L130-A174 HydrophobicContact CD2-CB 4.06Å; L130-A174 HydrophobicContact CG-CB 3.81Å; G170-A174 WeakPolarHBondContact O-CB 3.19Å; G170-A174 PolarHBondContact O-N 3Å; K171-A174 PolarHBondContact O-N 3.35Å; A174-G176 VanDerWaalsContact C-N 3.34Å; A174-Q177 PolarHBondContact O-N 2.82Å; A174-N178 WeakPolarHBondContact O-CB 3.25Å; A174-N178 VanDerWaalsContact O-CG 3.27Å; A174-N178 PolarHBondContact O-N 2.8Å; A174-N178 PolarHBondContact O-ND2 2.8Å
175	L	98.6	Very high	98	Very high	81 Å²	81	29.2 Å²	29.2	42%	0.424	14%	0.137	S	C	.	.	H	α-helix	trans	-64.3	-40.8	174.5	-70.8	179.2	0	0	0	111.3	F129 K171 T172 N178 L179	F129-L175 HydrophobicContact CD1-CD2 3.97Å; F129-L175 HydrophobicContact CD1-CG 4.41Å; K171-L175 HydrophobicContact CD-CD1 4.49Å; K171-L175 HydrophobicContact CG-CD1 3.81Å; K171-L175 HydrophobicContact CG-CG 4.25Å; K171-L175 WeakPolarHBondContact O-CB 3.14Å; K171-L175 VanDerWaalsContact O-CG 3.3Å; K171-L175 WeakPolarHBondContact O-CG 3.4Å; K171-L175 PolarHBondContact O-N 3.46Å; T172-L175 PolarHBondContact O-N 3.43Å; L175-N178 PolarHBondContact O-N 3.48Å; L175-L179 PolarHBondContact O-N 3.01Å
176	G	98.8	Very high	98.2	Very high	2 Å²	2	24.1 Å²	24.1	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-54.9	-53.6	168.8	0	0	0	0	0	111	T172 A174 N178 L179 V180 S297 T301 L491	T172-G176 PolarHBondContact O-N 3.48Å; A174-G176 VanDerWaalsContact C-N 3.34Å; G176-N178 PolarHBondContact O-N 2.89Å; G176-L179 WeakPolarHBondContact O-CA 3.26Å; G176-L179 VanDerWaalsContact O-CB 3.28Å; G176-L179 WeakPolarHBondContact O-CB 3.35Å; G176-L179 PolarHBondContact O-N 3.01Å; G176-V180 PolarHBondContact O-N 3.24Å; G176-S297 WeakPolarHBondContact CA-OG 3.26Å; G176-S297 PolarHBondContact O-OG 3.11Å; G176-T301 WeakPolarHBondContact CA-OG1 3.47Å; G176-L491 VanDerWaalsContact CA-CD2 3.47Å; G176-L491 VanDerWaalsContact O-CD2 3.28Å; G176-L491 WeakPolarHBondContact O-CD2 2.81Å
177	Q	98.7	Very high	98.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-35.7	-175.8	178.2	167.1	-5.5	0	0	111.5	L130 F173 A174 L179 V180 R181 F482 T487 L491 R492	L130-Q177 HydrophobicContact CD2-CB 3.95Å; L130-Q177 HydrophobicContact CD2-CG 3.93Å; F173-Q177 PolarHBondContact O-N 3.05Å; A174-Q177 PolarHBondContact O-N 2.82Å; Q177-L179 VanDerWaalsContact C-N 3.32Å; Q177-L179 PolarHBondContact O-N 2.79Å; Q177-V180 WeakPolarHBondContact O-CB 3.38Å; Q177-V180 PolarHBondContact O-N 2.66Å; Q177-R181 WeakPolarHBondContact O-CG 3.41Å; Q177-R181 PolarHBondContact O-N 3.49Å; Q177-F482 VanDerWaalsContact NE2-CE1 3.32Å; Q177-T487 PolarHBondContact NE2-O 2.81Å; Q177-L491 VanDerWaalsContact CA-CD2 3.46Å; Q177-L491 HydrophobicContact CB-CB 4.42Å; Q177-L491 HydrophobicContact CB-CD2 4.17Å; Q177-R492 HydrophobicContact CB-CG 4.26Å
178	N	98.6	Very high	98.4	Very high	12 Å²	12	23.4 Å²	23.4	6%	0.064	11%	0.114	C	C	.	.	H	α-helix	trans	-65.9	-30.9	173.3	-76.6	-18.4	0	0	0	113.3	F129 F133 A174 L175 G176 R181 R182	F129-N178 PolarHBondContact O-ND2 3.12Å; F133-N178 WeakPolarHBondContact CB-OD1 3.23Å; F133-N178 HydrophobicContact CD2-CB 3.53Å; F133-N178 VanDerWaalsContact CD2-CG 3.45Å; F133-N178 HydrophobicContact CE2-CB 3.87Å; F133-N178 VanDerWaalsContact CE2-O 3.31Å; F133-N178 WeakPolarHBondContact CE2-O 3.32Å; F133-N178 HydrophobicContact CG-CB 4.34Å; A174-N178 WeakPolarHBondContact O-CB 3.25Å; A174-N178 VanDerWaalsContact O-CG 3.27Å; A174-N178 PolarHBondContact O-N 2.8Å; A174-N178 PolarHBondContact O-ND2 2.8Å; L175-N178 PolarHBondContact O-N 3.48Å; G176-N178 PolarHBondContact O-N 2.89Å; N178-R181 PolarHBondContact O-N 3.05Å; N178-R181 PolarHBondContact OD1-NH1 2.67Å; N178-R182 WeakPolarHBondContact O-CB 3.31Å; N178-R182 PolarHBondContact O-N 3.12Å
179	L	98.7	Very high	98.4	Very high	25 Å²	25	25.9 Å²	25.9	13%	0.131	13%	0.13	C	C	.	.	H	α-helix	trans	-62.6	-46.1	170.1	173.6	60.2	0	0	0	110.4	L175 G176 Q177 R181 R182 L183 I203	L175-L179 PolarHBondContact O-N 3.01Å; G176-L179 WeakPolarHBondContact O-CA 3.26Å; G176-L179 VanDerWaalsContact O-CB 3.28Å; G176-L179 WeakPolarHBondContact O-CB 3.35Å; G176-L179 PolarHBondContact O-N 3.01Å; Q177-L179 VanDerWaalsContact C-N 3.32Å; Q177-L179 PolarHBondContact O-N 2.79Å; L179-R181 VanDerWaalsContact C-N 3.32Å; L179-R181 PolarHBondContact O-N 3.37Å; L179-R182 PolarHBondContact O-N 3.46Å; L179-L183 HydrophobicContact CD1-CD1 4.16Å; L179-L183 HydrophobicContact CD1-CG 4.15Å; L179-L183 HydrophobicContact CG-CD1 4.22Å; L179-L183 VanDerWaalsContact O-CG 3.29Å; L179-L183 WeakPolarHBondContact O-CG 3.29Å; L179-L183 PolarHBondContact O-N 3.03Å; L179-I203 HydrophobicContact CD1-CD1 3.69Å; L179-I203 HydrophobicContact CD1-CG1 4.46Å; L179-I203 HydrophobicContact CD2-CD1 4.01Å; L179-I203 HydrophobicContact CD2-CG2 4.06Å; L179-I203 HydrophobicContact CG-CD1 4.42Å
180	V	98.8	Very high	98.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.2	-44.7	174.8	-173.8	0	0	0	0	111.1	G176 Q177 R182 L183 A184 T290 A293 S297 L491	G176-V180 PolarHBondContact O-N 3.24Å; Q177-V180 WeakPolarHBondContact O-CB 3.38Å; Q177-V180 PolarHBondContact O-N 2.66Å; V180-R182 PolarHBondContact O-N 3.42Å; V180-L183 PolarHBondContact O-N 3.48Å; V180-A184 WeakPolarHBondContact O-CB 3.49Å; V180-A184 PolarHBondContact O-N 2.96Å; V180-T290 HydrophobicContact CG1-CG2 3.86Å; V180-A293 HydrophobicContact CG1-CB 3.88Å; V180-S297 VanDerWaalsContact CG2-CB 3.48Å; V180-L491 HydrophobicContact CG2-CB 4.09Å; V180-L491 HydrophobicContact CG2-CD1 3.86Å; V180-L491 HydrophobicContact CG2-CD2 4.02Å; V180-L491 HydrophobicContact CG2-CG 4.21Å
181	R	98.2	Very high	98.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-57.6	-47.9	176.3	-67.3	171.3	66.6	-165.8	0.2	111.5	L130 F133 Q177 N178 L179 L183 A184 D185 N483 S484 M486 T487	L130-R181 PolarHBondContact O-NH1 3.26Å; F133-R181 HydrophobicContact CD1-CB 4.42Å; F133-R181 HydrophobicContact CE1-CB 3.77Å; F133-R181 HydrophobicContact CE2-CB 4.45Å; F133-R181 HydrophobicContact CZ-CB 3.79Å; Q177-R181 WeakPolarHBondContact O-CG 3.41Å; Q177-R181 PolarHBondContact O-N 3.49Å; N178-R181 PolarHBondContact O-N 3.05Å; N178-R181 PolarHBondContact OD1-NH1 2.67Å; L179-R181 VanDerWaalsContact C-N 3.32Å; L179-R181 PolarHBondContact O-N 3.37Å; R181-L183 VanDerWaalsContact C-N 3.33Å; R181-L183 PolarHBondContact O-N 2.96Å; R181-A184 PolarHBondContact O-N 2.9Å; R181-D185 VanDerWaalsContact O-CB 3.26Å; R181-D185 WeakPolarHBondContact O-CB 3.35Å; R181-D185 PolarHBondContact O-N 2.83Å; R181-N483 VanDerWaalsContact NH2-N 3.14Å; R181-N483 PolarHBondContact NH2-OD1 3.22Å; R181-S484 PolarHBondContact NE-OG 3.24Å; R181-S484 PolarHBondContact NH2-OG 3.07Å; R181-M486 WeakPolarHBondContact CG-O 3.42Å; R181-M486 PolarHBondContact NE-O 3.5Å; R181-T487 WeakPolarHBondContact CD-O 3.26Å; R181-T487 VanDerWaalsContact CG-O 3.31Å; R181-T487 WeakPolarHBondContact CG-O 3.16Å
182	R	98.1	Very high	98.3	Very high	72 Å²	72	24.1 Å²	24.1	27%	0.272	13%	0.128	S	C	.	.	H	α-helix	trans	-58.5	-44.1	178.4	-179.3	179.4	176.3	-94.7	-13.6	112	F133 F135 E137 N178 L179 V180 M186	F133-R182 HydrophobicContact CE2-CB 4.22Å; F133-R182 HydrophobicContact CZ-CB 4Å; F135-R182 HydrophobicContact CD2-CG 4.47Å; F135-R182 HydrophobicContact CE2-CG 4.42Å; E137-R182 IonicContact OE1-CZ 3.56Å; E137-R182 IonicContact OE1-NE 2.76Å; E137-R182 PolarHBondContact OE1-NE 2.98Å; E137-R182 IonicContact OE1-NH2 3.78Å; E137-R182 PolarHBondContact OE1-NH2 3.21Å; E137-R182 IonicContact OE2-CZ 3.55Å; E137-R182 IonicContact OE2-NE 3.18Å; E137-R182 PolarHBondContact OE2-NE 3.23Å; E137-R182 IonicContact OE2-NH2 2.7Å; E137-R182 PolarHBondContact OE2-NH2 2.86Å; N178-R182 WeakPolarHBondContact O-CB 3.31Å; N178-R182 PolarHBondContact O-N 3.12Å; L179-R182 PolarHBondContact O-N 3.46Å; V180-R182 PolarHBondContact O-N 3.42Å; R182-M186 PolarHBondContact O-N 3.31Å
183	L	98.7	Very high	98.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.1	-44.9	179.1	-65.9	176.2	0	0	0	111.6	L179 V180 R181 M186 M191 F196 L199 M289 A293 L296	L179-L183 HydrophobicContact CD1-CD1 4.16Å; L179-L183 HydrophobicContact CD1-CG 4.15Å; L179-L183 HydrophobicContact CG-CD1 4.22Å; L179-L183 VanDerWaalsContact O-CG 3.29Å; L179-L183 WeakPolarHBondContact O-CG 3.29Å; L179-L183 PolarHBondContact O-N 3.03Å; V180-L183 PolarHBondContact O-N 3.48Å; R181-L183 VanDerWaalsContact C-N 3.33Å; R181-L183 PolarHBondContact O-N 2.96Å; L183-M186 WeakPolarHBondContact O-CB 3.37Å; L183-M186 PolarHBondContact O-N 3.24Å; L183-M191 HydrophobicContact CD2-CE 3.75Å; L183-M191 HydrophobicContact CD2-SD 4.28Å; L183-F196 HydrophobicContact CD1-CE2 4.04Å; L183-L199 HydrophobicContact CD2-CD2 3.16Å; L183-L199 HydrophobicContact CD2-CG 4.15Å; L183-M289 HydrophobicContact CB-CE 4.3Å; L183-A293 HydrophobicContact CB-CB 3.74Å; L183-A293 HydrophobicContact CD1-CB 3.67Å; L183-A293 HydrophobicContact CG-CB 4.33Å; L183-L296 HydrophobicContact CD1-CD2 4.05Å
184	A	98.3	Very high	98.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-72.8	-34.1	-179	0	0	0	0	0	113.4	V180 R181 M186 A287 T290 M486	V180-A184 WeakPolarHBondContact O-CB 3.49Å; V180-A184 PolarHBondContact O-N 2.96Å; R181-A184 PolarHBondContact O-N 2.9Å; A184-M186 VanDerWaalsContact C-N 3.26Å; A184-M186 PolarHBondContact O-N 3.16Å; A184-A287 HydrophobicContact CB-CB 4.11Å; A184-T290 HydrophobicContact CB-CG2 4.49Å; A184-T290 WeakPolarHBondContact CB-OG1 3.39Å; A184-M486 HydrophobicContact CB-CB 3.77Å; A184-M486 HydrophobicContact CB-CG 3.71Å
185	D	97.5	Very high	98.1	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-71.5	-23.1	175.8	-86.4	-59.2	0	0	0	111.9	F135 R181 R286 S484 D485 M486	F135-D185 HydrophobicContact CB-CB 4.03Å; F135-D185 HydrophobicContact CD1-CB 3.83Å; F135-D185 HydrophobicContact CD2-CB 3.73Å; F135-D185 HydrophobicContact CE1-CB 4.23Å; F135-D185 HydrophobicContact CE2-CB 4.15Å; F135-D185 HydrophobicContact CG-CB 3.56Å; F135-D185 HydrophobicContact CZ-CB 4.39Å; R181-D185 VanDerWaalsContact O-CB 3.26Å; R181-D185 WeakPolarHBondContact O-CB 3.35Å; R181-D185 PolarHBondContact O-N 2.83Å; D185-R286 PolarHBondContact O-NE 3.27Å; D185-R286 IonicContact OD1-NH2 2.66Å; D185-S484 WeakPolarHBondContact OD2-CB 3.36Å; D185-S484 PolarHBondContact OD2-OG 3.43Å; D185-D485 WeakPolarHBondContact OD1-CB 3.34Å; D185-D485 PolarHBondContact OD1-N 2.99Å; D185-M486 PolarHBondContact OD1-N 3.35Å
186	M	98.3	Very high	98.1	Very high	9 Å²	9	26.4 Å²	26.4	4%	0.044	13%	0.13	C	C	.	.	S	Bend	trans	-60.8	131.3	-177.3	-165.9	73.3	64.7	0	0	112.1	F135 E137 L138 R182 L183 A184 L190 M191 R286	F135-M186 HydrophobicContact CE2-CE 4.08Å; F135-M186 HydrophobicContact CE2-SD 4.25Å; F135-M186 HydrophobicContact CZ-CB 4.48Å; F135-M186 HydrophobicContact CZ-CE 4.36Å; F135-M186 HydrophobicContact CZ-SD 3.92Å; E137-M186 WeakPolarHBondContact OE1-CE 2.93Å; L138-M186 HydrophobicContact CD1-SD 4.33Å; L138-M186 HydrophobicContact CD2-SD 4.4Å; R182-M186 PolarHBondContact O-N 3.31Å; L183-M186 WeakPolarHBondContact O-CB 3.37Å; L183-M186 PolarHBondContact O-N 3.24Å; A184-M186 VanDerWaalsContact C-N 3.26Å; A184-M186 PolarHBondContact O-N 3.16Å; M186-L190 HydrophobicContact CG-CB 3.99Å; M186-L190 HydrophobicContact SD-CB 4.04Å; M186-L190 HydrophobicContact SD-CD1 4.35Å; M186-M191 HydrophobicContact CB-CB 4.05Å; M186-M191 HydrophobicContact CB-CE 3.78Å; M186-M191 HydrophobicContact CB-CG 4.44Å; M186-M191 HydrophobicContact CE-CE 4.16Å; M186-M191 HydrophobicContact CG-CB 3.85Å; M186-M191 HydrophobicContact CG-CE 3.68Å; M186-R286 WeakPolarHBondContact O-CD 3.43Å
187	P	98.2	Very high	98.1	Very high	37 Å²	37	26.3 Å²	26.3	24%	0.24	13%	0.129	C	C	.	.			trans	-57.4	139.1	170.5	-25.6	36.3	0	0	0	112.2	L138 N189 L190 M191	L138-P187 VanDerWaalsContact CD1-CD 3.45Å; L138-P187 HydrophobicContact CD1-CG 3.61Å; P187-N189 VanDerWaalsContact C-N 3.25Å; P187-N189 VanDerWaalsContact CB-OD1 3.24Å; P187-N189 WeakPolarHBondContact CB-OD1 3.04Å; P187-N189 PolarHBondContact O-N 3.5Å; P187-L190 CarbonylContact O-C 3.57Å; P187-L190 WeakPolarHBondContact O-CA 3.33Å; P187-L190 PolarHBondContact O-N 2.92Å; P187-M191 PolarHBondContact O-N 2.89Å; P187-M191 VanDerWaalsContact O-N 3.13Å
188	A	97.8	Very high	98	Very high	12 Å²	12	29.4 Å²	29.4	10%	0.099	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-58.1	-33.7	-175.7	0	0	0	0	0	114.1	L190 M191 T192 C268 F269 R286	A188-L190 PolarHBondContact O-N 3.47Å; A188-L190 VanDerWaalsContact O-N 3.15Å; A188-M191 CarbonylContact O-C 3.53Å; A188-M191 PolarHBondContact O-N 2.95Å; A188-T192 PolarHBondContact O-N 2.75Å; A188-C268 WeakPolarHBondContact CB-O 3.43Å; A188-F269 HydrophobicContact CB-CB 3.67Å; A188-F269 HydrophobicContact CB-CD2 3.67Å; A188-F269 HydrophobicContact CB-CG 4Å; A188-R286 HydrophobicContact CB-CB 4.25Å
189	N	97.3	Very high	98	Very high	122 Å²	122	30.4 Å²	30.4	65%	0.652	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-66.1	-15.2	175.9	70.4	-65.9	0	0	0	113.5	P187	P187-N189 VanDerWaalsContact C-N 3.25Å; P187-N189 VanDerWaalsContact CB-OD1 3.24Å; P187-N189 WeakPolarHBondContact CB-OD1 3.04Å; P187-N189 PolarHBondContact O-N 3.5Å
190	L	98.1	Very high	98	Very high	79 Å²	79	29.2 Å²	29.2	41%	0.414	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-108.9	-0.4	172.8	-58	-178.5	0	0	0	112.4	L138 M186 P187 A188	L138-L190 HydrophobicContact CD1-CD1 3.92Å; L138-L190 HydrophobicContact CD2-CD1 3.62Å; L138-L190 HydrophobicContact CG-CD1 4.45Å; M186-L190 HydrophobicContact CG-CB 3.99Å; M186-L190 HydrophobicContact SD-CB 4.04Å; M186-L190 HydrophobicContact SD-CD1 4.35Å; P187-L190 CarbonylContact O-C 3.57Å; P187-L190 WeakPolarHBondContact O-CA 3.33Å; P187-L190 PolarHBondContact O-N 2.92Å; A188-L190 PolarHBondContact O-N 3.47Å; A188-L190 VanDerWaalsContact O-N 3.15Å
191	M	98.1	Very high	98	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	16%	0.163	C	C	.	.	S	Bend	trans	-134.8	47.7	-178.8	-165.2	55.1	63.1	0	0	110.6	L183 M186 P187 A188 F196 L199 C268 M289	L183-M191 HydrophobicContact CD2-CE 3.75Å; L183-M191 HydrophobicContact CD2-SD 4.28Å; M186-M191 HydrophobicContact CB-CB 4.05Å; M186-M191 HydrophobicContact CB-CE 3.78Å; M186-M191 HydrophobicContact CB-CG 4.44Å; M186-M191 HydrophobicContact CE-CE 4.16Å; M186-M191 HydrophobicContact CG-CB 3.85Å; M186-M191 HydrophobicContact CG-CE 3.68Å; P187-M191 PolarHBondContact O-N 2.89Å; P187-M191 VanDerWaalsContact O-N 3.13Å; A188-M191 CarbonylContact O-C 3.53Å; A188-M191 PolarHBondContact O-N 2.95Å; M191-F196 HydrophobicContact CG-CD2 4.46Å; M191-F196 HydrophobicContact SD-CB 3.89Å; M191-F196 HydrophobicContact SD-CD2 3.67Å; M191-F196 HydrophobicContact SD-CG 4.25Å; M191-L199 HydrophobicContact CE-CD2 3.79Å; M191-C268 WeakPolarHBondContact O-CB 3.27Å; M191-C268 PolarHBondContact O-SG 2.84Å; M191-M289 HydrophobicContact CG-CE 3.86Å; M191-M289 HydrophobicContact SD-CE 4.26Å
192	T	98.2	Very high	98	Very high	12 Å²	12	39.8 Å²	39.8	7%	0.074	19%	0.19	C	C	.	.			trans	-69.8	164.6	172.3	79.4	0	0	0	0	110.4	A188 V194 R195 F196 E241	A188-T192 PolarHBondContact O-N 2.75Å; T192-V194 VanDerWaalsContact C-N 3.25Å; T192-V194 PolarHBondContact O-N 2.88Å; T192-R195 PolarHBondContact O-N 2.77Å; T192-F196 PolarHBondContact O-N 2.92Å; T192-E241 WeakPolarHBondContact CB-OE2 3.15Å; T192-E241 HydrophobicContact CG2-CG 4.14Å; T192-E241 WeakPolarHBondContact CG2-OE2 3.49Å; T192-E241 PolarHBondContact OG1-OE2 2.5Å
193	P	98	Very high	98	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-51.9	-41.4	179.9	-31.5	38	0	0	0	114.1	A197 I242 V244 C268 L319	P193-A197 PolarHBondContact O-N 3.35Å; P193-A197 VanDerWaalsContact O-N 3.09Å; P193-I242 VanDerWaalsContact CB-O 3.25Å; P193-I242 WeakPolarHBondContact CB-O 3.33Å; P193-V244 HydrophobicContact CB-CB 4.22Å; P193-V244 HydrophobicContact CB-CG2 3.96Å; P193-C268 HydrophobicContact CG-CB 4.43Å; P193-L319 HydrophobicContact CB-CB 3.71Å; P193-L319 HydrophobicContact CG-CB 4.31Å
194	V	96.5	Very high	98	Very high	25 Å²	25	38.1 Å²	38.1	15%	0.152	19%	0.187	C	C	.	.	H	α-helix	trans	-67.7	-43.3	177.6	177.5	0	0	0	0	111	T192 F196 A197 E198 I242 V244	T192-V194 VanDerWaalsContact C-N 3.25Å; T192-V194 PolarHBondContact O-N 2.88Å; V194-F196 PolarHBondContact O-N 2.95Å; V194-A197 WeakPolarHBondContact O-CB 3.33Å; V194-A197 PolarHBondContact O-N 2.8Å; V194-E198 WeakPolarHBondContact O-CG 3.29Å; V194-E198 PolarHBondContact O-N 3.03Å; V194-I242 HydrophobicContact CG2-CB 4.05Å; V194-I242 HydrophobicContact CG2-CG1 4.45Å; V194-V244 HydrophobicContact CG2-CG2 4.01Å
195	R	97.6	Very high	98	Very high	140 Å²	140	42.7 Å²	42.7	53%	0.528	22%	0.218	S	C	.	.	H	α-helix	trans	-65.4	-38.3	177.4	-66.4	-55.7	-168.8	-179.9	-0.8	112.4	T192 A197 E198 L199	T192-R195 PolarHBondContact O-N 2.77Å; R195-A197 VanDerWaalsContact C-N 3.3Å; R195-A197 PolarHBondContact O-N 2.86Å; R195-E198 WeakPolarHBondContact CD-OE2 3.36Å; R195-E198 IonicContact CZ-OE2 3.6Å; R195-E198 IonicContact NE-OE2 3.48Å; R195-E198 IonicContact NH1-OE1 3.87Å; R195-E198 IonicContact NH1-OE2 3.44Å; R195-E198 PolarHBondContact NH1-OE2 3.18Å; R195-E198 PolarHBondContact O-N 2.85Å; R195-L199 WeakPolarHBondContact O-CB 3.39Å; R195-L199 PolarHBondContact O-N 3.3Å
196	F	98.7	Very high	97.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-42.4	172.9	-174	-80.7	0	0	0	110.9	L183 M191 T192 V194 L199 A200 L246 M289 A292 A293 L296 V317 L319	L183-F196 HydrophobicContact CD1-CE2 4.04Å; M191-F196 HydrophobicContact CG-CD2 4.46Å; M191-F196 HydrophobicContact SD-CB 3.89Å; M191-F196 HydrophobicContact SD-CD2 3.67Å; M191-F196 HydrophobicContact SD-CG 4.25Å; T192-F196 PolarHBondContact O-N 2.92Å; V194-F196 PolarHBondContact O-N 2.95Å; F196-L199 PolarHBondContact O-N 2.82Å; F196-A200 WeakPolarHBondContact O-CB 3.34Å; F196-A200 PolarHBondContact O-N 3.01Å; F196-L246 HydrophobicContact CD1-CD1 3.7Å; F196-L246 HydrophobicContact CE1-CD1 3.69Å; F196-M289 HydrophobicContact CD2-CE 3.06Å; F196-M289 HydrophobicContact CE2-CE 3.07Å; F196-M289 HydrophobicContact CG-CE 4.27Å; F196-M289 HydrophobicContact CZ-CE 4.28Å; F196-A292 HydrophobicContact CE1-CB 4.47Å; F196-A292 HydrophobicContact CE2-CB 4.4Å; F196-A292 HydrophobicContact CZ-CB 3.97Å; F196-A293 HydrophobicContact CE2-CB 4.49Å; F196-L296 HydrophobicContact CE1-CD2 4.01Å; F196-L296 HydrophobicContact CE2-CD2 4.38Å; F196-L296 HydrophobicContact CZ-CB 4.17Å; F196-L296 HydrophobicContact CZ-CD2 3.73Å; F196-V317 HydrophobicContact CE1-CG1 4.37Å; F196-L319 HydrophobicContact CB-CD1 4.15Å; F196-L319 HydrophobicContact CB-CD2 4.21Å; F196-L319 HydrophobicContact CD1-CD1 3.45Å; F196-L319 VanDerWaalsContact CD1-CD1 3.45Å; F196-L319 HydrophobicContact CD1-CD2 3.66Å; F196-L319 HydrophobicContact CD1-CG 4.19Å; F196-L319 HydrophobicContact CD2-CD2 4.4Å; F196-L319 HydrophobicContact CE1-CD1 4.21Å; F196-L319 HydrophobicContact CE1-CD2 4.09Å; F196-L319 HydrophobicContact CG-CD1 4.09Å; F196-L319 HydrophobicContact CG-CD2 3.81Å
197	A	97.6	Very high	97.9	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-40.3	177.4	0	0	0	0	0	113.5	P193 V194 R195 A200 R201 V214 V244 L246	P193-A197 PolarHBondContact O-N 3.35Å; P193-A197 VanDerWaalsContact O-N 3.09Å; V194-A197 WeakPolarHBondContact O-CB 3.33Å; V194-A197 PolarHBondContact O-N 2.8Å; R195-A197 VanDerWaalsContact C-N 3.3Å; R195-A197 PolarHBondContact O-N 2.86Å; A197-A200 PolarHBondContact O-N 3.3Å; A197-R201 PolarHBondContact O-N 2.79Å; A197-R201 VanDerWaalsContact O-N 3.09Å; A197-V214 HydrophobicContact CB-CG1 3.87Å; A197-V244 HydrophobicContact CB-CG1 3.96Å; A197-L246 HydrophobicContact CB-CD2 3.68Å
198	E	97.7	Very high	97.8	Very high	65 Å²	65	51.8 Å²	51.8	30%	0.304	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-47.4	173.1	-71.1	173	168.2	0	0	110.9	V194 R195 A200 R201 D202	V194-E198 WeakPolarHBondContact O-CG 3.29Å; V194-E198 PolarHBondContact O-N 3.03Å; R195-E198 WeakPolarHBondContact CD-OE2 3.36Å; R195-E198 IonicContact CZ-OE2 3.6Å; R195-E198 IonicContact NE-OE2 3.48Å; R195-E198 IonicContact NH1-OE1 3.87Å; R195-E198 IonicContact NH1-OE2 3.44Å; R195-E198 PolarHBondContact NH1-OE2 3.18Å; R195-E198 PolarHBondContact O-N 2.85Å; E198-A200 PolarHBondContact O-N 3.16Å; E198-R201 WeakPolarHBondContact O-CB 3.03Å; E198-R201 PolarHBondContact O-N 2.89Å; E198-R201 VanDerWaalsContact O-N 3.14Å; E198-D202 PolarHBondContact O-N 3.03Å
199	L	98.2	Very high	97.8	Very high	32 Å²	32	54.1 Å²	54.1	17%	0.168	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-38.6	179	-177.9	55.5	0	0	0	112.4	L183 M191 R195 F196 R201 D202 I203	L183-L199 HydrophobicContact CD2-CD2 3.16Å; L183-L199 HydrophobicContact CD2-CG 4.15Å; M191-L199 HydrophobicContact CE-CD2 3.79Å; R195-L199 WeakPolarHBondContact O-CB 3.39Å; R195-L199 PolarHBondContact O-N 3.3Å; F196-L199 PolarHBondContact O-N 2.82Å; L199-R201 VanDerWaalsContact C-N 3.27Å; L199-R201 PolarHBondContact O-N 3.2Å; L199-D202 PolarHBondContact O-N 3.11Å; L199-I203 HydrophobicContact CD1-CD1 3.89Å; L199-I203 HydrophobicContact CD1-CG1 4.14Å; L199-I203 HydrophobicContact CG-CD1 3.71Å; L199-I203 HydrophobicContact CG-CG1 4.44Å; L199-I203 WeakPolarHBondContact O-CB 3.41Å; L199-I203 WeakPolarHBondContact O-CD1 3.36Å; L199-I203 VanDerWaalsContact O-CG1 3.25Å; L199-I203 WeakPolarHBondContact O-CG1 2.99Å; L199-I203 PolarHBondContact O-N 2.95Å
200	A	98.7	Very high	97.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-40.3	173	0	0	0	0	0	111.7	F196 A197 E198 L204 L212 L246 L296	F196-A200 WeakPolarHBondContact O-CB 3.34Å; F196-A200 PolarHBondContact O-N 3.01Å; A197-A200 PolarHBondContact O-N 3.3Å; E198-A200 PolarHBondContact O-N 3.16Å; A200-L204 WeakPolarHBondContact O-CB 3.43Å; A200-L204 VanDerWaalsContact O-CG 3.28Å; A200-L204 WeakPolarHBondContact O-CG 3.03Å; A200-L204 PolarHBondContact O-N 3.47Å; A200-L204 VanDerWaalsContact O-N 3.08Å; A200-L212 HydrophobicContact CB-CD2 4.37Å; A200-L246 HydrophobicContact CB-CD1 3.9Å; A200-L296 HydrophobicContact CB-CD1 3.85Å; A200-L296 HydrophobicContact CB-CD2 3.85Å
201	R	98.3	Very high	97.8	Very high	114 Å²	114	48.4 Å²	48.4	43%	0.43	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-46.2	175.2	-170.8	-173.2	-59.1	114.5	1	111.5	A197 E198 L199 L204 S205 L212	A197-R201 PolarHBondContact O-N 2.79Å; A197-R201 VanDerWaalsContact O-N 3.09Å; E198-R201 WeakPolarHBondContact O-CB 3.03Å; E198-R201 PolarHBondContact O-N 2.89Å; E198-R201 VanDerWaalsContact O-N 3.14Å; L199-R201 VanDerWaalsContact C-N 3.27Å; L199-R201 PolarHBondContact O-N 3.2Å; R201-L204 PolarHBondContact O-N 3.34Å; R201-S205 WeakPolarHBondContact O-CB 3.13Å; R201-S205 PolarHBondContact O-N 3.18Å; R201-L212 VanDerWaalsContact CA-CD2 3.45Å; R201-L212 HydrophobicContact CB-CD2 3.78Å; R201-L212 HydrophobicContact CG-CD2 4.31Å
202	D	98.4	Very high	97.8	Very high	108 Å²	108	50.3 Å²	50.3	58%	0.578	27%	0.272	S	S	*	.	H	α-helix	trans	-63.8	-45.5	-179	-68.4	-14.9	0	0	0	111.4	E198 L199 L204 S205	E198-D202 PolarHBondContact O-N 3.03Å; L199-D202 PolarHBondContact O-N 3.11Å; D202-L204 PolarHBondContact O-N 3.23Å; D202-S205 PolarHBondContact O-N 3.05Å; D202-S205 PolarHBondContact O-OG 3.3Å
203	I	98.6	Very high	97.7	Very high	30 Å²	30	52.7 Å²	52.7	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-45.3	178.5	-70.6	159.8	0	0	0	111.1	L179 L199 L296 D300	L179-I203 HydrophobicContact CD1-CD1 3.69Å; L179-I203 HydrophobicContact CD1-CG1 4.46Å; L179-I203 HydrophobicContact CD2-CD1 4.01Å; L179-I203 HydrophobicContact CD2-CG2 4.06Å; L179-I203 HydrophobicContact CG-CD1 4.42Å; L199-I203 HydrophobicContact CD1-CD1 3.89Å; L199-I203 HydrophobicContact CD1-CG1 4.14Å; L199-I203 HydrophobicContact CG-CD1 3.71Å; L199-I203 HydrophobicContact CG-CG1 4.44Å; L199-I203 WeakPolarHBondContact O-CB 3.41Å; L199-I203 WeakPolarHBondContact O-CD1 3.36Å; L199-I203 VanDerWaalsContact O-CG1 3.25Å; L199-I203 WeakPolarHBondContact O-CG1 2.99Å; L199-I203 PolarHBondContact O-N 2.95Å; I203-L296 HydrophobicContact CD1-CD2 3.95Å; I203-D300 HydrophobicContact CG2-CB 3.95Å
204	L	98.6	Very high	97.6	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-86.6	-8.1	-173.6	-60.7	174.5	0	0	0	113.8	A200 R201 D202 C206 H207 V210 L212 I248 L296 I299 D300	A200-L204 WeakPolarHBondContact O-CB 3.43Å; A200-L204 VanDerWaalsContact O-CG 3.28Å; A200-L204 WeakPolarHBondContact O-CG 3.03Å; A200-L204 PolarHBondContact O-N 3.47Å; A200-L204 VanDerWaalsContact O-N 3.08Å; R201-L204 PolarHBondContact O-N 3.34Å; D202-L204 PolarHBondContact O-N 3.23Å; L204-C206 PolarHBondContact O-N 3.06Å; L204-C206 VanDerWaalsContact O-N 3.12Å; L204-H207 PolarHBondContact O-N 2.99Å; L204-V210 HydrophobicContact CB-CG1 4.27Å; L204-V210 HydrophobicContact CD1-CG1 4.01Å; L204-V210 HydrophobicContact CD2-CG1 4.18Å; L204-V210 HydrophobicContact CG-CG1 4.38Å; L204-L212 HydrophobicContact CD1-CD1 4.47Å; L204-I248 HydrophobicContact CD1-CD1 4.17Å; L204-I248 HydrophobicContact CD1-CG1 4.33Å; L204-I248 HydrophobicContact CD1-CG2 3.61Å; L204-L296 HydrophobicContact CD1-CD1 3.75Å; L204-L296 HydrophobicContact CD2-CD1 4.22Å; L204-L296 HydrophobicContact CG-CD1 3.92Å; L204-I299 HydrophobicContact CD2-CG2 4.39Å; L204-D300 HydrophobicContact CD2-CB 4.07Å
205	S	97	Very high	97.4	Very high	95 Å²	95	55.6 Å²	55.6	66%	0.664	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.5	-173.9	65.3	0	0	0	0	114.8	R201 D202	R201-S205 WeakPolarHBondContact O-CB 3.13Å; R201-S205 PolarHBondContact O-N 3.18Å; D202-S205 PolarHBondContact O-N 3.05Å; D202-S205 PolarHBondContact O-OG 3.3Å
206	C	95.5	Very high	96.8	Very high	93 Å²	93	51.6 Å²	51.6	63%	0.628	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-10	179.2	60.6	0	0	0	0	113.9	L204	L204-C206 PolarHBondContact O-N 3.06Å; L204-C206 VanDerWaalsContact O-N 3.12Å
207	H	98	Very high	95.2	Very high	23 Å²	23	52.2 Å²	52.2	11%	0.106	29%	0.287	C	S	.	.			trans	-97.7	110	-175.7	-60	-52.3	0	0	0	111.5	L204 N209 V210 D300 A303 N304	L204-H207 PolarHBondContact O-N 2.99Å; H207-N209 VanDerWaalsContact C-N 3.26Å; H207-N209 PolarHBondContact O-N 3Å; H207-V210 HydrophobicContact CB-CB 3.85Å; H207-V210 HydrophobicContact CB-CG2 3.59Å; H207-V210 PolarHBondContact O-N 3.2Å; H207-D300 IonicContact CD2-OD1 3.95Å; H207-D300 IonicContact CE1-OD1 2.98Å; H207-D300 IonicContact NE2-OD1 3.97Å; H207-D300 PolarHBondContact NE2-OD1 3.35Å; H207-A303 HydrophobicContact CB-CB 4.35Å; H207-N304 PolarHBondContact CE1-OD1 3.42Å
208	S	96.5	Very high	93.3	Very high	125 Å²	125	57.1 Å²	57.1	87%	0.874	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-17.6	-178.1	58.7	0	0	0	0	114.5
209	N	97.2	Very high	91.2	Very high	61 Å²	61	61.4 Å²	61.4	33%	0.326	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	13.1	178.3	68.6	-37.7	0	0	0	113.3	H207 L250 K251	H207-N209 VanDerWaalsContact C-N 3.26Å; H207-N209 PolarHBondContact O-N 3Å; N209-L250 VanDerWaalsContact ND2-CD1 3.31Å; N209-L250 WeakPolarHBondContact ND2-CD1 3.44Å; N209-K251 PolarHBondContact ND2-O 2.93Å; N209-K251 PolarHBondContact O-N 3.45Å
210	V	98.6	Very high	89.1	Confident	15 Å²	15	63.4 Å²	63.4	9%	0.091	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.3	174.8	-179.1	0	0	0	0	110	L204 H207 I248 H249 L250 I299 A303	L204-V210 HydrophobicContact CB-CG1 4.27Å; L204-V210 HydrophobicContact CD1-CG1 4.01Å; L204-V210 HydrophobicContact CD2-CG1 4.18Å; L204-V210 HydrophobicContact CG-CG1 4.38Å; H207-V210 HydrophobicContact CB-CB 3.85Å; H207-V210 HydrophobicContact CB-CG2 3.59Å; H207-V210 PolarHBondContact O-N 3.2Å; V210-I248 HydrophobicContact CG1-CG2 3.67Å; V210-H249 CarbonylContact C-O 3.57Å; V210-H249 VanDerWaalsContact CA-O 3.27Å; V210-H249 WeakPolarHBondContact CA-O 3.27Å; V210-L250 HydrophobicContact CG2-CB 4.45Å; V210-L250 HydrophobicContact CG2-CD1 3.69Å; V210-I299 HydrophobicContact CG1-CG2 4.26Å; V210-I299 HydrophobicContact CG2-CG2 4.32Å; V210-A303 HydrophobicContact CG2-CB 4.11Å
211	D	98.3	Very high	87	Confident	67 Å²	67	68.3 Å²	68.3	36%	0.358	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.9	168.7	-58.8	-12.8	0	0	0	109.5	I248 H249 K251	D211-I248 CarbonylContact O-C 3.54Å; D211-I248 WeakPolarHBondContact O-CA 3.03Å; D211-H249 HydrophobicContact CB-CB 4.28Å; D211-H249 PolarHBondContact N-O 3.47Å; D211-H249 PolarHBondContact O-N 2.82Å; D211-K251 IonicContact OD1-NZ 2.76Å; D211-K251 PolarHBondContact OD1-NZ 3.03Å; D211-K251 WeakPolarHBondContact OD2-CE 3.44Å; D211-K251 IonicContact OD2-NZ 2.68Å; D211-K251 PolarHBondContact OD2-NZ 3.22Å
212	L	98.2	Very high	85.9	Confident	43 Å²	43	71 Å²	71	23%	0.225	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122	172.3	174	67.6	0	0	0	109.9	A200 R201 L204 V214 L246 I248	A200-L212 HydrophobicContact CB-CD2 4.37Å; R201-L212 VanDerWaalsContact CA-CD2 3.45Å; R201-L212 HydrophobicContact CB-CD2 3.78Å; R201-L212 HydrophobicContact CG-CD2 4.31Å; L204-L212 HydrophobicContact CD1-CD1 4.47Å; L212-V214 HydrophobicContact CD1-CG2 4.28Å; L212-V214 HydrophobicContact CD2-CG2 3.92Å; L212-V214 HydrophobicContact CG-CG2 3.84Å; L212-L246 HydrophobicContact CD1-CB 4.42Å; L212-I248 HydrophobicContact CD1-CG1 3.74Å
