A0A077Z3I7_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 A0A077Z3I7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 500 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.1	Very low	60.3	Low	242 Å²	242	136.1 Å²	136.1	100%	1.192	66%	0.655	S	S	*	*				0	95.6	0	-67.3	-175.7	-155.4	0	0	106.8	K3	M1-K3 PolarHBondContact O-N 3.37Å
2	D	38.9	Very low	63.4	Low	165 Å²	165	124.8 Å²	124.8	88%	0.882	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-60.5	119.4	179	-77.5	-42.1	0	0	0	109.2
3	K	36	Very low	66.1	Low	193 Å²	193	115.2 Å²	115.2	84%	0.839	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-53.4	127.9	161.8	-78	-179.3	176.3	177.8	0	106	M1 R5	M1-K3 PolarHBondContact O-N 3.37Å; K3-R5 PolarHBondContact O-N 3.16Å
4	P	42.6	Very low	68.3	Low	120 Å²	120	106.9 Å²	106.9	78%	0.779	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-57.8	119	176.9	23.6	-30.1	0	0	0	106.2	C6	P4-C6 PolarHBondContact O-N 3.15Å
5	R	41.8	Very low	70.3	Confident	206 Å²	206	99.8 Å²	99.8	78%	0.777	48%	0.48	S	S	*	.			trans	-45.7	121.1	168.8	-78	-179	-178.8	-179.3	0.5	105.2	K3 F7	K3-R5 PolarHBondContact O-N 3.16Å; R5-F7 HydrophobicContact CB-CD2 3.88Å; R5-F7 HydrophobicContact CB-CE2 3.75Å; R5-F7 HydrophobicContact CB-CZ 4.45Å; R5-F7 WeakPolarHBondContact O-CD2 3.48Å; R5-F7 PolarHBondContact O-N 3.18Å
6	C	45.8	Very low	71.9	Confident	123 Å²	123	93.9 Å²	93.9	83%	0.831	45%	0.452	S	S	*	.			trans	-67.9	76.3	177.3	-161.7	0	0	0	0	106.4	P4 K8	P4-C6 PolarHBondContact O-N 3.15Å; C6-K8 PolarHBondContact O-N 3.08Å
7	F	57.4	Low	73.2	Confident	149 Å²	149	90.6 Å²	90.6	65%	0.654	44%	0.435	S	S	*	.			trans	-60.6	114	175.3	-83.7	-82.1	0	0	0	105.1	R5 R9	R5-F7 HydrophobicContact CB-CD2 3.88Å; R5-F7 HydrophobicContact CB-CE2 3.75Å; R5-F7 HydrophobicContact CB-CZ 4.45Å; R5-F7 WeakPolarHBondContact O-CD2 3.48Å; R5-F7 PolarHBondContact O-N 3.18Å; F7-R9 PolarHBondContact O-N 3.4Å
8	K	76.5	Confident	74.2	Confident	131 Å²	131	88.8 Å²	88.8	57%	0.57	43%	0.426	S	S	*	.			trans	-53	112.5	171.8	-122.7	-173	-180	-153	0	105.8	C6 I10 N71 E116	C6-K8 PolarHBondContact O-N 3.08Å; K8-I10 HydrophobicContact CB-CD1 4.07Å; K8-I10 HydrophobicContact CB-CG1 3.93Å; K8-I10 HydrophobicContact CD-CD1 4.18Å; K8-I10 HydrophobicContact CD-CG1 4.47Å; K8-I10 HydrophobicContact CG-CG1 4.48Å; K8-I10 PolarHBondContact O-N 2.83Å; K8-N71 PolarHBondContact O-OD1 2.98Å; K8-E116 WeakPolarHBondContact CE-OE2 3.46Å; K8-E116 IonicContact NZ-OE2 3.6Å; K8-E116 PolarHBondContact NZ-OE2 2.75Å
9	R	92.2	Very high	74.6	Confident	136 Å²	136	86.4 Å²	86.4	51%	0.513	42%	0.418	S	S	.	.			trans	-81.1	96.1	177.7	-69.8	-174.7	-178.3	-178.6	-1.1	107.7	F7 N71 G113 M114 K115 E116	F7-R9 PolarHBondContact O-N 3.4Å; R9-N71 WeakPolarHBondContact CA-OD1 3.49Å; R9-G113 WeakPolarHBondContact CD-O 3.38Å; R9-M114 HydrophobicContact CB-CE 4.07Å; R9-M114 HydrophobicContact CB-SD 4.07Å; R9-K115 PolarHBondContact O-N 2.87Å; R9-E116 PolarHBondContact O-N 2.76Å
10	I	96.2	Very high	74.4	Confident	32 Å²	32	85.1 Å²	85.1	16%	0.164	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	124.7	-174.4	-46.9	173.9	0	0	0	108.5	K8 F70 N71 E116	K8-I10 HydrophobicContact CB-CD1 4.07Å; K8-I10 HydrophobicContact CB-CG1 3.93Å; K8-I10 HydrophobicContact CD-CD1 4.18Å; K8-I10 HydrophobicContact CD-CG1 4.47Å; K8-I10 HydrophobicContact CG-CG1 4.48Å; K8-I10 PolarHBondContact O-N 2.83Å; I10-F70 HydrophobicContact CB-CD1 4.25Å; I10-F70 HydrophobicContact CG2-CD1 3.6Å; I10-F70 HydrophobicContact CG2-CE1 3.68Å; I10-F70 CarbonylContact O-C 3.55Å; I10-N71 PolarHBondContact N-OD1 3.06Å; I10-N71 PolarHBondContact O-N 3.49Å; I10-E116 CarbonylContact C-O 2.96Å; I10-E116 WeakPolarHBondContact CA-O 3.49Å; I10-E116 HydrophobicContact CG1-CB 4.34Å; I10-E116 HydrophobicContact CG2-CB 4.21Å; I10-E116 HydrophobicContact CG2-CG 4.25Å
11	G	97.4	Very high	74	Confident	0 Å²	0	91.6 Å²	91.6	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	163.6	171.5	0	0	0	0	0	112.1	A72 E116 I117 H118	G11-A72 CarbonylContact C-O 3.59Å; G11-A72 WeakPolarHBondContact CA-O 3.47Å; G11-E116 PolarHBondContact N-O 3.42Å; G11-I117 WeakPolarHBondContact O-CA 3.37Å; G11-H118 PolarHBondContact O-N 3.08Å
12	V	97.9	Very high	74.9	Confident	0 Å²	0	88.9 Å²	88.9	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	137.7	169.7	60.7	0	0	0	0	110.9	I14 F37 F70 A72 V73 G74 H118 Y158	V12-I14 HydrophobicContact CG1-CG1 4.38Å; V12-I14 HydrophobicContact CG2-CD1 3.76Å; V12-I14 HydrophobicContact CG2-CG1 4.12Å; V12-F37 HydrophobicContact CG1-CE2 3.78Å; V12-F37 HydrophobicContact CG1-CZ 4.13Å; V12-F70 HydrophobicContact CB-CD1 3.69Å; V12-F70 HydrophobicContact CB-CD2 4.21Å; V12-F70 HydrophobicContact CB-CE1 3.73Å; V12-F70 HydrophobicContact CB-CE2 4.23Å; V12-F70 HydrophobicContact CB-CG 3.94Å; V12-F70 HydrophobicContact CB-CZ 4Å; V12-F70 HydrophobicContact CG1-CB 4.02Å; V12-F70 HydrophobicContact CG1-CD1 3.89Å; V12-F70 HydrophobicContact CG1-CD2 3.74Å; V12-F70 HydrophobicContact CG1-CE1 4.31Å; V12-F70 HydrophobicContact CG1-CE2 4.16Å; V12-F70 HydrophobicContact CG1-CG 3.59Å; V12-F70 HydrophobicContact CG1-CZ 4.42Å; V12-F70 HydrophobicContact CG2-CE1 4.44Å; V12-F70 HydrophobicContact CG2-CZ 4.32Å; V12-A72 PolarHBondContact N-O 3.24Å; V12-V73 HydrophobicContact CG1-CB 4.23Å; V12-V73 HydrophobicContact CG1-CG1 4.08Å; V12-V73 HydrophobicContact CG1-CG2 3.79Å; V12-V73 CarbonylContact O-C 3.55Å; V12-V73 WeakPolarHBondContact O-CA 3.49Å; V12-G74 PolarHBondContact O-N 3.39Å; V12-H118 CarbonylContact C-O 3.54Å; V12-H118 WeakPolarHBondContact CA-O 3.33Å; V12-H118 HydrophobicContact CB-CB 4.25Å; V12-H118 HydrophobicContact CG2-CB 4Å; V12-Y158 HydrophobicContact CG2-CD2 3.86Å; V12-Y158 HydrophobicContact CG2-CE2 4.22Å; V12-Y158 HydrophobicContact CG2-CG 4.31Å
13	V	98.3	Very high	75.6	Confident	0 Å²	0	89.1 Å²	89.1	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.4	170.4	179.2	0	0	0	0	108.7	G74 V76 V106 L109 I117 H118 V119 D120	V13-G74 CarbonylContact C-O 3.53Å; V13-G74 VanDerWaalsContact CA-O 3.28Å; V13-G74 WeakPolarHBondContact CA-O 3.25Å; V13-V76 HydrophobicContact CG1-CB 4.42Å; V13-V76 HydrophobicContact CG1-CG1 3.82Å; V13-V76 HydrophobicContact CG1-CG2 3.66Å; V13-V106 HydrophobicContact CG2-CG2 3.87Å; V13-L109 HydrophobicContact CG2-CD1 3.52Å; V13-I117 HydrophobicContact CG2-CG2 4.03Å; V13-H118 PolarHBondContact N-O 3.34Å; V13-V119 HydrophobicContact CG2-CG2 4.43Å; V13-D120 WeakPolarHBondContact O-CB 3.38Å; V13-D120 PolarHBondContact O-N 3.38Å