213	I	96.1	Very high	85.5	Confident	62 Å²	62	67.1 Å²	67.1	32%	0.318	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.1	172.4	-56	170.6	0	0	0	107.7	R215 E247	I213-R215 HydrophobicContact CG2-CG 4.1Å; I213-E247 HydrophobicContact CB-CB 4.16Å; I213-E247 HydrophobicContact CD1-CG 4.35Å; I213-E247 PolarHBondContact N-O 3.43Å; I213-E247 PolarHBondContact O-N 3.4Å
214	V	94.9	Very high	85.3	Confident	39 Å²	39	65.7 Å²	65.7	24%	0.236	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.6	178.8	-176	0	0	0	0	108.9	A197 L212 Q216 V244 L246	A197-V214 HydrophobicContact CB-CG1 3.87Å; L212-V214 HydrophobicContact CD1-CG2 4.28Å; L212-V214 HydrophobicContact CD2-CG2 3.92Å; L212-V214 HydrophobicContact CG-CG2 3.84Å; V214-Q216 HydrophobicContact CG1-CG 4.18Å; V214-V244 HydrophobicContact CG1-CG1 3.77Å; V214-L246 HydrophobicContact CB-CD2 4.14Å; V214-L246 HydrophobicContact CG1-CD2 3.82Å; V214-L246 HydrophobicContact CG2-CD2 3.87Å
215	R	93.4	Very high	84.9	Confident	47 Å²	47	70 Å²	70	18%	0.177	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	101.9	179.5	-50.4	-174.9	-173.3	-89.5	3.4	109.4	I213 W223 V244 F245 E247	I213-R215 HydrophobicContact CG2-CG 4.1Å; R215-W223 HydrophobicContact CB-CE3 4.18Å; R215-W223 HydrophobicContact CG-CD2 4.42Å; R215-W223 HydrophobicContact CG-CE3 4.43Å; R215-V244 CarbonylContact O-C 3.14Å; R215-V244 WeakPolarHBondContact O-CA 3.29Å; R215-F245 HydrophobicContact CB-CB 4.29Å; R215-F245 PolarHBondContact N-O 3.18Å; R215-F245 PolarHBondContact O-N 2.65Å; R215-E247 IonicContact CZ-OE2 2.7Å; R215-E247 IonicContact NE-OE2 3.48Å; R215-E247 IonicContact NH2-OE2 2.9Å; R215-E247 PolarHBondContact NH2-OE2 3.29Å
216	Q	83.9	Confident	84.7	Confident	56 Å²	56	70.8 Å²	70.8	26%	0.262	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.1	177.8	-59.1	-172.3	21.5	0	0	110.1	V214 L218 D220 V244	V214-Q216 HydrophobicContact CG1-CG 4.18Å; Q216-L218 VanDerWaalsContact C-N 3.31Å; Q216-L218 PolarHBondContact O-N 2.86Å; Q216-D220 WeakPolarHBondContact O-CA 3.33Å; Q216-D220 WeakPolarHBondContact O-CB 3.35Å; Q216-D220 PolarHBondContact O-N 3.03Å; Q216-D220 VanDerWaalsContact O-N 3.09Å; Q216-V244 HydrophobicContact CG-CG2 4.15Å
217	V	65.1	Low	84.7	Confident	12 Å²	12	68.6 Å²	68.6	7%	0.073	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	1.2	-168.1	-177.8	0	0	0	0	113.6	Q221 A224 F232 L233 P243	V217-Q221 HydrophobicContact CG1-CG 4.25Å; V217-Q221 WeakPolarHBondContact O-CA 3.42Å; V217-Q221 WeakPolarHBondContact O-CB 3.4Å; V217-Q221 VanDerWaalsContact O-CG 3.27Å; V217-Q221 WeakPolarHBondContact O-CG 3.32Å; V217-Q221 PolarHBondContact O-N 3.42Å; V217-A224 HydrophobicContact CG2-CB 4.19Å; V217-F232 HydrophobicContact CG2-CE1 4.2Å; V217-L233 HydrophobicContact CG1-CD2 3.74Å; V217-P243 HydrophobicContact CB-CG 3.86Å; V217-P243 HydrophobicContact CG1-CG 4.23Å; V217-P243 HydrophobicContact CG2-CG 4.1Å; V217-P243 WeakPolarHBondContact CG2-O 3.45Å; V217-P243 PolarHBondContact N-O 3.29Å; V217-P243 VanDerWaalsContact N-O 3.12Å
218	L	57.1	Low	84.6	Confident	105 Å²	105	74.6 Å²	74.6	55%	0.55	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-44.3	175.6	-109.3	150.1	0	0	0	113.7	Q216 D220 I242	Q216-L218 VanDerWaalsContact C-N 3.31Å; Q216-L218 PolarHBondContact O-N 2.86Å; L218-D220 VanDerWaalsContact C-N 3.33Å; L218-I242 HydrophobicContact CB-CD1 3.95Å; L218-I242 HydrophobicContact CB-CG1 4.45Å; L218-I242 HydrophobicContact CB-CG2 3.74Å; L218-I242 HydrophobicContact CD1-CB 4.04Å; L218-I242 HydrophobicContact CD1-CD1 3.54Å; L218-I242 HydrophobicContact CD1-CG1 3.39Å; L218-I242 HydrophobicContact CD1-CG2 3.87Å; L218-I242 HydrophobicContact CG-CD1 4.36Å; L218-I242 HydrophobicContact CG-CG2 4.23Å
219	D	54.7	Low	84.6	Confident	154 Å²	154	68.6 Å²	68.6	82%	0.824	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-21.2	171.2	-70.4	-24.7	0	0	0	111.7
220	D	54.2	Low	84.6	Confident	75 Å²	75	66.8 Å²	66.8	40%	0.401	33%	0.325	S	S	.	.			trans	-127.3	36.6	-174.4	-137.8	3.3	0	0	0	111.1	Q216 L218 R222 W223	Q216-D220 WeakPolarHBondContact O-CA 3.33Å; Q216-D220 WeakPolarHBondContact O-CB 3.35Å; Q216-D220 PolarHBondContact O-N 3.03Å; Q216-D220 VanDerWaalsContact O-N 3.09Å; L218-D220 VanDerWaalsContact C-N 3.33Å; D220-R222 PolarHBondContact O-N 2.71Å; D220-W223 PolarHBondContact O-N 2.84Å
221	Q	54.7	Low	84.6	Confident	102 Å²	102	66.1 Å²	66.1	48%	0.477	32%	0.321	S	S	.	.	H	α-helix	trans	-50.6	-17.2	177.5	-151.4	-177.8	-15	0	0	113	V217 E225	V217-Q221 HydrophobicContact CG1-CG 4.25Å; V217-Q221 WeakPolarHBondContact O-CA 3.42Å; V217-Q221 WeakPolarHBondContact O-CB 3.4Å; V217-Q221 VanDerWaalsContact O-CG 3.27Å; V217-Q221 WeakPolarHBondContact O-CG 3.32Å; V217-Q221 PolarHBondContact O-N 3.42Å; Q221-E225 WeakPolarHBondContact CG-OE1 3.01Å; Q221-E225 PolarHBondContact NE2-OE1 2.62Å; Q221-E225 WeakPolarHBondContact O-CB 3.44Å; Q221-E225 VanDerWaalsContact O-CD 3.32Å; Q221-E225 VanDerWaalsContact O-CG 3.27Å; Q221-E225 WeakPolarHBondContact O-CG 3.5Å
222	R	74.9	Confident	84.6	Confident	171 Å²	171	62.9 Å²	62.9	65%	0.645	30%	0.304	S	S	*	.	H	α-helix	trans	-65.2	-45	172.7	-67.9	-172	71.2	176	0.6	113.4	D220 E225 E226	D220-R222 PolarHBondContact O-N 2.71Å; R222-E225 PolarHBondContact O-N 2.87Å; R222-E226 HydrophobicContact CB-CG 4.37Å; R222-E226 IonicContact CZ-OE1 3.74Å; R222-E226 IonicContact NE-OE1 2.75Å; R222-E226 PolarHBondContact NE-OE1 3.32Å; R222-E226 IonicContact NH2-OE1 3.68Å; R222-E226 PolarHBondContact NH2-OE1 3.4Å; R222-E226 WeakPolarHBondContact O-CA 3.13Å; R222-E226 WeakPolarHBondContact O-CB 2.97Å; R222-E226 WeakPolarHBondContact O-CG 3.36Å; R222-E226 PolarHBondContact O-N 3.11Å
223	W	90.9	Very high	84.5	Confident	27 Å²	27	62.1 Å²	62.1	10%	0.102	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-53.5	-165.4	-179.3	81.1	0	0	0	113.4	R215 D220 E225 E226 M227 M229 F245 Y362	R215-W223 HydrophobicContact CB-CE3 4.18Å; R215-W223 HydrophobicContact CG-CD2 4.42Å; R215-W223 HydrophobicContact CG-CE3 4.43Å; D220-W223 PolarHBondContact O-N 2.84Å; W223-E225 VanDerWaalsContact C-N 3.31Å; W223-E225 PolarHBondContact O-N 3.43Å; W223-E226 PolarHBondContact O-N 3.46Å; W223-M227 HydrophobicContact CD2-CG 3.92Å; W223-M227 VanDerWaalsContact CE2-CG 3.5Å; W223-M227 HydrophobicContact CG-CG 4.28Å; W223-M227 HydrophobicContact CH2-CG 4.49Å; W223-M227 HydrophobicContact CZ2-CE 4.13Å; W223-M227 HydrophobicContact CZ2-CG 3.84Å; W223-M227 VanDerWaalsContact O-CB 3.28Å; W223-M227 WeakPolarHBondContact O-CB 3.42Å; W223-M227 WeakPolarHBondContact O-CG 3.46Å; W223-M227 PolarHBondContact O-N 2.99Å; W223-M229 HydrophobicContact CH2-CE 3.52Å; W223-M229 HydrophobicContact CH2-SD 3.84Å; W223-M229 HydrophobicContact CZ2-CE 4.2Å; W223-M229 HydrophobicContact CZ3-CE 4.02Å; W223-M229 HydrophobicContact CZ3-SD 3.67Å; W223-F245 HydrophobicContact CH2-CB 4.38Å; W223-F245 AromaticContact CH2-CD1 3.85Å; W223-F245 HydrophobicContact CH2-CD1 3.85Å; W223-F245 HydrophobicContact CH2-CD2 4.31Å; W223-F245 HydrophobicContact CH2-CE1 4.19Å; W223-F245 AromaticContact CH2-CG 3.92Å; W223-F245 HydrophobicContact CH2-CG 3.92Å; W223-F245 HydrophobicContact CZ3-CB 3.75Å; W223-F245 HydrophobicContact CZ3-CD1 4.09Å; W223-F245 HydrophobicContact CZ3-CD2 4.08Å; W223-F245 AromaticContact CZ3-CG 3.71Å; W223-F245 HydrophobicContact CZ3-CG 3.71Å; W223-Y362 HydrophobicContact CH2-CD1 4.35Å; W223-Y362 HydrophobicContact CH2-CE1 4.17Å; W223-Y362 HydrophobicContact CZ2-CD1 4.48Å; W223-Y362 AromaticContact CZ2-CE1 3.99Å; W223-Y362 HydrophobicContact CZ2-CE1 3.99Å; W223-Y362 HydrophobicContact CZ2-CE2 4.4Å; W223-Y362 AromaticContact CZ2-CZ 3.94Å
224	A	93.2	Very high	84.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-34.8	-177.7	0	0	0	0	0	112	V217 K228 M229 F232 L233	V217-A224 HydrophobicContact CG2-CB 4.19Å; A224-K228 PolarHBondContact O-N 3.21Å; A224-M229 HydrophobicContact CB-CB 4.45Å; A224-M229 WeakPolarHBondContact O-CB 3.35Å; A224-M229 PolarHBondContact O-N 3.13Å; A224-F232 HydrophobicContact CB-CD1 4.34Å; A224-F232 HydrophobicContact CB-CE1 4.32Å; A224-L233 HydrophobicContact CB-CD1 4.19Å; A224-L233 HydrophobicContact CB-CD2 3.9Å; A224-L233 HydrophobicContact CB-CG 4.16Å
225	E	91.3	Very high	84.7	Confident	99 Å²	99	57.4 Å²	57.4	46%	0.463	27%	0.274	S	S	.	.	H	α-helix	trans	-69.7	-42.5	174.6	-67.2	179.7	177.7	0	0	111.8	Q221 R222 W223 M227 K228 L233	Q221-E225 WeakPolarHBondContact CG-OE1 3.01Å; Q221-E225 PolarHBondContact NE2-OE1 2.62Å; Q221-E225 WeakPolarHBondContact O-CB 3.44Å; Q221-E225 VanDerWaalsContact O-CD 3.32Å; Q221-E225 VanDerWaalsContact O-CG 3.27Å; Q221-E225 WeakPolarHBondContact O-CG 3.5Å; R222-E225 PolarHBondContact O-N 2.87Å; W223-E225 VanDerWaalsContact C-N 3.31Å; W223-E225 PolarHBondContact O-N 3.43Å; E225-M227 VanDerWaalsContact C-N 3.32Å; E225-M227 PolarHBondContact O-N 3.45Å; E225-K228 WeakPolarHBondContact O-CA 3.42Å; E225-K228 PolarHBondContact O-N 2.66Å; E225-L233 HydrophobicContact CB-CD1 4.49Å; E225-L233 HydrophobicContact CG-CD1 3.68Å
226	E	91.9	Very high	84.9	Confident	110 Å²	110	55.6 Å²	55.6	51%	0.514	27%	0.269	S	S	.	.	H	α-helix	trans	-64.7	-36.4	175.7	-76	172.4	173.5	0	0	111.6	R222 W223 K228	R222-E226 HydrophobicContact CB-CG 4.37Å; R222-E226 IonicContact CZ-OE1 3.74Å; R222-E226 IonicContact NE-OE1 2.75Å; R222-E226 PolarHBondContact NE-OE1 3.32Å; R222-E226 IonicContact NH2-OE1 3.68Å; R222-E226 PolarHBondContact NH2-OE1 3.4Å; R222-E226 WeakPolarHBondContact O-CA 3.13Å; R222-E226 WeakPolarHBondContact O-CB 2.97Å; R222-E226 WeakPolarHBondContact O-CG 3.36Å; R222-E226 PolarHBondContact O-N 3.11Å; W223-E226 PolarHBondContact O-N 3.46Å; E226-K228 PolarHBondContact O-N 3.46Å
227	M	94.7	Very high	85.3	Confident	47 Å²	47	58.2 Å²	58.2	23%	0.232	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.3	171.9	-66.8	-66	-74	0	0	112.9	W223 E225 M229 M338 Y362	W223-M227 HydrophobicContact CD2-CG 3.92Å; W223-M227 VanDerWaalsContact CE2-CG 3.5Å; W223-M227 HydrophobicContact CG-CG 4.28Å; W223-M227 HydrophobicContact CH2-CG 4.49Å; W223-M227 HydrophobicContact CZ2-CE 4.13Å; W223-M227 HydrophobicContact CZ2-CG 3.84Å; W223-M227 VanDerWaalsContact O-CB 3.28Å; W223-M227 WeakPolarHBondContact O-CB 3.42Å; W223-M227 WeakPolarHBondContact O-CG 3.46Å; W223-M227 PolarHBondContact O-N 2.99Å; E225-M227 VanDerWaalsContact C-N 3.32Å; E225-M227 PolarHBondContact O-N 3.45Å; M227-M229 VanDerWaalsContact C-N 3.26Å; M227-M229 HydrophobicContact CB-CE 4.15Å; M227-M229 HydrophobicContact CB-CG 3.88Å; M227-M229 HydrophobicContact CB-SD 4.34Å; M227-M229 HydrophobicContact CE-CE 4.34Å; M227-M229 PolarHBondContact O-N 3.43Å; M227-M338 HydrophobicContact CE-CE 3.47Å; M227-M338 VanDerWaalsContact CE-CE 3.47Å; M227-M338 HydrophobicContact CE-SD 4.16Å; M227-M338 WeakPolarHBondContact O-CG 3.5Å; M227-Y362 HydrophobicContact CE-CD2 3.45Å; M227-Y362 VanDerWaalsContact CE-CD2 3.45Å; M227-Y362 HydrophobicContact CE-CE2 3.51Å; M227-Y362 HydrophobicContact CE-CG 4.36Å
228	K	96.7	Very high	86.8	Confident	149 Å²	149	58.1 Å²	58.1	65%	0.648	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	36.4	179.5	-54.6	178.4	-178.2	176.7	0	113.3	A224 E225 E226 G230 A337 M338	A224-K228 PolarHBondContact O-N 3.21Å; E225-K228 WeakPolarHBondContact O-CA 3.42Å; E225-K228 PolarHBondContact O-N 2.66Å; E226-K228 PolarHBondContact O-N 3.46Å; K228-G230 PolarHBondContact O-N 3.44Å; K228-A337 CarbonylContact O-C 3.59Å; K228-M338 WeakPolarHBondContact O-CA 3.28Å; K228-M338 PolarHBondContact O-N 2.7Å
229	M	97.1	Very high	88.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.257	C	S	.	.			trans	-79.6	60.6	180	-63.8	-172.4	166.6	0	0	111.7	W223 A224 M227 A231 F232 L233 F245 M338 D358 Y362	W223-M229 HydrophobicContact CH2-CE 3.52Å; W223-M229 HydrophobicContact CH2-SD 3.84Å; W223-M229 HydrophobicContact CZ2-CE 4.2Å; W223-M229 HydrophobicContact CZ3-CE 4.02Å; W223-M229 HydrophobicContact CZ3-SD 3.67Å; A224-M229 HydrophobicContact CB-CB 4.45Å; A224-M229 WeakPolarHBondContact O-CB 3.35Å; A224-M229 PolarHBondContact O-N 3.13Å; M227-M229 VanDerWaalsContact C-N 3.26Å; M227-M229 HydrophobicContact CB-CE 4.15Å; M227-M229 HydrophobicContact CB-CG 3.88Å; M227-M229 HydrophobicContact CB-SD 4.34Å; M227-M229 HydrophobicContact CE-CE 4.34Å; M227-M229 PolarHBondContact O-N 3.43Å; M229-A231 VanDerWaalsContact C-N 3.3Å; M229-A231 PolarHBondContact O-N 2.91Å; M229-F232 HydrophobicContact CB-CB 4.22Å; M229-F232 HydrophobicContact CB-CD1 4.4Å; M229-L233 WeakPolarHBondContact O-CB 3.22Å; M229-L233 WeakPolarHBondContact O-CG 3.38Å; M229-L233 PolarHBondContact O-N 3.25Å; M229-F245 HydrophobicContact CE-CE2 4.33Å; M229-F245 HydrophobicContact SD-CD2 4.29Å; M229-F245 HydrophobicContact SD-CE2 4.23Å; M229-M338 HydrophobicContact CE-SD 3.88Å; M229-M338 HydrophobicContact CG-CB 4.45Å; M229-D358 VanDerWaalsContact CA-CG 3.42Å; M229-D358 WeakPolarHBondContact CA-OD2 3.47Å; M229-D358 HydrophobicContact CB-CB 3.89Å; M229-D358 WeakPolarHBondContact CB-OD2 3.42Å; M229-D358 HydrophobicContact CG-CB 3.89Å; M229-D358 HydrophobicContact SD-CB 4.31Å; M229-Y362 HydrophobicContact CE-CD1 4.29Å; M229-Y362 HydrophobicContact CE-CG 3.96Å
230	G	97.3	Very high	90.5	Very high	23 Å²	23	52.1 Å²	52.1	24%	0.237	25%	0.254	C	S	.	.	H	α-helix	trans	-68.6	-26.1	-173.3	0	0	0	0	0	113.7	K228 S234 Y336 D358	K228-G230 PolarHBondContact O-N 3.44Å; G230-S234 VanDerWaalsContact O-CB 3.28Å; G230-S234 WeakPolarHBondContact O-CB 3.47Å; G230-S234 PolarHBondContact O-N 3.43Å; G230-Y336 WeakPolarHBondContact CA-O 3.31Å; G230-Y336 PolarHBondContact N-O 3.45Å; G230-D358 PolarHBondContact N-OD2 3Å
231	A	98.6	Very high	92.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-74.2	-47.4	177.9	0	0	0	0	0	110.9	M229 S234 V335 A337 I343 L354 D358	M229-A231 VanDerWaalsContact C-N 3.3Å; M229-A231 PolarHBondContact O-N 2.91Å; A231-S234 WeakPolarHBondContact O-CB 3.24Å; A231-S234 PolarHBondContact O-N 3.31Å; A231-S234 PolarHBondContact O-OG 3.44Å; A231-V335 HydrophobicContact CB-CG2 4.44Å; A231-A337 HydrophobicContact CB-CB 4.47Å; A231-I343 HydrophobicContact CB-CD1 3.91Å; A231-L354 HydrophobicContact CB-CB 4.22Å; A231-L354 VanDerWaalsContact CB-O 3.28Å; A231-L354 WeakPolarHBondContact CB-O 3.23Å; A231-D358 WeakPolarHBondContact CA-OD2 3.12Å; A231-D358 WeakPolarHBondContact CB-OD2 3.44Å; A231-D358 PolarHBondContact N-OD2 3.24Å
232	F	97.9	Very high	94.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.5	-51.2	172.5	168	-115.2	0	0	0	112	V217 A224 M229 S234 V235 P243 P318 V320 I355 D358	V217-F232 HydrophobicContact CG2-CE1 4.2Å; A224-F232 HydrophobicContact CB-CD1 4.34Å; A224-F232 HydrophobicContact CB-CE1 4.32Å; M229-F232 HydrophobicContact CB-CB 4.22Å; M229-F232 HydrophobicContact CB-CD1 4.4Å; F232-S234 PolarHBondContact O-N 2.87Å; F232-V235 PolarHBondContact O-N 3.1Å; F232-P243 HydrophobicContact CE1-CB 4.42Å; F232-P243 HydrophobicContact CE2-CB 4.45Å; F232-P243 HydrophobicContact CZ-CB 3.85Å; F232-P318 HydrophobicContact CD2-CB 3.6Å; F232-P318 HydrophobicContact CE2-CB 3.58Å; F232-V320 HydrophobicContact CD2-CG1 3.76Å; F232-V320 HydrophobicContact CE2-CG1 3.33Å; F232-V320 HydrophobicContact CZ-CG1 4.17Å; F232-I355 HydrophobicContact CD2-CB 4.05Å; F232-I355 HydrophobicContact CD2-CG2 4.02Å; F232-D358 HydrophobicContact CB-CB 4.09Å; F232-D358 WeakPolarHBondContact CB-OD2 3.12Å; F232-D358 PolarHBondContact N-OD2 2.96Å
233	L	96.2	Very high	95.3	Very high	27 Å²	27	41.1 Å²	41.1	14%	0.141	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-28.7	179.5	-69.8	172.2	0	0	0	112.2	V217 A224 E225 M229 V235 K237	V217-L233 HydrophobicContact CG1-CD2 3.74Å; A224-L233 HydrophobicContact CB-CD1 4.19Å; A224-L233 HydrophobicContact CB-CD2 3.9Å; A224-L233 HydrophobicContact CB-CG 4.16Å; E225-L233 HydrophobicContact CB-CD1 4.49Å; E225-L233 HydrophobicContact CG-CD1 3.68Å; M229-L233 WeakPolarHBondContact O-CB 3.22Å; M229-L233 WeakPolarHBondContact O-CG 3.38Å; M229-L233 PolarHBondContact O-N 3.25Å; L233-V235 VanDerWaalsContact C-N 3.33Å; L233-V235 PolarHBondContact O-N 3.11Å; L233-K237 WeakPolarHBondContact O-CG 3.31Å
234	S	97.8	Very high	95.6	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-33.6	-180	77.5	0	0	0	0	113.7	G230 A231 F232 S329	G230-S234 VanDerWaalsContact O-CB 3.28Å; G230-S234 WeakPolarHBondContact O-CB 3.47Å; G230-S234 PolarHBondContact O-N 3.43Å; A231-S234 WeakPolarHBondContact O-CB 3.24Å; A231-S234 PolarHBondContact O-N 3.31Å; A231-S234 PolarHBondContact O-OG 3.44Å; F232-S234 PolarHBondContact O-N 2.87Å; S234-S329 PolarHBondContact O-OG 3.42Å
235	V	98.1	Very high	95.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-75	-41.3	-178	178.9	0	0	0	0	110.6	F232 L233 K237 V320 N322 E351 L354 I355	F232-V235 PolarHBondContact O-N 3.1Å; L233-V235 VanDerWaalsContact C-N 3.33Å; L233-V235 PolarHBondContact O-N 3.11Å; V235-K237 VanDerWaalsContact C-N 3.28Å; V235-K237 PolarHBondContact O-N 3.3Å; V235-V320 HydrophobicContact CB-CG2 4.47Å; V235-V320 HydrophobicContact CG1-CB 4.47Å; V235-V320 HydrophobicContact CG1-CG2 3.73Å; V235-N322 HydrophobicContact CG1-CB 4.01Å; V235-E351 HydrophobicContact CB-CB 4.42Å; V235-E351 HydrophobicContact CG1-CB 3.68Å; V235-E351 HydrophobicContact CG1-CG 3.94Å; V235-E351 HydrophobicContact CG2-CB 3.83Å; V235-L354 HydrophobicContact CG2-CB 3.84Å; V235-L354 HydrophobicContact CG2-CD1 3.94Å; V235-L354 HydrophobicContact CG2-CG 4.5Å; V235-I355 HydrophobicContact CB-CG2 3.85Å; V235-I355 HydrophobicContact CG1-CG2 4.18Å; V235-I355 HydrophobicContact CG2-CG2 3.77Å
236	A	95.7	Very high	96.1	Very high	8 Å²	8	35.1 Å²	35.1	7%	0.066	18%	0.183	C	C	.	.	H	α-helix	trans	-69	-21.1	-175.7	0	0	0	0	0	114.7	G238 S239 P243 V320	A236-G238 PolarHBondContact O-N 3.04Å; A236-S239 PolarHBondContact O-N 3Å; A236-S239 VanDerWaalsContact O-N 3.16Å; A236-P243 HydrophobicContact CB-CB 3.53Å; A236-P243 HydrophobicContact CB-CG 3.5Å; A236-V320 HydrophobicContact CB-CB 4.31Å; A236-V320 HydrophobicContact CB-CG1 3.97Å
237	K	94.3	Very high	96.4	Very high	111 Å²	111	30.3 Å²	30.3	48%	0.483	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.4	-171.8	-77.6	170.5	-177.7	-179.6	0	114.7	L233 V235 R327	L233-K237 WeakPolarHBondContact O-CG 3.31Å; V235-K237 VanDerWaalsContact C-N 3.28Å; V235-K237 PolarHBondContact O-N 3.3Å; K237-R327 HydrophobicContact CB-CB 4.48Å; K237-R327 VanDerWaalsContact CB-O 3.23Å; K237-R327 WeakPolarHBondContact CB-O 3.27Å; K237-R327 WeakPolarHBondContact O-CB 3.21Å
238	G	95.8	Very high	96.6	Very high	10 Å²	10	28.1 Å²	28.1	10%	0.103	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-25.2	-178.5	0	0	0	0	0	114.3	A236 M323 G325	A236-G238 PolarHBondContact O-N 3.04Å; G238-M323 VanDerWaalsContact CA-O 3.31Å; G238-M323 WeakPolarHBondContact CA-O 3.28Å; G238-G325 WeakPolarHBondContact O-CA 3.19Å
239	S	96.1	Very high	96.7	Very high	8 Å²	8	22.3 Å²	22.3	6%	0.056	13%	0.125	C	C	.	.			trans	-93.1	161.4	-177.6	-178.3	0	0	0	0	113	A236 E241 E321	A236-S239 PolarHBondContact O-N 3Å; A236-S239 VanDerWaalsContact O-N 3.16Å; S239-E241 WeakPolarHBondContact OG-CB 3.45Å; S239-E241 PolarHBondContact OG-N 3.04Å; S239-E321 WeakPolarHBondContact CB-O 3.27Å; S239-E321 WeakPolarHBondContact CB-OE2 3.12Å; S239-E321 PolarHBondContact OG-OE2 3.14Å
240	V	94.2	Very high	96.7	Very high	126 Å²	126	22.8 Å²	22.8	76%	0.764	13%	0.128	S	C	*	.	S	Bend	trans	-87.3	-19.1	164.6	-63.5	0	0	0	0	112.1
241	E	94.9	Very high	96.8	Very high	61 Å²	61	25.5 Å²	25.5	29%	0.285	13%	0.133	S	C	.	.	S	Bend	trans	-68.4	139	174.2	-67.7	-62.1	145.3	0	0	110.5	T192 S239 E321	T192-E241 WeakPolarHBondContact CB-OE2 3.15Å; T192-E241 HydrophobicContact CG2-CG 4.14Å; T192-E241 WeakPolarHBondContact CG2-OE2 3.49Å; T192-E241 PolarHBondContact OG1-OE2 2.5Å; S239-E241 WeakPolarHBondContact OG-CB 3.45Å; S239-E241 PolarHBondContact OG-N 3.04Å; E241-E321 HydrophobicContact CB-CB 4.24Å
242	I	92.6	Very high	96.7	Very high	41 Å²	41	26.5 Å²	26.5	21%	0.21	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-76.6	125.3	-175.5	-45.1	-171.8	0	0	0	108.5	P193 V194 L218	P193-I242 VanDerWaalsContact CB-O 3.25Å; P193-I242 WeakPolarHBondContact CB-O 3.33Å; V194-I242 HydrophobicContact CG2-CB 4.05Å; V194-I242 HydrophobicContact CG2-CG1 4.45Å; L218-I242 HydrophobicContact CB-CD1 3.95Å; L218-I242 HydrophobicContact CB-CG1 4.45Å; L218-I242 HydrophobicContact CB-CG2 3.74Å; L218-I242 HydrophobicContact CD1-CB 4.04Å; L218-I242 HydrophobicContact CD1-CD1 3.54Å; L218-I242 HydrophobicContact CD1-CG1 3.39Å; L218-I242 HydrophobicContact CD1-CG2 3.87Å; L218-I242 HydrophobicContact CG-CD1 4.36Å; L218-I242 HydrophobicContact CG-CG2 4.23Å
243	P	95.9	Very high	96.5	Very high	15 Å²	15	34.5 Å²	34.5	10%	0.097	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-70.1	145.4	173.2	28.6	-30.8	0	0	0	110.4	V217 F232 A236 L319 V320	V217-P243 HydrophobicContact CB-CG 3.86Å; V217-P243 HydrophobicContact CG1-CG 4.23Å; V217-P243 HydrophobicContact CG2-CG 4.1Å; V217-P243 WeakPolarHBondContact CG2-O 3.45Å; V217-P243 PolarHBondContact N-O 3.29Å; V217-P243 VanDerWaalsContact N-O 3.12Å; F232-P243 HydrophobicContact CE1-CB 4.42Å; F232-P243 HydrophobicContact CE2-CB 4.45Å; F232-P243 HydrophobicContact CZ-CB 3.85Å; A236-P243 HydrophobicContact CB-CB 3.53Å; A236-P243 HydrophobicContact CB-CG 3.5Å; P243-L319 VanDerWaalsContact CA-O 3.31Å; P243-L319 WeakPolarHBondContact CA-O 3.4Å; P243-V320 HydrophobicContact CB-CG1 4.07Å
244	V	96.6	Very high	96.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.3	-177.5	-179.7	0	0	0	0	109	P193 V194 A197 V214 R215 Q216 L246 L319	P193-V244 HydrophobicContact CB-CB 4.22Å; P193-V244 HydrophobicContact CB-CG2 3.96Å; V194-V244 HydrophobicContact CG2-CG2 4.01Å; A197-V244 HydrophobicContact CB-CG1 3.96Å; V214-V244 HydrophobicContact CG1-CG1 3.77Å; R215-V244 CarbonylContact O-C 3.14Å; R215-V244 WeakPolarHBondContact O-CA 3.29Å; Q216-V244 HydrophobicContact CG-CG2 4.15Å; V244-L246 HydrophobicContact CG1-CD2 3.71Å; V244-L246 HydrophobicContact CG1-CG 4.42Å; V244-L319 HydrophobicContact CB-CB 4.29Å; V244-L319 HydrophobicContact CB-CD1 4.24Å; V244-L319 HydrophobicContact CG1-CD1 4.38Å; V244-L319 PolarHBondContact N-O 3.42Å; V244-L319 WeakPolarHBondContact O-CA 3.5Å; V244-L319 VanDerWaalsContact O-CB 3.31Å; V244-L319 WeakPolarHBondContact O-CB 3.12Å; V244-L319 PolarHBondContact O-N 2.96Å
245	F	97.4	Very high	96.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.7	169	-159.9	-76.3	0	0	0	109	R215 W223 M229 L316 P318 A359 Y362	R215-F245 HydrophobicContact CB-CB 4.29Å; R215-F245 PolarHBondContact N-O 3.18Å; R215-F245 PolarHBondContact O-N 2.65Å; W223-F245 HydrophobicContact CH2-CB 4.38Å; W223-F245 AromaticContact CH2-CD1 3.85Å; W223-F245 HydrophobicContact CH2-CD1 3.85Å; W223-F245 HydrophobicContact CH2-CD2 4.31Å; W223-F245 HydrophobicContact CH2-CE1 4.19Å; W223-F245 AromaticContact CH2-CG 3.92Å; W223-F245 HydrophobicContact CH2-CG 3.92Å; W223-F245 HydrophobicContact CZ3-CB 3.75Å; W223-F245 HydrophobicContact CZ3-CD1 4.09Å; W223-F245 HydrophobicContact CZ3-CD2 4.08Å; W223-F245 AromaticContact CZ3-CG 3.71Å; W223-F245 HydrophobicContact CZ3-CG 3.71Å; M229-F245 HydrophobicContact CE-CE2 4.33Å; M229-F245 HydrophobicContact SD-CD2 4.29Å; M229-F245 HydrophobicContact SD-CE2 4.23Å; F245-L316 HydrophobicContact CE1-CB 4.15Å; F245-L316 HydrophobicContact CE1-CD2 4.14Å; F245-L316 HydrophobicContact CZ-CB 4.1Å; F245-P318 HydrophobicContact CD2-CB 4Å; F245-P318 HydrophobicContact CE2-CB 3.97Å; F245-A359 HydrophobicContact CE2-CB 3.98Å; F245-A359 HydrophobicContact CZ-CB 3.99Å; F245-Y362 AromaticContact CE1-CD1 3.83Å; F245-Y362 HydrophobicContact CE1-CD1 3.83Å; F245-Y362 HydrophobicContact CE1-CE1 4.07Å; F245-Y362 AromaticContact CZ-CD1 3.88Å; F245-Y362 HydrophobicContact CZ-CD1 3.88Å
246	L	98	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.6	172.8	-49.6	-179.5	0	0	0	110.8	F196 A197 A200 L212 V214 V244 L316 V317 L319	F196-L246 HydrophobicContact CD1-CD1 3.7Å; F196-L246 HydrophobicContact CE1-CD1 3.69Å; A197-L246 HydrophobicContact CB-CD2 3.68Å; A200-L246 HydrophobicContact CB-CD1 3.9Å; L212-L246 HydrophobicContact CD1-CB 4.42Å; V214-L246 HydrophobicContact CB-CD2 4.14Å; V214-L246 HydrophobicContact CG1-CD2 3.82Å; V214-L246 HydrophobicContact CG2-CD2 3.87Å; V244-L246 HydrophobicContact CG1-CD2 3.71Å; V244-L246 HydrophobicContact CG1-CG 4.42Å; L246-L316 WeakPolarHBondContact O-CA 3.32Å; L246-V317 HydrophobicContact CB-CB 4.11Å; L246-V317 PolarHBondContact N-O 3.18Å; L246-V317 PolarHBondContact O-N 2.87Å; L246-L319 HydrophobicContact CD1-CD1 3.7Å; L246-L319 HydrophobicContact CD2-CD1 4.39Å; L246-L319 HydrophobicContact CG-CD1 3.69Å
247	E	98.2	Very high	95.8	Very high	9 Å²	9	54.7 Å²	54.7	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	116.7	173.8	172.4	-175.8	161.4	0	0	107.7	I213 R215 H249 G315 L316 Y362	I213-E247 HydrophobicContact CB-CB 4.16Å; I213-E247 HydrophobicContact CD1-CG 4.35Å; I213-E247 PolarHBondContact N-O 3.43Å; I213-E247 PolarHBondContact O-N 3.4Å; R215-E247 IonicContact CZ-OE2 2.7Å; R215-E247 IonicContact NE-OE2 3.48Å; R215-E247 IonicContact NH2-OE2 2.9Å; R215-E247 PolarHBondContact NH2-OE2 3.29Å; E247-H249 VanDerWaalsContact CG-NE2 3.33Å; E247-H249 WeakPolarHBondContact CG-NE2 3.48Å; E247-H249 IonicContact OE1-CD2 3.71Å; E247-H249 IonicContact OE1-CE1 3.12Å; E247-H249 IonicContact OE1-NE2 2.6Å; E247-H249 PolarHBondContact OE1-NE2 2.89Å; E247-G315 CarbonylContact C-O 3.52Å; E247-G315 WeakPolarHBondContact CA-O 3.33Å; E247-L316 HydrophobicContact CB-CD2 4.13Å; E247-L316 HydrophobicContact CG-CD2 3.89Å; E247-Y362 WeakPolarHBondContact OE2-CE1 3.4Å; E247-Y362 PolarHBondContact OE2-OH 3.28Å
248	I	98.8	Very high	96	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.6	-172.2	-48.9	170.6	0	0	0	108.3	L204 V210 D211 L212 L296 I299 I314 G315	L204-I248 HydrophobicContact CD1-CD1 4.17Å; L204-I248 HydrophobicContact CD1-CG1 4.33Å; L204-I248 HydrophobicContact CD1-CG2 3.61Å; V210-I248 HydrophobicContact CG1-CG2 3.67Å; D211-I248 CarbonylContact O-C 3.54Å; D211-I248 WeakPolarHBondContact O-CA 3.03Å; L212-I248 HydrophobicContact CD1-CG1 3.74Å; I248-L296 HydrophobicContact CD1-CD1 4.02Å; I248-I299 HydrophobicContact CB-CD1 3.7Å; I248-I299 HydrophobicContact CD1-CD1 4.33Å; I248-I299 HydrophobicContact CG2-CB 4.42Å; I248-I299 HydrophobicContact CG2-CD1 3.69Å; I248-I299 HydrophobicContact CG2-CG2 3.77Å; I248-I314 CarbonylContact O-C 3.59Å; I248-I314 VanDerWaalsContact O-CA 3.29Å; I248-I314 WeakPolarHBondContact O-CA 3.28Å; I248-G315 PolarHBondContact N-O 3.13Å; I248-G315 PolarHBondContact O-N 2.97Å
249	H	98.7	Very high	96.1	Very high	28 Å²	28	52.1 Å²	52.1	13%	0.13	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	106.3	179.7	-68.8	-100.7	0	0	0	110.8	V210 D211 E247 F366	V210-H249 CarbonylContact C-O 3.57Å; V210-H249 VanDerWaalsContact CA-O 3.27Å; V210-H249 WeakPolarHBondContact CA-O 3.27Å; D211-H249 HydrophobicContact CB-CB 4.28Å; D211-H249 PolarHBondContact N-O 3.47Å; D211-H249 PolarHBondContact O-N 2.82Å; E247-H249 VanDerWaalsContact CG-NE2 3.33Å; E247-H249 WeakPolarHBondContact CG-NE2 3.48Å; E247-H249 IonicContact OE1-CD2 3.71Å; E247-H249 IonicContact OE1-CE1 3.12Å; E247-H249 IonicContact OE1-NE2 2.6Å; E247-H249 PolarHBondContact OE1-NE2 2.89Å; H249-F366 AromaticContact CE1-CE1 3.84Å
250	L	98.7	Very high	96.3	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.052	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	109.3	164.9	174.9	62.2	0	0	0	109.3	N209 V210 I299 L302 A303 D312 V313	N209-L250 VanDerWaalsContact ND2-CD1 3.31Å; N209-L250 WeakPolarHBondContact ND2-CD1 3.44Å; V210-L250 HydrophobicContact CG2-CB 4.45Å; V210-L250 HydrophobicContact CG2-CD1 3.69Å; L250-I299 HydrophobicContact CB-CG2 3.98Å; L250-L302 HydrophobicContact CD2-CB 3.59Å; L250-L302 HydrophobicContact CD2-CD1 4.33Å; L250-A303 HydrophobicContact CD1-CB 4.06Å; L250-D312 WeakPolarHBondContact O-CA 3.4Å; L250-D312 WeakPolarHBondContact O-CB 3.39Å; L250-V313 HydrophobicContact CB-CB 4.21Å; L250-V313 HydrophobicContact CD2-CB 4.37Å; L250-V313 PolarHBondContact N-O 3.17Å; L250-V313 PolarHBondContact O-N 3.48Å
251	K	98.2	Very high	96.5	Very high	80 Å²	80	45.8 Å²	45.8	35%	0.348	22%	0.22	S	C	.	.			trans	-81.9	127.8	-179.1	-64.9	171.3	-178.5	158.1	0	110.8	N209 D211 D312	N209-K251 PolarHBondContact ND2-O 2.93Å; N209-K251 PolarHBondContact O-N 3.45Å; D211-K251 IonicContact OD1-NZ 2.76Å; D211-K251 PolarHBondContact OD1-NZ 3.03Å; D211-K251 WeakPolarHBondContact OD2-CE 3.44Å; D211-K251 IonicContact OD2-NZ 2.68Å; D211-K251 PolarHBondContact OD2-NZ 3.22Å; K251-D312 WeakPolarHBondContact CA-OD1 3.39Å
252	C	96.8	Very high	96.7	Very high	20 Å²	20	42.9 Å²	42.9	14%	0.135	21%	0.207	C	C	.	.			trans	-75.1	158.9	166.9	64.7	0	0	0	0	111.6	K255 L309 F311 D312	C252-K255 WeakPolarHBondContact SG-CG 3.42Å; C252-L309 WeakPolarHBondContact CB-O 3.48Å; C252-F311 WeakPolarHBondContact CB-O 3.17Å; C252-D312 PolarHBondContact N-OD1 2.81Å; C252-D312 PolarHBondContact SG-OD1 3.14Å
253	K	94.4	Very high	97	Very high	169 Å²	169	40.9 Å²	40.9	74%	0.735	20%	0.197	S	C	*	.	S	Bend	trans	-68.4	-40.6	176.8	-64.3	-177.7	-169.3	153.5	0	112.1	D308	K253-D308 VanDerWaalsContact CD-OD1 3.31Å; K253-D308 WeakPolarHBondContact CD-OD1 3.35Å; K253-D308 VanDerWaalsContact CE-OD1 3.3Å; K253-D308 WeakPolarHBondContact CE-OD1 3.19Å; K253-D308 IonicContact NZ-OD1 2.66Å; K253-D308 PolarHBondContact NZ-OD1 2.69Å
254	E	93.1	Very high	97.1	Very high	117 Å²	117	40.2 Å²	40.2	55%	0.547	19%	0.192	S	C	.	.	S	Bend	trans	-135.6	109.4	-178.2	-166.2	-171.3	168	0	0	110.2	K256	E254-K256 HydrophobicContact CG-CG 4.39Å; E254-K256 PolarHBondContact O-N 3.35Å; E254-K256 VanDerWaalsContact O-N 3.14Å; E254-K256 WeakPolarHBondContact OE1-CE 3.44Å; E254-K256 IonicContact OE1-NZ 2.68Å; E254-K256 WeakPolarHBondContact OE2-CE 3.45Å; E254-K256 IonicContact OE2-NZ 2.82Å; E254-K256 PolarHBondContact OE2-NZ 3.34Å
255	K	91.5	Very high	97.2	Very high	142 Å²	142	40.3 Å²	40.3	62%	0.617	19%	0.193	S	C	*	.			trans	-75.6	99.9	-179.2	-65.5	-178.6	-174	-155.7	0	110.7	C252 D312	C252-K255 WeakPolarHBondContact SG-CG 3.42Å; K255-D312 WeakPolarHBondContact CE-OD1 3.43Å; K255-D312 WeakPolarHBondContact CE-OD2 3.3Å; K255-D312 IonicContact NZ-OD1 2.66Å; K255-D312 IonicContact NZ-OD2 3.9Å; K255-D312 PolarHBondContact NZ-OD2 3.25Å
256	K	94	Very high	97.3	Very high	140 Å²	140	40.3 Å²	40.3	61%	0.609	19%	0.193	S	C	*	.			trans	-102.3	-19	175	-64.4	178.2	-176.4	167.2	0	112.8	E254 P310	E254-K256 HydrophobicContact CG-CG 4.39Å; E254-K256 PolarHBondContact O-N 3.35Å; E254-K256 VanDerWaalsContact O-N 3.14Å; E254-K256 WeakPolarHBondContact OE1-CE 3.44Å; E254-K256 IonicContact OE1-NZ 2.68Å; E254-K256 WeakPolarHBondContact OE2-CE 3.45Å; E254-K256 IonicContact OE2-NZ 2.82Å; E254-K256 PolarHBondContact OE2-NZ 3.34Å; K256-P310 HydrophobicContact CB-CB 4.05Å; K256-P310 PolarHBondContact N-O 2.9Å
257	M	94.6	Very high	97.3	Very high	62 Å²	62	40.3 Å²	40.3	31%	0.305	19%	0.193	S	C	.	.	S	Bend	trans	-135.7	159	-174.4	-68.4	176.6	66.1	0	0	111.4	P310 F311 T505	M257-P310 HydrophobicContact CG-CB 4.47Å; M257-P310 PolarHBondContact N-O 3.15Å; M257-P310 HydrophobicContact SD-CB 4.23Å; M257-P310 HydrophobicContact SD-CG 3.88Å; M257-F311 HydrophobicContact CB-CB 4.01Å; M257-F311 HydrophobicContact CB-CD1 4.32Å; M257-F311 HydrophobicContact CE-CD1 4.36Å; M257-F311 HydrophobicContact SD-CD1 4.13Å; M257-T505 HydrophobicContact CE-CG2 4.39Å; M257-T505 HydrophobicContact SD-CG2 3.41Å; M257-T505 WeakPolarHBondContact SD-CG2 3.25Å
258	A	97.6	Very high	97.4	Very high	44 Å²	44	40 Å²	40	36%	0.364	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-62.1	149.6	168.5	0	0	0	0	0	110.8	F311 K367 S369	A258-F311 WeakPolarHBondContact O-CB 3.22Å; A258-K367 WeakPolarHBondContact CB-O 3.32Å; A258-S369 WeakPolarHBondContact O-CB 3.47Å; A258-S369 PolarHBondContact O-OG 3Å
259	P	98.5	Very high	97.4	Very high	22 Å²	22	41.9 Å²	41.9	14%	0.143	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-62	157	-172.4	25.9	-35.2	0	0	0	112.8	D312 I314 F366 P368 S369	P259-D312 CarbonylContact C-O 3.46Å; P259-D312 VanDerWaalsContact CA-O 3.24Å; P259-D312 WeakPolarHBondContact CA-O 3.19Å; P259-D312 HydrophobicContact CB-CB 4.24Å; P259-D312 WeakPolarHBondContact CB-O 3.39Å; P259-I314 HydrophobicContact CB-CD1 3.68Å; P259-I314 HydrophobicContact CB-CG1 4.02Å; P259-I314 HydrophobicContact CG-CD1 3.84Å; P259-F366 HydrophobicContact CG-CB 4.31Å; P259-P368 CarbonylContact O-C 3.05Å; P259-P368 WeakPolarHBondContact O-CA 3.29Å; P259-P368 WeakPolarHBondContact O-CB 3.33Å; P259-S369 PolarHBondContact O-N 3.26Å; P259-S369 PolarHBondContact O-OG 3.41Å
260	V	98.8	Very high	97.3	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.7	163.5	174.4	0	0	0	0	108	L262 F311 D312 V313 I314 L501	V260-L262 HydrophobicContact CG1-CD2 4.27Å; V260-F311 HydrophobicContact CB-CD2 4.1Å; V260-F311 HydrophobicContact CB-CE2 4.05Å; V260-F311 HydrophobicContact CG2-CD1 4.28Å; V260-F311 HydrophobicContact CG2-CD2 3.65Å; V260-F311 HydrophobicContact CG2-CE1 4.18Å; V260-F311 HydrophobicContact CG2-CE2 3.54Å; V260-F311 HydrophobicContact CG2-CG 4.05Å; V260-F311 HydrophobicContact CG2-CZ 3.83Å; V260-D312 PolarHBondContact N-O 3.31Å; V260-V313 WeakPolarHBondContact O-CA 3.32Å; V260-I314 PolarHBondContact O-N 3.07Å; V260-L501 HydrophobicContact CG2-CD1 4.35Å
261	C	98.9	Very high	97.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132	176.3	-73.7	0	0	0	0	110.6	I314 A363 P368 S370 V371 I372	C261-I314 CarbonylContact C-O 3.47Å; C261-I314 VanDerWaalsContact CA-O 3.29Å; C261-I314 WeakPolarHBondContact CA-O 3.4Å; C261-A363 HydrophobicContact CB-CB 4.12Å; C261-P368 HydrophobicContact CB-CB 4.15Å; C261-P368 HydrophobicContact CB-CG 4.48Å; C261-S370 PolarHBondContact N-O 3.42Å; C261-V371 HydrophobicContact CB-CG2 4.2Å; C261-V371 CarbonylContact O-C 3.53Å; C261-V371 WeakPolarHBondContact O-CA 3.24Å; C261-I372 PolarHBondContact O-N 2.98Å
262	L	99	Very high	97.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.3	170.7	-54.5	-177.8	0	0	0	108.7	V260 V295 A298 V313 I314 G315 L316 I372 L494 I498	V260-L262 HydrophobicContact CG1-CD2 4.27Å; L262-V295 HydrophobicContact CB-CG1 3.96Å; L262-V295 HydrophobicContact CB-CG2 3.93Å; L262-A298 HydrophobicContact CD1-CB 4.11Å; L262-V313 HydrophobicContact CD1-CG1 3.83Å; L262-V313 HydrophobicContact CG-CG1 3.99Å; L262-I314 PolarHBondContact N-O 3.2Å; L262-G315 CarbonylContact O-C 3.16Å; L262-G315 WeakPolarHBondContact O-CA 3.48Å; L262-L316 PolarHBondContact O-N 3.15Å; L262-I372 CarbonylContact C-O 3.54Å; L262-I372 VanDerWaalsContact CA-O 3.26Å; L262-I372 WeakPolarHBondContact CA-O 3.28Å; L262-I372 HydrophobicContact CD2-CB 3.95Å; L262-I372 HydrophobicContact CD2-CD1 4.22Å; L262-I372 HydrophobicContact CD2-CG1 4.45Å; L262-L494 HydrophobicContact CD2-CD1 4.13Å; L262-I498 HydrophobicContact CD1-CD1 3.73Å; L262-I498 HydrophobicContact CD2-CD1 3.99Å; L262-I498 HydrophobicContact CG-CD1 4.38Å
263	V	99	Very high	97.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.8	-179.9	-173.1	0	0	0	0	110	L316 L356 A359 L360 A363 V371 I372 D373 I374	V263-L316 WeakPolarHBondContact CA-O 3.31Å; V263-L316 HydrophobicContact CG2-CB 4.35Å; V263-L356 HydrophobicContact CG1-CD2 3.72Å; V263-A359 HydrophobicContact CG1-CB 3.5Å; V263-A359 VanDerWaalsContact CG1-CB 3.5Å; V263-L360 HydrophobicContact CG2-CD2 4.21Å; V263-A363 HydrophobicContact CG2-CB 4.14Å; V263-V371 HydrophobicContact CG2-CG1 4.19Å; V263-I372 PolarHBondContact N-O 3.48Å; V263-D373 HydrophobicContact CB-CB 3.8Å; V263-D373 HydrophobicContact CG1-CB 4.47Å; V263-D373 CarbonylContact O-C 3.59Å; V263-D373 WeakPolarHBondContact O-CA 3.23Å; V263-I374 PolarHBondContact O-N 2.88Å
264	G	98.9	Very high	97.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.9	-172.2	0	0	0	0	0	112.9	G266 L316 P318	G264-G266 PolarHBondContact O-N 3.34Å; G264-L316 PolarHBondContact N-O 3.43Å; G264-P318 WeakPolarHBondContact O-CD 3.31Å
265	K	98.9	Very high	97.8	Very high	3 Å²	3	27.4 Å²	27.4	1%	0.013	14%	0.139	C	C	.	.			trans	-60.4	121.4	171.8	-178.4	-172.3	173.1	179.8	0	109.5	V267 D288 M289 A292 E351 I355 L356 I374 A375 T376	K265-V267 HydrophobicContact CD-CG2 4.38Å; K265-V267 HydrophobicContact CG-CG2 4.06Å; K265-D288 WeakPolarHBondContact CE-OD1 3.42Å; K265-D288 WeakPolarHBondContact CE-OD2 3.39Å; K265-D288 IonicContact NZ-OD1 3.61Å; K265-D288 PolarHBondContact NZ-OD1 3.46Å; K265-D288 IonicContact NZ-OD2 3.01Å; K265-D288 PolarHBondContact NZ-OD2 3.47Å; K265-M289 CarbonylContact O-C 3.53Å; K265-M289 WeakPolarHBondContact O-CA 3.38Å; K265-A292 WeakPolarHBondContact O-CB 3.25Å; K265-A292 PolarHBondContact O-N 2.85Å; K265-E351 VanDerWaalsContact CE-OE1 3.28Å; K265-E351 WeakPolarHBondContact CE-OE1 3.32Å; K265-E351 IonicContact NZ-OE1 2.62Å; K265-E351 PolarHBondContact NZ-OE1 2.91Å; K265-I355 HydrophobicContact CG-CD1 4.08Å; K265-L356 HydrophobicContact CB-CD1 4.24Å; K265-L356 HydrophobicContact CB-CD2 4.27Å; K265-L356 HydrophobicContact CB-CG 4.36Å; K265-I374 PolarHBondContact N-O 2.94Å; K265-A375 HydrophobicContact CB-CB 3.51Å; K265-A375 HydrophobicContact CD-CB 4.02Å; K265-A375 HydrophobicContact CG-CB 4.32Å; K265-T376 PolarHBondContact NZ-O 2.94Å
266	G	98.8	Very high	98.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	50.1	-176.9	0	0	0	0	0	114.3	G264 C268 P318 L319 V320	G264-G266 PolarHBondContact O-N 3.34Å; G266-C268 PolarHBondContact O-N 3.09Å; G266-P318 WeakPolarHBondContact CA-O 3.42Å; G266-P318 PolarHBondContact N-O 3.19Å; G266-L319 CarbonylContact O-C 3.52Å; G266-L319 VanDerWaalsContact O-CA 3.22Å; G266-L319 WeakPolarHBondContact O-CA 3.31Å; G266-V320 PolarHBondContact O-N 3.46Å
267	V	98.8	Very high	98.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	98.3	174.7	-173.8	0	0	0	0	108.8	K265 F269 D270 D288 M289 V320 N322 E351 I355	K265-V267 HydrophobicContact CD-CG2 4.38Å; K265-V267 HydrophobicContact CG-CG2 4.06Å; V267-F269 WeakPolarHBondContact CG1-O 3.31Å; V267-F269 PolarHBondContact O-N 3.5Å; V267-D270 HydrophobicContact CG1-CB 3.7Å; V267-D288 HydrophobicContact CB-CB 4.31Å; V267-D288 WeakPolarHBondContact CB-OD2 3.32Å; V267-D288 PolarHBondContact N-O 3.28Å; V267-D288 CarbonylContact O-C 3.56Å; V267-M289 WeakPolarHBondContact O-CB 3.22Å; V267-M289 PolarHBondContact O-N 3.29Å; V267-V320 CarbonylContact C-O 3.57Å; V267-V320 HydrophobicContact CB-CG2 4.43Å; V267-V320 HydrophobicContact CG1-CG2 4.36Å; V267-V320 HydrophobicContact CG2-CG2 3.94Å; V267-N322 HydrophobicContact CG1-CB 4.03Å; V267-E351 HydrophobicContact CG1-CG 4.49Å; V267-E351 HydrophobicContact CG2-CG 4.03Å; V267-I355 HydrophobicContact CG2-CD1 3.62Å
268	C	98.7	Very high	98.3	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	-29	-174.4	-75.1	0	0	0	0	113.5	A188 M191 P193 G266 V320	A188-C268 WeakPolarHBondContact CB-O 3.43Å; M191-C268 WeakPolarHBondContact O-CB 3.27Å; M191-C268 PolarHBondContact O-SG 2.84Å; P193-C268 HydrophobicContact CG-CB 4.43Å; G266-C268 PolarHBondContact O-N 3.09Å; C268-V320 PolarHBondContact N-O 3.36Å
269	F	98.7	Very high	98.2	Very high	40 Å²	40	25.5 Å²	25.5	18%	0.175	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	135.1	165.2	-169.8	-103.8	0	0	0	109.1	A188 V267 M282 M285 E321 N322 M323	A188-F269 HydrophobicContact CB-CB 3.67Å; A188-F269 HydrophobicContact CB-CD2 3.67Å; A188-F269 HydrophobicContact CB-CG 4Å; V267-F269 WeakPolarHBondContact CG1-O 3.31Å; V267-F269 PolarHBondContact O-N 3.5Å; F269-M282 HydrophobicContact CZ-CG 4.11Å; F269-M282 HydrophobicContact CZ-SD 4.45Å; F269-M285 WeakPolarHBondContact CA-O 3.28Å; F269-E321 HydrophobicContact CB-CG 3.8Å; F269-N322 PolarHBondContact O-N 2.93Å; F269-M323 HydrophobicContact CD1-SD 3.7Å; F269-M323 HydrophobicContact CE1-SD 4.08Å
270	D	98.4	Very high	98	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	100.1	178.9	-172.5	20.3	0	0	0	111.8	V267 G272 K277 M285 D288 N322	V267-D270 HydrophobicContact CG1-CB 3.7Å; D270-G272 VanDerWaalsContact C-N 3.28Å; D270-G272 WeakPolarHBondContact OD1-CA 3.39Å; D270-G272 PolarHBondContact OD1-N 2.97Å; D270-K277 WeakPolarHBondContact O-CE 3.27Å; D270-K277 WeakPolarHBondContact OD2-CE 3.4Å; D270-K277 IonicContact OD2-NZ 3.91Å; D270-K277 PolarHBondContact OD2-NZ 3.44Å; D270-M285 HydrophobicContact CB-CB 4.14Å; D270-M285 PolarHBondContact N-O 3.03Å; D270-M285 WeakPolarHBondContact O-CB 3.47Å; D270-M285 VanDerWaalsContact O-CG 3.28Å; D270-M285 WeakPolarHBondContact O-CG 3.32Å; D270-D288 HydrophobicContact CB-CB 4.06Å; D270-D288 VanDerWaalsContact CB-OD2 3.22Å; D270-D288 WeakPolarHBondContact CB-OD2 3.48Å; D270-N322 PolarHBondContact OD1-ND2 2.86Å
271	S	98.2	Very high	97.7	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.021	21%	0.21	C	C	.	.			trans	-82.5	-9.2	170	66.6	0	0	0	0	112.7	G273 L276 K277 N322 M323 P324	S271-G273 VanDerWaalsContact C-N 3.33Å; S271-G273 PolarHBondContact OG-N 3.17Å; S271-L276 WeakPolarHBondContact O-CA 3.45Å; S271-L276 VanDerWaalsContact O-CD1 3.28Å; S271-L276 WeakPolarHBondContact O-CD1 3.44Å; S271-K277 PolarHBondContact O-N 3Å; S271-N322 PolarHBondContact N-O 3.41Å; S271-N322 PolarHBondContact OG-O 3.09Å; S271-M323 WeakPolarHBondContact OG-CA 3.31Å; S271-P324 WeakPolarHBondContact OG-CD 3.23Å
272	G	98	Very high	97.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.			trans	84.8	-1.9	-167.7	0	0	0	0	0	114.9	D270 I274 S275 T348 D349	D270-G272 VanDerWaalsContact C-N 3.28Å; D270-G272 WeakPolarHBondContact OD1-CA 3.39Å; D270-G272 PolarHBondContact OD1-N 2.97Å; G272-I274 PolarHBondContact O-N 3.18Å; G272-S275 CarbonylContact O-C 3.54Å; G272-S275 PolarHBondContact O-N 2.7Å; G272-T348 CarbonylContact O-C 3.39Å; G272-T348 WeakPolarHBondContact O-CB 3.4Å; G272-T348 PolarHBondContact O-OG1 2.99Å; G272-D349 WeakPolarHBondContact CA-OD1 3.37Å; G272-D349 PolarHBondContact O-N 2.66Å
273	G	98	Very high	97.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.01	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	-130.3	-179.7	0	0	0	0	0	112.1	S271 N322 P324	S271-G273 VanDerWaalsContact C-N 3.33Å; S271-G273 PolarHBondContact OG-N 3.17Å; G273-N322 PolarHBondContact N-ND2 2.75Å; G273-P324 WeakPolarHBondContact O-CB 3.5Å
274	I	98.3	Very high	97.2	Very high	81 Å²	81	44.4 Å²	44.4	42%	0.415	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-36.9	177.2	-64	-59.5	0	0	0	111.7	G272 L276 A328 S329 K330 P331 T348	G272-I274 PolarHBondContact O-N 3.18Å; I274-L276 PolarHBondContact O-N 3.12Å; I274-A328 HydrophobicContact CD1-CB 4.11Å; I274-A328 HydrophobicContact CG1-CB 3.96Å; I274-S329 WeakPolarHBondContact CG1-O 3.4Å; I274-K330 HydrophobicContact CG1-CG 4.48Å; I274-P331 HydrophobicContact CG2-CG 4.41Å; I274-T348 HydrophobicContact CB-CG2 4.39Å; I274-T348 PolarHBondContact N-OG1 3.11Å
275	S	97.5	Very high	97.1	Very high	34 Å²	34	46 Å²	46	24%	0.238	26%	0.26	C	S	.	.	S	Bend	trans	-78.4	55.8	170.1	-57	0	0	0	0	111.2	G272 K277 N347 T348	G272-S275 CarbonylContact O-C 3.54Å; G272-S275 PolarHBondContact O-N 2.7Å; S275-K277 PolarHBondContact O-N 3.06Å; S275-N347 WeakPolarHBondContact CB-OD1 3.43Å; S275-N347 PolarHBondContact OG-OD1 2.69Å; S275-T348 WeakPolarHBondContact CB-OG1 3.2Å; S275-T348 PolarHBondContact N-OG1 2.71Å; S275-T348 PolarHBondContact OG-N 3.43Å; S275-T348 VanDerWaalsContact OG-N 3.15Å; S275-T348 PolarHBondContact OG-OG1 3.31Å
276	L	97.9	Very high	97.1	Very high	103 Å²	103	47.6 Å²	47.6	54%	0.539	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-50.4	131.5	-170.1	-167.9	69.8	0	0	0	113.4	S271 I274 M282 P324	S271-L276 WeakPolarHBondContact O-CA 3.45Å; S271-L276 VanDerWaalsContact O-CD1 3.28Å; S271-L276 WeakPolarHBondContact O-CD1 3.44Å; I274-L276 PolarHBondContact O-N 3.12Å; L276-M282 HydrophobicContact CD1-CE 4.28Å; L276-M282 HydrophobicContact CG-CE 4.38Å; L276-P324 HydrophobicContact CD1-CG 4.21Å
277	K	96.6	Very high	97	Very high	38 Å²	38	47.6 Å²	47.6	17%	0.165	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-64.1	154.2	172.6	-65.2	-175.9	-161.4	-73.1	0	111.4	D270 S271 S275 M282 M285 D349	D270-K277 WeakPolarHBondContact O-CE 3.27Å; D270-K277 WeakPolarHBondContact OD2-CE 3.4Å; D270-K277 IonicContact OD2-NZ 3.91Å; D270-K277 PolarHBondContact OD2-NZ 3.44Å; S271-K277 PolarHBondContact O-N 3Å; S275-K277 PolarHBondContact O-N 3.06Å; K277-M282 HydrophobicContact CB-CE 4.01Å; K277-M282 WeakPolarHBondContact O-CE 3.37Å; K277-M285 HydrophobicContact CD-CG 3.79Å; K277-M285 HydrophobicContact CD-SD 3.82Å; K277-M285 VanDerWaalsContact CE-SD 3.51Å; K277-D349 WeakPolarHBondContact CE-OD1 3.28Å; K277-D349 WeakPolarHBondContact CG-OD1 3.44Å; K277-D349 VanDerWaalsContact NZ-CG 3.26Å; K277-D349 IonicContact NZ-OD1 3.43Å; K277-D349 PolarHBondContact NZ-OD1 2.96Å; K277-D349 IonicContact NZ-OD2 3.61Å; K277-D349 PolarHBondContact NZ-OD2 2.99Å
278	P	96.6	Very high	97	Very high	102 Å²	102	48 Å²	48	66%	0.662	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-57.6	147.8	165.1	-21.8	33.8	0	0	0	111.7	D280	P278-D280 PolarHBondContact O-N 3.09Å
279	S	95.8	Very high	97	Very high	105 Å²	105	48 Å²	48	73%	0.734	27%	0.268	S	S	*	.	S	Bend	trans	-62.8	-29.3	179	-54.2	0	0	0	0	113.2	F281 M282	S279-F281 PolarHBondContact O-N 3.08Å; S279-M282 WeakPolarHBondContact O-CB 3.43Å; S279-M282 PolarHBondContact O-N 3.34Å
280	D	94.9	Very high	97	Very high	130 Å²	130	46.1 Å²	46.1	70%	0.695	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	124.7	177.7	-70.3	-11.8	0	0	0	109.7	P278 M282	P278-D280 PolarHBondContact O-N 3.09Å; D280-M282 PolarHBondContact O-N 3.41Å; D280-M282 VanDerWaalsContact O-N 3.08Å
281	F	91	Very high	97.1	Very high	165 Å²	165	46 Å²	46	72%	0.724	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	4.8	-178.6	-45.3	-77.5	0	0	0	116.1	S279 A283 S284	S279-F281 PolarHBondContact O-N 3.08Å; F281-A283 PolarHBondContact O-N 3.14Å; F281-A283 VanDerWaalsContact O-N 3.11Å; F281-S284 VanDerWaalsContact O-CB 3.29Å; F281-S284 WeakPolarHBondContact O-CB 3.15Å; F281-S284 PolarHBondContact O-N 3.33Å
282	M	96.9	Very high	97.1	Very high	36 Å²	36	45.9 Å²	45.9	18%	0.177	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-57	-30.1	176	-170.8	-172.9	-73.6	0	0	112.5	F269 L276 K277 S279 D280 S284 M285	F269-M282 HydrophobicContact CZ-CG 4.11Å; F269-M282 HydrophobicContact CZ-SD 4.45Å; L276-M282 HydrophobicContact CD1-CE 4.28Å; L276-M282 HydrophobicContact CG-CE 4.38Å; K277-M282 HydrophobicContact CB-CE 4.01Å; K277-M282 WeakPolarHBondContact O-CE 3.37Å; S279-M282 WeakPolarHBondContact O-CB 3.43Å; S279-M282 PolarHBondContact O-N 3.34Å; D280-M282 PolarHBondContact O-N 3.41Å; D280-M282 VanDerWaalsContact O-N 3.08Å; M282-S284 PolarHBondContact O-N 3.36Å; M282-M285 WeakPolarHBondContact O-CB 3.07Å; M282-M285 VanDerWaalsContact O-CG 3.31Å; M282-M285 WeakPolarHBondContact O-CG 3.38Å; M282-M285 PolarHBondContact O-N 2.96Å
283	A	94.9	Very high	97.1	Very high	72 Å²	72	45.9 Å²	45.9	60%	0.595	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-62.1	-23.2	175.6	0	0	0	0	0	113.5	F281 M285 R286	F281-A283 PolarHBondContact O-N 3.14Å; F281-A283 VanDerWaalsContact O-N 3.11Å; A283-M285 VanDerWaalsContact C-N 3.25Å; A283-M285 PolarHBondContact O-N 3.36Å; A283-R286 WeakPolarHBondContact O-CG 3.27Å; A283-R286 PolarHBondContact O-NH1 3.28Å
284	S	95.5	Very high	97.2	Very high	17 Å²	17	45.9 Å²	45.9	12%	0.119	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-73.1	-16.7	172.8	-69.9	0	0	0	0	112.7	F281 M282 R286 A287 E474	F281-S284 VanDerWaalsContact O-CB 3.29Å; F281-S284 WeakPolarHBondContact O-CB 3.15Å; F281-S284 PolarHBondContact O-N 3.33Å; M282-S284 PolarHBondContact O-N 3.36Å; S284-R286 PolarHBondContact O-N 3.19Å; S284-R286 VanDerWaalsContact O-N 3.08Å; S284-A287 WeakPolarHBondContact O-CB 3.37Å; S284-A287 PolarHBondContact O-N 3.01Å; S284-E474 WeakPolarHBondContact CB-OE1 2.85Å; S284-E474 PolarHBondContact OG-OE1 3.05Å
285	M	97.7	Very high	97.2	Very high	35 Å²	35	42 Å²	42	17%	0.172	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-71.6	-0.9	-179.7	-55.3	-63.6	93.4	0	0	113.5	F269 D270 K277 M282 A283 A287 D288	F269-M285 WeakPolarHBondContact CA-O 3.28Å; D270-M285 HydrophobicContact CB-CB 4.14Å; D270-M285 PolarHBondContact N-O 3.03Å; D270-M285 WeakPolarHBondContact O-CB 3.47Å; D270-M285 VanDerWaalsContact O-CG 3.28Å; D270-M285 WeakPolarHBondContact O-CG 3.32Å; K277-M285 HydrophobicContact CD-CG 3.79Å; K277-M285 HydrophobicContact CD-SD 3.82Å; K277-M285 VanDerWaalsContact CE-SD 3.51Å; M282-M285 WeakPolarHBondContact O-CB 3.07Å; M282-M285 VanDerWaalsContact O-CG 3.31Å; M282-M285 WeakPolarHBondContact O-CG 3.38Å; M282-M285 PolarHBondContact O-N 2.96Å; A283-M285 VanDerWaalsContact C-N 3.25Å; A283-M285 PolarHBondContact O-N 3.36Å; M285-A287 PolarHBondContact O-N 2.75Å; M285-D288 WeakPolarHBondContact O-CB 3.49Å; M285-D288 PolarHBondContact O-N 3.08Å
286	R	98.1	Very high	97.3	Very high	35 Å²	35	40.4 Å²	40.4	13%	0.132	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-59.3	-28.3	160	72.1	-174.9	-173.2	-87.1	3.3	112.7	D185 M186 A188 A283 S284 D288 M289 D485	D185-R286 PolarHBondContact O-NE 3.27Å; D185-R286 IonicContact OD1-NH2 2.66Å; M186-R286 WeakPolarHBondContact O-CD 3.43Å; A188-R286 HydrophobicContact CB-CB 4.25Å; A283-R286 WeakPolarHBondContact O-CG 3.27Å; A283-R286 PolarHBondContact O-NH1 3.28Å; S284-R286 PolarHBondContact O-N 3.19Å; S284-R286 VanDerWaalsContact O-N 3.08Å; R286-D288 VanDerWaalsContact C-N 3.3Å; R286-M289 WeakPolarHBondContact O-CG 3.14Å; R286-D485 IonicContact NH2-OD2 3.21Å; R286-D485 PolarHBondContact NH2-OD2 3.43Å
287	A	97.7	Very high	97.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-89	6.2	-179.1	0	0	0	0	0	112.9	A184 S284 M285 M289 T290 M473 M486	A184-A287 HydrophobicContact CB-CB 4.11Å; S284-A287 WeakPolarHBondContact O-CB 3.37Å; S284-A287 PolarHBondContact O-N 3.01Å; M285-A287 PolarHBondContact O-N 2.75Å; A287-M289 PolarHBondContact O-N 3.4Å; A287-T290 WeakPolarHBondContact O-CB 3.36Å; A287-T290 PolarHBondContact O-N 2.95Å; A287-T290 PolarHBondContact O-OG1 3.06Å; A287-M473 HydrophobicContact CB-CE 4.2Å; A287-M473 HydrophobicContact CB-CG 4.14Å; A287-M473 HydrophobicContact CB-SD 3.56Å; A287-M473 VanDerWaalsContact CB-SD 3.56Å; A287-M486 HydrophobicContact CB-CE 3.59Å; A287-M486 HydrophobicContact CB-CG 4.17Å; A287-M486 HydrophobicContact CB-SD 3.56Å; A287-M486 VanDerWaalsContact CB-SD 3.56Å
288	D	98.5	Very high	97.4	Very high	9 Å²	9	33.7 Å²	33.7	5%	0.048	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	3.9	-178.3	-160.1	37.9	0	0	0	114	K265 V267 D270 M285 R286 T376	K265-D288 WeakPolarHBondContact CE-OD1 3.42Å; K265-D288 WeakPolarHBondContact CE-OD2 3.39Å; K265-D288 IonicContact NZ-OD1 3.61Å; K265-D288 PolarHBondContact NZ-OD1 3.46Å; K265-D288 IonicContact NZ-OD2 3.01Å; K265-D288 PolarHBondContact NZ-OD2 3.47Å; V267-D288 HydrophobicContact CB-CB 4.31Å; V267-D288 WeakPolarHBondContact CB-OD2 3.32Å; V267-D288 PolarHBondContact N-O 3.28Å; V267-D288 CarbonylContact O-C 3.56Å; D270-D288 HydrophobicContact CB-CB 4.06Å; D270-D288 VanDerWaalsContact CB-OD2 3.22Å; D270-D288 WeakPolarHBondContact CB-OD2 3.48Å; M285-D288 WeakPolarHBondContact O-CB 3.49Å; M285-D288 PolarHBondContact O-N 3.08Å; R286-D288 VanDerWaalsContact C-N 3.3Å; D288-T376 WeakPolarHBondContact CA-OG1 3.45Å; D288-T376 PolarHBondContact O-OG1 3.44Å; D288-T376 VanDerWaalsContact O-OG1 3.11Å; D288-T376 VanDerWaalsContact OD1-CB 3.32Å; D288-T376 WeakPolarHBondContact OD1-CB 3.43Å; D288-T376 VanDerWaalsContact OD1-O 3.06Å; D288-T376 PolarHBondContact OD1-OG1 3Å
289	M	98.6	Very high	97.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	9.2	170	56.4	75.3	72.7	0	0	112.9	L183 M191 F196 K265 V267 R286 A287 G291 A292 A293	L183-M289 HydrophobicContact CB-CE 4.3Å; M191-M289 HydrophobicContact CG-CE 3.86Å; M191-M289 HydrophobicContact SD-CE 4.26Å; F196-M289 HydrophobicContact CD2-CE 3.06Å; F196-M289 HydrophobicContact CE2-CE 3.07Å; F196-M289 HydrophobicContact CG-CE 4.27Å; F196-M289 HydrophobicContact CZ-CE 4.28Å; K265-M289 CarbonylContact O-C 3.53Å; K265-M289 WeakPolarHBondContact O-CA 3.38Å; V267-M289 WeakPolarHBondContact O-CB 3.22Å; V267-M289 PolarHBondContact O-N 3.29Å; R286-M289 WeakPolarHBondContact O-CG 3.14Å; A287-M289 PolarHBondContact O-N 3.4Å; M289-G291 PolarHBondContact O-N 3.36Å; M289-G291 VanDerWaalsContact O-N 3.14Å; M289-A292 WeakPolarHBondContact O-CA 3.43Å; M289-A292 VanDerWaalsContact O-CB 3.26Å; M289-A292 WeakPolarHBondContact O-CB 3.34Å; M289-A292 PolarHBondContact O-N 3Å; M289-A293 HydrophobicContact CE-CB 4.38Å; M289-A293 PolarHBondContact O-N 3.31Å; M289-A293 HydrophobicContact SD-CB 4.38Å
290	T	98.8	Very high	97.7	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-30.3	-177.9	-61	0	0	0	0	111.9	V180 A184 A287 A293 C294 I469	V180-T290 HydrophobicContact CG1-CG2 3.86Å; A184-T290 HydrophobicContact CB-CG2 4.49Å; A184-T290 WeakPolarHBondContact CB-OG1 3.39Å; A287-T290 WeakPolarHBondContact O-CB 3.36Å; A287-T290 PolarHBondContact O-N 2.95Å; A287-T290 PolarHBondContact O-OG1 3.06Å; T290-A293 PolarHBondContact O-N 3.1Å; T290-C294 PolarHBondContact O-N 3.26Å; T290-C294 PolarHBondContact O-SG 2.76Å; T290-I469 HydrophobicContact CG2-CD1 3.62Å
291	G	98.9	Very high	97.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.7	-46.9	172.3	0	0	0	0	0	113.1	M289 C294 V295 I374	M289-G291 PolarHBondContact O-N 3.36Å; M289-G291 VanDerWaalsContact O-N 3.14Å; G291-C294 WeakPolarHBondContact O-CB 3.49Å; G291-C294 PolarHBondContact O-N 2.96Å; G291-V295 PolarHBondContact O-N 3.46Å; G291-V295 VanDerWaalsContact O-N 3.1Å; G291-I374 VanDerWaalsContact CA-O 3.24Å; G291-I374 WeakPolarHBondContact CA-O 3.45Å
292	A	98.9	Very high	98.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-59.1	-46	172.7	0	0	0	0	0	112.3	F196 K265 M289 C294 V295 L296 V317 L319	F196-A292 HydrophobicContact CE1-CB 4.47Å; F196-A292 HydrophobicContact CE2-CB 4.4Å; F196-A292 HydrophobicContact CZ-CB 3.97Å; K265-A292 WeakPolarHBondContact O-CB 3.25Å; K265-A292 PolarHBondContact O-N 2.85Å; M289-A292 WeakPolarHBondContact O-CA 3.43Å; M289-A292 VanDerWaalsContact O-CB 3.26Å; M289-A292 WeakPolarHBondContact O-CB 3.34Å; M289-A292 PolarHBondContact O-N 3Å; A292-C294 VanDerWaalsContact C-N 3.32Å; A292-C294 PolarHBondContact O-N 3.41Å; A292-V295 PolarHBondContact O-N 2.74Å; A292-L296 PolarHBondContact O-N 2.62Å; A292-V317 HydrophobicContact CB-CG1 3.21Å; A292-L319 HydrophobicContact CB-CD2 4.13Å
293	A	98.9	Very high	98.3	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.6	-41	176.9	0	0	0	0	0	111.9	V180 L183 F196 M289 T290 S297	V180-A293 HydrophobicContact CG1-CB 3.88Å; L183-A293 HydrophobicContact CB-CB 3.74Å; L183-A293 HydrophobicContact CD1-CB 3.67Å; L183-A293 HydrophobicContact CG-CB 4.33Å; F196-A293 HydrophobicContact CE2-CB 4.49Å; M289-A293 HydrophobicContact CE-CB 4.38Å; M289-A293 PolarHBondContact O-N 3.31Å; M289-A293 HydrophobicContact SD-CB 4.38Å; T290-A293 PolarHBondContact O-N 3.1Å; A293-S297 WeakPolarHBondContact O-CB 3.48Å; A293-S297 PolarHBondContact O-N 3.38Å
294	C	98.9	Very high	98.5	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-61.1	-43.5	174	-77.7	0	0	0	0	112.4	T290 G291 A292 A298 I374 L491	T290-C294 PolarHBondContact O-N 3.26Å; T290-C294 PolarHBondContact O-SG 2.76Å; G291-C294 WeakPolarHBondContact O-CB 3.49Å; G291-C294 PolarHBondContact O-N 2.96Å; A292-C294 VanDerWaalsContact C-N 3.32Å; A292-C294 PolarHBondContact O-N 3.41Å; C294-A298 WeakPolarHBondContact O-CB 3.48Å; C294-A298 PolarHBondContact O-N 3.27Å; C294-I374 HydrophobicContact CB-CG2 4.23Å; C294-L491 WeakPolarHBondContact O-CD1 3.18Å
295	V	99	Very high	98.6	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65	-50.2	178.8	172	0	0	0	0	111.6	L262 G291 A292 S297 A298 I299 V317 I374	L262-V295 HydrophobicContact CB-CG1 3.96Å; L262-V295 HydrophobicContact CB-CG2 3.93Å; G291-V295 PolarHBondContact O-N 3.46Å; G291-V295 VanDerWaalsContact O-N 3.1Å; A292-V295 PolarHBondContact O-N 2.74Å; V295-S297 PolarHBondContact O-N 3.42Å; V295-A298 PolarHBondContact O-N 3.1Å; V295-I299 HydrophobicContact CG1-CD1 4.38Å; V295-I299 PolarHBondContact O-N 3.03Å; V295-V317 HydrophobicContact CB-CG2 4.02Å; V295-V317 HydrophobicContact CG1-CG2 3.79Å; V295-I374 HydrophobicContact CG2-CD1 3.93Å
296	L	98.9	Very high	98.5	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-56.3	-51.1	177.4	170.8	59.7	0	0	0	111	L183 F196 A200 I203 L204 I248 A292 A298 I299 D300	L183-L296 HydrophobicContact CD1-CD2 4.05Å; F196-L296 HydrophobicContact CE1-CD2 4.01Å; F196-L296 HydrophobicContact CE2-CD2 4.38Å; F196-L296 HydrophobicContact CZ-CB 4.17Å; F196-L296 HydrophobicContact CZ-CD2 3.73Å; A200-L296 HydrophobicContact CB-CD1 3.85Å; A200-L296 HydrophobicContact CB-CD2 3.85Å; I203-L296 HydrophobicContact CD1-CD2 3.95Å; L204-L296 HydrophobicContact CD1-CD1 3.75Å; L204-L296 HydrophobicContact CD2-CD1 4.22Å; L204-L296 HydrophobicContact CG-CD1 3.92Å; I248-L296 HydrophobicContact CD1-CD1 4.02Å; A292-L296 PolarHBondContact O-N 2.62Å; L296-A298 VanDerWaalsContact C-N 3.34Å; L296-A298 PolarHBondContact O-N 3.07Å; L296-I299 PolarHBondContact O-N 3.18Å; L296-D300 PolarHBondContact O-N 3.21Å; L296-D300 VanDerWaalsContact O-N 3.07Å
297	S	98.9	Very high	98.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-70.2	-30	-177.8	-178.3	0	0	0	0	112.7	G176 V180 A293 V295 D300 T301 L491	G176-S297 WeakPolarHBondContact CA-OG 3.26Å; G176-S297 PolarHBondContact O-OG 3.11Å; V180-S297 VanDerWaalsContact CG2-CB 3.48Å; A293-S297 WeakPolarHBondContact O-CB 3.48Å; A293-S297 PolarHBondContact O-N 3.38Å; V295-S297 PolarHBondContact O-N 3.42Å; S297-D300 PolarHBondContact O-N 3.23Å; S297-T301 VanDerWaalsContact O-CB 3.23Å; S297-T301 WeakPolarHBondContact O-CB 3.36Å; S297-T301 PolarHBondContact O-N 2.91Å; S297-T301 PolarHBondContact O-OG1 2.62Å; S297-L491 VanDerWaalsContact OG-CD2 3.3Å; S297-L491 WeakPolarHBondContact OG-CD2 3.15Å
298	A	98.9	Very high	97.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-66.1	-42.3	177.1	0	0	0	0	0	110.6	L262 C294 V295 L296 T301 L302 L491 L494 V495	L262-A298 HydrophobicContact CD1-CB 4.11Å; C294-A298 WeakPolarHBondContact O-CB 3.48Å; C294-A298 PolarHBondContact O-N 3.27Å; V295-A298 PolarHBondContact O-N 3.1Å; L296-A298 VanDerWaalsContact C-N 3.34Å; L296-A298 PolarHBondContact O-N 3.07Å; A298-T301 PolarHBondContact O-N 2.69Å; A298-L302 WeakPolarHBondContact O-CB 3.45Å; A298-L302 WeakPolarHBondContact O-CD1 3.37Å; A298-L302 WeakPolarHBondContact O-CG 3.2Å; A298-L302 PolarHBondContact O-N 3.34Å; A298-L491 HydrophobicContact CB-CD1 3.92Å; A298-L494 HydrophobicContact CB-CD2 3.84Å; A298-L494 HydrophobicContact CB-CG 4.29Å; A298-V495 HydrophobicContact CB-CG2 4.03Å