14	I	97.7	Very high	76	Confident	0 Å²	0	87.3 Å²	87.3	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.4	179	-62.3	-62.5	0	0	0	109.9	V12 F30 F37 L45 V73 G74 V75 V76	V12-I14 HydrophobicContact CG1-CG1 4.38Å; V12-I14 HydrophobicContact CG2-CD1 3.76Å; V12-I14 HydrophobicContact CG2-CG1 4.12Å; I14-F30 HydrophobicContact CG2-CD1 4.11Å; I14-F30 HydrophobicContact CG2-CE1 4.38Å; I14-F37 HydrophobicContact CD1-CB 4.11Å; I14-F37 HydrophobicContact CD1-CD2 3.96Å; I14-F37 HydrophobicContact CD1-CG 4.05Å; I14-F37 HydrophobicContact CG1-CD2 4.36Å; I14-F37 HydrophobicContact CG1-CG 4.29Å; I14-L45 HydrophobicContact CG2-CD2 4.08Å; I14-V73 HydrophobicContact CB-CG1 4.43Å; I14-V73 HydrophobicContact CG1-CG1 4Å; I14-G74 PolarHBondContact N-O 3.06Å; I14-V75 CarbonylContact O-C 3.59Å; I14-V75 WeakPolarHBondContact O-CA 3.35Å; I14-V76 PolarHBondContact O-N 3.33Å
15	G	97.1	Very high	76.4	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	142	-179.6	0	0	0	0	0	113.8	T31 V76 D120	G15-T31 WeakPolarHBondContact O-CG2 3.18Å; G15-T31 PolarHBondContact O-N 2.95Å; G15-T31 VanDerWaalsContact O-N 3.07Å; G15-V76 WeakPolarHBondContact CA-O 3.03Å; G15-D120 PolarHBondContact N-OD2 2.72Å
16	I	96.1	Very high	77.1	Confident	6 Å²	6	83.4 Å²	83.4	3%	0.031	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.6	169	-164.7	173.6	0	0	0	109.8	V27 F30 L49 L55 V75 V76 C77 L78	I16-V27 HydrophobicContact CD1-CG1 4.44Å; I16-F30 HydrophobicContact CB-CD1 3.84Å; I16-F30 HydrophobicContact CB-CE1 4.06Å; I16-F30 HydrophobicContact CD1-CD1 4.09Å; I16-F30 HydrophobicContact CD1-CE1 3.83Å; I16-F30 HydrophobicContact CD1-CZ 4.21Å; I16-F30 HydrophobicContact CG1-CD1 3.91Å; I16-F30 HydrophobicContact CG1-CE1 4.13Å; I16-F30 HydrophobicContact CG1-CG 4.47Å; I16-L49 HydrophobicContact CD1-CD2 3.58Å; I16-L55 HydrophobicContact CG2-CD2 4.24Å; I16-V75 HydrophobicContact CB-CG1 4.24Å; I16-V75 HydrophobicContact CG2-CG1 3.77Å; I16-V76 PolarHBondContact N-O 2.66Å; I16-C77 HydrophobicContact CG2-CB 4.39Å; I16-C77 CarbonylContact O-C 3.19Å; I16-C77 VanDerWaalsContact O-CA 3.32Å; I16-C77 WeakPolarHBondContact O-CA 3.36Å; I16-L78 PolarHBondContact O-N 3.49Å
17	F	95.2	Very high	78.1	Confident	38 Å²	38	79.4 Å²	79.4	17%	0.167	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	153.8	172.9	-62.4	-75.3	0	0	0	110.7	G28 Q29 T31 L78 G79	F17-G28 CarbonylContact O-C 3.43Å; F17-G28 WeakPolarHBondContact O-CA 3.37Å; F17-Q29 WeakPolarHBondContact CD2-O 3.3Å; F17-Q29 PolarHBondContact N-O 3.34Å; F17-Q29 PolarHBondContact O-N 2.69Å; F17-T31 HydrophobicContact CE2-CG2 4.02Å; F17-T31 HydrophobicContact CZ-CG2 4.34Å; F17-L78 HydrophobicContact CD1-CB 3.74Å; F17-L78 HydrophobicContact CD1-CD1 4.2Å; F17-L78 HydrophobicContact CE1-CB 3.74Å; F17-L78 HydrophobicContact CE1-CD1 3.65Å; F17-L78 HydrophobicContact CE1-CG 4.34Å; F17-L78 HydrophobicContact CE2-CD1 4.26Å; F17-L78 HydrophobicContact CZ-CD1 3.68Å; F17-G79 CarbonylContact C-O 3.52Å; F17-G79 WeakPolarHBondContact CA-O 3.37Å
18	E	90.8	Very high	79	Confident	58 Å²	58	73 Å²	73	27%	0.271	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-58	146.8	172.1	-68.5	-178.8	167.9	0	0	111.5	S20 G79	E18-S20 PolarHBondContact O-N 2.73Å; E18-G79 PolarHBondContact N-O 3.46Å
19	P	81.6	Confident	79.6	Confident	42 Å²	42	72 Å²	72	27%	0.273	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-60.4	134.3	176.3	15.1	-18.4	0	0	0	110.7	E54	P19-E54 WeakPolarHBondContact CD-OE1 3.48Å; P19-E54 WeakPolarHBondContact CG-OE1 3.32Å
20	S	70.5	Confident	79.7	Confident	61 Å²	61	66 Å²	66	43%	0.427	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-72.3	135.6	175.2	81.5	0	0	0	0	109.4	E18 E22 R23	E18-S20 PolarHBondContact O-N 2.73Å; S20-E22 PolarHBondContact O-N 3.42Å; S20-R23 PolarHBondContact O-N 2.98Å; S20-R23 VanDerWaalsContact O-N 3.08Å; S20-R23 PolarHBondContact OG-N 3.24Å
21	K	65.7	Low	79.7	Confident	221 Å²	221	64.8 Å²	64.8	96%	0.961	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-19.4	177.3	-69.5	-173.1	176	-175.9	0	113.7
22	E	57.1	Low	79.5	Confident	186 Å²	186	68 Å²	68	87%	0.869	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-15.1	-177.4	-66.6	176.7	171.4	0	0	113.7	S20	S20-E22 PolarHBondContact O-N 3.42Å
23	R	52.8	Low	79.3	Confident	170 Å²	170	68.1 Å²	68.1	64%	0.642	36%	0.356	S	S	*	.	S	Bend	trans	-105.9	130	177	-70.8	-176.7	-178	-166.9	1.6	109	S20 A25	S20-R23 PolarHBondContact O-N 2.98Å; S20-R23 VanDerWaalsContact O-N 3.08Å; S20-R23 PolarHBondContact OG-N 3.24Å; R23-A25 PolarHBondContact O-N 3Å
24	T	46	Very low	79.2	Confident	155 Å²	155	68.1 Å²	68.1	95%	0.951	36%	0.356	S	S	*	.			trans	-64.3	13.8	174.2	49.2	0	0	0	0	114.2
25	A	50.4	Low	79	Confident	54 Å²	54	71.8 Å²	71.8	45%	0.446	37%	0.374	S	S	.	.			trans	-83.3	117.6	177.8	0	0	0	0	0	108.8	R23 V27	R23-A25 PolarHBondContact O-N 3Å; A25-V27 PolarHBondContact O-N 3.38Å
26	E	56.5	Low	78.9	Confident	189 Å²	189	75.5 Å²	75.5	88%	0.883	39%	0.387	S	S	*	.	S	Bend	trans	-63.7	-6.1	171.9	-70.3	-176.6	156.9	0	0	113
27	V	66.1	Low	78.9	Confident	39 Å²	39	75.2 Å²	75.2	24%	0.236	39%	0.386	C	S	.	.	S	Bend	trans	-123.9	138.3	-171.8	-160.7	0	0	0	0	111.3	I16 A25 L46 N50	I16-V27 HydrophobicContact CD1-CG1 4.44Å; A25-V27 PolarHBondContact O-N 3.38Å; V27-L46 HydrophobicContact CB-CD1 4.26Å; V27-L46 HydrophobicContact CG1-CD1 3.46Å; V27-L46 VanDerWaalsContact CG1-CD1 3.46Å; V27-N50 WeakPolarHBondContact CG1-OD1 3.36Å; V27-N50 WeakPolarHBondContact CG2-OD1 3.39Å
28	G	76.5	Confident	78.9	Confident	14 Å²	14	73.9 Å²	73.9	14%	0.144	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-55.5	158	174.7	0	0	0	0	0	114.4	F17	F17-G28 CarbonylContact O-C 3.43Å; F17-G28 WeakPolarHBondContact O-CA 3.37Å
29	Q	90.2	Very high	79.1	Confident	112 Å²	112	76.6 Å²	76.6	52%	0.523	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125	177.2	-176.2	179.6	-10.8	0	0	109.8	F17	F17-Q29 WeakPolarHBondContact CD2-O 3.3Å; F17-Q29 PolarHBondContact N-O 3.34Å; F17-Q29 PolarHBondContact O-N 2.69Å
30	F	94.3	Very high	79.7	Confident	8 Å²	8	79.4 Å²	79.4	4%	0.035	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	154.7	172	-71.9	-62.4	0	0	0	111.8	I14 I16 Q35 N38 L45 L46 L49 V75	I14-F30 HydrophobicContact CG2-CD1 4.11Å; I14-F30 HydrophobicContact CG2-CE1 4.38Å; I16-F30 HydrophobicContact CB-CD1 3.84Å; I16-F30 HydrophobicContact CB-CE1 4.06Å; I16-F30 HydrophobicContact CD1-CD1 4.09Å; I16-F30 HydrophobicContact CD1-CE1 3.83Å; I16-F30 HydrophobicContact CD1-CZ 4.21Å; I16-F30 HydrophobicContact CG1-CD1 3.91Å; I16-F30 HydrophobicContact CG1-CE1 4.13Å; I16-F30 HydrophobicContact CG1-CG 4.47Å; F30-Q35 HydrophobicContact CB-CB 4.28Å; F30-N38 HydrophobicContact CD2-CB 4.22Å; F30-N38 HydrophobicContact CE2-CB 4.1Å; F30-L45 HydrophobicContact CE1-CD2 3.88Å; F30-L45 HydrophobicContact CE1-CG 4.34Å; F30-L45 HydrophobicContact CE2-CD2 4.4Å; F30-L45 HydrophobicContact CZ-CD2 3.78Å; F30-L45 HydrophobicContact CZ-CG 3.87Å; F30-L46 HydrophobicContact CE2-CB 4.02Å; F30-L46 HydrophobicContact CE2-CD1 3.8Å; F30-L46 HydrophobicContact CE2-CG 4.44Å; F30-L46 HydrophobicContact CZ-CD1 4.21Å; F30-L49 HydrophobicContact CE1-CD2 4.42Å; F30-L49 HydrophobicContact CZ-CD2 4.25Å; F30-V75 HydrophobicContact CE1-CG1 4.27Å