299	I	98.9	Very high	97.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.9	-46.7	176.3	-70.5	171	0	0	0	111.2	L204 V210 I248 L250 V295 L296 T301 L302 A303 V313	L204-I299 HydrophobicContact CD2-CG2 4.39Å; V210-I299 HydrophobicContact CG1-CG2 4.26Å; V210-I299 HydrophobicContact CG2-CG2 4.32Å; I248-I299 HydrophobicContact CB-CD1 3.7Å; I248-I299 HydrophobicContact CD1-CD1 4.33Å; I248-I299 HydrophobicContact CG2-CB 4.42Å; I248-I299 HydrophobicContact CG2-CD1 3.69Å; I248-I299 HydrophobicContact CG2-CG2 3.77Å; L250-I299 HydrophobicContact CB-CG2 3.98Å; V295-I299 HydrophobicContact CG1-CD1 4.38Å; V295-I299 PolarHBondContact O-N 3.03Å; L296-I299 PolarHBondContact O-N 3.18Å; I299-T301 VanDerWaalsContact C-N 3.33Å; I299-T301 PolarHBondContact O-N 2.97Å; I299-L302 PolarHBondContact O-N 2.92Å; I299-A303 WeakPolarHBondContact O-CB 3.43Å; I299-A303 PolarHBondContact O-N 3.4Å; I299-V313 HydrophobicContact CG1-CG1 4.17Å
300	D	98.9	Very high	97.7	Very high	20 Å²	20	20.4 Å²	20.4	11%	0.107	12%	0.123	C	C	.	.	H	α-helix	trans	-58.3	-44.2	174.7	174.5	59.5	0	0	0	111.8	I203 L204 H207 L296 S297 A303 N304	I203-D300 HydrophobicContact CG2-CB 3.95Å; L204-D300 HydrophobicContact CD2-CB 4.07Å; H207-D300 IonicContact CD2-OD1 3.95Å; H207-D300 IonicContact CE1-OD1 2.98Å; H207-D300 IonicContact NE2-OD1 3.97Å; H207-D300 PolarHBondContact NE2-OD1 3.35Å; L296-D300 PolarHBondContact O-N 3.21Å; L296-D300 VanDerWaalsContact O-N 3.07Å; S297-D300 PolarHBondContact O-N 3.23Å; D300-A303 PolarHBondContact O-N 3.08Å; D300-N304 WeakPolarHBondContact O-CB 3.12Å; D300-N304 PolarHBondContact O-N 2.93Å; D300-N304 PolarHBondContact O-ND2 3.19Å; D300-N304 PolarHBondContact OD1-ND2 3.44Å; D300-N304 VanDerWaalsContact OD1-ND2 3.09Å; D300-N304 PolarHBondContact OD2-ND2 3.36Å
301	T	98.9	Very high	97.6	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.012	12%	0.123	C	C	.	.	H	α-helix	trans	-64.7	-43.9	178.7	-55.6	0	0	0	0	111.1	T172 G176 S297 A298 I299 N304 L305 V495	T172-T301 HydrophobicContact CG2-CG2 3.96Å; G176-T301 WeakPolarHBondContact CA-OG1 3.47Å; S297-T301 VanDerWaalsContact O-CB 3.23Å; S297-T301 WeakPolarHBondContact O-CB 3.36Å; S297-T301 PolarHBondContact O-N 2.91Å; S297-T301 PolarHBondContact O-OG1 2.62Å; A298-T301 PolarHBondContact O-N 2.69Å; I299-T301 VanDerWaalsContact C-N 3.33Å; I299-T301 PolarHBondContact O-N 2.97Å; T301-N304 PolarHBondContact O-N 3.5Å; T301-L305 HydrophobicContact CG2-CD1 4.19Å; T301-L305 VanDerWaalsContact O-CG 3.26Å; T301-L305 WeakPolarHBondContact O-CG 3.19Å; T301-L305 PolarHBondContact O-N 2.92Å; T301-V495 HydrophobicContact CG2-CG1 4Å; T301-V495 HydrophobicContact CG2-CG2 4.02Å
302	L	98.7	Very high	97.6	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-63.9	-40.4	176.6	-73.8	166.4	0	0	0	112.1	L250 A298 I299 L305 G306 L309 V313 V495 I498 E499	L250-L302 HydrophobicContact CD2-CB 3.59Å; L250-L302 HydrophobicContact CD2-CD1 4.33Å; A298-L302 WeakPolarHBondContact O-CB 3.45Å; A298-L302 WeakPolarHBondContact O-CD1 3.37Å; A298-L302 WeakPolarHBondContact O-CG 3.2Å; A298-L302 PolarHBondContact O-N 3.34Å; I299-L302 PolarHBondContact O-N 2.92Å; L302-L305 PolarHBondContact O-N 3Å; L302-G306 PolarHBondContact O-N 2.94Å; L302-G306 VanDerWaalsContact O-N 3.15Å; L302-L309 HydrophobicContact CD2-CD1 4.49Å; L302-V313 HydrophobicContact CD1-CG1 4.47Å; L302-V313 HydrophobicContact CD1-CG2 4.28Å; L302-V495 HydrophobicContact CD2-CG1 3.88Å; L302-V495 HydrophobicContact CG-CG1 4.2Å; L302-I498 HydrophobicContact CD1-CB 4.29Å; L302-I498 HydrophobicContact CD1-CD1 3.79Å; L302-I498 HydrophobicContact CD1-CG2 3.81Å; L302-I498 HydrophobicContact CD2-CB 4.46Å; L302-I498 HydrophobicContact CD2-CG2 4.18Å; L302-E499 HydrophobicContact CD2-CG 4.22Å
303	A	98.6	Very high	97.6	Very high	14 Å²	14	21.2 Å²	21.2	12%	0.116	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-44.9	175.3	0	0	0	0	0	111.4	H207 V210 L250 I299 D300 L305 G306	H207-A303 HydrophobicContact CB-CB 4.35Å; V210-A303 HydrophobicContact CG2-CB 4.11Å; L250-A303 HydrophobicContact CD1-CB 4.06Å; I299-A303 WeakPolarHBondContact O-CB 3.43Å; I299-A303 PolarHBondContact O-N 3.4Å; D300-A303 PolarHBondContact O-N 3.08Å; A303-L305 VanDerWaalsContact C-N 3.33Å; A303-L305 PolarHBondContact O-N 3.31Å; A303-G306 PolarHBondContact O-N 3.45Å
304	N	98.4	Very high	97.6	Very high	87 Å²	87	21.5 Å²	21.5	47%	0.465	13%	0.129	S	C	.	.	H	α-helix	trans	-64.5	-32.1	175.9	-78.5	-58.1	0	0	0	113.6	T172 H207 D300 T301 G306	T172-N304 HydrophobicContact CG2-CB 3.86Å; H207-N304 PolarHBondContact CE1-OD1 3.42Å; D300-N304 WeakPolarHBondContact O-CB 3.12Å; D300-N304 PolarHBondContact O-N 2.93Å; D300-N304 PolarHBondContact O-ND2 3.19Å; D300-N304 PolarHBondContact OD1-ND2 3.44Å; D300-N304 VanDerWaalsContact OD1-ND2 3.09Å; D300-N304 PolarHBondContact OD2-ND2 3.36Å; T301-N304 PolarHBondContact O-N 3.5Å; N304-G306 VanDerWaalsContact C-N 3.35Å
305	L	97.5	Very high	97.6	Very high	32 Å²	32	21.5 Å²	21.5	17%	0.168	13%	0.129	C	C	.	.	H	α-helix	trans	-71.1	-30.8	174.8	-72	165.2	0	0	0	112.2	R169 T172 F173 T301 L302 A303 N307 V495	R169-L305 HydrophobicContact CG-CD2 4.29Å; T172-L305 HydrophobicContact CG2-CD2 3.86Å; T172-L305 HydrophobicContact CG2-CG 3.84Å; F173-L305 HydrophobicContact CD2-CD1 4.3Å; F173-L305 HydrophobicContact CD2-CD2 4.32Å; F173-L305 HydrophobicContact CE2-CD1 3.62Å; F173-L305 HydrophobicContact CE2-CD2 4.09Å; F173-L305 HydrophobicContact CE2-CG 4.47Å; F173-L305 HydrophobicContact CZ-CD1 4.4Å; T301-L305 HydrophobicContact CG2-CD1 4.19Å; T301-L305 VanDerWaalsContact O-CG 3.26Å; T301-L305 WeakPolarHBondContact O-CG 3.19Å; T301-L305 PolarHBondContact O-N 2.92Å; L302-L305 PolarHBondContact O-N 3Å; A303-L305 VanDerWaalsContact C-N 3.33Å; A303-L305 PolarHBondContact O-N 3.31Å; L305-N307 PolarHBondContact O-N 3.27Å; L305-V495 HydrophobicContact CD1-CG1 3.74Å
306	G	94.7	Very high	97.6	Very high	49 Å²	49	21.5 Å²	21.5	51%	0.505	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	18.9	175.5	0	0	0	0	0	115.1	L302 A303 N304	L302-G306 PolarHBondContact O-N 2.94Å; L302-G306 VanDerWaalsContact O-N 3.15Å; A303-G306 PolarHBondContact O-N 3.45Å; N304-G306 VanDerWaalsContact C-N 3.35Å
307	N	92.8	Very high	97.6	Very high	69 Å²	69	21.4 Å²	21.4	37%	0.369	13%	0.129	S	C	.	.			trans	-65.2	147.2	-179.5	-63.6	-41.8	0	0	0	112.4	L305 L309 E499	L305-N307 PolarHBondContact O-N 3.27Å; N307-L309 PolarHBondContact O-N 2.65Å; N307-E499 PolarHBondContact ND2-OE1 3.41Å
308	D	90.4	Very high	97.6	Very high	115 Å²	115	21.4 Å²	21.4	62%	0.615	13%	0.129	S	C	*	.			trans	-78.3	89.4	173.7	-67.2	-31	0	0	0	110.9	K253	K253-D308 VanDerWaalsContact CD-OD1 3.31Å; K253-D308 WeakPolarHBondContact CD-OD1 3.35Å; K253-D308 VanDerWaalsContact CE-OD1 3.3Å; K253-D308 WeakPolarHBondContact CE-OD1 3.19Å; K253-D308 IonicContact NZ-OD1 2.66Å; K253-D308 PolarHBondContact NZ-OD1 2.69Å
309	L	96.8	Very high	97.6	Very high	18 Å²	18	21.4 Å²	21.4	9%	0.094	13%	0.129	C	C	.	.			trans	-79.1	142.8	171.6	-58.9	178.4	0	0	0	110.7	C252 L302 N307 F311 V313 I498 A502	C252-L309 WeakPolarHBondContact CB-O 3.48Å; L302-L309 HydrophobicContact CD2-CD1 4.49Å; N307-L309 PolarHBondContact O-N 2.65Å; L309-F311 VanDerWaalsContact C-N 3.27Å; L309-F311 HydrophobicContact CB-CE2 4.45Å; L309-F311 HydrophobicContact CD1-CE2 4.28Å; L309-F311 PolarHBondContact O-N 2.86Å; L309-V313 HydrophobicContact CD1-CG2 3.87Å; L309-I498 HydrophobicContact CD1-CG2 4.33Å; L309-A502 HydrophobicContact CD2-CB 3.93Å
310	P	96.6	Very high	97.5	Very high	15 Å²	15	21.5 Å²	21.5	10%	0.097	13%	0.129	C	C	.	.	S	Bend	trans	-84	3.4	176.4	32.1	-33.8	0	0	0	113.8	K256 M257 A502	K256-P310 HydrophobicContact CB-CB 4.05Å; K256-P310 PolarHBondContact N-O 2.9Å; M257-P310 HydrophobicContact CG-CB 4.47Å; M257-P310 PolarHBondContact N-O 3.15Å; M257-P310 HydrophobicContact SD-CB 4.23Å; M257-P310 HydrophobicContact SD-CG 3.88Å; P310-A502 VanDerWaalsContact CD-CB 3.41Å; P310-A502 HydrophobicContact CG-CB 4.1Å
311	F	98.1	Very high	97.5	Very high	1 Å²	1	21.9 Å²	21.9	0%	0.004	13%	0.13	C	C	.	.	S	Bend	trans	-143.1	156.3	-178.2	46.6	-104.4	0	0	0	110.3	C252 M257 A258 V260 L309 V313 I498 L501	C252-F311 WeakPolarHBondContact CB-O 3.17Å; M257-F311 HydrophobicContact CB-CB 4.01Å; M257-F311 HydrophobicContact CB-CD1 4.32Å; M257-F311 HydrophobicContact CE-CD1 4.36Å; M257-F311 HydrophobicContact SD-CD1 4.13Å; A258-F311 WeakPolarHBondContact O-CB 3.22Å; V260-F311 HydrophobicContact CB-CD2 4.1Å; V260-F311 HydrophobicContact CB-CE2 4.05Å; V260-F311 HydrophobicContact CG2-CD1 4.28Å; V260-F311 HydrophobicContact CG2-CD2 3.65Å; V260-F311 HydrophobicContact CG2-CE1 4.18Å; V260-F311 HydrophobicContact CG2-CE2 3.54Å; V260-F311 HydrophobicContact CG2-CG 4.05Å; V260-F311 HydrophobicContact CG2-CZ 3.83Å; L309-F311 VanDerWaalsContact C-N 3.27Å; L309-F311 HydrophobicContact CB-CE2 4.45Å; L309-F311 HydrophobicContact CD1-CE2 4.28Å; L309-F311 PolarHBondContact O-N 2.86Å; F311-V313 HydrophobicContact CD2-CG2 4.08Å; F311-V313 HydrophobicContact CE2-CG2 3.92Å; F311-I498 HydrophobicContact CE2-CG2 4Å; F311-I498 HydrophobicContact CZ-CG2 4.29Å; F311-L501 HydrophobicContact CE1-CB 4.13Å; F311-L501 HydrophobicContact CZ-CB 4Å
312	D	98.5	Very high	97.5	Very high	17 Å²	17	22 Å²	22	9%	0.091	13%	0.13	C	C	.	.			trans	-72	152.5	166.1	-64.2	-15.5	0	0	0	110.5	L250 K251 C252 K255 P259 V260	L250-D312 WeakPolarHBondContact O-CA 3.4Å; L250-D312 WeakPolarHBondContact O-CB 3.39Å; K251-D312 WeakPolarHBondContact CA-OD1 3.39Å; C252-D312 PolarHBondContact N-OD1 2.81Å; C252-D312 PolarHBondContact SG-OD1 3.14Å; K255-D312 WeakPolarHBondContact CE-OD1 3.43Å; K255-D312 WeakPolarHBondContact CE-OD2 3.3Å; K255-D312 IonicContact NZ-OD1 2.66Å; K255-D312 IonicContact NZ-OD2 3.9Å; K255-D312 PolarHBondContact NZ-OD2 3.25Å; P259-D312 CarbonylContact C-O 3.46Å; P259-D312 VanDerWaalsContact CA-O 3.24Å; P259-D312 WeakPolarHBondContact CA-O 3.19Å; P259-D312 HydrophobicContact CB-CB 4.24Å; P259-D312 WeakPolarHBondContact CB-O 3.39Å; V260-D312 PolarHBondContact N-O 3.31Å
313	V	98.8	Very high	97.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.4	169.3	-177.5	0	0	0	0	108.5	L250 V260 L262 I299 L302 L309 F311 I498	L250-V313 HydrophobicContact CB-CB 4.21Å; L250-V313 HydrophobicContact CD2-CB 4.37Å; L250-V313 PolarHBondContact N-O 3.17Å; L250-V313 PolarHBondContact O-N 3.48Å; V260-V313 WeakPolarHBondContact O-CA 3.32Å; L262-V313 HydrophobicContact CD1-CG1 3.83Å; L262-V313 HydrophobicContact CG-CG1 3.99Å; I299-V313 HydrophobicContact CG1-CG1 4.17Å; L302-V313 HydrophobicContact CD1-CG1 4.47Å; L302-V313 HydrophobicContact CD1-CG2 4.28Å; L309-V313 HydrophobicContact CD1-CG2 3.87Å; F311-V313 HydrophobicContact CD2-CG2 4.08Å; F311-V313 HydrophobicContact CE2-CG2 3.92Å; V313-I498 HydrophobicContact CG2-CG2 4.05Å
314	I	98.9	Very high	97.4	Very high	5 Å²	5	26.7 Å²	26.7	3%	0.026	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	118.3	-177.4	-55.8	177.3	0	0	0	108.8	I248 P259 V260 C261 L262 L316 F366	I248-I314 CarbonylContact O-C 3.59Å; I248-I314 VanDerWaalsContact O-CA 3.29Å; I248-I314 WeakPolarHBondContact O-CA 3.28Å; P259-I314 HydrophobicContact CB-CD1 3.68Å; P259-I314 HydrophobicContact CB-CG1 4.02Å; P259-I314 HydrophobicContact CG-CD1 3.84Å; V260-I314 PolarHBondContact O-N 3.07Å; C261-I314 CarbonylContact C-O 3.47Å; C261-I314 VanDerWaalsContact CA-O 3.29Å; C261-I314 WeakPolarHBondContact CA-O 3.4Å; L262-I314 PolarHBondContact N-O 3.2Å; I314-L316 HydrophobicContact CG2-CD2 3.97Å; I314-L316 HydrophobicContact CG2-CG 4.33Å; I314-F366 HydrophobicContact CD1-CB 4.03Å; I314-F366 HydrophobicContact CD1-CD1 3.66Å; I314-F366 HydrophobicContact CD1-CD2 4.49Å; I314-F366 HydrophobicContact CD1-CE1 4.25Å; I314-F366 HydrophobicContact CD1-CG 3.8Å; I314-F366 HydrophobicContact CG2-CE2 4.42Å
315	G	98.9	Very high	97.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.5	174.7	0	0	0	0	0	111.5	E247 I248 L262	E247-G315 CarbonylContact C-O 3.52Å; E247-G315 WeakPolarHBondContact CA-O 3.33Å; I248-G315 PolarHBondContact N-O 3.13Å; I248-G315 PolarHBondContact O-N 2.97Å; L262-G315 CarbonylContact O-C 3.16Å; L262-G315 WeakPolarHBondContact O-CA 3.48Å
316	L	98.9	Very high	97.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.9	175.9	-55.7	178.5	0	0	0	109.3	F245 L246 E247 L262 V263 G264 I314 Y362 A363 F366	F245-L316 HydrophobicContact CE1-CB 4.15Å; F245-L316 HydrophobicContact CE1-CD2 4.14Å; F245-L316 HydrophobicContact CZ-CB 4.1Å; L246-L316 WeakPolarHBondContact O-CA 3.32Å; E247-L316 HydrophobicContact CB-CD2 4.13Å; E247-L316 HydrophobicContact CG-CD2 3.89Å; L262-L316 PolarHBondContact O-N 3.15Å; V263-L316 WeakPolarHBondContact CA-O 3.31Å; V263-L316 HydrophobicContact CG2-CB 4.35Å; G264-L316 PolarHBondContact N-O 3.43Å; I314-L316 HydrophobicContact CG2-CD2 3.97Å; I314-L316 HydrophobicContact CG2-CG 4.33Å; L316-Y362 HydrophobicContact CD1-CD1 3.94Å; L316-Y362 HydrophobicContact CD1-CG 4.5Å; L316-Y362 HydrophobicContact CD2-CD1 3.92Å; L316-Y362 HydrophobicContact CD2-CE1 3.89Å; L316-A363 HydrophobicContact CD1-CB 3.75Å; L316-F366 HydrophobicContact CD1-CD2 4.49Å; L316-F366 HydrophobicContact CD1-CE2 4.16Å; L316-F366 HydrophobicContact CD2-CE2 4.07Å
317	V	98.8	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	96.4	-171.3	-174.4	0	0	0	0	110	F196 L246 A292 V295 L319	F196-V317 HydrophobicContact CE1-CG1 4.37Å; L246-V317 HydrophobicContact CB-CB 4.11Å; L246-V317 PolarHBondContact N-O 3.18Å; L246-V317 PolarHBondContact O-N 2.87Å; A292-V317 HydrophobicContact CB-CG1 3.21Å; V295-V317 HydrophobicContact CB-CG2 4.02Å; V295-V317 HydrophobicContact CG1-CG2 3.79Å; V317-L319 HydrophobicContact CG1-CD1 4.48Å; V317-L319 HydrophobicContact CG1-CD2 3.89Å; V317-L319 HydrophobicContact CG1-CG 3.93Å; V317-L319 PolarHBondContact O-N 3.18Å
318	P	98.6	Very high	97.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	118.7	168.4	29.8	-34.9	0	0	0	110.4	F232 F245 G264 G266 I355 A359	F232-P318 HydrophobicContact CD2-CB 3.6Å; F232-P318 HydrophobicContact CE2-CB 3.58Å; F245-P318 HydrophobicContact CD2-CB 4Å; F245-P318 HydrophobicContact CE2-CB 3.97Å; G264-P318 WeakPolarHBondContact O-CD 3.31Å; G266-P318 WeakPolarHBondContact CA-O 3.42Å; G266-P318 PolarHBondContact N-O 3.19Å; P318-I355 HydrophobicContact CB-CB 4.08Å; P318-I355 HydrophobicContact CB-CD1 4.39Å; P318-I355 HydrophobicContact CB-CG1 4.48Å; P318-I355 HydrophobicContact CG-CB 4.11Å; P318-I355 HydrophobicContact CG-CD1 4.1Å; P318-I355 HydrophobicContact CG-CG1 4.06Å; P318-A359 HydrophobicContact CG-CB 3.88Å
319	L	98.7	Very high	97.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.6	180	-61.2	156.6	0	0	0	111.3	P193 F196 P243 V244 L246 G266 A292 V317	P193-L319 HydrophobicContact CB-CB 3.71Å; P193-L319 HydrophobicContact CG-CB 4.31Å; F196-L319 HydrophobicContact CB-CD1 4.15Å; F196-L319 HydrophobicContact CB-CD2 4.21Å; F196-L319 HydrophobicContact CD1-CD1 3.45Å; F196-L319 VanDerWaalsContact CD1-CD1 3.45Å; F196-L319 HydrophobicContact CD1-CD2 3.66Å; F196-L319 HydrophobicContact CD1-CG 4.19Å; F196-L319 HydrophobicContact CD2-CD2 4.4Å; F196-L319 HydrophobicContact CE1-CD1 4.21Å; F196-L319 HydrophobicContact CE1-CD2 4.09Å; F196-L319 HydrophobicContact CG-CD1 4.09Å; F196-L319 HydrophobicContact CG-CD2 3.81Å; P243-L319 VanDerWaalsContact CA-O 3.31Å; P243-L319 WeakPolarHBondContact CA-O 3.4Å; V244-L319 HydrophobicContact CB-CB 4.29Å; V244-L319 HydrophobicContact CB-CD1 4.24Å; V244-L319 HydrophobicContact CG1-CD1 4.38Å; V244-L319 PolarHBondContact N-O 3.42Å; V244-L319 WeakPolarHBondContact O-CA 3.5Å; V244-L319 VanDerWaalsContact O-CB 3.31Å; V244-L319 WeakPolarHBondContact O-CB 3.12Å; V244-L319 PolarHBondContact O-N 2.96Å; L246-L319 HydrophobicContact CD1-CD1 3.7Å; L246-L319 HydrophobicContact CD2-CD1 4.39Å; L246-L319 HydrophobicContact CG-CD1 3.69Å; G266-L319 CarbonylContact O-C 3.52Å; G266-L319 VanDerWaalsContact O-CA 3.22Å; G266-L319 WeakPolarHBondContact O-CA 3.31Å; A292-L319 HydrophobicContact CB-CD2 4.13Å; V317-L319 HydrophobicContact CG1-CD1 4.48Å; V317-L319 HydrophobicContact CG1-CD2 3.89Å; V317-L319 HydrophobicContact CG1-CG 3.93Å; V317-L319 PolarHBondContact O-N 3.18Å
320	V	98.1	Very high	97.8	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	168.7	178.8	-55.9	0	0	0	0	110.7	F232 V235 A236 P243 G266 V267 C268 I355	F232-V320 HydrophobicContact CD2-CG1 3.76Å; F232-V320 HydrophobicContact CE2-CG1 3.33Å; F232-V320 HydrophobicContact CZ-CG1 4.17Å; V235-V320 HydrophobicContact CB-CG2 4.47Å; V235-V320 HydrophobicContact CG1-CB 4.47Å; V235-V320 HydrophobicContact CG1-CG2 3.73Å; A236-V320 HydrophobicContact CB-CB 4.31Å; A236-V320 HydrophobicContact CB-CG1 3.97Å; P243-V320 HydrophobicContact CB-CG1 4.07Å; G266-V320 PolarHBondContact O-N 3.46Å; V267-V320 CarbonylContact C-O 3.57Å; V267-V320 HydrophobicContact CB-CG2 4.43Å; V267-V320 HydrophobicContact CG1-CG2 4.36Å; V267-V320 HydrophobicContact CG2-CG2 3.94Å; C268-V320 PolarHBondContact N-O 3.36Å; V320-I355 HydrophobicContact CG1-CG2 4.08Å; V320-I355 HydrophobicContact CG2-CD1 4.24Å; V320-I355 HydrophobicContact CG2-CG2 4Å
321	E	98.1	Very high	97.9	Very high	29 Å²	29	31.5 Å²	31.5	14%	0.136	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.3	160.9	-164.5	-168.6	-135.5	0	0	108.3	S239 E241 F269 M323	S239-E321 WeakPolarHBondContact CB-O 3.27Å; S239-E321 WeakPolarHBondContact CB-OE2 3.12Å; S239-E321 PolarHBondContact OG-OE2 3.14Å; E241-E321 HydrophobicContact CB-CB 4.24Å; F269-E321 HydrophobicContact CB-CG 3.8Å; E321-M323 HydrophobicContact CG-CG 3.84Å; E321-M323 WeakPolarHBondContact OE2-CG 3.17Å
322	N	98.6	Very high	97.8	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	102.1	-179.1	-172.6	32.7	0	0	0	110.2	V235 V267 F269 D270 S271 G273 T348 E351	V235-N322 HydrophobicContact CG1-CB 4.01Å; V267-N322 HydrophobicContact CG1-CB 4.03Å; F269-N322 PolarHBondContact O-N 2.93Å; D270-N322 PolarHBondContact OD1-ND2 2.86Å; S271-N322 PolarHBondContact N-O 3.41Å; S271-N322 PolarHBondContact OG-O 3.09Å; G273-N322 PolarHBondContact N-ND2 2.75Å; N322-T348 PolarHBondContact ND2-O 2.62Å; N322-E351 HydrophobicContact CB-CG 4Å; N322-E351 WeakPolarHBondContact ND2-CG 3.3Å
323	M	98.3	Very high	97.8	Very high	55 Å²	55	35.2 Å²	35.2	27%	0.271	22%	0.217	S	C	.	.			trans	-126.7	146.5	-173.2	-69.5	-61.3	-73.3	0	0	112.4	G238 F269 S271 E321 G325	G238-M323 VanDerWaalsContact CA-O 3.31Å; G238-M323 WeakPolarHBondContact CA-O 3.28Å; F269-M323 HydrophobicContact CD1-SD 3.7Å; F269-M323 HydrophobicContact CE1-SD 4.08Å; S271-M323 WeakPolarHBondContact OG-CA 3.31Å; E321-M323 HydrophobicContact CG-CG 3.84Å; E321-M323 WeakPolarHBondContact OE2-CG 3.17Å; M323-G325 PolarHBondContact O-N 3.36Å
324	P	97.1	Very high	97.8	Very high	64 Å²	64	38.1 Å²	38.1	42%	0.416	23%	0.234	S	C	.	.			trans	-66.3	122.5	163.2	28.1	-34.4	0	0	0	108.7	S271 G273 L276	S271-P324 WeakPolarHBondContact OG-CD 3.23Å; G273-P324 WeakPolarHBondContact O-CB 3.5Å; L276-P324 HydrophobicContact CD1-CG 4.21Å
325	G	96	Very high	97.8	Very high	26 Å²	26	38.7 Å²	38.7	27%	0.268	24%	0.238	S	C	.	.			trans	-151.4	162.2	177.6	0	0	0	0	0	111.2	G238 M323 R327 A328	G238-G325 WeakPolarHBondContact O-CA 3.19Å; M323-G325 PolarHBondContact O-N 3.36Å; G325-R327 PolarHBondContact O-N 2.98Å; G325-A328 VanDerWaalsContact O-CB 3.25Å; G325-A328 WeakPolarHBondContact O-CB 3.47Å; G325-A328 PolarHBondContact O-N 3.49Å
326	G	96	Very high	97.8	Very high	95 Å²	95	45.6 Å²	45.6	98%	0.979	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.7	-177.3	0	0	0	0	0	115
327	R	95.2	Very high	97.8	Very high	180 Å²	180	45.7 Å²	45.7	68%	0.679	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	0.8	174.7	-64.1	-171.6	-57.6	-93.2	-2.7	113.6	K237 G325	K237-R327 HydrophobicContact CB-CB 4.48Å; K237-R327 VanDerWaalsContact CB-O 3.23Å; K237-R327 WeakPolarHBondContact CB-O 3.27Å; K237-R327 WeakPolarHBondContact O-CB 3.21Å; G325-R327 PolarHBondContact O-N 2.98Å
328	A	97.5	Very high	97.8	Very high	11 Å²	11	47.9 Å²	47.9	9%	0.091	28%	0.277	C	S	.	.			trans	-56.1	148.7	-178	0	0	0	0	0	111.2	I274 G325	I274-A328 HydrophobicContact CD1-CB 4.11Å; I274-A328 HydrophobicContact CG1-CB 3.96Å; G325-A328 VanDerWaalsContact O-CB 3.25Å; G325-A328 WeakPolarHBondContact O-CB 3.47Å; G325-A328 PolarHBondContact O-N 3.49Å
329	S	97.1	Very high	97.7	Very high	8 Å²	8	51.3 Å²	51.3	6%	0.056	30%	0.295	C	S	.	.			trans	-57.9	151.3	164.8	49.9	0	0	0	0	109.7	S234 I274 D333 T348	S234-S329 PolarHBondContact O-OG 3.42Å; I274-S329 WeakPolarHBondContact CG1-O 3.4Å; S329-D333 WeakPolarHBondContact CA-OD2 3.29Å; S329-T348 WeakPolarHBondContact O-CG2 3.49Å
330	K	98.2	Very high	97.7	Very high	101 Å²	101	53.6 Å²	53.6	44%	0.439	32%	0.318	S	S	.	.			trans	-123.6	151.8	-176.4	-58.9	167.5	-52.1	-47.5	0	109.3	I274 G332 D333	I274-K330 HydrophobicContact CG1-CG 4.48Å; K330-G332 PolarHBondContact O-N 3.46Å; K330-D333 PolarHBondContact N-OD2 3.04Å; K330-D333 IonicContact NZ-OD1 2.69Å; K330-D333 PolarHBondContact NZ-OD1 3.24Å; K330-D333 IonicContact NZ-OD2 3.74Å; K330-D333 PolarHBondContact NZ-OD2 2.73Å; K330-D333 WeakPolarHBondContact O-CB 3.07Å; K330-D333 PolarHBondContact O-N 2.94Å
331	P	97.6	Very high	97.7	Very high	66 Å²	66	55.8 Å²	55.8	43%	0.429	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	126.9	164.4	-31	38.7	0	0	0	111.9	I274 I345 D346	I274-P331 HydrophobicContact CG2-CG 4.41Å; P331-I345 CarbonylContact C-O 3.6Å; P331-I345 VanDerWaalsContact CA-O 3.27Å; P331-I345 WeakPolarHBondContact CA-O 3.26Å; P331-D346 VanDerWaalsContact CB-O 3.31Å; P331-D346 WeakPolarHBondContact CB-O 3.15Å
332	G	97.1	Very high	97.8	Very high	47 Å²	47	55 Å²	55	49%	0.485	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-5.7	-176.9	0	0	0	0	0	115.5	K330 I345	K330-G332 PolarHBondContact O-N 3.46Å; G332-I345 PolarHBondContact N-O 2.6Å
333	D	98.5	Very high	97.8	Very high	48 Å²	48	54.9 Å²	54.9	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	141.2	171.9	-74.9	-18.5	0	0	0	110	S329 K330 I345	S329-D333 WeakPolarHBondContact CA-OD2 3.29Å; K330-D333 PolarHBondContact N-OD2 3.04Å; K330-D333 IonicContact NZ-OD1 2.69Å; K330-D333 PolarHBondContact NZ-OD1 3.24Å; K330-D333 IonicContact NZ-OD2 3.74Å; K330-D333 PolarHBondContact NZ-OD2 2.73Å; K330-D333 WeakPolarHBondContact O-CB 3.07Å; K330-D333 PolarHBondContact O-N 2.94Å; D333-I345 PolarHBondContact O-N 2.74Å
334	V	98.6	Very high	97.8	Very high	61 Å²	61	54 Å²	54	37%	0.37	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.1	172.8	178.5	0	0	0	0	109.5	I343 A432	V334-I343 CarbonylContact C-O 3.5Å; V334-I343 VanDerWaalsContact CA-O 3.32Å; V334-I343 WeakPolarHBondContact CA-O 3.13Å; V334-A432 HydrophobicContact CG1-CB 4.08Å; V334-A432 HydrophobicContact CG2-CB 4.43Å
335	V	98.5	Very high	97.8	Very high	18 Å²	18	51 Å²	51	11%	0.109	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	163.8	177.6	-57.5	0	0	0	0	110.4	A231 S342 I343 I345	A231-V335 HydrophobicContact CB-CG2 4.44Å; V335-S342 CarbonylContact O-C 3.59Å; V335-S342 WeakPolarHBondContact O-CA 3.18Å; V335-I343 HydrophobicContact CG2-CB 4Å; V335-I343 HydrophobicContact CG2-CD1 4.43Å; V335-I343 PolarHBondContact N-O 3.38Å; V335-I343 PolarHBondContact O-N 3.26Å; V335-I345 HydrophobicContact CG1-CD1 3.82Å; V335-I345 HydrophobicContact CG2-CD1 4.05Å; V335-I345 HydrophobicContact CG2-CG1 4.25Å
336	Y	98.7	Very high	97.9	Very high	144 Å²	144	53.1 Å²	53.1	57%	0.565	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.9	177.2	-64.6	-95.5	0	0	0	108.8	G230	G230-Y336 WeakPolarHBondContact CA-O 3.31Å; G230-Y336 PolarHBondContact N-O 3.45Å
337	A	98.7	Very high	98	Very high	2 Å²	2	51 Å²	51	2%	0.017	27%	0.272	C	S	.	.			trans	-75.2	170	171.3	0	0	0	0	0	111	K228 A231 N339 G340 K341 I343 D358 F458	K228-A337 CarbonylContact O-C 3.59Å; A231-A337 HydrophobicContact CB-CB 4.47Å; A337-N339 PolarHBondContact O-N 2.95Å; A337-N339 VanDerWaalsContact O-N 3.17Å; A337-G340 WeakPolarHBondContact O-CA 3.42Å; A337-G340 PolarHBondContact O-N 2.78Å; A337-K341 PolarHBondContact N-O 3.2Å; A337-I343 HydrophobicContact CB-CD1 4.02Å; A337-D358 VanDerWaalsContact CA-OD1 3.26Å; A337-D358 WeakPolarHBondContact CA-OD1 3.35Å; A337-F458 HydrophobicContact CB-CD1 3.74Å; A337-F458 HydrophobicContact CB-CE1 3.46Å; A337-F458 VanDerWaalsContact CB-CE1 3.46Å
338	M	98.2	Very high	98.1	Very high	46 Å²	46	42.6 Å²	42.6	23%	0.227	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-34.1	180	171.9	176.6	177.6	0	0	113.1	M227 K228 M229 G340 D358 C361 Y362	M227-M338 HydrophobicContact CE-CE 3.47Å; M227-M338 VanDerWaalsContact CE-CE 3.47Å; M227-M338 HydrophobicContact CE-SD 4.16Å; M227-M338 WeakPolarHBondContact O-CG 3.5Å; K228-M338 WeakPolarHBondContact O-CA 3.28Å; K228-M338 PolarHBondContact O-N 2.7Å; M229-M338 HydrophobicContact CE-SD 3.88Å; M229-M338 HydrophobicContact CG-CB 4.45Å; M338-G340 PolarHBondContact O-N 3.32Å; M338-D358 WeakPolarHBondContact CB-OD1 3.25Å; M338-D358 PolarHBondContact N-OD1 2.87Å; M338-C361 HydrophobicContact CB-CB 3.76Å; M338-C361 HydrophobicContact CG-CB 3.94Å; M338-C361 HydrophobicContact SD-CB 3.94Å; M338-Y362 HydrophobicContact CE-CD2 4.21Å
339	N	97.8	Very high	98.2	Very high	73 Å²	73	44.4 Å²	44.4	39%	0.39	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	3.2	175.6	69.1	1.1	0	0	0	114.1	A337 K341 C361 E457	A337-N339 PolarHBondContact O-N 2.95Å; A337-N339 VanDerWaalsContact O-N 3.17Å; N339-K341 VanDerWaalsContact C-N 3.3Å; N339-K341 PolarHBondContact O-N 2.9Å; N339-K341 WeakPolarHBondContact OD1-CB 3.37Å; N339-K341 PolarHBondContact OD1-N 3.04Å; N339-C361 VanDerWaalsContact CG-SG 3.6Å; N339-E457 PolarHBondContact ND2-O 3.37Å
340	G	98.2	Very high	98.2	Very high	47 Å²	47	44.4 Å²	44.4	49%	0.485	25%	0.25	S	C	.	.	S	Bend	trans	81.6	-2	-179.5	0	0	0	0	0	115	A337 M338	A337-G340 WeakPolarHBondContact O-CA 3.42Å; A337-G340 PolarHBondContact O-N 2.78Å; M338-G340 PolarHBondContact O-N 3.32Å
341	K	98.5	Very high	98.2	Very high	48 Å²	48	39.8 Å²	39.8	21%	0.209	23%	0.23	C	C	.	.			trans	-70	132.1	177.2	-173.2	172.8	-73.1	176.6	0	110.1	A337 N339 D433 V434 E457 F458	A337-K341 PolarHBondContact N-O 3.2Å; N339-K341 VanDerWaalsContact C-N 3.3Å; N339-K341 PolarHBondContact O-N 2.9Å; N339-K341 WeakPolarHBondContact OD1-CB 3.37Å; N339-K341 PolarHBondContact OD1-N 3.04Å; K341-D433 HydrophobicContact CG-CB 3.79Å; K341-V434 HydrophobicContact CD-CG1 4.45Å; K341-V434 HydrophobicContact CD-CG2 4.39Å; K341-E457 HydrophobicContact CD-CB 4.15Å; K341-E457 PolarHBondContact NZ-O 3.12Å; K341-E457 IonicContact NZ-OE2 3.47Å; K341-E457 PolarHBondContact NZ-OE2 2.8Å; K341-F458 HydrophobicContact CB-CE1 4.03Å; K341-F458 HydrophobicContact CD-CE1 4.05Å; K341-F458 HydrophobicContact CD-CZ 4.08Å; K341-F458 HydrophobicContact CG-CE1 4.29Å; K341-F458 HydrophobicContact CG-CZ 4.49Å
342	S	98.8	Very high	98.3	Very high	13 Å²	13	36.7 Å²	36.7	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138	179.3	60.3	0	0	0	0	111.4	V335 A432 D433 V434	V335-S342 CarbonylContact O-C 3.59Å; V335-S342 WeakPolarHBondContact O-CA 3.18Å; S342-A432 WeakPolarHBondContact OG-CA 3.31Å; S342-D433 PolarHBondContact N-OD2 2.75Å; S342-D433 PolarHBondContact O-N 3.41Å; S342-D433 PolarHBondContact OG-N 2.83Å; S342-D433 PolarHBondContact OG-OD2 3.44Å; S342-V434 PolarHBondContact O-N 2.95Å
343	I	98.8	Very high	98.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.4	-178.5	-58.6	156.6	0	0	0	109.2	A231 V334 V335 A337 L354 V434 N436 F454 F458	A231-I343 HydrophobicContact CB-CD1 3.91Å; V334-I343 CarbonylContact C-O 3.5Å; V334-I343 VanDerWaalsContact CA-O 3.32Å; V334-I343 WeakPolarHBondContact CA-O 3.13Å; V335-I343 HydrophobicContact CG2-CB 4Å; V335-I343 HydrophobicContact CG2-CD1 4.43Å; V335-I343 PolarHBondContact N-O 3.38Å; V335-I343 PolarHBondContact O-N 3.26Å; A337-I343 HydrophobicContact CB-CD1 4.02Å; I343-L354 HydrophobicContact CD1-CD2 4.23Å; I343-L354 HydrophobicContact CG2-CD2 3.72Å; I343-V434 CarbonylContact C-O 3.55Å; I343-V434 WeakPolarHBondContact CA-O 3.26Å; I343-V434 HydrophobicContact CG1-CG2 3.9Å; I343-N436 HydrophobicContact CG2-CB 4.21Å; I343-F454 HydrophobicContact CD1-CZ 3.9Å; I343-F454 HydrophobicContact CG1-CE2 4.27Å; I343-F454 HydrophobicContact CG1-CZ 4.04Å; I343-F454 HydrophobicContact CG2-CE2 3.84Å; I343-F454 HydrophobicContact CG2-CZ 3.91Å; I343-F458 HydrophobicContact CD1-CE1 3.87Å; I343-F458 HydrophobicContact CD1-CE2 4.44Å; I343-F458 HydrophobicContact CD1-CZ 3.56Å; I343-F458 HydrophobicContact CG1-CE1 4.21Å; I343-F458 HydrophobicContact CG1-CZ 3.66Å
344	E	98.6	Very high	98.4	Very high	37 Å²	37	33.2 Å²	33.2	17%	0.173	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	123.1	163.1	178.4	179.4	-159.9	0	0	109.7	D346 S429 A432 V434 C435 N436	E344-D346 PolarHBondContact O-N 2.8Å; E344-S429 WeakPolarHBondContact OE2-CB 3.45Å; E344-S429 PolarHBondContact OE2-OG 3.33Å; E344-A432 HydrophobicContact CB-CB 4.03Å; E344-V434 PolarHBondContact N-O 3.13Å; E344-C435 WeakPolarHBondContact O-CA 3.13Å; E344-N436 PolarHBondContact O-N 3.42Å; E344-N436 PolarHBondContact O-OD1 3.3Å