31	T	95.1	Very high	80.9	Confident	8 Å²	8	77.2 Å²	77.2	5%	0.049	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-57.8	167.4	163.6	63.8	0	0	0	0	110.6	G15 F17 A33 G34 Q35 L78 D120 C122	G15-T31 WeakPolarHBondContact O-CG2 3.18Å; G15-T31 PolarHBondContact O-N 2.95Å; G15-T31 VanDerWaalsContact O-N 3.07Å; F17-T31 HydrophobicContact CE2-CG2 4.02Å; F17-T31 HydrophobicContact CZ-CG2 4.34Å; T31-A33 PolarHBondContact O-N 3.48Å; T31-G34 PolarHBondContact O-N 3.41Å; T31-G34 PolarHBondContact OG1-N 3.01Å; T31-Q35 WeakPolarHBondContact O-CB 3.33Å; T31-Q35 PolarHBondContact O-N 3.34Å; T31-L78 HydrophobicContact CG2-CD1 3.51Å; T31-D120 WeakPolarHBondContact CB-OD2 3.49Å; T31-D120 WeakPolarHBondContact CG2-OD2 3.3Å; T31-D120 PolarHBondContact OG1-OD2 2.97Å; T31-C122 HydrophobicContact CG2-CB 4.44Å
32	A	93.8	Very high	82.4	Confident	67 Å²	67	71.3 Å²	71.3	55%	0.554	38%	0.378	S	S	*	.	H	α-helix	trans	-57.7	-37.1	175.4	0	0	0	0	0	112.7	R36	A32-R36 WeakPolarHBondContact O-CG 3.49Å; A32-R36 PolarHBondContact O-N 3.34Å; A32-R36 PolarHBondContact O-NH1 3.32Å
33	A	93.8	Very high	84.1	Confident	3 Å²	3	63.8 Å²	63.8	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-72.1	-42.8	175.8	0	0	0	0	0	111.8	T31 Q35 R36 F37 Y158	T31-A33 PolarHBondContact O-N 3.48Å; A33-Q35 VanDerWaalsContact C-N 3.33Å; A33-Q35 PolarHBondContact O-N 2.64Å; A33-R36 PolarHBondContact O-N 2.98Å; A33-F37 WeakPolarHBondContact O-CB 3.48Å; A33-F37 PolarHBondContact O-N 3.17Å; A33-Y158 HydrophobicContact CB-CD1 4.14Å; A33-Y158 HydrophobicContact CB-CE1 4.43Å
34	G	95.1	Very high	86.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-35.9	177.1	0	0	0	0	0	113.6	T31 F37 N38	T31-G34 PolarHBondContact O-N 3.41Å; T31-G34 PolarHBondContact OG1-N 3.01Å; G34-F37 WeakPolarHBondContact O-CB 3.12Å; G34-F37 PolarHBondContact O-N 3.06Å; G34-N38 WeakPolarHBondContact O-CB 3.22Å; G34-N38 PolarHBondContact O-N 3.38Å
35	Q	95	Very high	88.6	Confident	77 Å²	77	52.9 Å²	52.9	36%	0.36	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-48.4	175	-177.7	59.7	29.8	0	0	110.8	F30 T31 A33 F37 N38 E39	F30-Q35 HydrophobicContact CB-CB 4.28Å; T31-Q35 WeakPolarHBondContact O-CB 3.33Å; T31-Q35 PolarHBondContact O-N 3.34Å; A33-Q35 VanDerWaalsContact C-N 3.33Å; A33-Q35 PolarHBondContact O-N 2.64Å; Q35-F37 VanDerWaalsContact C-N 3.33Å; Q35-F37 PolarHBondContact O-N 3.15Å; Q35-N38 PolarHBondContact O-N 3.17Å; Q35-E39 WeakPolarHBondContact CG-OE1 3.25Å; Q35-E39 PolarHBondContact NE2-OE1 3.09Å; Q35-E39 WeakPolarHBondContact O-CG 3.4Å; Q35-E39 PolarHBondContact O-N 2.81Å
36	R	94.7	Very high	90.6	Very high	77 Å²	77	52.8 Å²	52.8	29%	0.291	29%	0.286	S	S	.	.	H	α-helix	trans	-60.2	-42.3	174.7	-72.4	-172.4	-67.3	-94.3	6	112.1	A32 A33 E39 K40 E160	A32-R36 WeakPolarHBondContact O-CG 3.49Å; A32-R36 PolarHBondContact O-N 3.34Å; A32-R36 PolarHBondContact O-NH1 3.32Å; A33-R36 PolarHBondContact O-N 2.98Å; R36-E39 PolarHBondContact O-N 3.27Å; R36-K40 WeakPolarHBondContact O-CG 3.47Å; R36-K40 PolarHBondContact O-N 3.42Å; R36-E160 HydrophobicContact CB-CG 4.16Å; R36-E160 PolarHBondContact NH2-O 2.85Å
37	F	95.6	Very high	92.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.5	-50.9	174.6	-176.3	-76.5	0	0	0	110.7	V12 I14 A33 G34 Q35 E39 K40 V41 L45 V66 E68 F70 V73 Y158	V12-F37 HydrophobicContact CG1-CE2 3.78Å; V12-F37 HydrophobicContact CG1-CZ 4.13Å; I14-F37 HydrophobicContact CD1-CB 4.11Å; I14-F37 HydrophobicContact CD1-CD2 3.96Å; I14-F37 HydrophobicContact CD1-CG 4.05Å; I14-F37 HydrophobicContact CG1-CD2 4.36Å; I14-F37 HydrophobicContact CG1-CG 4.29Å; A33-F37 WeakPolarHBondContact O-CB 3.48Å; A33-F37 PolarHBondContact O-N 3.17Å; G34-F37 WeakPolarHBondContact O-CB 3.12Å; G34-F37 PolarHBondContact O-N 3.06Å; Q35-F37 VanDerWaalsContact C-N 3.33Å; Q35-F37 PolarHBondContact O-N 3.15Å; F37-E39 VanDerWaalsContact C-N 3.32Å; F37-E39 PolarHBondContact O-N 3.39Å; F37-K40 PolarHBondContact O-N 3.4Å; F37-V41 HydrophobicContact CD1-CG2 4.34Å; F37-V41 HydrophobicContact CE1-CG1 4.1Å; F37-V41 HydrophobicContact CE1-CG2 4.23Å; F37-V41 HydrophobicContact CZ-CG1 4.45Å; F37-V41 WeakPolarHBondContact O-CG2 3.1Å; F37-V41 PolarHBondContact O-N 3Å; F37-L45 HydrophobicContact CD1-CB 4.38Å; F37-L45 HydrophobicContact CD1-CD2 3.67Å; F37-L45 HydrophobicContact CE1-CB 4.41Å; F37-L45 HydrophobicContact CE1-CD2 4.12Å; F37-V66 HydrophobicContact CE1-CG1 3.83Å; F37-V66 HydrophobicContact CZ-CG1 4.46Å; F37-E68 WeakPolarHBondContact CD2-OE2 2.91Å; F37-E68 HydrophobicContact CE2-CB 4.25Å; F37-E68 WeakPolarHBondContact CE2-OE2 3.21Å; F37-E68 HydrophobicContact CZ-CB 4.43Å; F37-F70 AromaticContact CE2-CD2 3.64Å; F37-F70 HydrophobicContact CE2-CD2 3.64Å; F37-F70 AromaticContact CE2-CE2 3.83Å; F37-F70 HydrophobicContact CE2-CE2 3.83Å; F37-F70 HydrophobicContact CZ-CD2 4.2Å; F37-V73 HydrophobicContact CE1-CG2 4.14Å; F37-V73 HydrophobicContact CZ-CG2 3.73Å; F37-Y158 HydrophobicContact CD2-CE2 4.35Å; F37-Y158 AromaticContact CD2-CZ 3.85Å; F37-Y158 WeakPolarHBondContact CD2-OH 3.39Å
38	N	95.6	Very high	93.7	Very high	10 Å²	10	46.7 Å²	46.7	5%	0.053	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-40	-179.3	-175.5	52.1	0	0	0	112	F30 G34 Q35 V41 A42 G43 L45 L46	F30-N38 HydrophobicContact CD2-CB 4.22Å; F30-N38 HydrophobicContact CE2-CB 4.1Å; G34-N38 WeakPolarHBondContact O-CB 3.22Å; G34-N38 PolarHBondContact O-N 3.38Å; Q35-N38 PolarHBondContact O-N 3.17Å; N38-V41 CarbonylContact O-C 3.52Å; N38-V41 WeakPolarHBondContact O-CG2 3.39Å; N38-V41 PolarHBondContact O-N 2.83Å; N38-A42 PolarHBondContact O-N 3.1Å; N38-G43 WeakPolarHBondContact O-CA 3.37Å; N38-G43 PolarHBondContact O-N 3.36Å; N38-G43 VanDerWaalsContact OD1-C 3.25Å; N38-G43 VanDerWaalsContact OD1-CA 3.3Å; N38-G43 WeakPolarHBondContact OD1-CA 3.35Å; N38-G43 PolarHBondContact OD1-O 3.32Å; N38-L45 HydrophobicContact CB-CB 4.3Å; N38-L45 HydrophobicContact CB-CD2 4.45Å; N38-L45 WeakPolarHBondContact OD1-CB 3.45Å; N38-L45 PolarHBondContact OD1-N 2.85Å; N38-L46 PolarHBondContact OD1-N 2.81Å
39	E	95.1	Very high	94.4	Very high	116 Å²	116	46.5 Å²	46.5	54%	0.542	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-44.6	175.3	-74	165.4	-170.8	0	0	112.2	Q35 R36 F37 V41 A42	Q35-E39 WeakPolarHBondContact CG-OE1 3.25Å; Q35-E39 PolarHBondContact NE2-OE1 3.09Å; Q35-E39 WeakPolarHBondContact O-CG 3.4Å; Q35-E39 PolarHBondContact O-N 2.81Å; R36-E39 PolarHBondContact O-N 3.27Å; F37-E39 VanDerWaalsContact C-N 3.32Å; F37-E39 PolarHBondContact O-N 3.39Å; E39-V41 VanDerWaalsContact C-N 3.26Å; E39-V41 PolarHBondContact O-N 3.38Å; E39-A42 WeakPolarHBondContact O-CA 3.37Å; E39-A42 PolarHBondContact O-N 2.95Å