345	I	98.3	Very high	98.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	95.4	172.4	-56	176.8	0	0	0	107.6	P331 G332 D333 V335 T348 L354	P331-I345 CarbonylContact C-O 3.6Å; P331-I345 VanDerWaalsContact CA-O 3.27Å; P331-I345 WeakPolarHBondContact CA-O 3.26Å; G332-I345 PolarHBondContact N-O 2.6Å; D333-I345 PolarHBondContact O-N 2.74Å; V335-I345 HydrophobicContact CG1-CD1 3.82Å; V335-I345 HydrophobicContact CG2-CD1 4.05Å; V335-I345 HydrophobicContact CG2-CG1 4.25Å; I345-T348 HydrophobicContact CG2-CG2 3.91Å; I345-L354 HydrophobicContact CD1-CD1 3.95Å; I345-L354 HydrophobicContact CG1-CD1 4Å; I345-L354 HydrophobicContact CG2-CD1 4.44Å
346	D	97.4	Very high	98.4	Very high	70 Å²	70	29.5 Å²	29.5	37%	0.374	16%	0.156	S	C	.	.	S	Bend	trans	-80.7	-40.3	174	168.9	73.8	0	0	0	111.2	P331 E344 C435 N436 T437	P331-D346 VanDerWaalsContact CB-O 3.31Å; P331-D346 WeakPolarHBondContact CB-O 3.15Å; E344-D346 PolarHBondContact O-N 2.8Å; D346-C435 WeakPolarHBondContact CB-SG 3.49Å; D346-N436 PolarHBondContact N-OD1 2.95Å; D346-T437 HydrophobicContact CB-CG2 4.48Å; D346-T437 WeakPolarHBondContact CB-OG1 3.28Å; D346-T437 PolarHBondContact OD2-OG1 3.21Å
347	N	97.9	Very high	98.4	Very high	51 Å²	51	22.6 Å²	22.6	27%	0.273	13%	0.129	S	C	.	.			trans	-128.4	120	-179.1	-172.4	-13.3	0	0	0	110.3	S275 D349 A350 N436 T437	S275-N347 WeakPolarHBondContact CB-OD1 3.43Å; S275-N347 PolarHBondContact OG-OD1 2.69Å; N347-D349 PolarHBondContact O-N 2.96Å; N347-D349 WeakPolarHBondContact OD1-CA 3.39Å; N347-D349 WeakPolarHBondContact OD1-CB 3.34Å; N347-D349 PolarHBondContact OD1-N 2.85Å; N347-A350 HydrophobicContact CB-CB 4.39Å; N347-A350 PolarHBondContact O-N 2.78Å; N347-A350 VanDerWaalsContact O-N 3.13Å; N347-N436 PolarHBondContact N-OD1 3.43Å; N347-N436 PolarHBondContact O-ND2 2.95Å; N347-T437 HydrophobicContact CB-CG2 3.5Å; N347-T437 VanDerWaalsContact CB-CG2 3.5Å
348	T	98.3	Very high	98.4	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.018	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-6.1	179.2	62.5	0	0	0	0	113.3	G272 I274 S275 N322 S329 I345 A350	G272-T348 CarbonylContact O-C 3.39Å; G272-T348 WeakPolarHBondContact O-CB 3.4Å; G272-T348 PolarHBondContact O-OG1 2.99Å; I274-T348 HydrophobicContact CB-CG2 4.39Å; I274-T348 PolarHBondContact N-OG1 3.11Å; S275-T348 WeakPolarHBondContact CB-OG1 3.2Å; S275-T348 PolarHBondContact N-OG1 2.71Å; S275-T348 PolarHBondContact OG-N 3.43Å; S275-T348 VanDerWaalsContact OG-N 3.15Å; S275-T348 PolarHBondContact OG-OG1 3.31Å; N322-T348 PolarHBondContact ND2-O 2.62Å; S329-T348 WeakPolarHBondContact O-CG2 3.49Å; I345-T348 HydrophobicContact CG2-CG2 3.91Å; T348-A350 VanDerWaalsContact C-N 3.27Å
349	D	97.9	Very high	98.5	Very high	50 Å²	50	20.3 Å²	20.3	27%	0.267	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	3	168.4	-161.1	49.7	0	0	0	112.6	G272 K277 N347 E351	G272-D349 WeakPolarHBondContact CA-OD1 3.37Å; G272-D349 PolarHBondContact O-N 2.66Å; K277-D349 WeakPolarHBondContact CE-OD1 3.28Å; K277-D349 WeakPolarHBondContact CG-OD1 3.44Å; K277-D349 VanDerWaalsContact NZ-CG 3.26Å; K277-D349 IonicContact NZ-OD1 3.43Å; K277-D349 PolarHBondContact NZ-OD1 2.96Å; K277-D349 IonicContact NZ-OD2 3.61Å; K277-D349 PolarHBondContact NZ-OD2 2.99Å; N347-D349 PolarHBondContact O-N 2.96Å; N347-D349 WeakPolarHBondContact OD1-CA 3.39Å; N347-D349 WeakPolarHBondContact OD1-CB 3.34Å; N347-D349 PolarHBondContact OD1-N 2.85Å; D349-E351 WeakPolarHBondContact CA-OE2 3.35Å
350	A	98.2	Very high	98.5	Very high	8 Å²	8	16.9 Å²	16.9	7%	0.066	10%	0.099	C	C	.	.			trans	-108.6	47.5	167.8	0	0	0	0	0	109.6	N347 T348 R353 N436 T437	N347-A350 HydrophobicContact CB-CB 4.39Å; N347-A350 PolarHBondContact O-N 2.78Å; N347-A350 VanDerWaalsContact O-N 3.13Å; T348-A350 VanDerWaalsContact C-N 3.27Å; A350-R353 WeakPolarHBondContact O-CG 3.36Å; A350-N436 PolarHBondContact O-ND2 2.76Å; A350-N436 VanDerWaalsContact O-ND2 3.12Å; A350-T437 HydrophobicContact CB-CG2 4Å
351	E	98.5	Very high	98.5	Very high	4 Å²	4	15.2 Å²	15.2	2%	0.019	8%	0.079	C	C	.	.			trans	-82.3	-35.7	-175	79.2	-53.7	125.5	0	0	113.7	V235 K265 V267 N322 D349 R353 L354 I355	V235-E351 HydrophobicContact CB-CB 4.42Å; V235-E351 HydrophobicContact CG1-CB 3.68Å; V235-E351 HydrophobicContact CG1-CG 3.94Å; V235-E351 HydrophobicContact CG2-CB 3.83Å; K265-E351 VanDerWaalsContact CE-OE1 3.28Å; K265-E351 WeakPolarHBondContact CE-OE1 3.32Å; K265-E351 IonicContact NZ-OE1 2.62Å; K265-E351 PolarHBondContact NZ-OE1 2.91Å; V267-E351 HydrophobicContact CG1-CG 4.49Å; V267-E351 HydrophobicContact CG2-CG 4.03Å; N322-E351 HydrophobicContact CB-CG 4Å; N322-E351 WeakPolarHBondContact ND2-CG 3.3Å; D349-E351 WeakPolarHBondContact CA-OE2 3.35Å; E351-R353 PolarHBondContact O-N 3.14Å; E351-L354 WeakPolarHBondContact O-CA 3.26Å; E351-L354 VanDerWaalsContact O-CB 3.27Å; E351-L354 WeakPolarHBondContact O-CB 3.31Å; E351-L354 PolarHBondContact O-N 2.98Å; E351-I355 PolarHBondContact O-N 3.3Å
352	G	98.7	Very high	98.6	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-57.8	-38.7	-174.5	0	0	0	0	0	112.2	L354 I355 L356	G352-L354 VanDerWaalsContact C-N 3.31Å; G352-L354 PolarHBondContact O-N 2.94Å; G352-I355 VanDerWaalsContact O-CG1 3.23Å; G352-I355 WeakPolarHBondContact O-CG1 3.48Å; G352-L356 WeakPolarHBondContact O-CB 3.42Å; G352-L356 WeakPolarHBondContact O-CD1 3.29Å; G352-L356 WeakPolarHBondContact O-CG 3.47Å; G352-L356 PolarHBondContact O-N 3.21Å; G352-L356 VanDerWaalsContact O-N 3.12Å
353	R	98.7	Very high	98.6	Very high	21 Å²	21	13.2 Å²	13.2	8%	0.079	7%	0.069	C	C	.	.	H	α-helix	trans	-69.8	-26.5	176.1	70.7	-165.1	71	-169.9	-3.8	113.3	A350 E351 A357 L377 N436 A451 F454 L455	A350-R353 WeakPolarHBondContact O-CG 3.36Å; E351-R353 PolarHBondContact O-N 3.14Å; R353-A357 WeakPolarHBondContact O-CB 3.45Å; R353-A357 PolarHBondContact O-N 3.29Å; R353-L377 HydrophobicContact CB-CD1 4.14Å; R353-N436 WeakPolarHBondContact CD-O 3.43Å; R353-N436 PolarHBondContact NH1-O 2.97Å; R353-A451 VanDerWaalsContact CZ-CB 3.45Å; R353-F454 HydrophobicContact CB-CD1 3.66Å; R353-F454 HydrophobicContact CB-CE1 3.9Å; R353-F454 HydrophobicContact CG-CD1 3.66Å; R353-F454 HydrophobicContact CG-CE1 3.67Å; R353-F454 HydrophobicContact CG-CG 4.31Å; R353-F454 HydrophobicContact CG-CZ 4.33Å; R353-F454 WeakPolarHBondContact O-CE1 3.36Å; R353-L455 HydrophobicContact CB-CD2 3.91Å; R353-L455 HydrophobicContact CB-CG 4.44Å
354	L	98.9	Very high	98.5	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-71.6	-45.8	176.8	-60.2	177.1	0	0	0	111.1	A231 V235 I343 I345 E351 G352 L356 A357 N436 F454	A231-L354 HydrophobicContact CB-CB 4.22Å; A231-L354 VanDerWaalsContact CB-O 3.28Å; A231-L354 WeakPolarHBondContact CB-O 3.23Å; V235-L354 HydrophobicContact CG2-CB 3.84Å; V235-L354 HydrophobicContact CG2-CD1 3.94Å; V235-L354 HydrophobicContact CG2-CG 4.5Å; I343-L354 HydrophobicContact CD1-CD2 4.23Å; I343-L354 HydrophobicContact CG2-CD2 3.72Å; I345-L354 HydrophobicContact CD1-CD1 3.95Å; I345-L354 HydrophobicContact CG1-CD1 4Å; I345-L354 HydrophobicContact CG2-CD1 4.44Å; E351-L354 WeakPolarHBondContact O-CA 3.26Å; E351-L354 VanDerWaalsContact O-CB 3.27Å; E351-L354 WeakPolarHBondContact O-CB 3.31Å; E351-L354 PolarHBondContact O-N 2.98Å; G352-L354 VanDerWaalsContact C-N 3.31Å; G352-L354 PolarHBondContact O-N 2.94Å; L354-L356 VanDerWaalsContact C-N 3.3Å; L354-L356 PolarHBondContact O-N 3.05Å; L354-A357 WeakPolarHBondContact O-CB 3.43Å; L354-A357 PolarHBondContact O-N 3.24Å; L354-N436 HydrophobicContact CD2-CB 3.92Å; L354-F454 HydrophobicContact CD2-CE1 4.47Å; L354-F454 HydrophobicContact CD2-CZ 3.89Å
355	I	98.8	Very high	98.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-67.5	-35	177.3	70	170.4	0	0	0	111.5	F232 V235 K265 V267 P318 V320 E351 G352 A359	F232-I355 HydrophobicContact CD2-CB 4.05Å; F232-I355 HydrophobicContact CD2-CG2 4.02Å; V235-I355 HydrophobicContact CB-CG2 3.85Å; V235-I355 HydrophobicContact CG1-CG2 4.18Å; V235-I355 HydrophobicContact CG2-CG2 3.77Å; K265-I355 HydrophobicContact CG-CD1 4.08Å; V267-I355 HydrophobicContact CG2-CD1 3.62Å; P318-I355 HydrophobicContact CB-CB 4.08Å; P318-I355 HydrophobicContact CB-CD1 4.39Å; P318-I355 HydrophobicContact CB-CG1 4.48Å; P318-I355 HydrophobicContact CG-CB 4.11Å; P318-I355 HydrophobicContact CG-CD1 4.1Å; P318-I355 HydrophobicContact CG-CG1 4.06Å; V320-I355 HydrophobicContact CG1-CG2 4.08Å; V320-I355 HydrophobicContact CG2-CD1 4.24Å; V320-I355 HydrophobicContact CG2-CG2 4Å; E351-I355 PolarHBondContact O-N 3.3Å; G352-I355 VanDerWaalsContact O-CG1 3.23Å; G352-I355 WeakPolarHBondContact O-CG1 3.48Å; I355-A359 PolarHBondContact O-N 3.41Å
356	L	98.9	Very high	98.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-70	-33.7	175.9	-70.6	169.8	0	0	0	112.3	V263 K265 G352 L354 D358 A359 L360 A375 L377 L455	V263-L356 HydrophobicContact CG1-CD2 3.72Å; K265-L356 HydrophobicContact CB-CD1 4.24Å; K265-L356 HydrophobicContact CB-CD2 4.27Å; K265-L356 HydrophobicContact CB-CG 4.36Å; G352-L356 WeakPolarHBondContact O-CB 3.42Å; G352-L356 WeakPolarHBondContact O-CD1 3.29Å; G352-L356 WeakPolarHBondContact O-CG 3.47Å; G352-L356 PolarHBondContact O-N 3.21Å; G352-L356 VanDerWaalsContact O-N 3.12Å; L354-L356 VanDerWaalsContact C-N 3.3Å; L354-L356 PolarHBondContact O-N 3.05Å; L356-D358 VanDerWaalsContact C-N 3.35Å; L356-D358 PolarHBondContact O-N 3.36Å; L356-A359 PolarHBondContact O-N 3.38Å; L356-L360 WeakPolarHBondContact O-CB 3.28Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.42Å; L356-L360 PolarHBondContact O-N 3.48Å; L356-A375 HydrophobicContact CD1-CB 3.74Å; L356-L377 HydrophobicContact CD1-CD1 4.13Å; L356-L455 HydrophobicContact CB-CD2 3.56Å; L356-L455 HydrophobicContact CD1-CD1 4.18Å; L356-L455 HydrophobicContact CD1-CD2 3.98Å; L356-L455 HydrophobicContact CG-CD2 4.45Å
357	A	98.9	Very high	98.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-54.9	-49.2	179.3	0	0	0	0	0	112	R353 L354 L360 C361 F454 F458	R353-A357 WeakPolarHBondContact O-CB 3.45Å; R353-A357 PolarHBondContact O-N 3.29Å; L354-A357 WeakPolarHBondContact O-CB 3.43Å; L354-A357 PolarHBondContact O-N 3.24Å; A357-L360 PolarHBondContact O-N 3.21Å; A357-C361 PolarHBondContact O-N 3.4Å; A357-C361 PolarHBondContact O-SG 3.49Å; A357-F454 HydrophobicContact CB-CE1 4.2Å; A357-F458 HydrophobicContact CB-CB 4.05Å; A357-F458 HydrophobicContact CB-CD1 3.78Å; A357-F458 HydrophobicContact CB-CD2 3.56Å; A357-F458 HydrophobicContact CB-CE1 4.14Å; A357-F458 HydrophobicContact CB-CE2 3.96Å; A357-F458 HydrophobicContact CB-CG 3.49Å; A357-F458 VanDerWaalsContact CB-CG 3.49Å; A357-F458 HydrophobicContact CB-CZ 4.24Å; A357-F458 WeakPolarHBondContact O-CB 3.49Å
358	D	98.8	Very high	98.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.6	-36.7	178	-75.5	-33	0	0	0	112.6	M229 G230 A231 F232 A337 M338 L356 C361 Y362	M229-D358 VanDerWaalsContact CA-CG 3.42Å; M229-D358 WeakPolarHBondContact CA-OD2 3.47Å; M229-D358 HydrophobicContact CB-CB 3.89Å; M229-D358 WeakPolarHBondContact CB-OD2 3.42Å; M229-D358 HydrophobicContact CG-CB 3.89Å; M229-D358 HydrophobicContact SD-CB 4.31Å; G230-D358 PolarHBondContact N-OD2 3Å; A231-D358 WeakPolarHBondContact CA-OD2 3.12Å; A231-D358 WeakPolarHBondContact CB-OD2 3.44Å; A231-D358 PolarHBondContact N-OD2 3.24Å; F232-D358 HydrophobicContact CB-CB 4.09Å; F232-D358 WeakPolarHBondContact CB-OD2 3.12Å; F232-D358 PolarHBondContact N-OD2 2.96Å; A337-D358 VanDerWaalsContact CA-OD1 3.26Å; A337-D358 WeakPolarHBondContact CA-OD1 3.35Å; M338-D358 WeakPolarHBondContact CB-OD1 3.25Å; M338-D358 PolarHBondContact N-OD1 2.87Å; L356-D358 VanDerWaalsContact C-N 3.35Å; L356-D358 PolarHBondContact O-N 3.36Å; D358-C361 PolarHBondContact O-N 3.01Å; D358-Y362 WeakPolarHBondContact O-CB 3.38Å; D358-Y362 PolarHBondContact O-N 3.27Å
359	A	98.9	Very high	98.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.6	-35.4	176.7	0	0	0	0	0	112.7	F245 V263 P318 I355 L356 Y362 A363	F245-A359 HydrophobicContact CE2-CB 3.98Å; F245-A359 HydrophobicContact CZ-CB 3.99Å; V263-A359 HydrophobicContact CG1-CB 3.5Å; V263-A359 VanDerWaalsContact CG1-CB 3.5Å; P318-A359 HydrophobicContact CG-CB 3.88Å; I355-A359 PolarHBondContact O-N 3.41Å; L356-A359 PolarHBondContact O-N 3.38Å; A359-Y362 PolarHBondContact O-N 3.49Å; A359-A363 WeakPolarHBondContact O-CB 3.49Å; A359-A363 PolarHBondContact O-N 2.95Å
360	L	98.9	Very high	98.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68	-42.9	173.2	-74.8	170.4	0	0	0	111.5	V263 L356 A357 Y362 A363 D364 V371 D373 L455 F458	V263-L360 HydrophobicContact CG2-CD2 4.21Å; L356-L360 WeakPolarHBondContact O-CB 3.28Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.42Å; L356-L360 PolarHBondContact O-N 3.48Å; A357-L360 PolarHBondContact O-N 3.21Å; L360-Y362 PolarHBondContact O-N 2.8Å; L360-A363 WeakPolarHBondContact O-CB 3.47Å; L360-A363 PolarHBondContact O-N 3.23Å; L360-A363 VanDerWaalsContact O-N 3.15Å; L360-D364 PolarHBondContact O-N 2.87Å; L360-V371 HydrophobicContact CD2-CG1 3.67Å; L360-D373 HydrophobicContact CD2-CB 4.16Å; L360-L455 HydrophobicContact CD1-CB 3.94Å; L360-L455 HydrophobicContact CD1-CD2 3.92Å; L360-L455 HydrophobicContact CD1-CG 4.45Å; L360-F458 CarbonylContact C-O 3.55Å; L360-F458 VanDerWaalsContact C-O 3.3Å; L360-F458 HydrophobicContact CB-CB 4.33Å; L360-F458 WeakPolarHBondContact CB-O 3.44Å
361	C	98.8	Very high	98.7	Very high	12 Å²	12	21 Å²	21	8%	0.081	11%	0.11	C	C	.	.	H	α-helix	trans	-59.2	-40.6	173	-68.8	0	0	0	0	111.1	M338 N339 A357 D358 F458	M338-C361 HydrophobicContact CB-CB 3.76Å; M338-C361 HydrophobicContact CG-CB 3.94Å; M338-C361 HydrophobicContact SD-CB 3.94Å; N339-C361 VanDerWaalsContact CG-SG 3.6Å; A357-C361 PolarHBondContact O-N 3.4Å; A357-C361 PolarHBondContact O-SG 3.49Å; D358-C361 PolarHBondContact O-N 3.01Å; C361-F458 PolarHBondContact N-O 3.12Å; C361-F458 VanDerWaalsContact N-O 3.14Å; C361-F458 PolarHBondContact SG-O 3.1Å
362	Y	98.7	Very high	98.7	Very high	19 Å²	19	20.9 Å²	20.9	8%	0.075	11%	0.109	C	C	.	.	H	α-helix	trans	-69.7	-37.1	176.8	-173.3	-137.1	0	0	0	112.2	W223 M227 M229 F245 E247 L316 M338 D358 A359 L360 D364 S365 F366	W223-Y362 HydrophobicContact CH2-CD1 4.35Å; W223-Y362 HydrophobicContact CH2-CE1 4.17Å; W223-Y362 HydrophobicContact CZ2-CD1 4.48Å; W223-Y362 AromaticContact CZ2-CE1 3.99Å; W223-Y362 HydrophobicContact CZ2-CE1 3.99Å; W223-Y362 HydrophobicContact CZ2-CE2 4.4Å; W223-Y362 AromaticContact CZ2-CZ 3.94Å; M227-Y362 HydrophobicContact CE-CD2 3.45Å; M227-Y362 VanDerWaalsContact CE-CD2 3.45Å; M227-Y362 HydrophobicContact CE-CE2 3.51Å; M227-Y362 HydrophobicContact CE-CG 4.36Å; M229-Y362 HydrophobicContact CE-CD1 4.29Å; M229-Y362 HydrophobicContact CE-CG 3.96Å; F245-Y362 AromaticContact CE1-CD1 3.83Å; F245-Y362 HydrophobicContact CE1-CD1 3.83Å; F245-Y362 HydrophobicContact CE1-CE1 4.07Å; F245-Y362 AromaticContact CZ-CD1 3.88Å; F245-Y362 HydrophobicContact CZ-CD1 3.88Å; E247-Y362 WeakPolarHBondContact OE2-CE1 3.4Å; E247-Y362 PolarHBondContact OE2-OH 3.28Å; L316-Y362 HydrophobicContact CD1-CD1 3.94Å; L316-Y362 HydrophobicContact CD1-CG 4.5Å; L316-Y362 HydrophobicContact CD2-CD1 3.92Å; L316-Y362 HydrophobicContact CD2-CE1 3.89Å; M338-Y362 HydrophobicContact CE-CD2 4.21Å; D358-Y362 WeakPolarHBondContact O-CB 3.38Å; D358-Y362 PolarHBondContact O-N 3.27Å; A359-Y362 PolarHBondContact O-N 3.49Å; L360-Y362 PolarHBondContact O-N 2.8Å; Y362-D364 VanDerWaalsContact C-N 3.28Å; Y362-D364 PolarHBondContact O-N 3.41Å; Y362-S365 WeakPolarHBondContact CD2-OG 3.28Å; Y362-S365 VanDerWaalsContact O-CB 3.28Å; Y362-S365 WeakPolarHBondContact O-CB 3.25Å; Y362-S365 PolarHBondContact O-N 3.19Å; Y362-S365 PolarHBondContact O-OG 2.92Å; Y362-F366 HydrophobicContact CD1-CE2 4.17Å; Y362-F366 HydrophobicContact CD2-CE2 4.36Å; Y362-F366 AromaticContact CE1-CE2 3.88Å; Y362-F366 HydrophobicContact CE1-CE2 3.88Å; Y362-F366 HydrophobicContact CE1-CZ 4.03Å; Y362-F366 HydrophobicContact CE2-CE2 4.08Å; Y362-F366 HydrophobicContact CE2-CZ 4.15Å; Y362-F366 HydrophobicContact CG-CE2 4.4Å; Y362-F366 AromaticContact CZ-CE2 3.83Å; Y362-F366 AromaticContact CZ-CZ 3.69Å; Y362-F366 WeakPolarHBondContact O-CD2 3.31Å
363	A	98.9	Very high	98.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-55.4	-43.4	175	0	0	0	0	0	111.8	C261 V263 L316 A359 L360 S365 F366 P368 V371	C261-A363 HydrophobicContact CB-CB 4.12Å; V263-A363 HydrophobicContact CG2-CB 4.14Å; L316-A363 HydrophobicContact CD1-CB 3.75Å; A359-A363 WeakPolarHBondContact O-CB 3.49Å; A359-A363 PolarHBondContact O-N 2.95Å; L360-A363 WeakPolarHBondContact O-CB 3.47Å; L360-A363 PolarHBondContact O-N 3.23Å; L360-A363 VanDerWaalsContact O-N 3.15Å; A363-S365 PolarHBondContact O-N 3.4Å; A363-F366 WeakPolarHBondContact O-CB 3.46Å; A363-F366 PolarHBondContact O-N 3.41Å; A363-F366 VanDerWaalsContact O-N 3.1Å; A363-P368 VanDerWaalsContact O-CD 3.3Å; A363-P368 WeakPolarHBondContact O-CD 3.26Å; A363-V371 HydrophobicContact CB-CG1 4.34Å; A363-V371 HydrophobicContact CB-CG2 4.31Å
364	D	98.6	Very high	98.7	Very high	34 Å²	34	19.8 Å²	19.8	18%	0.182	10%	0.104	C	C	.	.	H	α-helix	trans	-60.9	-26.4	179	-73.3	-16.3	0	0	0	113.2	L360 Y362 F366 K367 T459 Q460 C461	L360-D364 PolarHBondContact O-N 2.87Å; Y362-D364 VanDerWaalsContact C-N 3.28Å; Y362-D364 PolarHBondContact O-N 3.41Å; D364-F366 PolarHBondContact O-N 3.36Å; D364-K367 PolarHBondContact O-N 3.06Å; D364-T459 PolarHBondContact OD1-OG1 3.02Å; D364-T459 VanDerWaalsContact OD2-CA 3.26Å; D364-T459 WeakPolarHBondContact OD2-CA 3.43Å; D364-Q460 PolarHBondContact OD1-N 3.26Å; D364-Q460 PolarHBondContact OD2-N 3.23Å; D364-C461 PolarHBondContact OD1-N 2.92Å
365	S	98.1	Very high	98.7	Very high	67 Å²	67	19.8 Å²	19.8	47%	0.469	10%	0.104	S	C	.	.	H	α-helix	trans	-63.4	-24.8	178	79.3	0	0	0	0	113	Y362 A363 K367	Y362-S365 WeakPolarHBondContact CD2-OG 3.28Å; Y362-S365 VanDerWaalsContact O-CB 3.28Å; Y362-S365 WeakPolarHBondContact O-CB 3.25Å; Y362-S365 PolarHBondContact O-N 3.19Å; Y362-S365 PolarHBondContact O-OG 2.92Å; A363-S365 PolarHBondContact O-N 3.4Å; S365-K367 VanDerWaalsContact C-N 3.25Å; S365-K367 PolarHBondContact O-N 2.91Å
366	F	98.3	Very high	98.7	Very high	49 Å²	49	20 Å²	20	22%	0.215	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2.2	175.1	-61.8	-77.6	0	0	0	113.4	H249 P259 I314 L316 Y362 A363 D364	H249-F366 AromaticContact CE1-CE1 3.84Å; P259-F366 HydrophobicContact CG-CB 4.31Å; I314-F366 HydrophobicContact CD1-CB 4.03Å; I314-F366 HydrophobicContact CD1-CD1 3.66Å; I314-F366 HydrophobicContact CD1-CD2 4.49Å; I314-F366 HydrophobicContact CD1-CE1 4.25Å; I314-F366 HydrophobicContact CD1-CG 3.8Å; I314-F366 HydrophobicContact CG2-CE2 4.42Å; L316-F366 HydrophobicContact CD1-CD2 4.49Å; L316-F366 HydrophobicContact CD1-CE2 4.16Å; L316-F366 HydrophobicContact CD2-CE2 4.07Å; Y362-F366 HydrophobicContact CD1-CE2 4.17Å; Y362-F366 HydrophobicContact CD2-CE2 4.36Å; Y362-F366 AromaticContact CE1-CE2 3.88Å; Y362-F366 HydrophobicContact CE1-CE2 3.88Å; Y362-F366 HydrophobicContact CE1-CZ 4.03Å; Y362-F366 HydrophobicContact CE2-CE2 4.08Å; Y362-F366 HydrophobicContact CE2-CZ 4.15Å; Y362-F366 HydrophobicContact CG-CE2 4.4Å; Y362-F366 AromaticContact CZ-CE2 3.83Å; Y362-F366 AromaticContact CZ-CZ 3.69Å; Y362-F366 WeakPolarHBondContact O-CD2 3.31Å; A363-F366 WeakPolarHBondContact O-CB 3.46Å; A363-F366 PolarHBondContact O-N 3.41Å; A363-F366 VanDerWaalsContact O-N 3.1Å; D364-F366 PolarHBondContact O-N 3.36Å
367	K	98.3	Very high	98.7	Very high	174 Å²	174	20.8 Å²	20.8	76%	0.757	11%	0.11	S	C	*	.			trans	49	54.5	-175.1	-56.8	178.4	-176.1	177	0	112.1	A258 D364 S365	A258-K367 WeakPolarHBondContact CB-O 3.32Å; D364-K367 PolarHBondContact O-N 3.06Å; S365-K367 VanDerWaalsContact C-N 3.25Å; S365-K367 PolarHBondContact O-N 2.91Å
368	P	98.5	Very high	98.6	Very high	16 Å²	16	21.2 Å²	21.2	10%	0.104	11%	0.112	C	C	.	.			trans	-67.7	149.7	-171.1	28.2	-34.7	0	0	0	112.2	P259 C261 A363 S370 V371	P259-P368 CarbonylContact O-C 3.05Å; P259-P368 WeakPolarHBondContact O-CA 3.29Å; P259-P368 WeakPolarHBondContact O-CB 3.33Å; C261-P368 HydrophobicContact CB-CB 4.15Å; C261-P368 HydrophobicContact CB-CG 4.48Å; A363-P368 VanDerWaalsContact O-CD 3.3Å; A363-P368 WeakPolarHBondContact O-CD 3.26Å; P368-S370 VanDerWaalsContact C-N 3.3Å; P368-V371 HydrophobicContact CB-CG2 4.07Å; P368-V371 HydrophobicContact CG-CG2 3.36Å
369	S	98	Very high	98.5	Very high	36 Å²	36	24.3 Å²	24.3	25%	0.252	14%	0.144	S	C	.	.	S	Bend	trans	-71.6	-27.9	168.5	59.8	0	0	0	0	112	A258 P259 S463	A258-S369 WeakPolarHBondContact O-CB 3.47Å; A258-S369 PolarHBondContact O-OG 3Å; P259-S369 PolarHBondContact O-N 3.26Å; P259-S369 PolarHBondContact O-OG 3.41Å; S369-S463 WeakPolarHBondContact O-CB 3.27Å
370	S	98.7	Very high	98.5	Very high	8 Å²	8	26 Å²	26	6%	0.056	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	148.3	172.7	-66.1	0	0	0	0	111.2	C261 P368 S463	C261-S370 PolarHBondContact N-O 3.42Å; P368-S370 VanDerWaalsContact C-N 3.3Å; S370-S463 CarbonylContact C-O 3.3Å; S370-S463 WeakPolarHBondContact CA-O 3.47Å; S370-S463 WeakPolarHBondContact CB-O 3.4Å; S370-S463 WeakPolarHBondContact OG-CB 3.11Å; S370-S463 PolarHBondContact OG-OG 3.37Å
371	V	98.9	Very high	98.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.2	173.3	-179.4	0	0	0	0	108.6	C261 V263 L360 A363 P368 C461 S463 W464 M465	C261-V371 HydrophobicContact CB-CG2 4.2Å; C261-V371 CarbonylContact O-C 3.53Å; C261-V371 WeakPolarHBondContact O-CA 3.24Å; V263-V371 HydrophobicContact CG2-CG1 4.19Å; L360-V371 HydrophobicContact CD2-CG1 3.67Å; A363-V371 HydrophobicContact CB-CG1 4.34Å; A363-V371 HydrophobicContact CB-CG2 4.31Å; P368-V371 HydrophobicContact CB-CG2 4.07Å; P368-V371 HydrophobicContact CG-CG2 3.36Å; V371-C461 HydrophobicContact CB-CB 4.27Å; V371-C461 HydrophobicContact CG2-CB 3.65Å; V371-S463 PolarHBondContact N-O 3.13Å; V371-W464 CarbonylContact O-C 3.21Å; V371-W464 VanDerWaalsContact O-CA 3.29Å; V371-W464 WeakPolarHBondContact O-CA 3.35Å; V371-M465 PolarHBondContact O-N 2.89Å
372	I	98.9	Very high	98.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	114.7	173.5	-54.3	171.9	0	0	0	107.8	C261 L262 V263 I374 L399 M403 M465 M467 L494	C261-I372 PolarHBondContact O-N 2.98Å; L262-I372 CarbonylContact C-O 3.54Å; L262-I372 VanDerWaalsContact CA-O 3.26Å; L262-I372 WeakPolarHBondContact CA-O 3.28Å; L262-I372 HydrophobicContact CD2-CB 3.95Å; L262-I372 HydrophobicContact CD2-CD1 4.22Å; L262-I372 HydrophobicContact CD2-CG1 4.45Å; V263-I372 PolarHBondContact N-O 3.48Å; I372-I374 HydrophobicContact CG2-CD1 4.1Å; I372-I374 HydrophobicContact CG2-CG1 4.35Å; I372-L399 HydrophobicContact CD1-CD1 4.18Å; I372-L399 HydrophobicContact CG1-CD1 4.39Å; I372-L399 HydrophobicContact CG1-CD2 4.31Å; I372-M403 HydrophobicContact CD1-CE 3.96Å; I372-M403 HydrophobicContact CG2-CE 4.26Å; I372-M465 CarbonylContact C-O 3.45Å; I372-M465 WeakPolarHBondContact CA-O 3.35Å; I372-M465 HydrophobicContact CG1-CB 4.47Å; I372-M467 HydrophobicContact CG2-CG 4.11Å; I372-M467 HydrophobicContact CG2-SD 3.84Å; I372-L494 HydrophobicContact CD1-CD1 4.19Å; I372-L494 HydrophobicContact CG2-CD1 4.1Å
373	D	98.9	Very high	98.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	142.3	171.1	79.8	-97.6	0	0	0	112	V263 L360 W464 M465 H466 M467	V263-D373 HydrophobicContact CB-CB 3.8Å; V263-D373 HydrophobicContact CG1-CB 4.47Å; V263-D373 CarbonylContact O-C 3.59Å; V263-D373 WeakPolarHBondContact O-CA 3.23Å; L360-D373 HydrophobicContact CD2-CB 4.16Å; D373-W464 PolarHBondContact OD1-NE1 3.11Å; D373-M465 PolarHBondContact N-O 2.82Å; D373-H466 WeakPolarHBondContact OD1-CA 3.4Å; D373-H466 IonicContact OD1-ND1 2.76Å; D373-H466 IonicContact OD2-CE1 3.78Å; D373-H466 IonicContact OD2-CG 3.19Å; D373-H466 IonicContact OD2-ND1 2.79Å; D373-H466 PolarHBondContact OD2-ND1 2.87Å; D373-M467 PolarHBondContact O-N 3.47Å
374	I	98.9	Very high	98.3	Very high	0 Å²	0	35 Å²	35	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.8	-174.9	-52.8	95.1	0	0	0	108.5	V263 K265 G291 C294 V295 I372 M467 I469 L494	V263-I374 PolarHBondContact O-N 2.88Å; K265-I374 PolarHBondContact N-O 2.94Å; G291-I374 VanDerWaalsContact CA-O 3.24Å; G291-I374 WeakPolarHBondContact CA-O 3.45Å; C294-I374 HydrophobicContact CB-CG2 4.23Å; V295-I374 HydrophobicContact CG2-CD1 3.93Å; I372-I374 HydrophobicContact CG2-CD1 4.1Å; I372-I374 HydrophobicContact CG2-CG1 4.35Å; I374-M467 HydrophobicContact CG1-CB 4.28Å; I374-M467 HydrophobicContact CG1-CG 4.44Å; I374-M467 HydrophobicContact CG1-SD 3.99Å; I374-M467 HydrophobicContact CG2-CB 4.41Å; I374-I469 HydrophobicContact CG2-CD1 3.88Å; I374-I469 HydrophobicContact CG2-CG1 4.18Å; I374-I469 HydrophobicContact CG2-CG2 3.83Å; I374-L494 HydrophobicContact CD1-CD1 4.4Å; I374-L494 HydrophobicContact CD1-CD2 3.83Å; I374-L494 HydrophobicContact CG1-CD2 4.21Å
375	A	98.9	Very high	98.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	143.1	-176	0	0	0	0	0	113.8	K265 L356 L377 M467 D468 I469	K265-A375 HydrophobicContact CB-CB 3.51Å; K265-A375 HydrophobicContact CD-CB 4.02Å; K265-A375 HydrophobicContact CG-CB 4.32Å; L356-A375 HydrophobicContact CD1-CB 3.74Å; A375-L377 HydrophobicContact CB-CB 3.9Å; A375-L377 HydrophobicContact CB-CD1 4.22Å; A375-L377 PolarHBondContact O-N 3.48Å; A375-M467 PolarHBondContact N-O 3.37Å; A375-D468 WeakPolarHBondContact O-CA 3.37Å; A375-I469 VanDerWaalsContact C-CG1 3.45Å; A375-I469 VanDerWaalsContact O-CG1 3.27Å; A375-I469 WeakPolarHBondContact O-CG1 3.3Å; A375-I469 PolarHBondContact O-N 2.87Å
376	T	98.5	Very high	98.1	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.031	22%	0.223	C	C	.	.			trans	-74.8	70.8	159.7	44.5	0	0	0	0	107.8	K265 D288 I469 M473	K265-T376 PolarHBondContact NZ-O 2.94Å; D288-T376 WeakPolarHBondContact CA-OG1 3.45Å; D288-T376 PolarHBondContact O-OG1 3.44Å; D288-T376 VanDerWaalsContact O-OG1 3.11Å; D288-T376 VanDerWaalsContact OD1-CB 3.32Å; D288-T376 WeakPolarHBondContact OD1-CB 3.43Å; D288-T376 VanDerWaalsContact OD1-O 3.06Å; D288-T376 PolarHBondContact OD1-OG1 3Å; T376-I469 HydrophobicContact CG2-CD1 4.06Å; T376-I469 HydrophobicContact CG2-CG1 3.91Å; T376-M473 HydrophobicContact CG2-CB 4.26Å; T376-M473 HydrophobicContact CG2-CG 4.08Å; T376-M473 HydrophobicContact CG2-SD 3.49Å; T376-M473 WeakPolarHBondContact CG2-SD 3.28Å
377	L	98.5	Very high	98	Very high	17 Å²	17	32.6 Å²	32.6	9%	0.089	22%	0.221	C	C	.	.			trans	-91.1	-46	-160	-164.1	65.2	0	0	0	113.4	R353 L356 A375 A451 L455 H466 D468	R353-L377 HydrophobicContact CB-CD1 4.14Å; L356-L377 HydrophobicContact CD1-CD1 4.13Å; A375-L377 HydrophobicContact CB-CB 3.9Å; A375-L377 HydrophobicContact CB-CD1 4.22Å; A375-L377 PolarHBondContact O-N 3.48Å; L377-A451 HydrophobicContact CD2-CB 3.74Å; L377-A451 HydrophobicContact CG-CB 4.35Å; L377-L455 HydrophobicContact CD2-CD1 3.68Å; L377-L455 HydrophobicContact CD2-CG 4.4Å; L377-H466 VanDerWaalsContact CD2-CE1 3.45Å; L377-H466 WeakPolarHBondContact CD2-CE1 3.34Å; L377-H466 WeakPolarHBondContact CD2-NE2 3.31Å; L377-D468 PolarHBondContact N-OD1 2.91Å; L377-D468 VanDerWaalsContact N-OD1 3.12Å
378	T	98.1	Very high	97.8	Very high	8 Å²	8	27 Å²	27	5%	0.049	21%	0.207	C	C	.	.			trans	-133.6	130.9	-171.2	74	0	0	0	0	113.7	A380 I381 S448 A451 D468 A470	T378-A380 PolarHBondContact O-N 3.27Å; T378-I381 WeakPolarHBondContact O-CG2 3.34Å; T378-I381 PolarHBondContact O-N 3.37Å; T378-I381 PolarHBondContact OG1-N 2.8Å; T378-S448 WeakPolarHBondContact OG1-CB 3.34Å; T378-S448 PolarHBondContact OG1-OG 3.21Å; T378-A451 HydrophobicContact CG2-CB 3.46Å; T378-A451 VanDerWaalsContact CG2-CB 3.46Å; T378-D468 WeakPolarHBondContact CB-OD2 3.4Å; T378-D468 PolarHBondContact N-OD1 3.17Å; T378-D468 PolarHBondContact N-OD2 2.71Å; T378-D468 PolarHBondContact OG1-OD2 2.81Å; T378-A470 WeakPolarHBondContact O-CB 3.15Å
379	G	95.9	Very high	97.7	Very high	65 Å²	65	26.8 Å²	26.8	67%	0.67	21%	0.206	S	C	*	.	H	α-helix	trans	-58.2	-26.8	165	0	0	0	0	0	112.3	I381 G382 V383	G379-I381 VanDerWaalsContact C-N 3.3Å; G379-I381 PolarHBondContact O-N 3.31Å; G379-G382 PolarHBondContact O-N 3.19Å; G379-V383 PolarHBondContact O-N 2.83Å; G379-V383 VanDerWaalsContact O-N 3.16Å
380	A	98.2	Very high	97.8	Very high	37 Å²	37	25.1 Å²	25.1	31%	0.306	19%	0.194	S	C	.	.	H	α-helix	trans	-62.2	-30	177.3	0	0	0	0	0	113.6	T378 G382 V383 A384 S448	T378-A380 PolarHBondContact O-N 3.27Å; A380-G382 VanDerWaalsContact C-N 3.34Å; A380-V383 PolarHBondContact O-N 3.2Å; A380-A384 PolarHBondContact O-N 3.01Å; A380-S448 VanDerWaalsContact CB-OG 3.29Å; A380-S448 WeakPolarHBondContact CB-OG 3.44Å
381	I	98.6	Very high	97.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-73.8	-33.9	178.2	-159.8	65.6	0	0	0	110.5	T378 G379 V383 A384 L385 M417 S448 D468 A470	T378-I381 WeakPolarHBondContact O-CG2 3.34Å; T378-I381 PolarHBondContact O-N 3.37Å; T378-I381 PolarHBondContact OG1-N 2.8Å; G379-I381 VanDerWaalsContact C-N 3.3Å; G379-I381 PolarHBondContact O-N 3.31Å; I381-V383 VanDerWaalsContact C-N 3.29Å; I381-V383 PolarHBondContact O-N 3.21Å; I381-A384 HydrophobicContact CD1-CB 4.49Å; I381-A384 PolarHBondContact O-N 3.18Å; I381-L385 HydrophobicContact CD1-CD1 3.8Å; I381-L385 HydrophobicContact CD1-CG 4.11Å; I381-L385 HydrophobicContact CG1-CD1 4.06Å; I381-L385 HydrophobicContact CG1-CG 4.42Å; I381-L385 PolarHBondContact O-N 3.48Å; I381-M417 HydrophobicContact CD1-CE 3.96Å; I381-M417 HydrophobicContact CD1-CG 3.99Å; I381-M417 HydrophobicContact CD1-SD 4.13Å; I381-S448 WeakPolarHBondContact CA-OG 3.42Å; I381-S448 PolarHBondContact N-OG 3.04Å; I381-D468 HydrophobicContact CB-CB 4.21Å; I381-D468 WeakPolarHBondContact CB-OD2 3.35Å; I381-D468 HydrophobicContact CG1-CB 4.21Å; I381-D468 HydrophobicContact CG2-CB 4.01Å; I381-D468 VanDerWaalsContact CG2-OD1 3.31Å; I381-D468 WeakPolarHBondContact CG2-OD1 3.49Å; I381-D468 WeakPolarHBondContact CG2-OD2 3.31Å; I381-A470 HydrophobicContact CG2-CB 3.96Å
382	G	97.1	Very high	97.8	Very high	28 Å²	28	24.7 Å²	24.7	29%	0.289	19%	0.192	S	C	.	.	H	α-helix	trans	-63.7	-35.2	172.3	0	0	0	0	0	111.9	G379 A380 G386	G379-G382 PolarHBondContact O-N 3.19Å; A380-G382 VanDerWaalsContact C-N 3.34Å; G382-G386 WeakPolarHBondContact O-CA 3.45Å; G382-G386 PolarHBondContact O-N 3.39Å
383	V	97.4	Very high	97.8	Very high	131 Å²	131	24.7 Å²	24.7	79%	0.794	19%	0.192	S	C	*	.	H	α-helix	trans	-68.2	-39.4	172.1	177.3	0	0	0	0	111.5	G379 A380 I381	G379-V383 PolarHBondContact O-N 2.83Å; G379-V383 VanDerWaalsContact O-N 3.16Å; A380-V383 PolarHBondContact O-N 3.2Å; I381-V383 VanDerWaalsContact C-N 3.29Å; I381-V383 PolarHBondContact O-N 3.21Å
384	A	98.2	Very high	97.7	Very high	60 Å²	60	25 Å²	25	50%	0.496	19%	0.194	S	C	.	.	H	α-helix	trans	-76.1	-43.7	-175.5	0	0	0	0	0	113.9	A380 I381 M417	A380-A384 PolarHBondContact O-N 3.01Å; I381-A384 HydrophobicContact CD1-CB 4.49Å; I381-A384 PolarHBondContact O-N 3.18Å; A384-M417 HydrophobicContact CB-CE 4.43Å
385	L	97.7	Very high	97.7	Very high	39 Å²	39	27.7 Å²	27.7	20%	0.204	21%	0.208	C	C	.	.	H	α-helix	trans	-117.2	-5.3	-171.2	-58.8	-178.1	0	0	0	113.6	I381 C387 A388 W415 M417	I381-L385 HydrophobicContact CD1-CD1 3.8Å; I381-L385 HydrophobicContact CD1-CG 4.11Å; I381-L385 HydrophobicContact CG1-CD1 4.06Å; I381-L385 HydrophobicContact CG1-CG 4.42Å; I381-L385 PolarHBondContact O-N 3.48Å; L385-C387 PolarHBondContact O-N 3.46Å; L385-A388 PolarHBondContact O-N 3.48Å; L385-W415 HydrophobicContact CD1-CB 3.99Å; L385-W415 HydrophobicContact CD2-CB 4.41Å; L385-W415 HydrophobicContact CD2-CG 4.25Å; L385-M417 HydrophobicContact CD1-SD 4.21Å; L385-M417 HydrophobicContact CD2-SD 4.36Å; L385-M417 HydrophobicContact CG-SD 4.48Å
386	G	96.2	Very high	97.7	Very high	36 Å²	36	28.5 Å²	28.5	37%	0.371	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	-132	-169.8	0	0	0	0	0	110.7	G382 G471	G382-G386 WeakPolarHBondContact O-CA 3.45Å; G382-G386 PolarHBondContact O-N 3.39Å; G386-G471 CarbonylContact O-C 3.5Å; G386-G471 WeakPolarHBondContact O-CA 3.48Å
387	C	94.8	Very high	97.7	Very high	24 Å²	24	32.7 Å²	32.7	16%	0.162	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	14.1	176.3	62.5	0	0	0	0	113.8	L385 G471 K476 R489	L385-C387 PolarHBondContact O-N 3.46Å; C387-G471 WeakPolarHBondContact CA-O 3.09Å; C387-G471 VanDerWaalsContact CB-O 3.23Å; C387-G471 WeakPolarHBondContact CB-O 3.19Å; C387-K476 HydrophobicContact CB-CG 3.85Å; C387-K476 VanDerWaalsContact SG-CG 3.53Å; C387-R489 PolarHBondContact O-NH1 2.9Å
388	A	94.6	Very high	97.6	Very high	56 Å²	56	36.8 Å²	36.8	46%	0.463	25%	0.251	S	S	.	.	S	Bend	trans	-73.8	-43	-174	0	0	0	0	0	112.2	L385 R489	L385-A388 PolarHBondContact O-N 3.48Å; A388-R489 PolarHBondContact O-NH2 3.35Å
389	A	97.1	Very high	97.6	Very high	11 Å²	11	36.4 Å²	36.4	9%	0.091	25%	0.248	C	C	.	.	S	Bend	trans	-147.5	152.8	-175.3	0	0	0	0	0	111.9	R413 W415	A389-R413 VanDerWaalsContact CA-O 3.27Å; A389-R413 WeakPolarHBondContact CA-O 3.22Å; A389-R413 HydrophobicContact CB-CB 3.79Å; A389-R413 WeakPolarHBondContact CB-O 3.48Å; A389-W415 HydrophobicContact CB-CB 4.15Å
390	T	98.7	Very high	97.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	133.4	165.8	-66.3	0	0	0	0	109.9	V392 R413 V414 W415 M467 I469 V472 P490	T390-V392 HydrophobicContact CG2-CG2 4.21Å; T390-R413 PolarHBondContact N-O 3.26Å; T390-V414 CarbonylContact O-C 3.53Å; T390-V414 WeakPolarHBondContact O-CA 3.43Å; T390-W415 PolarHBondContact O-N 2.99Å; T390-M467 HydrophobicContact CG2-CB 3.93Å; T390-M467 HydrophobicContact CG2-CE 4.13Å; T390-I469 HydrophobicContact CG2-CG2 3.56Å; T390-V472 WeakPolarHBondContact OG1-CG2 3.42Å; T390-P490 HydrophobicContact CG2-CG 4.45Å
391	G	98.8	Very high	97.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	126	173.6	0	0	0	0	0	110.7	M467 D468	G391-M467 CarbonylContact O-C 3.54Å; G391-D468 PolarHBondContact N-O 2.95Å; G391-D468 PolarHBondContact O-N 3.12Å
392	V	98.9	Very high	97.7	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127	-176.8	173.7	0	0	0	0	110.8	T390 W400 V414 W415 R416 M417 M465 H466 M467	T390-V392 HydrophobicContact CG2-CG2 4.21Å; V392-W400 HydrophobicContact CB-CE3 4.23Å; V392-W400 HydrophobicContact CB-CZ3 3.89Å; V392-W400 HydrophobicContact CG1-CE3 3.8Å; V392-W400 HydrophobicContact CG1-CZ3 3.98Å; V392-W400 HydrophobicContact CG2-CZ3 4.44Å; V392-V414 HydrophobicContact CG2-CB 3.75Å; V392-V414 HydrophobicContact CG2-CG1 3.98Å; V392-W415 PolarHBondContact N-O 2.88Å; V392-R416 CarbonylContact O-C 3.59Å; V392-R416 WeakPolarHBondContact O-CA 3.5Å; V392-M417 PolarHBondContact O-N 3.38Å; V392-M465 HydrophobicContact CG1-CE 3.61Å; V392-M465 HydrophobicContact CG1-CG 3.6Å; V392-M465 HydrophobicContact CG1-SD 3.55Å; V392-M465 VanDerWaalsContact CG1-SD 3.55Å; V392-H466 WeakPolarHBondContact CA-O 3.39Å; V392-M467 HydrophobicContact CG2-CE 4.45Å; V392-M467 HydrophobicContact CG2-CG 4.31Å
393	F	98.9	Very high	97.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.9	174.2	-58.4	-101	0	0	0	107.9	M417 P418 L419 S448 C449 A452 M465 H466	F393-M417 HydrophobicContact CD1-CB 3.57Å; F393-M417 HydrophobicContact CD2-CB 4.11Å; F393-M417 HydrophobicContact CE1-CB 3.15Å; F393-M417 HydrophobicContact CE1-CG 4.1Å; F393-M417 HydrophobicContact CE2-CB 3.76Å; F393-M417 HydrophobicContact CE2-CG 3.92Å; F393-M417 HydrophobicContact CG-CB 4.03Å; F393-M417 HydrophobicContact CZ-CB 3.26Å; F393-M417 HydrophobicContact CZ-CG 3.67Å; F393-P418 WeakPolarHBondContact CD1-O 3.46Å; F393-P418 WeakPolarHBondContact CE1-O 3.09Å; F393-L419 HydrophobicContact CB-CD1 4.44Å; F393-S448 WeakPolarHBondContact CZ-O 3.35Å; F393-C449 VanDerWaalsContact CE1-CA 3.5Å; F393-C449 HydrophobicContact CE1-CB 4.03Å; F393-A452 HydrophobicContact CB-CB 3.69Å; F393-A452 HydrophobicContact CD1-CB 3.42Å; F393-A452 VanDerWaalsContact CD1-CB 3.42Å; F393-A452 HydrophobicContact CD2-CB 3.71Å; F393-A452 HydrophobicContact CE1-CB 3.9Å; F393-A452 HydrophobicContact CE2-CB 4.15Å; F393-A452 HydrophobicContact CG-CB 3.31Å; F393-A452 HydrophobicContact CZ-CB 4.24Å; F393-M465 CarbonylContact O-C 3.51Å; F393-M465 VanDerWaalsContact O-CA 3.29Å; F393-M465 WeakPolarHBondContact O-CA 3.44Å; F393-H466 HydrophobicContact CB-CB 4.34Å; F393-H466 AromaticContact CD2-CD2 3.61Å; F393-H466 PolarHBondContact N-O 2.86Å; F393-H466 PolarHBondContact O-N 3.05Å
394	S	98.8	Very high	97.8	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	140.5	-179.2	-177.4	0	0	0	0	111.8	C396 R416 W464	S394-C396 VanDerWaalsContact C-N 3.3Å; S394-C396 PolarHBondContact OG-N 2.94Å; S394-C396 VanDerWaalsContact OG-N 3.13Å; S394-C396 PolarHBondContact OG-O 3.44Å; S394-R416 PolarHBondContact O-NH2 3.44Å; S394-W464 WeakPolarHBondContact CA-O 3.5Å; S394-W464 WeakPolarHBondContact CB-O 2.99Å; S394-W464 PolarHBondContact OG-O 3.46Å
395	N	98.4	Very high	97.7	Very high	56 Å²	56	31 Å²	31	30%	0.299	17%	0.174	S	C	.	.	S	Bend	trans	-86.7	2.6	172.3	66.6	3.4	0	0	0	112.8	L419 H456 C461 T462 W464	N395-L419 HydrophobicContact CB-CD2 4.34Å; N395-H456 PolarHBondContact ND2-NE2 3.47Å; N395-C461 PolarHBondContact ND2-O 3.35Å; N395-C461 VanDerWaalsContact ND2-O 3.11Å; N395-T462 PolarHBondContact OD1-O 3.26Å; N395-W464 PolarHBondContact N-O 3.37Å; N395-W464 PolarHBondContact OD1-N 3.41Å; N395-W464 PolarHBondContact OD1-O 2.85Å
396	C	98.4	Very high	97.6	Very high	18 Å²	18	29.2 Å²	29.2	12%	0.122	16%	0.164	C	C	.	.			trans	-132.2	114.3	-175	174.9	0	0	0	0	111.9	S394 Y398 L399 W400 S463	S394-C396 VanDerWaalsContact C-N 3.3Å; S394-C396 PolarHBondContact OG-N 2.94Å; S394-C396 VanDerWaalsContact OG-N 3.13Å; S394-C396 PolarHBondContact OG-O 3.44Å; C396-Y398 VanDerWaalsContact C-N 3.34Å; C396-Y398 PolarHBondContact O-N 3.43Å; C396-L399 HydrophobicContact CB-CB 4.05Å; C396-L399 PolarHBondContact O-N 3.21Å; C396-L399 PolarHBondContact SG-N 3.24Å; C396-W400 PolarHBondContact O-N 2.87Å; C396-S463 PolarHBondContact SG-OG 3.49Å; C396-S463 VanDerWaalsContact SG-OG 3.39Å
397	D	98.1	Very high	97.7	Very high	92 Å²	92	27.5 Å²	27.5	49%	0.492	15%	0.147	S	C	.	.	H	α-helix	trans	-63.8	-39.2	-179.7	-72.4	-13.4	0	0	0	112.3	L399 W400 H401 R416	D397-L399 PolarHBondContact O-N 2.88Å; D397-W400 WeakPolarHBondContact O-CB 3.36Å; D397-W400 PolarHBondContact O-N 3.41Å; D397-H401 PolarHBondContact O-CD2 3.13Å; D397-H401 PolarHBondContact O-N 3.11Å; D397-R416 IonicContact OD1-CZ 2.73Å; D397-R416 IonicContact OD1-NH1 3.63Å; D397-R416 PolarHBondContact OD1-NH1 3.32Å; D397-R416 IonicContact OD1-NH2 3.78Å; D397-R416 PolarHBondContact OD1-NH2 2.93Å
398	Y	97.2	Very high	97.7	Very high	103 Å²	103	28.4 Å²	28.4	40%	0.404	15%	0.148	S	C	.	.	H	α-helix	trans	-58.5	-49	177.1	175.3	-101.4	0	0	0	111.3	C396 W400 H401 K402 L501	C396-Y398 VanDerWaalsContact C-N 3.34Å; C396-Y398 PolarHBondContact O-N 3.43Å; Y398-W400 PolarHBondContact O-N 3.41Å; Y398-H401 PolarHBondContact O-N 2.87Å; Y398-K402 HydrophobicContact CE1-CG 4.18Å; Y398-K402 HydrophobicContact CE2-CD 4.46Å; Y398-K402 VanDerWaalsContact CE2-CE 3.43Å; Y398-K402 HydrophobicContact CE2-CG 4.34Å; Y398-K402 VanDerWaalsContact CZ-CE 3.42Å; Y398-K402 WeakPolarHBondContact O-CG 3.16Å; Y398-K402 PolarHBondContact O-N 3.5Å; Y398-K402 VanDerWaalsContact O-N 3.1Å; Y398-K402 WeakPolarHBondContact OH-CE 3.35Å; Y398-L501 HydrophobicContact CD1-CD2 4.37Å; Y398-L501 HydrophobicContact CE1-CD2 3.65Å
399	L	98.1	Very high	97.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.6	-41.6	178.6	-174.4	58.4	0	0	0	111.4	I372 C396 D397 H401 K402 M403 M465 L501	I372-L399 HydrophobicContact CD1-CD1 4.18Å; I372-L399 HydrophobicContact CG1-CD1 4.39Å; I372-L399 HydrophobicContact CG1-CD2 4.31Å; C396-L399 HydrophobicContact CB-CB 4.05Å; C396-L399 PolarHBondContact O-N 3.21Å; C396-L399 PolarHBondContact SG-N 3.24Å; D397-L399 PolarHBondContact O-N 2.88Å; L399-H401 PolarHBondContact O-N 3.49Å; L399-K402 PolarHBondContact O-N 2.94Å; L399-M403 PolarHBondContact O-N 2.97Å; L399-M465 HydrophobicContact CB-CE 4.4Å; L399-M465 HydrophobicContact CD2-CB 3.62Å; L399-M465 HydrophobicContact CD2-CE 4.43Å; L399-M465 HydrophobicContact CG-CB 4.23Å; L399-M465 HydrophobicContact CG-CE 3.8Å; L399-L501 HydrophobicContact CD1-CD1 4.06Å; L399-L501 HydrophobicContact CD1-CD2 4.09Å
400	W	98.2	Very high	97.7	Very high	22 Å²	22	27.1 Å²	27.1	8%	0.083	13%	0.133	C	C	.	.	H	α-helix	trans	-55.3	-50.4	172.4	163.2	-109.7	0	0	0	112.5	V392 C396 D397 Y398 K402 M403 N404 V414 R416 M465	V392-W400 HydrophobicContact CB-CE3 4.23Å; V392-W400 HydrophobicContact CB-CZ3 3.89Å; V392-W400 HydrophobicContact CG1-CE3 3.8Å; V392-W400 HydrophobicContact CG1-CZ3 3.98Å; V392-W400 HydrophobicContact CG2-CZ3 4.44Å; C396-W400 PolarHBondContact O-N 2.87Å; D397-W400 WeakPolarHBondContact O-CB 3.36Å; D397-W400 PolarHBondContact O-N 3.41Å; Y398-W400 PolarHBondContact O-N 3.41Å; W400-K402 VanDerWaalsContact C-N 3.32Å; W400-K402 PolarHBondContact O-N 3.43Å; W400-M403 PolarHBondContact O-N 3.35Å; W400-N404 HydrophobicContact CD2-CB 4.45Å; W400-N404 HydrophobicContact CH2-CB 4.07Å; W400-N404 HydrophobicContact CZ2-CB 3.86Å; W400-N404 HydrophobicContact CZ3-CB 4.47Å; W400-N404 WeakPolarHBondContact O-CB 3.48Å; W400-N404 PolarHBondContact O-N 3.49Å; W400-V414 HydrophobicContact CH2-CG2 3.96Å; W400-V414 HydrophobicContact CZ3-CB 4.3Å; W400-V414 HydrophobicContact CZ3-CG2 3.8Å; W400-R416 HydrophobicContact CD2-CB 3.92Å; W400-R416 HydrophobicContact CD2-CG 3.97Å; W400-R416 HydrophobicContact CE3-CB 3.9Å; W400-R416 HydrophobicContact CE3-CG 4.04Å; W400-R416 HydrophobicContact CG-CG 4.48Å; W400-R416 HydrophobicContact CH2-CB 3.61Å; W400-R416 HydrophobicContact CZ2-CB 3.59Å; W400-R416 HydrophobicContact CZ3-CB 3.75Å; W400-R416 HydrophobicContact CZ3-CG 4.36Å; W400-M465 HydrophobicContact CB-CE 4.39Å
401	H	97.9	Very high	97.5	Very high	98 Å²	98	27.5 Å²	27.5	45%	0.454	14%	0.138	S	C	.	.	H	α-helix	trans	-62.4	-39.5	-178.7	-73.1	-59.3	0	0	0	112.1	D397 Y398 L399 N404 D405	D397-H401 PolarHBondContact O-CD2 3.13Å; D397-H401 PolarHBondContact O-N 3.11Å; Y398-H401 PolarHBondContact O-N 2.87Å; L399-H401 PolarHBondContact O-N 3.49Å; H401-N404 PolarHBondContact O-N 2.87Å; H401-D405 WeakPolarHBondContact O-CB 3.3Å; H401-D405 VanDerWaalsContact O-CG 3.23Å; H401-D405 PolarHBondContact O-N 2.98Å
402	K	97.9	Very high	97.4	Very high	16 Å²	16	27.6 Å²	27.6	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-43.3	175.3	-65.2	-56	-172.2	172.7	0	112.7	Y398 L399 W400 A406 K500 L501 N504	Y398-K402 HydrophobicContact CE1-CG 4.18Å; Y398-K402 HydrophobicContact CE2-CD 4.46Å; Y398-K402 VanDerWaalsContact CE2-CE 3.43Å; Y398-K402 HydrophobicContact CE2-CG 4.34Å; Y398-K402 VanDerWaalsContact CZ-CE 3.42Å; Y398-K402 WeakPolarHBondContact O-CG 3.16Å; Y398-K402 PolarHBondContact O-N 3.5Å; Y398-K402 VanDerWaalsContact O-N 3.1Å; Y398-K402 WeakPolarHBondContact OH-CE 3.35Å; L399-K402 PolarHBondContact O-N 2.94Å; W400-K402 VanDerWaalsContact C-N 3.32Å; W400-K402 PolarHBondContact O-N 3.43Å; K402-A406 WeakPolarHBondContact O-CB 3.4Å; K402-A406 PolarHBondContact O-N 3.41Å; K402-K500 HydrophobicContact CD-CB 4.1Å; K402-L501 HydrophobicContact CB-CD2 4.33Å; K402-L501 HydrophobicContact CG-CD2 4Å; K402-N504 PolarHBondContact NZ-ND2 3.31Å; K402-N504 PolarHBondContact NZ-OD1 3.33Å
403	M	98.3	Very high	97.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.2	-43.7	178.2	-170.1	63.1	73.1	0	0	111.9	I372 L399 W400 A406 G407 V414 M465 M467 T493 L494 C497	I372-M403 HydrophobicContact CD1-CE 3.96Å; I372-M403 HydrophobicContact CG2-CE 4.26Å; L399-M403 PolarHBondContact O-N 2.97Å; W400-M403 PolarHBondContact O-N 3.35Å; M403-A406 WeakPolarHBondContact O-CB 3.46Å; M403-A406 PolarHBondContact O-N 2.98Å; M403-G407 PolarHBondContact O-N 2.83Å; M403-V414 HydrophobicContact CG-CG1 4.12Å; M403-V414 HydrophobicContact CG-CG2 4.23Å; M403-M465 HydrophobicContact CB-CE 3.75Å; M403-M465 HydrophobicContact CB-SD 3.89Å; M403-M465 HydrophobicContact CE-SD 3.64Å; M403-M465 HydrophobicContact CG-CE 4.26Å; M403-M465 HydrophobicContact CG-SD 3.79Å; M403-M467 HydrophobicContact CE-CE 3.97Å; M403-M467 HydrophobicContact CE-SD 3.64Å; M403-M467 HydrophobicContact CG-CE 4.14Å; M403-M467 HydrophobicContact SD-CE 3.63Å; M403-M467 HydrophobicContact SD-SD 4.14Å; M403-T493 HydrophobicContact CG-CG2 4.39Å; M403-T493 HydrophobicContact SD-CG2 3.62Å; M403-L494 HydrophobicContact CE-CD1 4.22Å; M403-C497 HydrophobicContact CE-CB 3.83Å; M403-C497 HydrophobicContact SD-CB 3.71Å
404	N	97.7	Very high	97.2	Very high	16 Å²	16	30.9 Å²	30.9	9%	0.086	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-48.1	176.9	-172.5	24	0	0	0	111.1	W400 H401 A406 G407 K408 V414	W400-N404 HydrophobicContact CD2-CB 4.45Å; W400-N404 HydrophobicContact CH2-CB 4.07Å; W400-N404 HydrophobicContact CZ2-CB 3.86Å; W400-N404 HydrophobicContact CZ3-CB 4.47Å; W400-N404 WeakPolarHBondContact O-CB 3.48Å; W400-N404 PolarHBondContact O-N 3.49Å; H401-N404 PolarHBondContact O-N 2.87Å; N404-A406 PolarHBondContact O-N 2.96Å; N404-G407 PolarHBondContact O-N 3.28Å; N404-G407 VanDerWaalsContact O-N 3.11Å; N404-K408 WeakPolarHBondContact ND2-CE 3.16Å; N404-K408 VanDerWaalsContact O-CG 3.27Å; N404-K408 WeakPolarHBondContact O-CG 3.26Å; N404-K408 PolarHBondContact O-N 2.8Å; N404-V414 HydrophobicContact CB-CG2 4.21Å
405	D	96.2	Very high	97.2	Very high	58 Å²	58	36.5 Å²	36.5	31%	0.31	17%	0.171	S	C	.	.	H	α-helix	trans	-62.9	-31.8	176.7	-71.2	-12.9	0	0	0	112.9	H401 K408 K500	H401-D405 WeakPolarHBondContact O-CB 3.3Å; H401-D405 VanDerWaalsContact O-CG 3.23Å; H401-D405 PolarHBondContact O-N 2.98Å; D405-K408 IonicContact OD1-NZ 2.64Å; D405-K408 PolarHBondContact OD1-NZ 3.33Å; D405-K500 HydrophobicContact CB-CD 4.3Å
406	A	97.6	Very high	97.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-47.3	172.2	0	0	0	0	0	111.7	K402 M403 N404 K408 V409 T410 T493 H496 C497 K500	K402-A406 WeakPolarHBondContact O-CB 3.4Å; K402-A406 PolarHBondContact O-N 3.41Å; M403-A406 WeakPolarHBondContact O-CB 3.46Å; M403-A406 PolarHBondContact O-N 2.98Å; N404-A406 PolarHBondContact O-N 2.96Å; A406-K408 VanDerWaalsContact C-N 3.31Å; A406-K408 PolarHBondContact O-N 3.17Å; A406-V409 PolarHBondContact O-N 3.18Å; A406-V409 VanDerWaalsContact O-N 3.1Å; A406-T410 WeakPolarHBondContact O-CG2 3.19Å; A406-T410 PolarHBondContact O-N 2.96Å; A406-T410 VanDerWaalsContact O-N 3.1Å; A406-T410 PolarHBondContact O-OG1 3.08Å; A406-T410 VanDerWaalsContact O-OG1 3.07Å; A406-T493 HydrophobicContact CB-CG2 4.02Å; A406-T493 WeakPolarHBondContact CB-O 3.42Å; A406-H496 HydrophobicContact CB-CB 4.01Å; A406-C497 HydrophobicContact CB-CB 3.92Å; A406-K500 HydrophobicContact CB-CD 4.44Å
407	G	97.6	Very high	97.2	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-38.8	179.4	0	0	0	0	0	113.5	M403 N404 V409 T410 G411 D412 T493	M403-G407 PolarHBondContact O-N 2.83Å; N404-G407 PolarHBondContact O-N 3.28Å; N404-G407 VanDerWaalsContact O-N 3.11Å; G407-V409 PolarHBondContact O-N 2.81Å; G407-T410 PolarHBondContact O-N 3.41Å; G407-T410 PolarHBondContact O-OG1 3.01Å; G407-G411 PolarHBondContact O-N 3Å; G407-D412 WeakPolarHBondContact CA-O 3.46Å; G407-D412 PolarHBondContact O-N 2.96Å; G407-T493 WeakPolarHBondContact CA-OG1 3.49Å
408	K	95.1	Very high	97.2	Very high	44 Å²	44	35.6 Å²	35.6	19%	0.191	16%	0.161	C	C	.	.	H	α-helix	trans	-56.8	-37.4	174.7	-70	175	-167.4	164.4	0	113.3	W81 Q86 N88 N404 D405 A406	W81-K408 HydrophobicContact CH2-CB 4.13Å; W81-K408 HydrophobicContact CH2-CD 3.27Å; W81-K408 HydrophobicContact CH2-CG 3.42Å; W81-K408 VanDerWaalsContact CH2-CG 3.42Å; W81-K408 HydrophobicContact CZ2-CD 4.15Å; W81-K408 HydrophobicContact CZ3-CB 3.59Å; W81-K408 HydrophobicContact CZ3-CD 3.56Å; W81-K408 HydrophobicContact CZ3-CG 3.43Å; W81-K408 VanDerWaalsContact CZ3-CG 3.43Å; Q86-K408 WeakPolarHBondContact O-CG 3.26Å; N88-K408 PolarHBondContact N-O 3.4Å; N404-K408 WeakPolarHBondContact ND2-CE 3.16Å; N404-K408 VanDerWaalsContact O-CG 3.27Å; N404-K408 WeakPolarHBondContact O-CG 3.26Å; N404-K408 PolarHBondContact O-N 2.8Å; D405-K408 IonicContact OD1-NZ 2.64Å; D405-K408 PolarHBondContact OD1-NZ 3.33Å; A406-K408 VanDerWaalsContact C-N 3.31Å; A406-K408 PolarHBondContact O-N 3.17Å
409	V	94	Very high	97.3	Very high	37 Å²	37	32.5 Å²	32.5	22%	0.224	15%	0.151	C	C	.	.	H	α-helix	trans	-82.5	-41.5	-175.7	160.7	0	0	0	0	111.7	R95 A406 G407	R95-V409 PolarHBondContact NH1-O 2.93Å; R95-V409 VanDerWaalsContact NH1-O 3.11Å; R95-V409 PolarHBondContact NH2-O 3.26Å; A406-V409 PolarHBondContact O-N 3.18Å; A406-V409 VanDerWaalsContact O-N 3.1Å; G407-V409 PolarHBondContact O-N 2.81Å
410	T	96.9	Very high	97.3	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-84	-15.7	-174.7	57.4	0	0	0	0	113	R95 A406 G407 D412 R492 T493 H496	R95-T410 VanDerWaalsContact CZ-O 3.27Å; R95-T410 PolarHBondContact NH1-O 3.18Å; A406-T410 WeakPolarHBondContact O-CG2 3.19Å; A406-T410 PolarHBondContact O-N 2.96Å; A406-T410 VanDerWaalsContact O-N 3.1Å; A406-T410 PolarHBondContact O-OG1 3.08Å; A406-T410 VanDerWaalsContact O-OG1 3.07Å; G407-T410 PolarHBondContact O-N 3.41Å; G407-T410 PolarHBondContact O-OG1 3.01Å; T410-D412 VanDerWaalsContact C-N 3.27Å; T410-D412 PolarHBondContact OG1-N 3.4Å; T410-R492 HydrophobicContact CG2-CB 4.02Å; T410-R492 VanDerWaalsContact O-CZ 3.22Å; T410-R492 PolarHBondContact O-NH1 2.82Å; T410-R492 PolarHBondContact O-NH2 3.41Å; T410-T493 PolarHBondContact OG1-OG1 2.88Å; T410-H496 HydrophobicContact CG2-CB 4.06Å
411	G	94.9	Very high	97.2	Very high	10 Å²	10	45.2 Å²	45.2	10%	0.103	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	1.3	-174.8	0	0	0	0	0	114	E92 G407	E92-G411 WeakPolarHBondContact OE1-CA 3.24Å; G407-G411 PolarHBondContact O-N 3Å
412	D	95.7	Very high	97.2	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.011	21%	0.208	C	C	.	.			trans	-108.4	87.2	-175.4	-166.4	-5.6	0	0	0	109.8	G407 T410 R489 P490 T493	G407-D412 WeakPolarHBondContact CA-O 3.46Å; G407-D412 PolarHBondContact O-N 2.96Å; T410-D412 VanDerWaalsContact C-N 3.27Å; T410-D412 PolarHBondContact OG1-N 3.4Å; D412-R489 VanDerWaalsContact CG-NE 3.3Å; D412-R489 IonicContact OD1-CZ 2.73Å; D412-R489 IonicContact OD1-NE 2.67Å; D412-R489 PolarHBondContact OD1-NE 3.01Å; D412-R489 IonicContact OD1-NH2 3.8Å; D412-R489 PolarHBondContact OD1-NH2 3.45Å; D412-R489 WeakPolarHBondContact OD2-CB 3.41Å; D412-R489 WeakPolarHBondContact OD2-CG 3.44Å; D412-R489 IonicContact OD2-NE 3.95Å; D412-R489 PolarHBondContact OD2-NE 3.21Å; D412-P490 WeakPolarHBondContact OD2-CA 3.26Å; D412-T493 WeakPolarHBondContact CB-OG1 3.37Å; D412-T493 PolarHBondContact O-OG1 3.14Å
413	R	96.2	Very high	97.3	Very high	66 Å²	66	46 Å²	46	25%	0.249	21%	0.21	C	C	.	.			trans	-59.1	145.3	-171.2	-62.7	-177.7	-172.7	94.1	-11.5	111.9	E85 A389 T390	E85-R413 PolarHBondContact O-NE 3.28Å; E85-R413 IonicContact OE2-CZ 2.8Å; E85-R413 IonicContact OE2-NH2 2.81Å; E85-R413 PolarHBondContact OE2-NH2 2.98Å; A389-R413 VanDerWaalsContact CA-O 3.27Å; A389-R413 WeakPolarHBondContact CA-O 3.22Å; A389-R413 HydrophobicContact CB-CB 3.79Å; A389-R413 WeakPolarHBondContact CB-O 3.48Å; T390-R413 PolarHBondContact N-O 3.26Å
414	V	98.2	Very high	97.2	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.9	168.6	-63.5	0	0	0	0	109.2	T390 V392 W400 M403 N404 M467 T493	T390-V414 CarbonylContact O-C 3.53Å; T390-V414 WeakPolarHBondContact O-CA 3.43Å; V392-V414 HydrophobicContact CG2-CB 3.75Å; V392-V414 HydrophobicContact CG2-CG1 3.98Å; W400-V414 HydrophobicContact CH2-CG2 3.96Å; W400-V414 HydrophobicContact CZ3-CB 4.3Å; W400-V414 HydrophobicContact CZ3-CG2 3.8Å; M403-V414 HydrophobicContact CG-CG1 4.12Å; M403-V414 HydrophobicContact CG-CG2 4.23Å; N404-V414 HydrophobicContact CB-CG2 4.21Å; V414-M467 HydrophobicContact CG1-CE 4.15Å; V414-T493 HydrophobicContact CG1-CG2 4.11Å
415	W	98.3	Very high	97.2	Very high	124 Å²	124	50.6 Å²	50.6	47%	0.47	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.1	177.4	-173.2	-102.6	0	0	0	111.2	L385 A389 T390 V392 M417	L385-W415 HydrophobicContact CD1-CB 3.99Å; L385-W415 HydrophobicContact CD2-CB 4.41Å; L385-W415 HydrophobicContact CD2-CG 4.25Å; A389-W415 HydrophobicContact CB-CB 4.15Å; T390-W415 PolarHBondContact O-N 2.99Å; V392-W415 PolarHBondContact N-O 2.88Å; W415-M417 PolarHBondContact O-N 2.9Å
416	R	98.6	Very high	97.3	Very high	79 Å²	79	48 Å²	48	30%	0.298	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	115.9	-177.8	-161.7	174.9	-172.2	176.5	-0.7	110.8	V392 S394 D397 W400	V392-R416 CarbonylContact O-C 3.59Å; V392-R416 WeakPolarHBondContact O-CA 3.5Å; S394-R416 PolarHBondContact O-NH2 3.44Å; D397-R416 IonicContact OD1-CZ 2.73Å; D397-R416 IonicContact OD1-NH1 3.63Å; D397-R416 PolarHBondContact OD1-NH1 3.32Å; D397-R416 IonicContact OD1-NH2 3.78Å; D397-R416 PolarHBondContact OD1-NH2 2.93Å; W400-R416 HydrophobicContact CD2-CB 3.92Å; W400-R416 HydrophobicContact CD2-CG 3.97Å; W400-R416 HydrophobicContact CE3-CB 3.9Å; W400-R416 HydrophobicContact CE3-CG 4.04Å; W400-R416 HydrophobicContact CG-CG 4.48Å; W400-R416 HydrophobicContact CH2-CB 3.61Å; W400-R416 HydrophobicContact CZ2-CB 3.59Å; W400-R416 HydrophobicContact CZ3-CB 3.75Å; W400-R416 HydrophobicContact CZ3-CG 4.36Å
417	M	98.8	Very high	97.3	Very high	27 Å²	27	48 Å²	48	13%	0.133	22%	0.22	C	C	.	.			trans	-93.1	151.7	174.3	-60.1	-60.5	-70.8	0	0	110.4	I381 A384 L385 V392 F393 W415	I381-M417 HydrophobicContact CD1-CE 3.96Å; I381-M417 HydrophobicContact CD1-CG 3.99Å; I381-M417 HydrophobicContact CD1-SD 4.13Å; A384-M417 HydrophobicContact CB-CE 4.43Å; L385-M417 HydrophobicContact CD1-SD 4.21Å; L385-M417 HydrophobicContact CD2-SD 4.36Å; L385-M417 HydrophobicContact CG-SD 4.48Å; V392-M417 PolarHBondContact O-N 3.38Å; F393-M417 HydrophobicContact CD1-CB 3.57Å; F393-M417 HydrophobicContact CD2-CB 4.11Å; F393-M417 HydrophobicContact CE1-CB 3.15Å; F393-M417 HydrophobicContact CE1-CG 4.1Å; F393-M417 HydrophobicContact CE2-CB 3.76Å; F393-M417 HydrophobicContact CE2-CG 3.92Å; F393-M417 HydrophobicContact CG-CB 4.03Å; F393-M417 HydrophobicContact CZ-CB 3.26Å; F393-M417 HydrophobicContact CZ-CG 3.67Å; W415-M417 PolarHBondContact O-N 2.9Å
418	P	98.4	Very high	97.3	Very high	41 Å²	41	50.3 Å²	50.3	27%	0.266	23%	0.234	S	C	.	.			trans	-72.3	142.4	-178.3	30.2	-36	0	0	0	112.2	F393 F420 Y423	F393-P418 WeakPolarHBondContact CD1-O 3.46Å; F393-P418 WeakPolarHBondContact CE1-O 3.09Å; P418-F420 HydrophobicContact CB-CD1 4.35Å; P418-F420 HydrophobicContact CB-CD2 3.89Å; P418-F420 HydrophobicContact CB-CE1 3.97Å; P418-F420 HydrophobicContact CB-CE2 3.47Å; P418-F420 VanDerWaalsContact CB-CE2 3.47Å; P418-F420 HydrophobicContact CB-CG 4.32Å; P418-F420 HydrophobicContact CB-CZ 3.51Å; P418-F420 HydrophobicContact CG-CE2 4.36Å; P418-Y423 HydrophobicContact CB-CE2 3.98Å; P418-Y423 HydrophobicContact CG-CE2 3.97Å; P418-Y423 VanDerWaalsContact CG-OH 3.3Å; P418-Y423 WeakPolarHBondContact CG-OH 3.4Å; P418-Y423 WeakPolarHBondContact O-CE2 3.44Å
419	L	98	Very high	97.3	Very high	38 Å²	38	49.4 Å²	49.4	20%	0.199	23%	0.234	C	C	.	.			trans	-126	53.4	176.8	-171.9	71.5	0	0	0	110	F393 N395 A452 W464	F393-L419 HydrophobicContact CB-CD1 4.44Å; N395-L419 HydrophobicContact CB-CD2 4.34Å; L419-A452 HydrophobicContact CD1-CB 4.03Å; L419-W464 HydrophobicContact CD1-CZ3 4.25Å; L419-W464 HydrophobicContact CD2-CE3 4.32Å; L419-W464 HydrophobicContact CD2-CZ3 3.67Å
420	F	98.2	Very high	97.2	Very high	133 Å²	133	53.4 Å²	53.4	58%	0.583	26%	0.263	S	S	*	.			trans	-75.4	151.2	-178.3	-53	-37.2	0	0	0	111.7	P418 H422 Y423	P418-F420 HydrophobicContact CB-CD1 4.35Å; P418-F420 HydrophobicContact CB-CD2 3.89Å; P418-F420 HydrophobicContact CB-CE1 3.97Å; P418-F420 HydrophobicContact CB-CE2 3.47Å; P418-F420 VanDerWaalsContact CB-CE2 3.47Å; P418-F420 HydrophobicContact CB-CG 4.32Å; P418-F420 HydrophobicContact CB-CZ 3.51Å; P418-F420 HydrophobicContact CG-CE2 4.36Å; F420-H422 HydrophobicContact CB-CB 4.3Å; F420-H422 PolarHBondContact O-N 3.29Å; F420-Y423 HydrophobicContact CB-CD2 4.19Å; F420-Y423 HydrophobicContact CB-CE2 4.08Å; F420-Y423 AromaticContact CD2-CE2 3.98Å; F420-Y423 HydrophobicContact CD2-CE2 3.98Å; F420-Y423 HydrophobicContact CG-CE2 4.23Å; F420-Y423 WeakPolarHBondContact O-CD2 3.3Å; F420-Y423 PolarHBondContact O-N 3.35Å
421	K	97.7	Very high	96.9	Very high	157 Å²	157	57.2 Å²	57.2	68%	0.683	29%	0.29	S	S	*	.	H	α-helix	trans	-51.8	-30	172.7	-176.4	177.5	176.7	-176	0	112.9	Y423 S424 E425	K421-Y423 PolarHBondContact O-N 2.95Å; K421-Y423 VanDerWaalsContact O-N 3.14Å; K421-S424 WeakPolarHBondContact O-CB 3.46Å; K421-S424 PolarHBondContact O-N 3.25Å; K421-E425 WeakPolarHBondContact CE-OE1 3.35Å; K421-E425 IonicContact NZ-OE1 3.36Å; K421-E425 PolarHBondContact O-N 2.91Å
422	H	97.8	Very high	97.1	Very high	102 Å²	102	57.4 Å²	57.4	47%	0.472	29%	0.29	S	S	.	.	H	α-helix	trans	-47.4	-39.9	172.6	174.2	70.2	0	0	0	113	F420 E425 C426 F442	F420-H422 HydrophobicContact CB-CB 4.3Å; F420-H422 PolarHBondContact O-N 3.29Å; H422-E425 WeakPolarHBondContact O-CB 3.37Å; H422-E425 PolarHBondContact O-N 3.39Å; H422-C426 PolarHBondContact O-N 2.95Å; H422-C426 PolarHBondContact O-SG 3.35Å; H422-F442 AromaticContact CE1-CE1 3.93Å
423	Y	98.5	Very high	97.2	Very high	28 Å²	28	61.8 Å²	61.8	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-72.9	-32.4	-178.8	-56.8	-55.8	0	0	0	113.2	P418 F420 K421 E425 C426 A446 C449 T450	P418-Y423 HydrophobicContact CB-CE2 3.98Å; P418-Y423 HydrophobicContact CG-CE2 3.97Å; P418-Y423 VanDerWaalsContact CG-OH 3.3Å; P418-Y423 WeakPolarHBondContact CG-OH 3.4Å; P418-Y423 WeakPolarHBondContact O-CE2 3.44Å; F420-Y423 HydrophobicContact CB-CD2 4.19Å; F420-Y423 HydrophobicContact CB-CE2 4.08Å; F420-Y423 AromaticContact CD2-CE2 3.98Å; F420-Y423 HydrophobicContact CD2-CE2 3.98Å; F420-Y423 HydrophobicContact CG-CE2 4.23Å; F420-Y423 WeakPolarHBondContact O-CD2 3.3Å; F420-Y423 PolarHBondContact O-N 3.35Å; K421-Y423 PolarHBondContact O-N 2.95Å; K421-Y423 VanDerWaalsContact O-N 3.14Å; Y423-E425 VanDerWaalsContact C-N 3.32Å; Y423-C426 WeakPolarHBondContact O-CB 3.26Å; Y423-C426 PolarHBondContact O-N 3.15Å; Y423-A446 HydrophobicContact CD1-CB 4.18Å; Y423-A446 HydrophobicContact CE1-CB 3.75Å; Y423-C449 HydrophobicContact CD1-CB 3.58Å; Y423-C449 HydrophobicContact CD2-CB 3.68Å; Y423-C449 HydrophobicContact CE1-CB 3.49Å; Y423-C449 VanDerWaalsContact CE1-CB 3.49Å; Y423-C449 HydrophobicContact CE2-CB 3.6Å; Y423-C449 HydrophobicContact CG-CB 3.68Å; Y423-T450 HydrophobicContact CD1-CG2 4.11Å