40	K	94.8	Very high	94.4	Very high	100 Å²	100	45.3 Å²	45.3	44%	0.435	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-32.3	177.4	-76	-176.3	179.7	-171.8	0	113.6	R36 F37 A42 E68 E160	R36-K40 WeakPolarHBondContact O-CG 3.47Å; R36-K40 PolarHBondContact O-N 3.42Å; F37-K40 PolarHBondContact O-N 3.4Å; K40-A42 VanDerWaalsContact C-N 3.26Å; K40-E68 HydrophobicContact CD-CG 4.45Å; K40-E68 WeakPolarHBondContact CD-OE1 3.29Å; K40-E68 IonicContact NZ-OE1 2.98Å; K40-E68 PolarHBondContact NZ-OE1 2.78Å; K40-E160 WeakPolarHBondContact CE-OE1 3.49Å; K40-E160 WeakPolarHBondContact CE-OE2 3.3Å; K40-E160 IonicContact NZ-OE1 3.09Å; K40-E160 PolarHBondContact NZ-OE1 3.39Å; K40-E160 IonicContact NZ-OE2 2.89Å; K40-E160 PolarHBondContact NZ-OE2 3.44Å
41	V	95.8	Very high	94.2	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.097	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	21.2	174.3	-57.2	0	0	0	0	112.6	F37 N38 E39 G43 K44 L45 V66 E68	F37-V41 HydrophobicContact CD1-CG2 4.34Å; F37-V41 HydrophobicContact CE1-CG1 4.1Å; F37-V41 HydrophobicContact CE1-CG2 4.23Å; F37-V41 HydrophobicContact CZ-CG1 4.45Å; F37-V41 WeakPolarHBondContact O-CG2 3.1Å; F37-V41 PolarHBondContact O-N 3Å; N38-V41 CarbonylContact O-C 3.52Å; N38-V41 WeakPolarHBondContact O-CG2 3.39Å; N38-V41 PolarHBondContact O-N 2.83Å; E39-V41 VanDerWaalsContact C-N 3.26Å; E39-V41 PolarHBondContact O-N 3.38Å; V41-G43 VanDerWaalsContact C-N 3.3Å; V41-G43 PolarHBondContact O-N 3.38Å; V41-K44 HydrophobicContact CB-CB 4.31Å; V41-K44 HydrophobicContact CG2-CB 4.15Å; V41-K44 WeakPolarHBondContact O-CB 3.49Å; V41-K44 PolarHBondContact O-N 3.31Å; V41-L45 HydrophobicContact CG2-CB 4.07Å; V41-V66 HydrophobicContact CB-CG1 4.46Å; V41-V66 HydrophobicContact CG1-CG1 4.43Å; V41-V66 HydrophobicContact CG2-CG1 3.99Å; V41-E68 HydrophobicContact CG1-CB 4.26Å
42	A	95.6	Very high	93.8	Very high	97 Å²	97	54.6 Å²	54.6	80%	0.802	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	42	176.8	0	0	0	0	0	113.9	N38 E39 K40 K44	N38-A42 PolarHBondContact O-N 3.1Å; E39-A42 WeakPolarHBondContact O-CA 3.37Å; E39-A42 PolarHBondContact O-N 2.95Å; K40-A42 VanDerWaalsContact C-N 3.26Å; A42-K44 PolarHBondContact O-N 2.86Å
43	G	94.6	Very high	93.5	Very high	27 Å²	27	59.5 Å²	59.5	28%	0.278	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	2.4	178.5	0	0	0	0	0	114.9	N38 V41 L45 L46 S47	N38-G43 WeakPolarHBondContact O-CA 3.37Å; N38-G43 PolarHBondContact O-N 3.36Å; N38-G43 VanDerWaalsContact OD1-C 3.25Å; N38-G43 VanDerWaalsContact OD1-CA 3.3Å; N38-G43 WeakPolarHBondContact OD1-CA 3.35Å; N38-G43 PolarHBondContact OD1-O 3.32Å; V41-G43 VanDerWaalsContact C-N 3.3Å; V41-G43 PolarHBondContact O-N 3.38Å; G43-L45 VanDerWaalsContact C-N 3.31Å; G43-L45 PolarHBondContact O-N 2.96Å; G43-L46 PolarHBondContact O-N 2.83Å; G43-S47 PolarHBondContact O-N 3.2Å
44	K	96	Very high	93.1	Very high	96 Å²	96	65.2 Å²	65.2	42%	0.417	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-34.5	-175.3	-171.2	171.7	-177.8	-172	0	113.1	V41 A42 S47 L48 D65 V66	V41-K44 HydrophobicContact CB-CB 4.31Å; V41-K44 HydrophobicContact CG2-CB 4.15Å; V41-K44 WeakPolarHBondContact O-CB 3.49Å; V41-K44 PolarHBondContact O-N 3.31Å; A42-K44 PolarHBondContact O-N 2.86Å; K44-S47 PolarHBondContact O-N 3.41Å; K44-L48 HydrophobicContact CG-CD1 4.03Å; K44-L48 HydrophobicContact CG-CG 4.33Å; K44-L48 WeakPolarHBondContact O-CB 3.48Å; K44-L48 WeakPolarHBondContact O-CG 3.29Å; K44-L48 PolarHBondContact O-N 2.82Å; K44-D65 WeakPolarHBondContact CE-O 3.33Å; K44-D65 PolarHBondContact NZ-O 2.91Å; K44-V66 WeakPolarHBondContact CD-O 3.48Å
45	L	95.5	Very high	92.9	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.6	-52.1	177.6	176.7	64.5	0	0	0	110.8	I14 F30 F37 N38 V41 G43 S47 L48 L49 L63 V66 V73 V75	I14-L45 HydrophobicContact CG2-CD2 4.08Å; F30-L45 HydrophobicContact CE1-CD2 3.88Å; F30-L45 HydrophobicContact CE1-CG 4.34Å; F30-L45 HydrophobicContact CE2-CD2 4.4Å; F30-L45 HydrophobicContact CZ-CD2 3.78Å; F30-L45 HydrophobicContact CZ-CG 3.87Å; F37-L45 HydrophobicContact CD1-CB 4.38Å; F37-L45 HydrophobicContact CD1-CD2 3.67Å; F37-L45 HydrophobicContact CE1-CB 4.41Å; F37-L45 HydrophobicContact CE1-CD2 4.12Å; N38-L45 HydrophobicContact CB-CB 4.3Å; N38-L45 HydrophobicContact CB-CD2 4.45Å; N38-L45 WeakPolarHBondContact OD1-CB 3.45Å; N38-L45 PolarHBondContact OD1-N 2.85Å; V41-L45 HydrophobicContact CG2-CB 4.07Å; G43-L45 VanDerWaalsContact C-N 3.31Å; G43-L45 PolarHBondContact O-N 2.96Å; L45-S47 VanDerWaalsContact C-N 3.35Å; L45-S47 PolarHBondContact O-N 2.89Å; L45-L48 PolarHBondContact O-N 3.07Å; L45-L49 WeakPolarHBondContact O-CB 3.47Å; L45-L49 PolarHBondContact O-N 2.91Å; L45-L63 HydrophobicContact CD1-CD1 3.73Å; L45-V66 HydrophobicContact CB-CG1 3.84Å; L45-V66 HydrophobicContact CD1-CG1 4.06Å; L45-V66 HydrophobicContact CD1-CG2 4.44Å; L45-V73 HydrophobicContact CD1-CB 4.45Å; L45-V73 HydrophobicContact CD1-CG1 3.82Å; L45-V75 HydrophobicContact CD1-CG2 3.7Å; L45-V75 HydrophobicContact CG-CG2 4.5Å
46	L	93.5	Very high	92.7	Very high	52 Å²	52	69.6 Å²	69.6	27%	0.272	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-44.6	177.3	-171.6	61.4	0	0	0	111.6	V27 F30 N38 G43 L48 L49 N50	V27-L46 HydrophobicContact CB-CD1 4.26Å; V27-L46 HydrophobicContact CG1-CD1 3.46Å; V27-L46 VanDerWaalsContact CG1-CD1 3.46Å; F30-L46 HydrophobicContact CE2-CB 4.02Å; F30-L46 HydrophobicContact CE2-CD1 3.8Å; F30-L46 HydrophobicContact CE2-CG 4.44Å; F30-L46 HydrophobicContact CZ-CD1 4.21Å; N38-L46 PolarHBondContact OD1-N 2.81Å; G43-L46 PolarHBondContact O-N 2.83Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 2.8Å; L46-L49 PolarHBondContact O-N 2.82Å; L46-N50 VanDerWaalsContact O-CG 3.24Å; L46-N50 PolarHBondContact O-N 3.45Å; L46-N50 PolarHBondContact O-OD1 3.17Å
47	S	93.2	Very high	92.7	Very high	62 Å²	62	69.1 Å²	69.1	43%	0.434	36%	0.358	S	S	.	.	H	α-helix	trans	-58.7	-42.3	178.7	179.1	0	0	0	0	112.5	G43 K44 L45	G43-S47 PolarHBondContact O-N 3.2Å; K44-S47 PolarHBondContact O-N 3.41Å; L45-S47 VanDerWaalsContact C-N 3.35Å; L45-S47 PolarHBondContact O-N 2.89Å
48	L	93.8	Very high	92.6	Very high	38 Å²	38	69.9 Å²	69.9	20%	0.199	37%	0.367	C	S	.	.	H	α-helix	trans	-70.6	-40.4	177	-72.5	171.9	0	0	0	111.9	K44 L45 L46 N50 K51 L63 V66	K44-L48 HydrophobicContact CG-CD1 4.03Å; K44-L48 HydrophobicContact CG-CG 4.33Å; K44-L48 WeakPolarHBondContact O-CB 3.48Å; K44-L48 WeakPolarHBondContact O-CG 3.29Å; K44-L48 PolarHBondContact O-N 2.82Å; L45-L48 PolarHBondContact O-N 3.07Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 2.8Å; L48-N50 VanDerWaalsContact C-N 3.3Å; L48-N50 PolarHBondContact O-N 3.26Å; L48-K51 WeakPolarHBondContact O-CB 3.16Å; L48-K51 PolarHBondContact O-N 3.21Å; L48-L63 HydrophobicContact CB-CD1 4.16Å; L48-L63 HydrophobicContact CB-CD2 4.38Å; L48-V66 HydrophobicContact CD1-CG2 3.93Å