424	S	97.8	Very high	97.3	Very high	27 Å²	27	59 Å²	59	19%	0.189	30%	0.304	C	S	.	.	H	α-helix	trans	-63.8	-38.6	170	-62.1	0	0	0	0	111.2	K421 C426 I427 E457	K421-S424 WeakPolarHBondContact O-CB 3.46Å; K421-S424 PolarHBondContact O-N 3.25Å; S424-C426 PolarHBondContact O-N 2.88Å; S424-I427 WeakPolarHBondContact O-CG1 3.48Å; S424-I427 PolarHBondContact O-N 3Å; S424-E457 PolarHBondContact OG-OE1 2.72Å
425	E	97.5	Very high	97.3	Very high	86 Å²	86	59.2 Å²	59.2	40%	0.402	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-26.3	175.4	-59.4	-63.6	161.9	0	0	112.6	K421 H422 Y423 I427 T428 K439	K421-E425 WeakPolarHBondContact CE-OE1 3.35Å; K421-E425 IonicContact NZ-OE1 3.36Å; K421-E425 PolarHBondContact O-N 2.91Å; H422-E425 WeakPolarHBondContact O-CB 3.37Å; H422-E425 PolarHBondContact O-N 3.39Å; Y423-E425 VanDerWaalsContact C-N 3.32Å; E425-I427 VanDerWaalsContact C-N 3.3Å; E425-I427 PolarHBondContact O-N 3Å; E425-T428 PolarHBondContact O-OG1 3Å; E425-K439 VanDerWaalsContact O-CE 3.24Å; E425-K439 WeakPolarHBondContact O-CE 3.49Å; E425-K439 PolarHBondContact O-NZ 2.81Å
426	C	98.1	Very high	97.3	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-73.4	-19.7	178.5	-69	0	0	0	0	113.6	H422 Y423 S424 N438 K439 F442 T450	H422-C426 PolarHBondContact O-N 2.95Å; H422-C426 PolarHBondContact O-SG 3.35Å; Y423-C426 WeakPolarHBondContact O-CB 3.26Å; Y423-C426 PolarHBondContact O-N 3.15Å; S424-C426 PolarHBondContact O-N 2.88Å; C426-N438 WeakPolarHBondContact O-CA 3.22Å; C426-K439 WeakPolarHBondContact O-CG 3.31Å; C426-K439 PolarHBondContact O-N 2.98Å; C426-F442 HydrophobicContact CB-CB 4.35Å; C426-F442 HydrophobicContact CB-CD2 4.13Å; C426-F442 HydrophobicContact CB-CG 4.22Å; C426-T450 HydrophobicContact CB-CG2 3.8Å
427	I	97.8	Very high	97.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	7.2	-176	61.6	165	0	0	0	113.4	S424 E425 V434 C435 T450 A453 F454 E457	S424-I427 WeakPolarHBondContact O-CG1 3.48Å; S424-I427 PolarHBondContact O-N 3Å; E425-I427 VanDerWaalsContact C-N 3.3Å; E425-I427 PolarHBondContact O-N 3Å; I427-V434 HydrophobicContact CD1-CG1 4.31Å; I427-V434 CarbonylContact O-C 3.51Å; I427-V434 WeakPolarHBondContact O-CA 3Å; I427-C435 PolarHBondContact O-N 3Å; I427-T450 HydrophobicContact CG2-CG2 4.42Å; I427-A453 HydrophobicContact CD1-CB 4.49Å; I427-F454 VanDerWaalsContact CD1-CA 3.45Å; I427-F454 HydrophobicContact CD1-CB 3.83Å; I427-F454 HydrophobicContact CD1-CD2 4.27Å; I427-E457 HydrophobicContact CD1-CG 4.28Å
428	T	97.1	Very high	97.1	Very high	48 Å²	48	50.2 Å²	50.2	29%	0.294	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-61.5	139	173.5	60	0	0	0	0	110.8	E425 K439	E425-T428 PolarHBondContact O-OG1 3Å; T428-K439 WeakPolarHBondContact OG1-CD 3.27Å; T428-K439 PolarHBondContact OG1-NZ 2.76Å; T428-K439 VanDerWaalsContact OG1-NZ 3.09Å
429	S	95.7	Very high	96.9	Very high	25 Å²	25	51.3 Å²	51.3	18%	0.175	28%	0.275	C	S	.	.			trans	-105.6	156.6	175.2	169.8	0	0	0	0	111.7	E344 S431 A432	E344-S429 WeakPolarHBondContact OE2-CB 3.45Å; E344-S429 PolarHBondContact OE2-OG 3.33Å; S429-S431 PolarHBondContact OG-N 2.64Å; S429-A432 CarbonylContact C-O 3.56Å; S429-A432 VanDerWaalsContact CB-O 3.27Å; S429-A432 WeakPolarHBondContact CB-O 3.29Å; S429-A432 PolarHBondContact OG-N 2.87Å
430	S	91.9	Very high	96.5	Very high	121 Å²	121	54.8 Å²	54.8	85%	0.846	30%	0.302	S	S	*	.	S	Bend	trans	-83.3	-21.2	167.9	53.5	0	0	0	0	113.1
431	S	90.7	Very high	96.3	Very high	83 Å²	83	52.5 Å²	52.5	58%	0.58	30%	0.303	S	S	*	.	S	Bend	trans	-108.3	-20.7	-171.3	-52.6	0	0	0	0	112.5	S429	S429-S431 PolarHBondContact OG-N 2.64Å
432	A	97.6	Very high	96.1	Very high	13 Å²	13	47.7 Å²	47.7	11%	0.107	28%	0.282	C	S	.	.	S	Bend	trans	-142.7	177.4	-179	0	0	0	0	0	110	V334 S342 E344 S429	V334-A432 HydrophobicContact CG1-CB 4.08Å; V334-A432 HydrophobicContact CG2-CB 4.43Å; S342-A432 WeakPolarHBondContact OG-CA 3.31Å; E344-A432 HydrophobicContact CB-CB 4.03Å; S429-A432 CarbonylContact C-O 3.56Å; S429-A432 VanDerWaalsContact CB-O 3.27Å; S429-A432 WeakPolarHBondContact CB-O 3.29Å; S429-A432 PolarHBondContact OG-N 2.87Å
433	D	98.4	Very high	95.9	Very high	94 Å²	94	50.5 Å²	50.5	50%	0.503	29%	0.293	S	S	.	.	S	Bend	trans	-67.2	-42.7	177.4	-58.8	-56.5	0	0	0	110.8	K341 S342	K341-D433 HydrophobicContact CG-CB 3.79Å; S342-D433 PolarHBondContact N-OD2 2.75Å; S342-D433 PolarHBondContact O-N 3.41Å; S342-D433 PolarHBondContact OG-N 2.83Å; S342-D433 PolarHBondContact OG-OD2 3.44Å
434	V	98.4	Very high	95.5	Very high	8 Å²	8	53 Å²	53	5%	0.048	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	156.9	176.6	-63.3	0	0	0	0	112.4	K341 S342 I343 E344 I427 F454 E457 F458	K341-V434 HydrophobicContact CD-CG1 4.45Å; K341-V434 HydrophobicContact CD-CG2 4.39Å; S342-V434 PolarHBondContact O-N 2.95Å; I343-V434 CarbonylContact C-O 3.55Å; I343-V434 WeakPolarHBondContact CA-O 3.26Å; I343-V434 HydrophobicContact CG1-CG2 3.9Å; E344-V434 PolarHBondContact N-O 3.13Å; I427-V434 HydrophobicContact CD1-CG1 4.31Å; I427-V434 CarbonylContact O-C 3.51Å; I427-V434 WeakPolarHBondContact O-CA 3Å; V434-F454 HydrophobicContact CB-CE2 4.49Å; V434-F454 HydrophobicContact CG2-CD2 4.18Å; V434-F454 HydrophobicContact CG2-CE2 3.75Å; V434-E457 HydrophobicContact CG1-CG 4.25Å; V434-F458 HydrophobicContact CG2-CZ 4.06Å
435	C	98.4	Very high	95.4	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.041	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.6	168.1	-174.1	0	0	0	0	108.9	E344 D346 I427 T437 F454	E344-C435 WeakPolarHBondContact O-CA 3.13Å; D346-C435 WeakPolarHBondContact CB-SG 3.49Å; I427-C435 PolarHBondContact O-N 3Å; C435-T437 WeakPolarHBondContact CB-O 3.41Å; C435-T437 PolarHBondContact O-N 2.8Å; C435-F454 WeakPolarHBondContact O-CD2 3.35Å
436	N	98	Very high	95.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-70.8	-11.4	176.6	77.7	-28.2	0	0	0	113.2	I343 E344 D346 N347 A350 R353 L354 F454	I343-N436 HydrophobicContact CG2-CB 4.21Å; E344-N436 PolarHBondContact O-N 3.42Å; E344-N436 PolarHBondContact O-OD1 3.3Å; D346-N436 PolarHBondContact N-OD1 2.95Å; N347-N436 PolarHBondContact N-OD1 3.43Å; N347-N436 PolarHBondContact O-ND2 2.95Å; A350-N436 PolarHBondContact O-ND2 2.76Å; A350-N436 VanDerWaalsContact O-ND2 3.12Å; R353-N436 WeakPolarHBondContact CD-O 3.43Å; R353-N436 PolarHBondContact NH1-O 2.97Å; L354-N436 HydrophobicContact CD2-CB 3.92Å; N436-F454 HydrophobicContact CB-CE2 4.04Å; N436-F454 HydrophobicContact CB-CZ 4.33Å
437	T	97.4	Very high	95.4	Very high	22 Å²	22	56.3 Å²	56.3	14%	0.135	36%	0.355	C	S	.	.	S	Bend	trans	-121.7	-177.1	170.7	67.4	0	0	0	0	111.3	D346 N347 A350 C435	D346-T437 HydrophobicContact CB-CG2 4.48Å; D346-T437 WeakPolarHBondContact CB-OG1 3.28Å; D346-T437 PolarHBondContact OD2-OG1 3.21Å; N347-T437 HydrophobicContact CB-CG2 3.5Å; N347-T437 VanDerWaalsContact CB-CG2 3.5Å; A350-T437 HydrophobicContact CB-CG2 4Å; C435-T437 WeakPolarHBondContact CB-O 3.41Å; C435-T437 PolarHBondContact O-N 2.8Å
438	N	96.1	Very high	95.4	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.102	36%	0.356	C	S	.	.			trans	-70.4	139.9	173.4	-66	11.5	0	0	0	110.4	C426 F442 M445 T450	C426-N438 WeakPolarHBondContact O-CA 3.22Å; N438-F442 HydrophobicContact CB-CB 4.11Å; N438-F442 PolarHBondContact ND2-O 2.84Å; N438-M445 PolarHBondContact ND2-O 3.01Å; N438-T450 WeakPolarHBondContact OD1-CB 3.48Å; N438-T450 WeakPolarHBondContact OD1-CG2 3.14Å; N438-T450 PolarHBondContact OD1-OG1 3.38Å
439	K	94	Very high	95.5	Very high	65 Å²	65	54.6 Å²	54.6	28%	0.283	35%	0.345	S	S	.	.			trans	-57.7	154.5	166.3	73.3	-170.1	176.6	-165.2	0	110.9	E425 C426 T428 S441 F442 K443	E425-K439 VanDerWaalsContact O-CE 3.24Å; E425-K439 WeakPolarHBondContact O-CE 3.49Å; E425-K439 PolarHBondContact O-NZ 2.81Å; C426-K439 WeakPolarHBondContact O-CG 3.31Å; C426-K439 PolarHBondContact O-N 2.98Å; T428-K439 WeakPolarHBondContact OG1-CD 3.27Å; T428-K439 PolarHBondContact OG1-NZ 2.76Å; T428-K439 VanDerWaalsContact OG1-NZ 3.09Å; K439-S441 PolarHBondContact O-N 2.79Å; K439-F442 HydrophobicContact CD-CD2 4.36Å; K439-F442 VanDerWaalsContact CE-CE2 3.42Å; K439-F442 HydrophobicContact CG-CD2 3.9Å; K439-F442 PolarHBondContact O-N 3.47Å; K439-K443 PolarHBondContact O-N 2.78Å
440	S	90.5	Very high	95.6	Very high	110 Å²	110	53.5 Å²	53.5	77%	0.769	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-48	-38	-170.2	-171.6	0	0	0	0	114.7	F442 K443	S440-F442 PolarHBondContact O-N 2.82Å; S440-K443 WeakPolarHBondContact O-CB 3.5Å; S440-K443 PolarHBondContact O-N 3.29Å
441	S	93.5	Very high	96	Very high	85 Å²	85	47.7 Å²	47.7	59%	0.594	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-65.8	-17.6	179.5	63.3	0	0	0	0	115.1	K439	K439-S441 PolarHBondContact O-N 2.79Å
442	F	93.8	Very high	96.4	Very high	57 Å²	57	43.8 Å²	43.8	25%	0.25	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-119.4	15.6	179.9	-64	-76.7	0	0	0	112.4	H422 C426 N438 K439 S440 G444 M445	H422-F442 AromaticContact CE1-CE1 3.93Å; C426-F442 HydrophobicContact CB-CB 4.35Å; C426-F442 HydrophobicContact CB-CD2 4.13Å; C426-F442 HydrophobicContact CB-CG 4.22Å; N438-F442 HydrophobicContact CB-CB 4.11Å; N438-F442 PolarHBondContact ND2-O 2.84Å; K439-F442 HydrophobicContact CD-CD2 4.36Å; K439-F442 VanDerWaalsContact CE-CE2 3.42Å; K439-F442 HydrophobicContact CG-CD2 3.9Å; K439-F442 PolarHBondContact O-N 3.47Å; S440-F442 PolarHBondContact O-N 2.82Å; F442-G444 PolarHBondContact O-N 3.01Å; F442-M445 WeakPolarHBondContact O-CB 3.45Å; F442-M445 PolarHBondContact O-N 3.22Å; F442-M445 VanDerWaalsContact O-N 3.11Å
443	K	92.6	Very high	96.4	Very high	160 Å²	160	43.1 Å²	43.1	70%	0.696	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	129.9	-173.8	-172.3	169.5	-175.9	166.7	0	111.6	K439 S440 M445	K439-K443 PolarHBondContact O-N 2.78Å; S440-K443 WeakPolarHBondContact O-CB 3.5Å; S440-K443 PolarHBondContact O-N 3.29Å; K443-M445 VanDerWaalsContact C-N 3.3Å; K443-M445 PolarHBondContact O-N 2.54Å
444	G	89.7	Confident	96.4	Very high	81 Å²	81	38.7 Å²	38.7	84%	0.835	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.9	3.9	178.4	0	0	0	0	0	115.8	F442	F442-G444 PolarHBondContact O-N 3.01Å
445	M	96.9	Very high	96.5	Very high	114 Å²	114	38.3 Å²	38.3	56%	0.562	24%	0.238	S	C	*	.	S	Bend	trans	-101.4	142.4	-178.2	-56.8	-177	-178	0	0	112	N438 F442 K443 G447	N438-M445 PolarHBondContact ND2-O 3.01Å; F442-M445 WeakPolarHBondContact O-CB 3.45Å; F442-M445 PolarHBondContact O-N 3.22Å; F442-M445 VanDerWaalsContact O-N 3.11Å; K443-M445 VanDerWaalsContact C-N 3.3Å; K443-M445 PolarHBondContact O-N 2.54Å; M445-G447 PolarHBondContact O-N 3.19Å
446	A	97.3	Very high	96.5	Very high	46 Å²	46	40.9 Å²	40.9	38%	0.38	25%	0.249	S	C	.	.	S	Bend	trans	50	35.2	169.6	0	0	0	0	0	116	Y423 S448 C449 T450	Y423-A446 HydrophobicContact CD1-CB 4.18Å; Y423-A446 HydrophobicContact CE1-CB 3.75Å; A446-S448 VanDerWaalsContact C-N 3.28Å; A446-S448 PolarHBondContact O-N 2.91Å; A446-S448 VanDerWaalsContact O-N 3.09Å; A446-C449 HydrophobicContact CB-CB 4.26Å; A446-C449 WeakPolarHBondContact O-CA 3.47Å; A446-C449 WeakPolarHBondContact O-CB 3.38Å; A446-C449 PolarHBondContact O-N 2.93Å; A446-T450 PolarHBondContact O-N 3.36Å; A446-T450 PolarHBondContact O-OG1 3.14Å
447	G	97.6	Very high	96.5	Very high	25 Å²	25	43.6 Å²	43.6	26%	0.258	26%	0.262	S	S	.	.	H	α-helix	trans	-54.6	-34.7	-167.9	0	0	0	0	0	115.7	M445 T450 A451	M445-G447 PolarHBondContact O-N 3.19Å; G447-T450 PolarHBondContact O-OG1 3.38Å; G447-A451 VanDerWaalsContact O-CB 3.27Å; G447-A451 WeakPolarHBondContact O-CB 3.32Å; G447-A451 PolarHBondContact O-N 3.45Å; G447-A451 VanDerWaalsContact O-N 3.08Å
448	S	98.5	Very high	96.6	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.028	26%	0.256	C	S	.	.	H	α-helix	trans	-71.3	-39.2	174.8	-47	0	0	0	0	112.5	T378 A380 I381 F393 A446 A451 A452	T378-S448 WeakPolarHBondContact OG1-CB 3.34Å; T378-S448 PolarHBondContact OG1-OG 3.21Å; A380-S448 VanDerWaalsContact CB-OG 3.29Å; A380-S448 WeakPolarHBondContact CB-OG 3.44Å; I381-S448 WeakPolarHBondContact CA-OG 3.42Å; I381-S448 PolarHBondContact N-OG 3.04Å; F393-S448 WeakPolarHBondContact CZ-O 3.35Å; A446-S448 VanDerWaalsContact C-N 3.28Å; A446-S448 PolarHBondContact O-N 2.91Å; A446-S448 VanDerWaalsContact O-N 3.09Å; S448-A451 PolarHBondContact O-N 2.89Å; S448-A452 PolarHBondContact O-N 3.32Å
449	C	98.8	Very high	96.7	Very high	9 Å²	9	42.2 Å²	42.2	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-71.1	-38.2	-179.5	-55.7	0	0	0	0	111.6	F393 Y423 A446 A452 A453	F393-C449 VanDerWaalsContact CE1-CA 3.5Å; F393-C449 HydrophobicContact CE1-CB 4.03Å; Y423-C449 HydrophobicContact CD1-CB 3.58Å; Y423-C449 HydrophobicContact CD2-CB 3.68Å; Y423-C449 HydrophobicContact CE1-CB 3.49Å; Y423-C449 VanDerWaalsContact CE1-CB 3.49Å; Y423-C449 HydrophobicContact CE2-CB 3.6Å; Y423-C449 HydrophobicContact CG-CB 3.68Å; A446-C449 HydrophobicContact CB-CB 4.26Å; A446-C449 WeakPolarHBondContact O-CA 3.47Å; A446-C449 WeakPolarHBondContact O-CB 3.38Å; A446-C449 PolarHBondContact O-N 2.93Å; C449-A452 PolarHBondContact O-N 3.45Å; C449-A453 WeakPolarHBondContact O-CB 3.28Å; C449-A453 PolarHBondContact O-N 3.26Å
450	T	98.6	Very high	96.9	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-74.1	-31.6	176.6	57.8	0	0	0	0	112.4	Y423 C426 I427 N438 A446 G447 A453 F454	Y423-T450 HydrophobicContact CD1-CG2 4.11Å; C426-T450 HydrophobicContact CB-CG2 3.8Å; I427-T450 HydrophobicContact CG2-CG2 4.42Å; N438-T450 WeakPolarHBondContact OD1-CB 3.48Å; N438-T450 WeakPolarHBondContact OD1-CG2 3.14Å; N438-T450 PolarHBondContact OD1-OG1 3.38Å; A446-T450 PolarHBondContact O-N 3.36Å; A446-T450 PolarHBondContact O-OG1 3.14Å; G447-T450 PolarHBondContact O-OG1 3.38Å; T450-A453 PolarHBondContact O-N 2.84Å; T450-F454 WeakPolarHBondContact O-CB 3.35Å; T450-F454 PolarHBondContact O-N 3.43Å
451	A	98.8	Very high	97.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-44.9	169	0	0	0	0	0	112.2	R353 L377 T378 G447 S448 F454 L455	R353-A451 VanDerWaalsContact CZ-CB 3.45Å; L377-A451 HydrophobicContact CD2-CB 3.74Å; L377-A451 HydrophobicContact CG-CB 4.35Å; T378-A451 HydrophobicContact CG2-CB 3.46Å; T378-A451 VanDerWaalsContact CG2-CB 3.46Å; G447-A451 VanDerWaalsContact O-CB 3.27Å; G447-A451 WeakPolarHBondContact O-CB 3.32Å; G447-A451 PolarHBondContact O-N 3.45Å; G447-A451 VanDerWaalsContact O-N 3.08Å; S448-A451 PolarHBondContact O-N 2.89Å; A451-F454 WeakPolarHBondContact O-CB 3.49Å; A451-F454 PolarHBondContact O-N 3.1Å; A451-L455 PolarHBondContact O-N 3.03Å
452	A	98.9	Very high	97.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-41.2	175	0	0	0	0	0	112	F393 L419 S448 C449 F454 L455 H456 W464	F393-A452 HydrophobicContact CB-CB 3.69Å; F393-A452 HydrophobicContact CD1-CB 3.42Å; F393-A452 VanDerWaalsContact CD1-CB 3.42Å; F393-A452 HydrophobicContact CD2-CB 3.71Å; F393-A452 HydrophobicContact CE1-CB 3.9Å; F393-A452 HydrophobicContact CE2-CB 4.15Å; F393-A452 HydrophobicContact CG-CB 3.31Å; F393-A452 HydrophobicContact CZ-CB 4.24Å; L419-A452 HydrophobicContact CD1-CB 4.03Å; S448-A452 PolarHBondContact O-N 3.32Å; C449-A452 PolarHBondContact O-N 3.45Å; A452-F454 VanDerWaalsContact C-N 3.3Å; A452-F454 PolarHBondContact O-N 3.45Å; A452-L455 PolarHBondContact O-N 3.09Å; A452-H456 PolarHBondContact O-N 2.81Å; A452-W464 WeakPolarHBondContact O-CH2 3.44Å
453	A	98.7	Very high	97.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-40.8	174	0	0	0	0	0	111.7	I427 C449 T450 H456 E457	I427-A453 HydrophobicContact CD1-CB 4.49Å; C449-A453 WeakPolarHBondContact O-CB 3.28Å; C449-A453 PolarHBondContact O-N 3.26Å; T450-A453 PolarHBondContact O-N 2.84Å; A453-H456 WeakPolarHBondContact O-CB 3.34Å; A453-H456 PolarHBondContact O-N 2.83Å; A453-E457 PolarHBondContact O-N 2.8Å
454	F	98.8	Very high	97.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-49.2	173.3	-180	-82.1	0	0	0	111.3	I343 R353 L354 A357 I427 V434 C435 N436 T450 A451 A452 H456 E457 F458	I343-F454 HydrophobicContact CD1-CZ 3.9Å; I343-F454 HydrophobicContact CG1-CE2 4.27Å; I343-F454 HydrophobicContact CG1-CZ 4.04Å; I343-F454 HydrophobicContact CG2-CE2 3.84Å; I343-F454 HydrophobicContact CG2-CZ 3.91Å; R353-F454 HydrophobicContact CB-CD1 3.66Å; R353-F454 HydrophobicContact CB-CE1 3.9Å; R353-F454 HydrophobicContact CG-CD1 3.66Å; R353-F454 HydrophobicContact CG-CE1 3.67Å; R353-F454 HydrophobicContact CG-CG 4.31Å; R353-F454 HydrophobicContact CG-CZ 4.33Å; R353-F454 WeakPolarHBondContact O-CE1 3.36Å; L354-F454 HydrophobicContact CD2-CE1 4.47Å; L354-F454 HydrophobicContact CD2-CZ 3.89Å; A357-F454 HydrophobicContact CB-CE1 4.2Å; I427-F454 VanDerWaalsContact CD1-CA 3.45Å; I427-F454 HydrophobicContact CD1-CB 3.83Å; I427-F454 HydrophobicContact CD1-CD2 4.27Å; V434-F454 HydrophobicContact CB-CE2 4.49Å; V434-F454 HydrophobicContact CG2-CD2 4.18Å; V434-F454 HydrophobicContact CG2-CE2 3.75Å; C435-F454 WeakPolarHBondContact O-CD2 3.35Å; N436-F454 HydrophobicContact CB-CE2 4.04Å; N436-F454 HydrophobicContact CB-CZ 4.33Å; T450-F454 WeakPolarHBondContact O-CB 3.35Å; T450-F454 PolarHBondContact O-N 3.43Å; A451-F454 WeakPolarHBondContact O-CB 3.49Å; A451-F454 PolarHBondContact O-N 3.1Å; A452-F454 VanDerWaalsContact C-N 3.3Å; A452-F454 PolarHBondContact O-N 3.45Å; F454-H456 VanDerWaalsContact C-N 3.3Å; F454-H456 PolarHBondContact O-N 2.96Å; F454-E457 VanDerWaalsContact O-CB 3.3Å; F454-E457 WeakPolarHBondContact O-CB 3.26Å; F454-E457 PolarHBondContact O-N 3.36Å; F454-E457 VanDerWaalsContact O-N 3.12Å; F454-F458 HydrophobicContact CD1-CD2 4.19Å; F454-F458 AromaticContact CD1-CE2 3.77Å; F454-F458 HydrophobicContact CD1-CE2 3.77Å; F454-F458 HydrophobicContact CD2-CE2 4.27Å; F454-F458 AromaticContact CE1-CD2 3.96Å; F454-F458 HydrophobicContact CE1-CD2 3.96Å; F454-F458 AromaticContact CE1-CE2 3.37Å; F454-F458 HydrophobicContact CE1-CE2 3.37Å; F454-F458 HydrophobicContact CE1-CZ 4.2Å; F454-F458 AromaticContact CE2-CE2 3.92Å; F454-F458 HydrophobicContact CE2-CE2 3.92Å; F454-F458 HydrophobicContact CE2-CZ 4.29Å; F454-F458 HydrophobicContact CG-CE2 4.21Å; F454-F458 HydrophobicContact CZ-CD2 4.45Å; F454-F458 AromaticContact CZ-CE2 3.46Å; F454-F458 HydrophobicContact CZ-CE2 3.46Å; F454-F458 VanDerWaalsContact CZ-CE2 3.46Å; F454-F458 AromaticContact CZ-CZ 3.87Å; F454-F458 HydrophobicContact CZ-CZ 3.87Å; F454-F458 WeakPolarHBondContact O-CD2 3.43Å; F454-F458 VanDerWaalsContact O-CE2 3.26Å; F454-F458 WeakPolarHBondContact O-CE2 3.21Å
455	L	98.9	Very high	98.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-39.2	178.2	-68.1	178.2	0	0	0	112.7	R353 L356 L360 L377 A451 A452 E457 F458 W464 H466	R353-L455 HydrophobicContact CB-CD2 3.91Å; R353-L455 HydrophobicContact CB-CG 4.44Å; L356-L455 HydrophobicContact CB-CD2 3.56Å; L356-L455 HydrophobicContact CD1-CD1 4.18Å; L356-L455 HydrophobicContact CD1-CD2 3.98Å; L356-L455 HydrophobicContact CG-CD2 4.45Å; L360-L455 HydrophobicContact CD1-CB 3.94Å; L360-L455 HydrophobicContact CD1-CD2 3.92Å; L360-L455 HydrophobicContact CD1-CG 4.45Å; L377-L455 HydrophobicContact CD2-CD1 3.68Å; L377-L455 HydrophobicContact CD2-CG 4.4Å; A451-L455 PolarHBondContact O-N 3.03Å; A452-L455 PolarHBondContact O-N 3.09Å; L455-E457 PolarHBondContact O-N 3.26Å; L455-F458 PolarHBondContact O-N 2.96Å; L455-W464 HydrophobicContact CB-CH2 4.21Å; L455-W464 HydrophobicContact CB-CZ2 3.74Å; L455-H466 HydrophobicContact CD1-CB 4.31Å; L455-H466 WeakPolarHBondContact CD1-ND1 3.35Å
456	H	98.6	Very high	98.5	Very high	60 Å²	60	25.5 Å²	25.5	28%	0.278	15%	0.147	S	C	.	.	H	α-helix	trans	-60.7	-25.5	178	-166.5	-172.2	0	0	0	112.7	N395 A452 A453 F454 F458 W464	N395-H456 PolarHBondContact ND2-NE2 3.47Å; A452-H456 PolarHBondContact O-N 2.81Å; A453-H456 WeakPolarHBondContact O-CB 3.34Å; A453-H456 PolarHBondContact O-N 2.83Å; F454-H456 VanDerWaalsContact C-N 3.3Å; F454-H456 PolarHBondContact O-N 2.96Å; H456-F458 PolarHBondContact O-N 2.83Å; H456-W464 HydrophobicContact CB-CE3 4.27Å; H456-W464 HydrophobicContact CB-CH2 3.86Å; H456-W464 HydrophobicContact CB-CZ3 3.62Å; H456-W464 AromaticContact CG-CZ3 3.79Å
457	E	98.4	Very high	98.5	Very high	57 Å²	57	23.3 Å²	23.3	27%	0.266	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-12	175.7	-65.4	-61.6	146.5	0	0	113.8	N339 K341 S424 I427 V434 A453 F454 L455	N339-E457 PolarHBondContact ND2-O 3.37Å; K341-E457 HydrophobicContact CD-CB 4.15Å; K341-E457 PolarHBondContact NZ-O 3.12Å; K341-E457 IonicContact NZ-OE2 3.47Å; K341-E457 PolarHBondContact NZ-OE2 2.8Å; S424-E457 PolarHBondContact OG-OE1 2.72Å; I427-E457 HydrophobicContact CD1-CG 4.28Å; V434-E457 HydrophobicContact CG1-CG 4.25Å; A453-E457 PolarHBondContact O-N 2.8Å; F454-E457 VanDerWaalsContact O-CB 3.3Å; F454-E457 WeakPolarHBondContact O-CB 3.26Å; F454-E457 PolarHBondContact O-N 3.36Å; F454-E457 VanDerWaalsContact O-N 3.12Å; L455-E457 PolarHBondContact O-N 3.26Å
458	F	98.8	Very high	98.6	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.009	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	11.3	-174.5	-58.1	-79.3	0	0	0	113.9	A337 K341 I343 A357 L360 C361 V434 F454 L455 H456	A337-F458 HydrophobicContact CB-CD1 3.74Å; A337-F458 HydrophobicContact CB-CE1 3.46Å; A337-F458 VanDerWaalsContact CB-CE1 3.46Å; K341-F458 HydrophobicContact CB-CE1 4.03Å; K341-F458 HydrophobicContact CD-CE1 4.05Å; K341-F458 HydrophobicContact CD-CZ 4.08Å; K341-F458 HydrophobicContact CG-CE1 4.29Å; K341-F458 HydrophobicContact CG-CZ 4.49Å; I343-F458 HydrophobicContact CD1-CE1 3.87Å; I343-F458 HydrophobicContact CD1-CE2 4.44Å; I343-F458 HydrophobicContact CD1-CZ 3.56Å; I343-F458 HydrophobicContact CG1-CE1 4.21Å; I343-F458 HydrophobicContact CG1-CZ 3.66Å; A357-F458 HydrophobicContact CB-CB 4.05Å; A357-F458 HydrophobicContact CB-CD1 3.78Å; A357-F458 HydrophobicContact CB-CD2 3.56Å; A357-F458 HydrophobicContact CB-CE1 4.14Å; A357-F458 HydrophobicContact CB-CE2 3.96Å; A357-F458 HydrophobicContact CB-CG 3.49Å; A357-F458 VanDerWaalsContact CB-CG 3.49Å; A357-F458 HydrophobicContact CB-CZ 4.24Å; A357-F458 WeakPolarHBondContact O-CB 3.49Å; L360-F458 CarbonylContact C-O 3.55Å; L360-F458 VanDerWaalsContact C-O 3.3Å; L360-F458 HydrophobicContact CB-CB 4.33Å; L360-F458 WeakPolarHBondContact CB-O 3.44Å; C361-F458 PolarHBondContact N-O 3.12Å; C361-F458 VanDerWaalsContact N-O 3.14Å; C361-F458 PolarHBondContact SG-O 3.1Å; V434-F458 HydrophobicContact CG2-CZ 4.06Å; F454-F458 HydrophobicContact CD1-CD2 4.19Å; F454-F458 AromaticContact CD1-CE2 3.77Å; F454-F458 HydrophobicContact CD1-CE2 3.77Å; F454-F458 HydrophobicContact CD2-CE2 4.27Å; F454-F458 AromaticContact CE1-CD2 3.96Å; F454-F458 HydrophobicContact CE1-CD2 3.96Å; F454-F458 AromaticContact CE1-CE2 3.37Å; F454-F458 HydrophobicContact CE1-CE2 3.37Å; F454-F458 HydrophobicContact CE1-CZ 4.2Å; F454-F458 AromaticContact CE2-CE2 3.92Å; F454-F458 HydrophobicContact CE2-CE2 3.92Å; F454-F458 HydrophobicContact CE2-CZ 4.29Å; F454-F458 HydrophobicContact CG-CE2 4.21Å; F454-F458 HydrophobicContact CZ-CD2 4.45Å; F454-F458 AromaticContact CZ-CE2 3.46Å; F454-F458 HydrophobicContact CZ-CE2 3.46Å; F454-F458 VanDerWaalsContact CZ-CE2 3.46Å; F454-F458 AromaticContact CZ-CZ 3.87Å; F454-F458 HydrophobicContact CZ-CZ 3.87Å; F454-F458 WeakPolarHBondContact O-CD2 3.43Å; F454-F458 VanDerWaalsContact O-CE2 3.26Å; F454-F458 WeakPolarHBondContact O-CE2 3.21Å; L455-F458 PolarHBondContact O-N 2.96Å; H456-F458 PolarHBondContact O-N 2.83Å
459	T	98.5	Very high	98.6	Very high	10 Å²	10	22 Å²	22	6%	0.061	12%	0.116	C	C	.	.			trans	-134.4	140.7	168	-175.8	0	0	0	0	111.1	D364 C461 W464	D364-T459 PolarHBondContact OD1-OG1 3.02Å; D364-T459 VanDerWaalsContact OD2-CA 3.26Å; D364-T459 WeakPolarHBondContact OD2-CA 3.43Å; T459-C461 WeakPolarHBondContact OG1-CB 3.39Å; T459-C461 PolarHBondContact OG1-N 2.7Å; T459-W464 HydrophobicContact CG2-CB 4.08Å; T459-W464 HydrophobicContact CG2-CD2 3.84Å; T459-W464 HydrophobicContact CG2-CG 3.59Å
460	Q	97.8	Very high	98.6	Very high	173 Å²	173	23 Å²	23	81%	0.808	12%	0.124	S	C	*	.			trans	-102.4	-1.1	173.8	-59.1	-174	-4	0	0	111.6	D364 T462	D364-Q460 PolarHBondContact OD1-N 3.26Å; D364-Q460 PolarHBondContact OD2-N 3.23Å; Q460-T462 PolarHBondContact O-N 3.27Å
461	C	98.4	Very high	98.5	Very high	12 Å²	12	23.4 Å²	23.4	8%	0.081	13%	0.129	C	C	.	.			trans	-64.3	122.5	179.3	-170.9	0	0	0	0	110.5	D364 V371 N395 T459 S463 W464	D364-C461 PolarHBondContact OD1-N 2.92Å; V371-C461 HydrophobicContact CB-CB 4.27Å; V371-C461 HydrophobicContact CG2-CB 3.65Å; N395-C461 PolarHBondContact ND2-O 3.35Å; N395-C461 VanDerWaalsContact ND2-O 3.11Å; T459-C461 WeakPolarHBondContact OG1-CB 3.39Å; T459-C461 PolarHBondContact OG1-N 2.7Å; C461-S463 PolarHBondContact O-N 3.06Å; C461-W464 HydrophobicContact CB-CB 4.47Å
462	T	97.5	Very high	98.4	Very high	125 Å²	125	23.4 Å²	23.4	77%	0.767	13%	0.129	S	C	*	.	S	Bend	trans	-72.1	-7.3	177.8	58.1	0	0	0	0	113.2	N395 Q460	N395-T462 PolarHBondContact OD1-O 3.26Å; Q460-T462 PolarHBondContact O-N 3.27Å
463	S	98.4	Very high	98.3	Very high	12 Å²	12	24 Å²	24	8%	0.084	13%	0.132	C	C	.	.	S	Bend	trans	-126.1	69.4	175.5	-169.9	0	0	0	0	109.6	S369 S370 V371 C396 C461	S369-S463 WeakPolarHBondContact O-CB 3.27Å; S370-S463 CarbonylContact C-O 3.3Å; S370-S463 WeakPolarHBondContact CA-O 3.47Å; S370-S463 WeakPolarHBondContact CB-O 3.4Å; S370-S463 WeakPolarHBondContact OG-CB 3.11Å; S370-S463 PolarHBondContact OG-OG 3.37Å; V371-S463 PolarHBondContact N-O 3.13Å; C396-S463 PolarHBondContact SG-OG 3.49Å; C396-S463 VanDerWaalsContact SG-OG 3.39Å; C461-S463 PolarHBondContact O-N 3.06Å
464	W	98.8	Very high	98.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.9	-178.1	169.2	70.9	0	0	0	112	V371 D373 S394 N395 L419 A452 L455 H456 T459 C461 H466	V371-W464 CarbonylContact O-C 3.21Å; V371-W464 VanDerWaalsContact O-CA 3.29Å; V371-W464 WeakPolarHBondContact O-CA 3.35Å; D373-W464 PolarHBondContact OD1-NE1 3.11Å; S394-W464 WeakPolarHBondContact CA-O 3.5Å; S394-W464 WeakPolarHBondContact CB-O 2.99Å; S394-W464 PolarHBondContact OG-O 3.46Å; N395-W464 PolarHBondContact N-O 3.37Å; N395-W464 PolarHBondContact OD1-N 3.41Å; N395-W464 PolarHBondContact OD1-O 2.85Å; L419-W464 HydrophobicContact CD1-CZ3 4.25Å; L419-W464 HydrophobicContact CD2-CE3 4.32Å; L419-W464 HydrophobicContact CD2-CZ3 3.67Å; A452-W464 WeakPolarHBondContact O-CH2 3.44Å; L455-W464 HydrophobicContact CB-CH2 4.21Å; L455-W464 HydrophobicContact CB-CZ2 3.74Å; H456-W464 HydrophobicContact CB-CE3 4.27Å; H456-W464 HydrophobicContact CB-CH2 3.86Å; H456-W464 HydrophobicContact CB-CZ3 3.62Å; H456-W464 AromaticContact CG-CZ3 3.79Å; T459-W464 HydrophobicContact CG2-CB 4.08Å; T459-W464 HydrophobicContact CG2-CD2 3.84Å; T459-W464 HydrophobicContact CG2-CG 3.59Å; C461-W464 HydrophobicContact CB-CB 4.47Å; W464-H466 HydrophobicContact CH2-CB 3.91Å; W464-H466 HydrophobicContact CZ2-CB 3.51Å
465	M	98.9	Very high	97.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	130.7	175.1	178.7	176.9	-73.5	0	0	111.2	V371 I372 D373 V392 F393 L399 W400 M403 M467	V371-M465 PolarHBondContact O-N 2.89Å; I372-M465 CarbonylContact C-O 3.45Å; I372-M465 WeakPolarHBondContact CA-O 3.35Å; I372-M465 HydrophobicContact CG1-CB 4.47Å; D373-M465 PolarHBondContact N-O 2.82Å; V392-M465 HydrophobicContact CG1-CE 3.61Å; V392-M465 HydrophobicContact CG1-CG 3.6Å; V392-M465 HydrophobicContact CG1-SD 3.55Å; V392-M465 VanDerWaalsContact CG1-SD 3.55Å; F393-M465 CarbonylContact O-C 3.51Å; F393-M465 VanDerWaalsContact O-CA 3.29Å; F393-M465 WeakPolarHBondContact O-CA 3.44Å; L399-M465 HydrophobicContact CB-CE 4.4Å; L399-M465 HydrophobicContact CD2-CB 3.62Å; L399-M465 HydrophobicContact CD2-CE 4.43Å; L399-M465 HydrophobicContact CG-CB 4.23Å; L399-M465 HydrophobicContact CG-CE 3.8Å; W400-M465 HydrophobicContact CB-CE 4.39Å; M403-M465 HydrophobicContact CB-CE 3.75Å; M403-M465 HydrophobicContact CB-SD 3.89Å; M403-M465 HydrophobicContact CE-SD 3.64Å; M403-M465 HydrophobicContact CG-CE 4.26Å; M403-M465 HydrophobicContact CG-SD 3.79Å; M465-M467 HydrophobicContact CG-CG 4.25Å; M465-M467 HydrophobicContact SD-CG 4.26Å
466	H	98.9	Very high	97.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.9	165.6	169	56.7	0	0	0	110.5	D373 L377 V392 F393 L455 W464	D373-H466 WeakPolarHBondContact OD1-CA 3.4Å; D373-H466 IonicContact OD1-ND1 2.76Å; D373-H466 IonicContact OD2-CE1 3.78Å; D373-H466 IonicContact OD2-CG 3.19Å; D373-H466 IonicContact OD2-ND1 2.79Å; D373-H466 PolarHBondContact OD2-ND1 2.87Å; L377-H466 VanDerWaalsContact CD2-CE1 3.45Å; L377-H466 WeakPolarHBondContact CD2-CE1 3.34Å; L377-H466 WeakPolarHBondContact CD2-NE2 3.31Å; V392-H466 WeakPolarHBondContact CA-O 3.39Å; F393-H466 HydrophobicContact CB-CB 4.34Å; F393-H466 AromaticContact CD2-CD2 3.61Å; F393-H466 PolarHBondContact N-O 2.86Å; F393-H466 PolarHBondContact O-N 3.05Å; L455-H466 HydrophobicContact CD1-CB 4.31Å; L455-H466 WeakPolarHBondContact CD1-ND1 3.35Å; W464-H466 HydrophobicContact CH2-CB 3.91Å; W464-H466 HydrophobicContact CZ2-CB 3.51Å