49	L	92.5	Very high	92.5	Very high	10 Å²	10	75.6 Å²	75.6	5%	0.052	39%	0.391	C	S	.	.	H	α-helix	trans	-60.4	-41.3	177.7	-170.6	65.4	0	0	0	111.5	I16 F30 L45 L46 K51 S52 L63 V75	I16-L49 HydrophobicContact CD1-CD2 3.58Å; F30-L49 HydrophobicContact CE1-CD2 4.42Å; F30-L49 HydrophobicContact CZ-CD2 4.25Å; L45-L49 WeakPolarHBondContact O-CB 3.47Å; L45-L49 PolarHBondContact O-N 2.91Å; L46-L49 PolarHBondContact O-N 2.82Å; L49-K51 PolarHBondContact O-N 3.44Å; L49-K51 VanDerWaalsContact O-N 3.15Å; L49-S52 PolarHBondContact O-N 2.99Å; L49-S52 VanDerWaalsContact O-N 3.16Å; L49-S52 PolarHBondContact O-OG 2.89Å; L49-L63 HydrophobicContact CB-CD1 4.4Å; L49-V75 HydrophobicContact CD1-CB 4.36Å; L49-V75 HydrophobicContact CD1-CG1 4.26Å; L49-V75 HydrophobicContact CD2-CG1 4.1Å
50	N	89.4	Confident	92.5	Very high	88 Å²	88	71.8 Å²	71.8	47%	0.471	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.1	178.9	-69.9	-5.1	0	0	0	114.5	V27 L46 L48 S52	V27-N50 WeakPolarHBondContact CG1-OD1 3.36Å; V27-N50 WeakPolarHBondContact CG2-OD1 3.39Å; L46-N50 VanDerWaalsContact O-CG 3.24Å; L46-N50 PolarHBondContact O-N 3.45Å; L46-N50 PolarHBondContact O-OD1 3.17Å; L48-N50 VanDerWaalsContact C-N 3.3Å; L48-N50 PolarHBondContact O-N 3.26Å; N50-S52 PolarHBondContact O-N 2.89Å
51	K	90.3	Very high	92.6	Very high	163 Å²	163	69.6 Å²	69.6	71%	0.709	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	5.3	174.4	-65.3	179.1	-177.6	-175.3	0	113.2	L48 L49	L48-K51 WeakPolarHBondContact O-CB 3.16Å; L48-K51 PolarHBondContact O-N 3.21Å; L49-K51 PolarHBondContact O-N 3.44Å; L49-K51 VanDerWaalsContact O-N 3.15Å
52	S	86.2	Confident	92.7	Very high	47 Å²	47	70.6 Å²	70.6	33%	0.329	37%	0.37	S	S	.	.	S	Bend	trans	-139.2	163	-174.6	48.5	0	0	0	0	110.4	L49 N50 R61	L49-S52 PolarHBondContact O-N 2.99Å; L49-S52 VanDerWaalsContact O-N 3.16Å; L49-S52 PolarHBondContact O-OG 2.89Å; N50-S52 PolarHBondContact O-N 2.89Å; S52-R61 VanDerWaalsContact OG-CD 3.3Å; S52-R61 WeakPolarHBondContact OG-CD 3.37Å; S52-R61 VanDerWaalsContact OG-CZ 3.26Å; S52-R61 PolarHBondContact OG-NE 2.88Å; S52-R61 PolarHBondContact OG-NH1 3.33Å
53	E	87.2	Confident	92.8	Very high	170 Å²	170	67 Å²	67	79%	0.794	34%	0.337	S	S	*	.			trans	-57.4	162.9	-178.6	-65.4	-172	166.2	0	0	112.9	L55 R61	E53-L55 PolarHBondContact O-N 3.4Å; E53-R61 PolarHBondContact O-NH1 3.41Å; E53-R61 PolarHBondContact O-NH2 3.15Å
54	E	85.9	Confident	92.8	Very high	124 Å²	124	71.4 Å²	71.4	58%	0.579	35%	0.346	S	S	*	.			trans	-57.1	140.8	177.1	-170.1	178.7	-172.7	0	0	112.7	P19	P19-E54 WeakPolarHBondContact CD-OE1 3.48Å; P19-E54 WeakPolarHBondContact CG-OE1 3.32Å
55	L	90.1	Very high	92.6	Very high	16 Å²	16	73.1 Å²	73.1	8%	0.084	36%	0.36	C	S	.	.			trans	-88.7	113.6	178	-159.6	74.8	0	0	0	109.9	I16 E53 K59 R61 V75 C77	I16-L55 HydrophobicContact CG2-CD2 4.24Å; E53-L55 PolarHBondContact O-N 3.4Å; L55-K59 HydrophobicContact CD1-CB 4.3Å; L55-K59 HydrophobicContact CG-CB 4.46Å; L55-R61 HydrophobicContact CD1-CB 3.67Å; L55-V75 HydrophobicContact CD2-CB 4.41Å; L55-V75 HydrophobicContact CD2-CG1 4.05Å; L55-V75 VanDerWaalsContact CD2-O 3.25Å; L55-V75 WeakPolarHBondContact CD2-O 3.28Å; L55-C77 HydrophobicContact CB-CB 4.22Å; L55-C77 HydrophobicContact CD2-CB 3.89Å; L55-C77 HydrophobicContact CG-CB 3.94Å; L55-C77 WeakPolarHBondContact O-CB 3.04Å; L55-C77 PolarHBondContact O-SG 3.45Å
56	K	91.5	Very high	92.5	Very high	152 Å²	152	73.4 Å²	73.4	66%	0.661	36%	0.362	S	S	*	.			trans	-79.6	155	179.4	-60.5	-176.1	179.7	-179.1	0	112.5	G58 K59 C77	K56-G58 PolarHBondContact O-N 3.22Å; K56-K59 HydrophobicContact CB-CG 4.13Å; K56-K59 WeakPolarHBondContact O-CB 3.38Å; K56-K59 WeakPolarHBondContact O-CG 3.42Å; K56-K59 PolarHBondContact O-N 3.17Å; K56-C77 WeakPolarHBondContact O-CB 3.36Å
57	E	93.7	Very high	92	Very high	67 Å²	67	72.4 Å²	72.4	31%	0.313	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.9	131.5	175.1	-172.4	-161.3	123.4	0	0	113.1	K59 N97 R100	E57-K59 PolarHBondContact O-N 3.22Å; E57-K59 VanDerWaalsContact O-N 3.15Å; E57-N97 PolarHBondContact OE1-OD1 3.44Å; E57-R100 IonicContact OE1-NH1 3.51Å
58	G	93.9	Very high	91.5	Very high	17 Å²	17	72.9 Å²	72.9	18%	0.175	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	3.8	176.8	0	0	0	0	0	114.5	K56 C77 A104	K56-G58 PolarHBondContact O-N 3.22Å; G58-C77 PolarHBondContact N-O 3.15Å; G58-A104 WeakPolarHBondContact O-CB 3.26Å
59	K	94.2	Very high	91.3	Very high	129 Å²	129	74 Å²	74	56%	0.561	38%	0.381	S	S	*	.			trans	-93.5	152.8	173.6	-55.4	-58.2	-178.8	-178.9	0	111.1	L55 K56 E57 V76 C77	L55-K59 HydrophobicContact CD1-CB 4.3Å; L55-K59 HydrophobicContact CG-CB 4.46Å; K56-K59 HydrophobicContact CB-CG 4.13Å; K56-K59 WeakPolarHBondContact O-CB 3.38Å; K56-K59 WeakPolarHBondContact O-CG 3.42Å; K56-K59 PolarHBondContact O-N 3.17Å; E57-K59 PolarHBondContact O-N 3.22Å; E57-K59 VanDerWaalsContact O-N 3.15Å; K59-V76 WeakPolarHBondContact O-CA 3.36Å; K59-C77 PolarHBondContact O-N 2.89Å; K59-C77 VanDerWaalsContact O-N 3.1Å
60	C	95.8	Very high	91.4	Very high	37 Å²	37	74.8 Å²	74.8	25%	0.25	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.7	176.9	177.9	0	0	0	0	109.8	V75 V76 A104 A108	C60-V75 CarbonylContact C-O 3.57Å; C60-V75 VanDerWaalsContact CA-O 3.29Å; C60-V75 WeakPolarHBondContact CA-O 3.41Å; C60-V76 HydrophobicContact CB-CG1 3.97Å; C60-A104 HydrophobicContact CB-CB 4.19Å; C60-A108 HydrophobicContact CB-CB 4.42Å
61	R	96.4	Very high	91.7	Very high	53 Å²	53	73.6 Å²	73.6	20%	0.2	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.6	164.7	-175.9	169.8	-64.1	142.2	4.5	109.8	S52 E53 L55 L63 G74 V75	S52-R61 VanDerWaalsContact OG-CD 3.3Å; S52-R61 WeakPolarHBondContact OG-CD 3.37Å; S52-R61 VanDerWaalsContact OG-CZ 3.26Å; S52-R61 PolarHBondContact OG-NE 2.88Å; S52-R61 PolarHBondContact OG-NH1 3.33Å; E53-R61 PolarHBondContact O-NH1 3.41Å; E53-R61 PolarHBondContact O-NH2 3.15Å; L55-R61 HydrophobicContact CD1-CB 3.67Å; R61-L63 HydrophobicContact CG-CD2 4.19Å; R61-G74 WeakPolarHBondContact O-CA 3.45Å; R61-V75 PolarHBondContact N-O 3.48Å; R61-V75 PolarHBondContact O-N 3.04Å
62	I	97.3	Very high	92	Very high	38 Å²	38	65.9 Å²	65.9	20%	0.195	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	127.6	174.7	-56.2	-58.2	0	0	0	109.1	Y64 A72 V73 A108 L109	I62-Y64 HydrophobicContact CG2-CE1 3.87Å; I62-Y64 HydrophobicContact CG2-CE2 3.93Å; I62-A72 HydrophobicContact CG2-CB 4.12Å; I62-V73 CarbonylContact C-O 3.58Å; I62-V73 WeakPolarHBondContact CA-O 3.44Å; I62-A108 HydrophobicContact CD1-CB 3.84Å; I62-A108 HydrophobicContact CG1-CB 4.17Å; I62-L109 HydrophobicContact CD1-CD2 3.77Å; I62-L109 HydrophobicContact CD1-CG 3.96Å
63	L	97	Very high	92.6	Very high	20 Å²	20	63.7 Å²	63.7	11%	0.105	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.2	174.2	-59.6	175.2	0	0	0	109	L45 L48 L49 R61 V66 A72 V73 V75	L45-L63 HydrophobicContact CD1-CD1 3.73Å; L48-L63 HydrophobicContact CB-CD1 4.16Å; L48-L63 HydrophobicContact CB-CD2 4.38Å; L49-L63 HydrophobicContact CB-CD1 4.4Å; R61-L63 HydrophobicContact CG-CD2 4.19Å; L63-V66 HydrophobicContact CB-CG2 3.77Å; L63-A72 WeakPolarHBondContact O-CA 3.45Å; L63-V73 PolarHBondContact N-O 2.96Å; L63-V73 PolarHBondContact O-N 3.45Å; L63-V75 HydrophobicContact CD1-CG2 3.89Å
64	Y	95.8	Very high	93.1	Very high	121 Å²	121	55.6 Å²	55.6	48%	0.475	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	165.5	177.2	-56.8	-78.4	0	0	0	110.3	I62 V66 A72 V112	I62-Y64 HydrophobicContact CG2-CE1 3.87Å; I62-Y64 HydrophobicContact CG2-CE2 3.93Å; Y64-V66 PolarHBondContact O-N 3.06Å; Y64-V66 VanDerWaalsContact O-N 3.09Å; Y64-A72 HydrophobicContact CD1-CB 4.05Å; Y64-A72 HydrophobicContact CE1-CB 3.94Å; Y64-V112 WeakPolarHBondContact OH-CG1 3.24Å
65	D	90.6	Very high	93.7	Very high	132 Å²	132	49.7 Å²	49.7	71%	0.706	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54	30.1	176.2	-61.2	-33.6	0	0	0	114.4	K44	K44-D65 WeakPolarHBondContact CE-O 3.33Å; K44-D65 PolarHBondContact NZ-O 2.91Å
66	V	93.5	Very high	94	Very high	5 Å²	5	49 Å²	49	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-44.7	-179.4	-170.7	0	0	0	0	111.4	F37 V41 K44 L45 L48 L63 Y64 V73	F37-V66 HydrophobicContact CE1-CG1 3.83Å; F37-V66 HydrophobicContact CZ-CG1 4.46Å; V41-V66 HydrophobicContact CB-CG1 4.46Å; V41-V66 HydrophobicContact CG1-CG1 4.43Å; V41-V66 HydrophobicContact CG2-CG1 3.99Å; K44-V66 WeakPolarHBondContact CD-O 3.48Å; L45-V66 HydrophobicContact CB-CG1 3.84Å; L45-V66 HydrophobicContact CD1-CG1 4.06Å; L45-V66 HydrophobicContact CD1-CG2 4.44Å; L48-V66 HydrophobicContact CD1-CG2 3.93Å; L63-V66 HydrophobicContact CB-CG2 3.77Å; Y64-V66 PolarHBondContact O-N 3.06Å; Y64-V66 VanDerWaalsContact O-N 3.09Å; V66-V73 HydrophobicContact CB-CG2 3.76Å; V66-V73 HydrophobicContact CG1-CG2 4.29Å; V66-V73 HydrophobicContact CG2-CB 4.05Å; V66-V73 HydrophobicContact CG2-CG2 3.68Å
67	G	84.6	Confident	94.3	Very high	31 Å²	31	41.8 Å²	41.8	32%	0.32	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	130.5	-163.6	178.9	0	0	0	0	0	113.9	G69 F70	G67-G69 PolarHBondContact O-N 3.13Å; G67-G69 VanDerWaalsContact O-N 3.15Å; G67-F70 PolarHBondContact O-N 3.27Å
68	E	82	Confident	94.4	Very high	72 Å²	72	38.7 Å²	38.7	34%	0.336	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	16.8	177.1	-144.3	-165.1	-171.6	0	0	116.3	F37 K40 V41 F70 Y158	F37-E68 WeakPolarHBondContact CD2-OE2 2.91Å; F37-E68 HydrophobicContact CE2-CB 4.25Å; F37-E68 WeakPolarHBondContact CE2-OE2 3.21Å; F37-E68 HydrophobicContact CZ-CB 4.43Å; K40-E68 HydrophobicContact CD-CG 4.45Å; K40-E68 WeakPolarHBondContact CD-OE1 3.29Å; K40-E68 IonicContact NZ-OE1 2.98Å; K40-E68 PolarHBondContact NZ-OE1 2.78Å; V41-E68 HydrophobicContact CG1-CB 4.26Å; E68-F70 VanDerWaalsContact C-N 3.3Å; E68-F70 HydrophobicContact CB-CD2 4.09Å; E68-F70 HydrophobicContact CB-CE2 4.36Å; E68-F70 PolarHBondContact O-N 3.38Å; E68-Y158 PolarHBondContact OE1-OH 3.01Å; E68-Y158 PolarHBondContact OE2-OH 2.8Å
69	G	88.7	Confident	94.4	Very high	63 Å²	63	37.9 Å²	37.9	65%	0.649	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.2	3.3	179.8	0	0	0	0	0	114.6	G67	G67-G69 PolarHBondContact O-N 3.13Å; G67-G69 VanDerWaalsContact O-N 3.15Å
70	F	95.1	Very high	94.4	Very high	25 Å²	25	37.8 Å²	37.8	11%	0.11	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135.5	170	-62.2	-75.5	0	0	0	110.9	I10 V12 F37 G67 E68 H118 Y158	I10-F70 HydrophobicContact CB-CD1 4.25Å; I10-F70 HydrophobicContact CG2-CD1 3.6Å; I10-F70 HydrophobicContact CG2-CE1 3.68Å; I10-F70 CarbonylContact O-C 3.55Å; V12-F70 HydrophobicContact CB-CD1 3.69Å; V12-F70 HydrophobicContact CB-CD2 4.21Å; V12-F70 HydrophobicContact CB-CE1 3.73Å; V12-F70 HydrophobicContact CB-CE2 4.23Å; V12-F70 HydrophobicContact CB-CG 3.94Å; V12-F70 HydrophobicContact CB-CZ 4Å; V12-F70 HydrophobicContact CG1-CB 4.02Å; V12-F70 HydrophobicContact CG1-CD1 3.89Å; V12-F70 HydrophobicContact CG1-CD2 3.74Å; V12-F70 HydrophobicContact CG1-CE1 4.31Å; V12-F70 HydrophobicContact CG1-CE2 4.16Å; V12-F70 HydrophobicContact CG1-CG 3.59Å; V12-F70 HydrophobicContact CG1-CZ 4.42Å; V12-F70 HydrophobicContact CG2-CE1 4.44Å; V12-F70 HydrophobicContact CG2-CZ 4.32Å; F37-F70 AromaticContact CE2-CD2 3.64Å; F37-F70 HydrophobicContact CE2-CD2 3.64Å; F37-F70 AromaticContact CE2-CE2 3.83Å; F37-F70 HydrophobicContact CE2-CE2 3.83Å; F37-F70 HydrophobicContact CZ-CD2 4.2Å; G67-F70 PolarHBondContact O-N 3.27Å; E68-F70 VanDerWaalsContact C-N 3.3Å; E68-F70 HydrophobicContact CB-CD2 4.09Å; E68-F70 HydrophobicContact CB-CE2 4.36Å; E68-F70 PolarHBondContact O-N 3.38Å; F70-H118 HydrophobicContact CE1-CB 3.99Å; F70-H118 AromaticContact CE1-CD2 3.96Å; F70-H118 AromaticContact CE1-CG 3.8Å; F70-H118 HydrophobicContact CZ-CB 4.29Å; F70-Y158 AromaticContact CE2-CE2 3.84Å; F70-Y158 HydrophobicContact CE2-CE2 3.84Å; F70-Y158 HydrophobicContact CZ-CD2 4.1Å; F70-Y158 AromaticContact CZ-CE2 3.76Å; F70-Y158 HydrophobicContact CZ-CE2 3.76Å
71	N	96.1	Very high	94.1	Very high	64 Å²	64	39.5 Å²	39.5	34%	0.342	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-28.1	176.9	-57.4	105.1	0	0	0	112.4	K8 R9 I10 M114	K8-N71 PolarHBondContact O-OD1 2.98Å; R9-N71 WeakPolarHBondContact CA-OD1 3.49Å; I10-N71 PolarHBondContact N-OD1 3.06Å; I10-N71 PolarHBondContact O-N 3.49Å; N71-M114 HydrophobicContact CB-CE 4.21Å; N71-M114 HydrophobicContact CB-SD 3.91Å
72	A	97.4	Very high	93.8	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	140.4	178	0	0	0	0	0	110.7	G11 V12 I62 L63 Y64 L109 M114	G11-A72 CarbonylContact C-O 3.59Å; G11-A72 WeakPolarHBondContact CA-O 3.47Å; V12-A72 PolarHBondContact N-O 3.24Å; I62-A72 HydrophobicContact CG2-CB 4.12Å; L63-A72 WeakPolarHBondContact O-CA 3.45Å; Y64-A72 HydrophobicContact CD1-CB 4.05Å; Y64-A72 HydrophobicContact CE1-CB 3.94Å; A72-L109 HydrophobicContact CB-CD2 3.75Å; A72-M114 HydrophobicContact CB-CE 4.29Å; A72-M114 HydrophobicContact CB-CG 4.21Å; A72-M114 HydrophobicContact CB-SD 4.01Å
73	V	97.9	Very high	93.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117.3	174.8	-178.3	0	0	0	0	108.4	V12 I14 F37 L45 I62 L63 V66 V75	V12-V73 HydrophobicContact CG1-CB 4.23Å; V12-V73 HydrophobicContact CG1-CG1 4.08Å; V12-V73 HydrophobicContact CG1-CG2 3.79Å; V12-V73 CarbonylContact O-C 3.55Å; V12-V73 WeakPolarHBondContact O-CA 3.49Å; I14-V73 HydrophobicContact CB-CG1 4.43Å; I14-V73 HydrophobicContact CG1-CG1 4Å; F37-V73 HydrophobicContact CE1-CG2 4.14Å; F37-V73 HydrophobicContact CZ-CG2 3.73Å; L45-V73 HydrophobicContact CD1-CB 4.45Å; L45-V73 HydrophobicContact CD1-CG1 3.82Å; I62-V73 CarbonylContact C-O 3.58Å; I62-V73 WeakPolarHBondContact CA-O 3.44Å; L63-V73 PolarHBondContact N-O 2.96Å; L63-V73 PolarHBondContact O-N 3.45Å; V66-V73 HydrophobicContact CB-CG2 3.76Å; V66-V73 HydrophobicContact CG1-CG2 4.29Å; V66-V73 HydrophobicContact CG2-CB 4.05Å; V66-V73 HydrophobicContact CG2-CG2 3.68Å; V73-V75 HydrophobicContact CG1-CG2 4.19Å