467	M	98.9	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	103.7	173.5	-56.9	-175.4	80.6	0	0	109.9	I372 D373 I374 A375 T390 G391 V392 M403 V414 M465 I469 P490 L494	I372-M467 HydrophobicContact CG2-CG 4.11Å; I372-M467 HydrophobicContact CG2-SD 3.84Å; D373-M467 PolarHBondContact O-N 3.47Å; I374-M467 HydrophobicContact CG1-CB 4.28Å; I374-M467 HydrophobicContact CG1-CG 4.44Å; I374-M467 HydrophobicContact CG1-SD 3.99Å; I374-M467 HydrophobicContact CG2-CB 4.41Å; A375-M467 PolarHBondContact N-O 3.37Å; T390-M467 HydrophobicContact CG2-CB 3.93Å; T390-M467 HydrophobicContact CG2-CE 4.13Å; G391-M467 CarbonylContact O-C 3.54Å; V392-M467 HydrophobicContact CG2-CE 4.45Å; V392-M467 HydrophobicContact CG2-CG 4.31Å; M403-M467 HydrophobicContact CE-CE 3.97Å; M403-M467 HydrophobicContact CE-SD 3.64Å; M403-M467 HydrophobicContact CG-CE 4.14Å; M403-M467 HydrophobicContact SD-CE 3.63Å; M403-M467 HydrophobicContact SD-SD 4.14Å; V414-M467 HydrophobicContact CG1-CE 4.15Å; M465-M467 HydrophobicContact CG-CG 4.25Å; M465-M467 HydrophobicContact SD-CG 4.26Å; M467-I469 HydrophobicContact CB-CG2 4.27Å; M467-I469 PolarHBondContact O-N 2.92Å; M467-P490 HydrophobicContact CE-CB 4.26Å; M467-P490 HydrophobicContact CE-CG 3.53Å; M467-P490 HydrophobicContact SD-CG 4.42Å; M467-L494 HydrophobicContact SD-CD1 4.44Å
468	D	98.9	Very high	96.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	104.6	172.3	-162.8	-17.2	0	0	0	110.1	A375 L377 T378 I381 G391 A470	A375-D468 WeakPolarHBondContact O-CA 3.37Å; L377-D468 PolarHBondContact N-OD1 2.91Å; L377-D468 VanDerWaalsContact N-OD1 3.12Å; T378-D468 WeakPolarHBondContact CB-OD2 3.4Å; T378-D468 PolarHBondContact N-OD1 3.17Å; T378-D468 PolarHBondContact N-OD2 2.71Å; T378-D468 PolarHBondContact OG1-OD2 2.81Å; I381-D468 HydrophobicContact CB-CB 4.21Å; I381-D468 WeakPolarHBondContact CB-OD2 3.35Å; I381-D468 HydrophobicContact CG1-CB 4.21Å; I381-D468 HydrophobicContact CG2-CB 4.01Å; I381-D468 VanDerWaalsContact CG2-OD1 3.31Å; I381-D468 WeakPolarHBondContact CG2-OD1 3.49Å; I381-D468 WeakPolarHBondContact CG2-OD2 3.31Å; G391-D468 PolarHBondContact N-O 2.95Å; G391-D468 PolarHBondContact O-N 3.12Å; D468-A470 WeakPolarHBondContact OD1-CB 3.26Å; D468-A470 PolarHBondContact OD1-N 3.32Å
469	I	98.8	Very high	95.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.222	C	C	.	.			trans	-101.1	3.1	-171.3	63.2	158.5	0	0	0	112.6	T290 I374 A375 T376 T390 M467 G471 V472 M473 P490	T290-I469 HydrophobicContact CG2-CD1 3.62Å; I374-I469 HydrophobicContact CG2-CD1 3.88Å; I374-I469 HydrophobicContact CG2-CG1 4.18Å; I374-I469 HydrophobicContact CG2-CG2 3.83Å; A375-I469 VanDerWaalsContact C-CG1 3.45Å; A375-I469 VanDerWaalsContact O-CG1 3.27Å; A375-I469 WeakPolarHBondContact O-CG1 3.3Å; A375-I469 PolarHBondContact O-N 2.87Å; T376-I469 HydrophobicContact CG2-CD1 4.06Å; T376-I469 HydrophobicContact CG2-CG1 3.91Å; T390-I469 HydrophobicContact CG2-CG2 3.56Å; M467-I469 HydrophobicContact CB-CG2 4.27Å; M467-I469 PolarHBondContact O-N 2.92Å; I469-G471 VanDerWaalsContact C-N 3.25Å; I469-G471 PolarHBondContact O-N 2.75Å; I469-V472 HydrophobicContact CB-CG2 3.99Å; I469-V472 VanDerWaalsContact O-CG2 3.27Å; I469-V472 WeakPolarHBondContact O-CG2 3.4Å; I469-V472 PolarHBondContact O-N 3.16Å; I469-M473 PolarHBondContact O-N 3.47Å; I469-P490 HydrophobicContact CG2-CG 3.83Å
470	A	98.2	Very high	94.9	Very high	29 Å²	29	45.1 Å²	45.1	24%	0.24	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-57.1	-38.6	-175.1	0	0	0	0	0	112.7	T378 I381 D468 V472	T378-A470 WeakPolarHBondContact O-CB 3.15Å; I381-A470 HydrophobicContact CG2-CB 3.96Å; D468-A470 WeakPolarHBondContact OD1-CB 3.26Å; D468-A470 PolarHBondContact OD1-N 3.32Å; A470-V472 VanDerWaalsContact C-N 3.3Å; A470-V472 PolarHBondContact O-N 3.29Å
471	G	96.8	Very high	94.4	Very high	10 Å²	10	37.3 Å²	37.3	10%	0.103	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-65.9	-28.6	178.1	0	0	0	0	0	114.3	G386 C387 I469	G386-G471 CarbonylContact O-C 3.5Å; G386-G471 WeakPolarHBondContact O-CA 3.48Å; C387-G471 WeakPolarHBondContact CA-O 3.09Å; C387-G471 VanDerWaalsContact CB-O 3.23Å; C387-G471 WeakPolarHBondContact CB-O 3.19Å; I469-G471 VanDerWaalsContact C-N 3.25Å; I469-G471 PolarHBondContact O-N 2.75Å
472	V	97.3	Very high	94	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-104.3	-2.3	-175.7	-59	0	0	0	0	113.8	T390 I469 A470 T487 R489	T390-V472 WeakPolarHBondContact OG1-CG2 3.42Å; I469-V472 HydrophobicContact CB-CG2 3.99Å; I469-V472 VanDerWaalsContact O-CG2 3.27Å; I469-V472 WeakPolarHBondContact O-CG2 3.4Å; I469-V472 PolarHBondContact O-N 3.16Å; A470-V472 VanDerWaalsContact C-N 3.3Å; A470-V472 PolarHBondContact O-N 3.29Å; V472-T487 WeakPolarHBondContact O-CG2 3.41Å; V472-T487 PolarHBondContact O-OG1 3.45Å; V472-R489 HydrophobicContact CB-CB 4.31Å; V472-R489 HydrophobicContact CG2-CB 3.97Å
473	M	96.3	Very high	93.4	Very high	13 Å²	13	32.8 Å²	32.8	6%	0.064	18%	0.176	C	C	.	.	S	Bend	trans	-58.9	-50.9	-176.7	179	-175.2	76	0	0	112.3	A287 T376 I469 M486 T487	A287-M473 HydrophobicContact CB-CE 4.2Å; A287-M473 HydrophobicContact CB-CG 4.14Å; A287-M473 HydrophobicContact CB-SD 3.56Å; A287-M473 VanDerWaalsContact CB-SD 3.56Å; T376-M473 HydrophobicContact CG2-CB 4.26Å; T376-M473 HydrophobicContact CG2-CG 4.08Å; T376-M473 HydrophobicContact CG2-SD 3.49Å; T376-M473 WeakPolarHBondContact CG2-SD 3.28Å; I469-M473 PolarHBondContact O-N 3.47Å; M473-M486 HydrophobicContact CE-SD 4.49Å; M473-M486 HydrophobicContact CG-SD 3.87Å; M473-M486 WeakPolarHBondContact O-CA 3.34Å; M473-T487 PolarHBondContact O-N 3.04Å; M473-T487 PolarHBondContact O-OG1 3.16Å
474	E	95.3	Very high	92.9	Very high	44 Å²	44	32.9 Å²	32.9	21%	0.206	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-92.5	144	-177.3	-66.3	-178.5	173.8	0	0	112.4	S284 K476 D485 M486	S284-E474 WeakPolarHBondContact CB-OE1 2.85Å; S284-E474 PolarHBondContact OG-OE1 3.05Å; E474-K476 IonicContact OE2-NZ 2.82Å; E474-K476 PolarHBondContact OE2-NZ 2.97Å; E474-D485 CarbonylContact C-O 3.55Å; E474-D485 WeakPolarHBondContact CA-O 2.84Å; E474-M486 HydrophobicContact CG-CE 4.19Å; E474-M486 HydrophobicContact CG-SD 4.05Å
475	K	94	Very high	92.7	Very high	76 Å²	76	37.6 Å²	37.6	33%	0.33	20%	0.202	S	C	.	.			trans	-61.1	138.5	168.4	174.7	-172.1	174.4	174.3	0	110.5	Q479 F482 S484 D485 T487	K475-Q479 WeakPolarHBondContact CE-O 3.34Å; K475-F482 HydrophobicContact CB-CB 4.31Å; K475-F482 HydrophobicContact CD-CB 4.18Å; K475-F482 WeakPolarHBondContact CD-O 3.45Å; K475-F482 WeakPolarHBondContact CE-O 3.38Å; K475-F482 HydrophobicContact CG-CB 4.13Å; K475-F482 PolarHBondContact NZ-O 3.08Å; K475-S484 WeakPolarHBondContact CD-O 3.34Å; K475-D485 WeakPolarHBondContact CB-O 3.38Å; K475-D485 PolarHBondContact N-O 3.33Å; K475-T487 HydrophobicContact CB-CG2 4.37Å
476	K	92.2	Very high	92.6	Very high	74 Å²	74	37.6 Å²	37.6	32%	0.322	20%	0.202	S	C	.	.			trans	-113.8	161.4	167.1	-58.3	-56.7	171.8	-162.7	0	112.4	C387 E474 D478 Q479	C387-K476 HydrophobicContact CB-CG 3.85Å; C387-K476 VanDerWaalsContact SG-CG 3.53Å; E474-K476 IonicContact OE2-NZ 2.82Å; E474-K476 PolarHBondContact OE2-NZ 2.97Å; K476-D478 VanDerWaalsContact C-N 3.27Å; K476-D478 PolarHBondContact O-N 2.97Å; K476-Q479 WeakPolarHBondContact O-CB 3.26Å; K476-Q479 PolarHBondContact O-N 3.35Å
477	P	86.8	Confident	92.5	Very high	127 Å²	127	37.6 Å²	37.6	83%	0.825	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.4	-169.1	-28.6	37	0	0	0	116.2	Q479	P477-Q479 VanDerWaalsContact C-N 3.3Å
478	D	83.6	Confident	92.5	Very high	120 Å²	120	37.7 Å²	37.7	64%	0.642	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.9	177.6	61.8	-35.5	0	0	0	113.3	K476 Q480	K476-D478 VanDerWaalsContact C-N 3.27Å; K476-D478 PolarHBondContact O-N 2.97Å; D478-Q480 PolarHBondContact O-N 3.04Å
479	Q	87.5	Confident	92.4	Very high	26 Å²	26	38.4 Å²	38.4	12%	0.121	21%	0.205	C	C	.	.			trans	-92.2	75.7	-177.1	-60.9	172.7	-20.4	0	0	111.8	K475 K476 P477 M481 F482	K475-Q479 WeakPolarHBondContact CE-O 3.34Å; K476-Q479 WeakPolarHBondContact O-CB 3.26Å; K476-Q479 PolarHBondContact O-N 3.35Å; P477-Q479 VanDerWaalsContact C-N 3.3Å; Q479-M481 PolarHBondContact O-N 3.17Å; Q479-F482 HydrophobicContact CB-CD2 3.91Å; Q479-F482 HydrophobicContact CB-CE2 4.45Å; Q479-F482 PolarHBondContact O-N 3.47Å
480	Q	79.4	Confident	92.4	Very high	106 Å²	106	38.4 Å²	38.4	50%	0.495	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.4	-175.1	-60	-177.1	17.4	0	0	114	D478 F482	D478-Q480 PolarHBondContact O-N 3.04Å; Q480-F482 VanDerWaalsContact C-N 3.26Å; Q480-F482 PolarHBondContact O-N 2.98Å
481	M	88.7	Confident	92.4	Very high	9 Å²	9	37 Å²	37	4%	0.044	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.1	-179.2	-175.6	172.7	63.6	0	0	113.2	R95 S99 L130 Q479	R95-M481 HydrophobicContact CB-SD 4.01Å; S99-M481 WeakPolarHBondContact OG-CA 3.43Å; L130-M481 HydrophobicContact CB-CG 3.9Å; L130-M481 HydrophobicContact CB-SD 4.16Å; L130-M481 HydrophobicContact CD1-CE 3.78Å; L130-M481 HydrophobicContact CD1-CG 4.34Å; L130-M481 HydrophobicContact CD1-SD 3.56Å; L130-M481 VanDerWaalsContact CD1-SD 3.56Å; Q479-M481 PolarHBondContact O-N 3.17Å
482	F	88.2	Confident	92.5	Very high	11 Å²	11	36.8 Å²	36.8	5%	0.048	19%	0.19	C	C	.	.			trans	-91.9	131.4	177.8	-52.2	-58	0	0	0	109.4	Q177 K475 Q479 Q480 T487 R489	Q177-F482 VanDerWaalsContact NE2-CE1 3.32Å; K475-F482 HydrophobicContact CB-CB 4.31Å; K475-F482 HydrophobicContact CD-CB 4.18Å; K475-F482 WeakPolarHBondContact CD-O 3.45Å; K475-F482 WeakPolarHBondContact CE-O 3.38Å; K475-F482 HydrophobicContact CG-CB 4.13Å; K475-F482 PolarHBondContact NZ-O 3.08Å; Q479-F482 HydrophobicContact CB-CD2 3.91Å; Q479-F482 HydrophobicContact CB-CE2 4.45Å; Q479-F482 PolarHBondContact O-N 3.47Å; Q480-F482 VanDerWaalsContact C-N 3.26Å; Q480-F482 PolarHBondContact O-N 2.98Å; F482-T487 HydrophobicContact CD2-CG2 3.75Å; F482-T487 HydrophobicContact CE2-CG2 4.06Å; F482-T487 HydrophobicContact CG-CG2 4.19Å; F482-R489 HydrophobicContact CZ-CG 4.18Å
483	N	86.1	Confident	92.6	Very high	31 Å²	31	36.8 Å²	36.8	17%	0.166	19%	0.19	C	C	.	.			trans	-129.2	22.1	-174.5	65.6	-4.3	0	0	0	112.7	R106 G131 F133 R181	R106-N483 PolarHBondContact NH2-ND2 3.35Å; G131-N483 PolarHBondContact O-ND2 3.32Å; F133-N483 PolarHBondContact O-ND2 2.9Å; F133-N483 PolarHBondContact O-OD1 2.79Å; R181-N483 VanDerWaalsContact NH2-N 3.14Å; R181-N483 PolarHBondContact NH2-OD1 3.22Å
484	S	88.3	Confident	92.7	Very high	13 Å²	13	36.2 Å²	36.2	9%	0.091	19%	0.187	C	C	.	.	S	Bend	trans	-130	179.9	166	63.5	0	0	0	0	108.8	F133 R181 D185 K475 M486	F133-S484 WeakPolarHBondContact CE1-OG 3.06Å; R181-S484 PolarHBondContact NE-OG 3.24Å; R181-S484 PolarHBondContact NH2-OG 3.07Å; D185-S484 WeakPolarHBondContact OD2-CB 3.36Å; D185-S484 PolarHBondContact OD2-OG 3.43Å; K475-S484 WeakPolarHBondContact CD-O 3.34Å; S484-M486 PolarHBondContact OG-O 3.31Å
485	D	93.8	Very high	92.8	Very high	99 Å²	99	34.1 Å²	34.1	53%	0.529	18%	0.177	S	C	.	.	S	Bend	trans	-74.2	-33.5	-176.8	-60.3	-19.1	0	0	0	111.1	D185 R286 E474 K475	D185-D485 WeakPolarHBondContact OD1-CB 3.34Å; D185-D485 PolarHBondContact OD1-N 2.99Å; R286-D485 IonicContact NH2-OD2 3.21Å; R286-D485 PolarHBondContact NH2-OD2 3.43Å; E474-D485 CarbonylContact C-O 3.55Å; E474-D485 WeakPolarHBondContact CA-O 2.84Å; K475-D485 WeakPolarHBondContact CB-O 3.38Å; K475-D485 PolarHBondContact N-O 3.33Å
486	M	96.6	Very high	93	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-101.2	144.6	-177.8	-56.2	-58.5	158.7	0	0	112.7	R181 A184 D185 A287 M473 E474 S484	R181-M486 WeakPolarHBondContact CG-O 3.42Å; R181-M486 PolarHBondContact NE-O 3.5Å; A184-M486 HydrophobicContact CB-CB 3.77Å; A184-M486 HydrophobicContact CB-CG 3.71Å; D185-M486 PolarHBondContact OD1-N 3.35Å; A287-M486 HydrophobicContact CB-CE 3.59Å; A287-M486 HydrophobicContact CB-CG 4.17Å; A287-M486 HydrophobicContact CB-SD 3.56Å; A287-M486 VanDerWaalsContact CB-SD 3.56Å; M473-M486 HydrophobicContact CE-SD 4.49Å; M473-M486 HydrophobicContact CG-SD 3.87Å; M473-M486 WeakPolarHBondContact O-CA 3.34Å; E474-M486 HydrophobicContact CG-CE 4.19Å; E474-M486 HydrophobicContact CG-SD 4.05Å; S484-M486 PolarHBondContact OG-O 3.31Å
487	T	97.4	Very high	93.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.			trans	-91.7	-25.6	-176.5	70.7	0	0	0	0	113.4	Q177 R181 V472 M473 K475 F482 R489	Q177-T487 PolarHBondContact NE2-O 2.81Å; R181-T487 WeakPolarHBondContact CD-O 3.26Å; R181-T487 VanDerWaalsContact CG-O 3.31Å; R181-T487 WeakPolarHBondContact CG-O 3.16Å; V472-T487 WeakPolarHBondContact O-CG2 3.41Å; V472-T487 PolarHBondContact O-OG1 3.45Å; M473-T487 PolarHBondContact O-N 3.04Å; M473-T487 PolarHBondContact O-OG1 3.16Å; K475-T487 HydrophobicContact CB-CG2 4.37Å; F482-T487 HydrophobicContact CD2-CG2 3.75Å; F482-T487 HydrophobicContact CE2-CG2 4.06Å; F482-T487 HydrophobicContact CG-CG2 4.19Å; T487-R489 PolarHBondContact O-N 3.48Å; T487-R489 WeakPolarHBondContact OG1-CB 3.24Å; T487-R489 WeakPolarHBondContact OG1-CD 3.1Å; T487-R489 VanDerWaalsContact OG1-CG 3.26Å; T487-R489 WeakPolarHBondContact OG1-CG 3.34Å; T487-R489 PolarHBondContact OG1-N 2.9Å
488	G	97.9	Very high	93.9	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.01	11%	0.111	C	C	.	.			trans	68.4	13.4	-173.9	0	0	0	0	0	114.8	L491	G488-L491 PolarHBondContact O-N 2.96Å
489	R	98	Very high	94.5	Very high	16 Å²	16	16.6 Å²	16.6	6%	0.06	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	145.3	177	-63.5	172	63.3	-168.1	-1.9	110.2	C387 A388 D412 V472 F482 T487	C387-R489 PolarHBondContact O-NH1 2.9Å; A388-R489 PolarHBondContact O-NH2 3.35Å; D412-R489 VanDerWaalsContact CG-NE 3.3Å; D412-R489 IonicContact OD1-CZ 2.73Å; D412-R489 IonicContact OD1-NE 2.67Å; D412-R489 PolarHBondContact OD1-NE 3.01Å; D412-R489 IonicContact OD1-NH2 3.8Å; D412-R489 PolarHBondContact OD1-NH2 3.45Å; D412-R489 WeakPolarHBondContact OD2-CB 3.41Å; D412-R489 WeakPolarHBondContact OD2-CG 3.44Å; D412-R489 IonicContact OD2-NE 3.95Å; D412-R489 PolarHBondContact OD2-NE 3.21Å; V472-R489 HydrophobicContact CB-CB 4.31Å; V472-R489 HydrophobicContact CG2-CB 3.97Å; F482-R489 HydrophobicContact CZ-CG 4.18Å; T487-R489 PolarHBondContact O-N 3.48Å; T487-R489 WeakPolarHBondContact OG1-CB 3.24Å; T487-R489 WeakPolarHBondContact OG1-CD 3.1Å; T487-R489 VanDerWaalsContact OG1-CG 3.26Å; T487-R489 WeakPolarHBondContact OG1-CG 3.34Å; T487-R489 PolarHBondContact OG1-N 2.9Å
490	P	97.6	Very high	94.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	cis	-109.5	42.7	8.7	41	-34.8	0	0	0	114.3	T390 D412 M467 I469 R492 T493 L494	T390-P490 HydrophobicContact CG2-CG 4.45Å; D412-P490 WeakPolarHBondContact OD2-CA 3.26Å; M467-P490 HydrophobicContact CE-CB 4.26Å; M467-P490 HydrophobicContact CE-CG 3.53Å; M467-P490 HydrophobicContact SD-CG 4.42Å; I469-P490 HydrophobicContact CG2-CG 3.83Å; P490-R492 VanDerWaalsContact C-N 3.34Å; P490-R492 PolarHBondContact O-N 3.41Å; P490-T493 WeakPolarHBondContact O-CB 3.35Å; P490-T493 PolarHBondContact O-N 2.99Å; P490-L494 PolarHBondContact O-N 3.16Å
491	L	98.8	Very high	95.7	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-49.9	-50.4	-168.9	-175.5	81.7	0	0	0	113.9	G176 Q177 V180 C294 S297 A298 G488 T493 L494 V495	G176-L491 VanDerWaalsContact CA-CD2 3.47Å; G176-L491 VanDerWaalsContact O-CD2 3.28Å; G176-L491 WeakPolarHBondContact O-CD2 2.81Å; Q177-L491 VanDerWaalsContact CA-CD2 3.46Å; Q177-L491 HydrophobicContact CB-CB 4.42Å; Q177-L491 HydrophobicContact CB-CD2 4.17Å; V180-L491 HydrophobicContact CG2-CB 4.09Å; V180-L491 HydrophobicContact CG2-CD1 3.86Å; V180-L491 HydrophobicContact CG2-CD2 4.02Å; V180-L491 HydrophobicContact CG2-CG 4.21Å; C294-L491 WeakPolarHBondContact O-CD1 3.18Å; S297-L491 VanDerWaalsContact OG-CD2 3.3Å; S297-L491 WeakPolarHBondContact OG-CD2 3.15Å; A298-L491 HydrophobicContact CB-CD1 3.92Å; G488-L491 PolarHBondContact O-N 2.96Å; L491-T493 VanDerWaalsContact C-N 3.28Å; L491-T493 PolarHBondContact O-N 3.49Å; L491-L494 WeakPolarHBondContact O-CB 3.43Å; L491-L494 PolarHBondContact O-N 3.34Å; L491-L494 VanDerWaalsContact O-N 3.11Å; L491-V495 HydrophobicContact CD1-CG2 4.41Å; L491-V495 HydrophobicContact CG-CG2 4.25Å; L491-V495 WeakPolarHBondContact O-CG2 3.43Å; L491-V495 PolarHBondContact O-N 3.29Å
492	R	98.6	Very high	95.7	Very high	5 Å²	5	13 Å²	13	2%	0.019	7%	0.068	C	C	.	.	H	α-helix	trans	-59.6	-42	-177	-69	-169.9	-65.8	129.5	8	111.3	E126 F173 Q177 T410 P490 H496	E126-R492 VanDerWaalsContact OE1-CD 3.28Å; E126-R492 WeakPolarHBondContact OE1-CD 3.21Å; E126-R492 IonicContact OE1-CZ 2.66Å; E126-R492 IonicContact OE1-NE 2.71Å; E126-R492 IonicContact OE1-NH1 2.81Å; E126-R492 PolarHBondContact OE1-NH1 3.4Å; E126-R492 IonicContact OE2-NH1 2.79Å; E126-R492 PolarHBondContact OE2-NH1 2.78Å; F173-R492 HydrophobicContact CB-CG 4.04Å; F173-R492 HydrophobicContact CD1-CB 3.75Å; F173-R492 HydrophobicContact CD1-CG 3.78Å; F173-R492 HydrophobicContact CE1-CB 4.33Å; F173-R492 WeakPolarHBondContact CE1-O 3.46Å; F173-R492 HydrophobicContact CG-CG 4.39Å; Q177-R492 HydrophobicContact CB-CG 4.26Å; T410-R492 HydrophobicContact CG2-CB 4.02Å; T410-R492 VanDerWaalsContact O-CZ 3.22Å; T410-R492 PolarHBondContact O-NH1 2.82Å; T410-R492 PolarHBondContact O-NH2 3.41Å; P490-R492 VanDerWaalsContact C-N 3.34Å; P490-R492 PolarHBondContact O-N 3.41Å; R492-H496 WeakPolarHBondContact O-CB 3.31Å; R492-H496 PolarHBondContact O-N 3.38Å
493	T	98.7	Very high	95.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-43.2	175	-65.7	0	0	0	0	111.7	M403 A406 G407 T410 D412 V414 P490 L491 H496 C497	M403-T493 HydrophobicContact CG-CG2 4.39Å; M403-T493 HydrophobicContact SD-CG2 3.62Å; A406-T493 HydrophobicContact CB-CG2 4.02Å; A406-T493 WeakPolarHBondContact CB-O 3.42Å; G407-T493 WeakPolarHBondContact CA-OG1 3.49Å; T410-T493 PolarHBondContact OG1-OG1 2.88Å; D412-T493 WeakPolarHBondContact CB-OG1 3.37Å; D412-T493 PolarHBondContact O-OG1 3.14Å; V414-T493 HydrophobicContact CG1-CG2 4.11Å; P490-T493 WeakPolarHBondContact O-CB 3.35Å; P490-T493 PolarHBondContact O-N 2.99Å; L491-T493 VanDerWaalsContact C-N 3.28Å; L491-T493 PolarHBondContact O-N 3.49Å; T493-H496 PolarHBondContact O-N 3.35Å; T493-C497 VanDerWaalsContact O-CB 3.31Å; T493-C497 WeakPolarHBondContact O-CB 3.42Å; T493-C497 PolarHBondContact O-N 3.01Å
494	L	98.8	Very high	94.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.4	-51.5	177.6	177.6	60.7	0	0	0	111.8	L262 A298 I372 I374 M403 M467 P490 L491 H496 C497 I498	L262-L494 HydrophobicContact CD2-CD1 4.13Å; A298-L494 HydrophobicContact CB-CD2 3.84Å; A298-L494 HydrophobicContact CB-CG 4.29Å; I372-L494 HydrophobicContact CD1-CD1 4.19Å; I372-L494 HydrophobicContact CG2-CD1 4.1Å; I374-L494 HydrophobicContact CD1-CD1 4.4Å; I374-L494 HydrophobicContact CD1-CD2 3.83Å; I374-L494 HydrophobicContact CG1-CD2 4.21Å; M403-L494 HydrophobicContact CE-CD1 4.22Å; M467-L494 HydrophobicContact SD-CD1 4.44Å; P490-L494 PolarHBondContact O-N 3.16Å; L491-L494 WeakPolarHBondContact O-CB 3.43Å; L491-L494 PolarHBondContact O-N 3.34Å; L491-L494 VanDerWaalsContact O-N 3.11Å; L494-H496 VanDerWaalsContact C-N 3.34Å; L494-H496 PolarHBondContact O-N 2.9Å; L494-C497 WeakPolarHBondContact O-CB 3.23Å; L494-C497 PolarHBondContact O-N 3.47Å; L494-I498 HydrophobicContact CD1-CD1 4.18Å; L494-I498 HydrophobicContact CG-CD1 4.18Å; L494-I498 WeakPolarHBondContact O-CG1 3.47Å; L494-I498 PolarHBondContact O-N 3.45Å
495	V	98.8	Very high	92.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-46	178.8	173.4	0	0	0	0	110.7	F173 A298 T301 L302 L305 L491 C497 I498 E499	F173-V495 HydrophobicContact CE1-CB 4.34Å; F173-V495 HydrophobicContact CE1-CG1 4.25Å; F173-V495 HydrophobicContact CE2-CG1 4.08Å; F173-V495 HydrophobicContact CZ-CB 4.28Å; F173-V495 HydrophobicContact CZ-CG1 3.71Å; A298-V495 HydrophobicContact CB-CG2 4.03Å; T301-V495 HydrophobicContact CG2-CG1 4Å; T301-V495 HydrophobicContact CG2-CG2 4.02Å; L302-V495 HydrophobicContact CD2-CG1 3.88Å; L302-V495 HydrophobicContact CG-CG1 4.2Å; L305-V495 HydrophobicContact CD1-CG1 3.74Å; L491-V495 HydrophobicContact CD1-CG2 4.41Å; L491-V495 HydrophobicContact CG-CG2 4.25Å; L491-V495 WeakPolarHBondContact O-CG2 3.43Å; L491-V495 PolarHBondContact O-N 3.29Å; V495-C497 VanDerWaalsContact C-N 3.34Å; V495-C497 PolarHBondContact O-N 3.25Å; V495-I498 PolarHBondContact O-N 3.03Å; V495-E499 PolarHBondContact O-N 3.37Å; V495-E499 VanDerWaalsContact O-N 3.13Å
496	H	98.1	Very high	90	Very high	19 Å²	19	25.1 Å²	25.1	9%	0.088	14%	0.136	C	C	.	.	H	α-helix	trans	-67	-34.3	179.7	-166.7	42.6	0	0	0	113.1	R169 F173 A406 T410 R492 T493 L494 E499 K500	R169-H496 PolarHBondContact NH2-ND1 2.86Å; F173-H496 HydrophobicContact CE1-CB 4.01Å; F173-H496 HydrophobicContact CZ-CB 4.24Å; A406-H496 HydrophobicContact CB-CB 4.01Å; T410-H496 HydrophobicContact CG2-CB 4.06Å; R492-H496 WeakPolarHBondContact O-CB 3.31Å; R492-H496 PolarHBondContact O-N 3.38Å; T493-H496 PolarHBondContact O-N 3.35Å; L494-H496 VanDerWaalsContact C-N 3.34Å; L494-H496 PolarHBondContact O-N 2.9Å; H496-E499 IonicContact ND1-OE2 3.9Å; H496-E499 PolarHBondContact ND1-OE2 3.41Å; H496-E499 PolarHBondContact O-N 3.09Å; H496-K500 VanDerWaalsContact NE2-CE 3.32Å; H496-K500 WeakPolarHBondContact NE2-CE 3.41Å; H496-K500 WeakPolarHBondContact O-CG 3.39Å; H496-K500 PolarHBondContact O-N 3.01Å
497	C	98.4	Very high	87.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-44.3	173	-178.2	0	0	0	0	111.2	M403 A406 T493 L494 V495 E499 K500 L501	M403-C497 HydrophobicContact CE-CB 3.83Å; M403-C497 HydrophobicContact SD-CB 3.71Å; A406-C497 HydrophobicContact CB-CB 3.92Å; T493-C497 VanDerWaalsContact O-CB 3.31Å; T493-C497 WeakPolarHBondContact O-CB 3.42Å; T493-C497 PolarHBondContact O-N 3.01Å; L494-C497 WeakPolarHBondContact O-CB 3.23Å; L494-C497 PolarHBondContact O-N 3.47Å; V495-C497 VanDerWaalsContact C-N 3.34Å; V495-C497 PolarHBondContact O-N 3.25Å; C497-E499 PolarHBondContact O-N 3.11Å; C497-K500 WeakPolarHBondContact O-CB 3.46Å; C497-K500 PolarHBondContact O-N 3.36Å; C497-K500 VanDerWaalsContact O-N 3.12Å; C497-L501 WeakPolarHBondContact O-CG 3.33Å; C497-L501 PolarHBondContact O-N 2.82Å
498	I	98.5	Very high	84.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-43.2	179.2	-65.2	162.8	0	0	0	111	L262 L302 L309 F311 V313 L494 V495 K500 L501 A502	L262-I498 HydrophobicContact CD1-CD1 3.73Å; L262-I498 HydrophobicContact CD2-CD1 3.99Å; L262-I498 HydrophobicContact CG-CD1 4.38Å; L302-I498 HydrophobicContact CD1-CB 4.29Å; L302-I498 HydrophobicContact CD1-CD1 3.79Å; L302-I498 HydrophobicContact CD1-CG2 3.81Å; L302-I498 HydrophobicContact CD2-CB 4.46Å; L302-I498 HydrophobicContact CD2-CG2 4.18Å; L309-I498 HydrophobicContact CD1-CG2 4.33Å; F311-I498 HydrophobicContact CE2-CG2 4Å; F311-I498 HydrophobicContact CZ-CG2 4.29Å; V313-I498 HydrophobicContact CG2-CG2 4.05Å; L494-I498 HydrophobicContact CD1-CD1 4.18Å; L494-I498 HydrophobicContact CG-CD1 4.18Å; L494-I498 WeakPolarHBondContact O-CG1 3.47Å; L494-I498 PolarHBondContact O-N 3.45Å; V495-I498 PolarHBondContact O-N 3.03Å; I498-K500 VanDerWaalsContact C-N 3.33Å; I498-K500 PolarHBondContact O-N 3.21Å; I498-L501 WeakPolarHBondContact O-CB 3.49Å; I498-L501 PolarHBondContact O-N 3.34Å; I498-A502 PolarHBondContact O-N 3.19Å
499	E	96.9	Very high	81.2	Confident	11 Å²	11	43.4 Å²	43.4	5%	0.051	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-40.5	173.1	-64.9	172.7	125.8	0	0	112.1	R169 L302 N307 V495 H496 C497 L501 A502 Q503	R169-E499 IonicContact CZ-OE1 2.96Å; R169-E499 IonicContact CZ-OE2 2.71Å; R169-E499 IonicContact NH1-OE1 2.99Å; R169-E499 PolarHBondContact NH1-OE1 2.97Å; R169-E499 IonicContact NH1-OE2 3.92Å; R169-E499 IonicContact NH2-OE1 3.56Å; R169-E499 PolarHBondContact NH2-OE1 3.27Å; R169-E499 IonicContact NH2-OE2 3.1Å; R169-E499 PolarHBondContact NH2-OE2 3.42Å; L302-E499 HydrophobicContact CD2-CG 4.22Å; N307-E499 PolarHBondContact ND2-OE1 3.41Å; V495-E499 PolarHBondContact O-N 3.37Å; V495-E499 VanDerWaalsContact O-N 3.13Å; H496-E499 IonicContact ND1-OE2 3.9Å; H496-E499 PolarHBondContact ND1-OE2 3.41Å; H496-E499 PolarHBondContact O-N 3.09Å; C497-E499 PolarHBondContact O-N 3.11Å; E499-L501 VanDerWaalsContact C-N 3.27Å; E499-L501 PolarHBondContact O-N 3.2Å; E499-A502 VanDerWaalsContact O-CB 3.27Å; E499-A502 WeakPolarHBondContact O-CB 3.48Å; E499-A502 PolarHBondContact O-N 3.34Å; E499-Q503 PolarHBondContact O-N 3.28Å
500	K	95.2	Very high	78.2	Confident	37 Å²	37	53.8 Å²	53.8	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-66.7	-26.6	177.6	-78.1	-176.1	171.6	-69.4	0	113.4	K402 D405 A406 H496 C497 I498 A502 Q503	K402-K500 HydrophobicContact CD-CB 4.1Å; D405-K500 HydrophobicContact CB-CD 4.3Å; A406-K500 HydrophobicContact CB-CD 4.44Å; H496-K500 VanDerWaalsContact NE2-CE 3.32Å; H496-K500 WeakPolarHBondContact NE2-CE 3.41Å; H496-K500 WeakPolarHBondContact O-CG 3.39Å; H496-K500 PolarHBondContact O-N 3.01Å; C497-K500 WeakPolarHBondContact O-CB 3.46Å; C497-K500 PolarHBondContact O-N 3.36Å; C497-K500 VanDerWaalsContact O-N 3.12Å; I498-K500 VanDerWaalsContact C-N 3.33Å; I498-K500 PolarHBondContact O-N 3.21Å; K500-A502 PolarHBondContact O-N 3.39Å; K500-Q503 PolarHBondContact O-N 3.14Å
501	L	95.3	Very high	75.2	Confident	11 Å²	11	63.5 Å²	63.5	6%	0.058	35%	0.347	C	S	.	.	H	α-helix	trans	-66.3	-27.7	171.8	-70.7	171.7	0	0	0	111.5	V260 F311 Y398 L399 K402 C497 I498 E499	V260-L501 HydrophobicContact CG2-CD1 4.35Å; F311-L501 HydrophobicContact CE1-CB 4.13Å; F311-L501 HydrophobicContact CZ-CB 4Å; Y398-L501 HydrophobicContact CD1-CD2 4.37Å; Y398-L501 HydrophobicContact CE1-CD2 3.65Å; L399-L501 HydrophobicContact CD1-CD1 4.06Å; L399-L501 HydrophobicContact CD1-CD2 4.09Å; K402-L501 HydrophobicContact CB-CD2 4.33Å; K402-L501 HydrophobicContact CG-CD2 4Å; C497-L501 WeakPolarHBondContact O-CG 3.33Å; C497-L501 PolarHBondContact O-N 2.82Å; I498-L501 WeakPolarHBondContact O-CB 3.49Å; I498-L501 PolarHBondContact O-N 3.34Å; E499-L501 VanDerWaalsContact C-N 3.27Å; E499-L501 PolarHBondContact O-N 3.2Å
502	A	89.7	Confident	74	Confident	16 Å²	16	66.6 Å²	66.6	13%	0.132	36%	0.364	C	S	.	.	H	α-helix	trans	-73.3	-34.2	175.1	0	0	0	0	0	113.4	L309 P310 I498 E499 K500 T505	L309-A502 HydrophobicContact CD2-CB 3.93Å; P310-A502 VanDerWaalsContact CD-CB 3.41Å; P310-A502 HydrophobicContact CG-CB 4.1Å; I498-A502 PolarHBondContact O-N 3.19Å; E499-A502 VanDerWaalsContact O-CB 3.27Å; E499-A502 WeakPolarHBondContact O-CB 3.48Å; E499-A502 PolarHBondContact O-N 3.34Å; K500-A502 PolarHBondContact O-N 3.39Å; A502-T505 PolarHBondContact O-OG1 3.05Å; A502-T505 VanDerWaalsContact O-OG1 3.08Å
503	Q	81.7	Confident	72.8	Confident	120 Å²	120	69.8 Å²	69.8	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-74.7	-28.3	-166	-69.5	171.1	-4.2	0	0	116	E499 K500	E499-Q503 PolarHBondContact O-N 3.28Å; K500-Q503 PolarHBondContact O-N 3.14Å
504	N	62.2	Low	71.3	Confident	71 Å²	71	73.7 Å²	73.7	38%	0.38	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	17.2	-170.1	-86.8	31.3	0	0	0	115.2	K402 V506 T507	K402-N504 PolarHBondContact NZ-ND2 3.31Å; K402-N504 PolarHBondContact NZ-OD1 3.33Å; N504-V506 PolarHBondContact O-N 3.25Å; N504-V506 VanDerWaalsContact O-N 3.13Å; N504-T507 PolarHBondContact O-N 3.48Å; N504-T507 PolarHBondContact O-OG1 3.47Å
505	T	50.8	Low	69.7	Low	82 Å²	82	78.1 Å²	78.1	50%	0.503	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-4.8	178.6	31.1	0	0	0	0	114.7	M257 A502	M257-T505 HydrophobicContact CE-CG2 4.39Å; M257-T505 HydrophobicContact SD-CG2 3.41Å; M257-T505 WeakPolarHBondContact SD-CG2 3.25Å; A502-T505 PolarHBondContact O-OG1 3.05Å; A502-T505 VanDerWaalsContact O-OG1 3.08Å
506	V	42.2	Very low	67.9	Low	136 Å²	136	82.9 Å²	82.9	82%	0.824	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-11.9	176.1	-173.8	0	0	0	0	113	N504	N504-V506 PolarHBondContact O-N 3.25Å; N504-V506 VanDerWaalsContact O-N 3.13Å
507	T	38.4	Very low	65.9	Low	101 Å²	101	87.2 Å²	87.2	62%	0.62	48%	0.478	S	S	*	.			trans	-118.3	100	-178.5	39.3	0	0	0	0	111.5	N504 D509	N504-T507 PolarHBondContact O-N 3.48Å; N504-T507 PolarHBondContact O-OG1 3.47Å; T507-D509 PolarHBondContact O-N 2.71Å; T507-D509 VanDerWaalsContact O-N 3.11Å
508	T	33.6	Very low	63.5	Low	126 Å²	126	93.4 Å²	93.4	77%	0.773	51%	0.512	S	S	*	.			trans	-74.2	82.9	174.1	48.4	0	0	0	0	110.8
509	D	35.2	Very low	60.8	Low	160 Å²	160	100.6 Å²	100.6	86%	0.856	55%	0.552	S	S	*	*			trans	-139.4	93.7	159.6	-80	-41.9	0	0	0	107	T507	T507-D509 PolarHBondContact O-N 2.71Å; T507-D509 VanDerWaalsContact O-N 3.11Å
510	R	33.9	Very low	57.8	Low	234 Å²	234	108.1 Å²	108.1	88%	0.883	59%	0.593	S	S	*	*			trans	-92.4	127.9	178.9	-73.6	-176.3	178.4	-173.6	-0.2	109.3
511	C	35.8	Very low	54.4	Low	203 Å²	203	114.5 Å²	114.5	100%	1.372	63%	0.633	S	S	*	*			trans	71.1	0	162.5	-65.1	0	0	0	0	117.6

Retrieved 511 of 511 residues in 415.8 ms (Link to these results)

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