74	G	97.7	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	103.3	170.1	0	0	0	0	0	110.2	V12 V13 I14 R61	V12-G74 PolarHBondContact O-N 3.39Å; V13-G74 CarbonylContact C-O 3.53Å; V13-G74 VanDerWaalsContact CA-O 3.28Å; V13-G74 WeakPolarHBondContact CA-O 3.25Å; I14-G74 PolarHBondContact N-O 3.06Å; R61-G74 WeakPolarHBondContact O-CA 3.45Å
75	V	97.7	Very high	93.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	127.3	171.9	-174.6	0	0	0	0	108.4	I14 I16 F30 L45 L49 L55 C60 R61 L63 V73	I14-V75 CarbonylContact O-C 3.59Å; I14-V75 WeakPolarHBondContact O-CA 3.35Å; I16-V75 HydrophobicContact CB-CG1 4.24Å; I16-V75 HydrophobicContact CG2-CG1 3.77Å; F30-V75 HydrophobicContact CE1-CG1 4.27Å; L45-V75 HydrophobicContact CD1-CG2 3.7Å; L45-V75 HydrophobicContact CG-CG2 4.5Å; L49-V75 HydrophobicContact CD1-CB 4.36Å; L49-V75 HydrophobicContact CD1-CG1 4.26Å; L49-V75 HydrophobicContact CD2-CG1 4.1Å; L55-V75 HydrophobicContact CD2-CB 4.41Å; L55-V75 HydrophobicContact CD2-CG1 4.05Å; L55-V75 VanDerWaalsContact CD2-O 3.25Å; L55-V75 WeakPolarHBondContact CD2-O 3.28Å; C60-V75 CarbonylContact C-O 3.57Å; C60-V75 VanDerWaalsContact CA-O 3.29Å; C60-V75 WeakPolarHBondContact CA-O 3.41Å; R61-V75 PolarHBondContact N-O 3.48Å; R61-V75 PolarHBondContact O-N 3.04Å; L63-V75 HydrophobicContact CD1-CG2 3.89Å; V73-V75 HydrophobicContact CG1-CG2 4.19Å
76	V	97.6	Very high	93.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.5	-178.1	-59.9	0	0	0	0	111.1	V13 I14 G15 I16 K59 C60 L78 A101 G105	V13-V76 HydrophobicContact CG1-CB 4.42Å; V13-V76 HydrophobicContact CG1-CG1 3.82Å; V13-V76 HydrophobicContact CG1-CG2 3.66Å; I14-V76 PolarHBondContact O-N 3.33Å; G15-V76 WeakPolarHBondContact CA-O 3.03Å; I16-V76 PolarHBondContact N-O 2.66Å; K59-V76 WeakPolarHBondContact O-CA 3.36Å; C60-V76 HydrophobicContact CB-CG1 3.97Å; V76-L78 HydrophobicContact CG2-CD2 4.27Å; V76-A101 HydrophobicContact CB-CB 4.03Å; V76-A101 VanDerWaalsContact CG1-O 3.26Å; V76-A101 WeakPolarHBondContact CG1-O 3.49Å; V76-A101 HydrophobicContact CG2-CB 4.06Å; V76-G105 VanDerWaalsContact CG1-CA 3.47Å
77	C	96.4	Very high	93.5	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.007	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.7	179.7	-174.4	0	0	0	0	111.2	I16 L55 K56 G58 K59 A101	I16-C77 HydrophobicContact CG2-CB 4.39Å; I16-C77 CarbonylContact O-C 3.19Å; I16-C77 VanDerWaalsContact O-CA 3.32Å; I16-C77 WeakPolarHBondContact O-CA 3.36Å; L55-C77 HydrophobicContact CB-CB 4.22Å; L55-C77 HydrophobicContact CD2-CB 3.89Å; L55-C77 HydrophobicContact CG-CB 3.94Å; L55-C77 WeakPolarHBondContact O-CB 3.04Å; L55-C77 PolarHBondContact O-SG 3.45Å; K56-C77 WeakPolarHBondContact O-CB 3.36Å; G58-C77 PolarHBondContact N-O 3.15Å; K59-C77 PolarHBondContact O-N 2.89Å; K59-C77 VanDerWaalsContact O-N 3.1Å; C77-A101 WeakPolarHBondContact O-CB 3.03Å
78	L	96.7	Very high	94	Very high	3 Å²	3	45 Å²	45	2%	0.016	28%	0.279	C	S	.	.			trans	-91.2	4.8	-174.9	-56.1	-179.4	0	0	0	113.4	I16 F17 T31 V76 N97 V98 A101 C122	I16-L78 PolarHBondContact O-N 3.49Å; F17-L78 HydrophobicContact CD1-CB 3.74Å; F17-L78 HydrophobicContact CD1-CD1 4.2Å; F17-L78 HydrophobicContact CE1-CB 3.74Å; F17-L78 HydrophobicContact CE1-CD1 3.65Å; F17-L78 HydrophobicContact CE1-CG 4.34Å; F17-L78 HydrophobicContact CE2-CD1 4.26Å; F17-L78 HydrophobicContact CZ-CD1 3.68Å; T31-L78 HydrophobicContact CG2-CD1 3.51Å; V76-L78 HydrophobicContact CG2-CD2 4.27Å; L78-N97 WeakPolarHBondContact O-CB 3.48Å; L78-N97 PolarHBondContact O-ND2 3.28Å; L78-V98 HydrophobicContact CD2-CG2 4.21Å; L78-A101 HydrophobicContact CD2-CB 3.68Å; L78-C122 HydrophobicContact CD1-CB 3.79Å; L78-C122 HydrophobicContact CD2-CB 4.16Å
79	G	94.7	Very high	94.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.283	C	S	.	.			trans	74.5	-149.5	-169.9	0	0	0	0	0	111.1	F17 E18	F17-G79 CarbonylContact C-O 3.52Å; F17-G79 WeakPolarHBondContact CA-O 3.37Å; E18-G79 PolarHBondContact N-O 3.46Å
80	K	92.9	Very high	94.9	Very high	127 Å²	127	45.1 Å²	45.1	55%	0.552	26%	0.262	S	S	*	.	S	Bend	trans	-76.1	143.4	-177.7	-62.4	171.4	-169.2	154.2	0	111.3	E83	K80-E83 HydrophobicContact CB-CG 3.87Å
81	S	91.2	Very high	94.9	Very high	72 Å²	72	44.3 Å²	44.3	50%	0.503	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	142.9	172	-173.6	0	0	0	0	111
82	G	88.6	Confident	94.9	Very high	74 Å²	74	43.2 Å²	43.2	76%	0.763	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	12.7	176.2	0	0	0	0	0	115.6	G84	G82-G84 PolarHBondContact O-N 3.33Å
83	E	90.9	Very high	94.9	Very high	44 Å²	44	44.6 Å²	44.6	21%	0.206	26%	0.258	C	S	.	.			trans	-68.1	114.5	176.7	-72.3	-167.2	143.7	0	0	112.3	K80 H92 Q93 G94 N97	K80-E83 HydrophobicContact CB-CG 3.87Å; E83-H92 PolarHBondContact O-CE1 2.95Å; E83-H92 VanDerWaalsContact O-CE1 3.26Å; E83-Q93 HydrophobicContact CB-CB 4.19Å; E83-Q93 HydrophobicContact CB-CG 4.32Å; E83-Q93 WeakPolarHBondContact OE2-CG 3.45Å; E83-G94 VanDerWaalsContact O-CA 3.29Å; E83-G94 WeakPolarHBondContact O-CA 3.34Å; E83-G94 PolarHBondContact O-N 3.4Å; E83-G94 VanDerWaalsContact O-N 3.1Å; E83-N97 PolarHBondContact OE2-ND2 3.04Å
84	G	93.6	Very high	94.8	Very high	31 Å²	31	45 Å²	45	32%	0.32	26%	0.262	S	S	.	.			trans	-96.7	-139.6	177.2	0	0	0	0	0	113.3	G82 Q93	G82-G84 PolarHBondContact O-N 3.33Å; G84-Q93 PolarHBondContact O-N 2.99Å
85	Y	94.6	Very high	94.8	Very high	96 Å²	96	47.3 Å²	47.3	38%	0.376	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.9	174.7	178.9	-110.2	0	0	0	111.9	N87 I91 M407	Y85-N87 HydrophobicContact CE1-CB 4.06Å; Y85-I91 WeakPolarHBondContact CA-O 3.46Å; Y85-I91 WeakPolarHBondContact CD2-O 3.3Å; Y85-M407 HydrophobicContact CD1-CE 4.41Å; Y85-M407 HydrophobicContact CD2-CE 3.45Å; Y85-M407 VanDerWaalsContact CD2-CE 3.45Å; Y85-M407 HydrophobicContact CE1-CE 4.09Å; Y85-M407 HydrophobicContact CE2-CB 4.2Å; Y85-M407 HydrophobicContact CE2-CE 3.05Å; Y85-M407 HydrophobicContact CE2-CG 3.76Å; Y85-M407 HydrophobicContact CE2-SD 3.82Å; Y85-M407 HydrophobicContact CG-CE 4.11Å
86	V	95.8	Very high	94.7	Very high	44 Å²	44	48.2 Å²	48.2	27%	0.267	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	108.2	176.3	176.4	0	0	0	0	108.9	S88 E89 E90 I91 Q93	V86-S88 VanDerWaalsContact C-N 3.31Å; V86-S88 WeakPolarHBondContact CG1-OG 3.4Å; V86-S88 PolarHBondContact O-N 3.02Å; V86-E89 HydrophobicContact CB-CB 4.47Å; V86-E89 HydrophobicContact CG1-CB 4.15Å; V86-E89 HydrophobicContact CG1-CG 4.16Å; V86-E89 PolarHBondContact O-N 3.4Å; V86-E89 VanDerWaalsContact O-N 3.15Å; V86-E90 PolarHBondContact O-N 2.87Å; V86-I91 PolarHBondContact N-O 2.97Å; V86-Q93 HydrophobicContact CG2-CB 3.62Å; V86-Q93 HydrophobicContact CG2-CG 4.26Å
87	N	94	Very high	94.7	Very high	125 Å²	125	48.2 Å²	48.2	67%	0.668	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-35.2	-174	-171.8	77.6	0	0	0	113.7	Y85 E89	Y85-N87 HydrophobicContact CE1-CB 4.06Å; N87-E89 VanDerWaalsContact C-N 3.26Å; N87-E89 PolarHBondContact O-N 2.79Å
88	S	94.5	Very high	94.7	Very high	103 Å²	103	48.4 Å²	48.4	72%	0.72	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-23.3	179.7	56	0	0	0	0	113.7	V86	V86-S88 VanDerWaalsContact C-N 3.31Å; V86-S88 WeakPolarHBondContact CG1-OG 3.4Å; V86-S88 PolarHBondContact O-N 3.02Å
89	E	94	Very high	94.8	Very high	90 Å²	90	48.3 Å²	48.3	42%	0.421	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-9.8	-179.2	-68.8	-63.7	146.9	0	0	112.8	V86 N87 I91 R412	V86-E89 HydrophobicContact CB-CB 4.47Å; V86-E89 HydrophobicContact CG1-CB 4.15Å; V86-E89 HydrophobicContact CG1-CG 4.16Å; V86-E89 PolarHBondContact O-N 3.4Å; V86-E89 VanDerWaalsContact O-N 3.15Å; N87-E89 VanDerWaalsContact C-N 3.26Å; N87-E89 PolarHBondContact O-N 2.79Å; E89-I91 VanDerWaalsContact C-N 3.3Å; E89-I91 HydrophobicContact CB-CD1 4.23Å; E89-I91 HydrophobicContact CB-CG1 3.82Å; E89-I91 PolarHBondContact O-N 2.78Å; E89-R412 VanDerWaalsContact O-CD 3.27Å; E89-R412 WeakPolarHBondContact O-CD 3.39Å; E89-R412 PolarHBondContact O-NH1 2.87Å; E89-R412 IonicContact OE2-NH1 2.84Å; E89-R412 PolarHBondContact OE2-NH1 3.22Å
90	E	95.4	Very high	94.8	Very high	46 Å²	46	52.7 Å²	52.7	22%	0.215	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	42.2	-175	-57.3	-170.9	168.2	0	0	114	V86 H403 M407	V86-E90 PolarHBondContact O-N 2.87Å; E90-H403 IonicContact OE1-NE2 2.67Å; E90-H403 IonicContact OE2-CD2 3.98Å; E90-H403 IonicContact OE2-CE1 2.66Å; E90-H403 IonicContact OE2-NE2 2.68Å; E90-H403 PolarHBondContact OE2-NE2 3.3Å; E90-M407 WeakPolarHBondContact O-CA 3.22Å; E90-M407 VanDerWaalsContact O-CG 3.31Å; E90-M407 WeakPolarHBondContact O-CG 3.26Å
91	I	95.8	Very high	95	Very high	9 Å²	9	46.7 Å²	46.7	5%	0.046	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	158	178.5	60	175.1	0	0	0	112.6	Y85 V86 E89 Q93 E96 R412	Y85-I91 WeakPolarHBondContact CA-O 3.46Å; Y85-I91 WeakPolarHBondContact CD2-O 3.3Å; V86-I91 PolarHBondContact N-O 2.97Å; E89-I91 VanDerWaalsContact C-N 3.3Å; E89-I91 HydrophobicContact CB-CD1 4.23Å; E89-I91 HydrophobicContact CB-CG1 3.82Å; E89-I91 PolarHBondContact O-N 2.78Å; I91-Q93 PolarHBondContact O-N 2.97Å; I91-E96 HydrophobicContact CD1-CB 4.16Å; I91-E96 HydrophobicContact CD1-CG 4.15Å; I91-R412 HydrophobicContact CG2-CG 3.49Å; I91-R412 VanDerWaalsContact CG2-CG 3.49Å
92	H	96.5	Very high	95.4	Very high	41 Å²	41	43.2 Å²	43.2	19%	0.19	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	99.6	162.5	-168.9	-43.7	0	0	0	110.4	E83 G94 R95 E96 Y124 M407	E83-H92 PolarHBondContact O-CE1 2.95Å; E83-H92 VanDerWaalsContact O-CE1 3.26Å; H92-G94 PolarHBondContact ND1-N 3.3Å; H92-G94 PolarHBondContact O-N 3.1Å; H92-R95 HydrophobicContact CB-CB 4.31Å; H92-R95 HydrophobicContact CB-CG 4.36Å; H92-R95 PolarHBondContact ND1-N 3.33Å; H92-R95 PolarHBondContact O-N 3.06Å; H92-E96 PolarHBondContact O-N 2.99Å; H92-Y124 AromaticContact CE1-CZ 3.66Å; H92-Y124 PolarHBondContact CE1-OH 3.21Å; H92-M407 PolarHBondContact N-O 2.66Å
93	Q	96.2	Very high	95.8	Very high	30 Å²	30	39.8 Å²	39.8	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-45.1	-172.2	-172.3	68.4	49.2	0	0	113	E83 G84 V86 I91 R95 E96 N97	E83-Q93 HydrophobicContact CB-CB 4.19Å; E83-Q93 HydrophobicContact CB-CG 4.32Å; E83-Q93 WeakPolarHBondContact OE2-CG 3.45Å; G84-Q93 PolarHBondContact O-N 2.99Å; V86-Q93 HydrophobicContact CG2-CB 3.62Å; V86-Q93 HydrophobicContact CG2-CG 4.26Å; I91-Q93 PolarHBondContact O-N 2.97Å; Q93-R95 VanDerWaalsContact C-N 3.32Å; Q93-R95 PolarHBondContact O-N 2.84Å; Q93-E96 PolarHBondContact O-N 2.79Å; Q93-N97 PolarHBondContact NE2-OD1 3.45Å; Q93-N97 PolarHBondContact O-N 2.76Å; Q93-N97 PolarHBondContact O-OD1 2.97Å
94	G	96.4	Very high	96	Very high	9 Å²	9	38.8 Å²	38.8	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-57.9	-40.9	178.8	0	0	0	0	0	113.7	E83 H92 V98	E83-G94 VanDerWaalsContact O-CA 3.29Å; E83-G94 WeakPolarHBondContact O-CA 3.34Å; E83-G94 PolarHBondContact O-N 3.4Å; E83-G94 VanDerWaalsContact O-N 3.1Å; H92-G94 PolarHBondContact ND1-N 3.3Å; H92-G94 PolarHBondContact O-N 3.1Å; G94-V98 WeakPolarHBondContact O-CG2 3.11Å; G94-V98 PolarHBondContact O-N 3.25Å; G94-V98 VanDerWaalsContact O-N 3.08Å
95	R	97.4	Very high	96.2	Very high	48 Å²	48	37.3 Å²	37.3	18%	0.181	19%	0.19	C	C	.	.	H	α-helix	trans	-64	-42	174.7	-73.1	176.6	158.7	-111.1	-15.6	111.5	H92 Q93 V98 R99 Y124 D126 A127	H92-R95 HydrophobicContact CB-CB 4.31Å; H92-R95 HydrophobicContact CB-CG 4.36Å; H92-R95 PolarHBondContact ND1-N 3.33Å; H92-R95 PolarHBondContact O-N 3.06Å; Q93-R95 VanDerWaalsContact C-N 3.32Å; Q93-R95 PolarHBondContact O-N 2.84Å; R95-V98 PolarHBondContact O-N 2.51Å; R95-R99 WeakPolarHBondContact O-CG 3.33Å; R95-R99 PolarHBondContact O-N 2.87Å; R95-R99 VanDerWaalsContact O-N 3.07Å; R95-Y124 HydrophobicContact CG-CD1 3.79Å; R95-Y124 HydrophobicContact CG-CD2 4.18Å; R95-Y124 HydrophobicContact CG-CE1 4.06Å; R95-Y124 HydrophobicContact CG-CE2 4.44Å; R95-Y124 HydrophobicContact CG-CG 3.85Å; R95-D126 IonicContact CZ-OD2 3.62Å; R95-D126 VanDerWaalsContact CZ-OD2 3.25Å; R95-D126 IonicContact NH1-OD2 3.27Å; R95-D126 PolarHBondContact NH1-OD2 3.45Å; R95-D126 IonicContact NH2-OD1 2.63Å; R95-D126 IonicContact NH2-OD2 3.48Å; R95-D126 PolarHBondContact NH2-OD2 3.2Å; R95-A127 HydrophobicContact CB-CB 4.24Å; R95-A127 HydrophobicContact CG-CB 4.49Å
96	E	96.2	Very high	96.4	Very high	19 Å²	19	32.7 Å²	32.7	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-68	-40.1	179.6	-168.8	57.8	-161.1	0	0	112.5	I91 H92 Q93 V98 R99 R100	I91-E96 HydrophobicContact CD1-CB 4.16Å; I91-E96 HydrophobicContact CD1-CG 4.15Å; H92-E96 PolarHBondContact O-N 2.99Å; Q93-E96 PolarHBondContact O-N 2.79Å; E96-V98 VanDerWaalsContact C-N 3.32Å; E96-V98 PolarHBondContact O-N 2.94Å; E96-R99 PolarHBondContact O-N 3.08Å; E96-R99 IonicContact OE2-CZ 2.72Å; E96-R99 IonicContact OE2-NH1 3.59Å; E96-R99 PolarHBondContact OE2-NH1 2.93Å; E96-R100 WeakPolarHBondContact O-CG 3.41Å; E96-R100 PolarHBondContact O-N 3.36Å
97	N	96.3	Very high	96.4	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-43.7	173.6	-65.5	-2.9	0	0	0	111.1	E57 L78 E83 Q93 R99 R100 A101	E57-N97 PolarHBondContact OE1-OD1 3.44Å; L78-N97 WeakPolarHBondContact O-CB 3.48Å; L78-N97 PolarHBondContact O-ND2 3.28Å; E83-N97 PolarHBondContact OE2-ND2 3.04Å; Q93-N97 PolarHBondContact NE2-OD1 3.45Å; Q93-N97 PolarHBondContact O-N 2.76Å; Q93-N97 PolarHBondContact O-OD1 2.97Å; N97-R99 PolarHBondContact O-N 3.48Å; N97-R100 PolarHBondContact O-N 2.84Å; N97-A101 WeakPolarHBondContact O-CB 3.33Å; N97-A101 PolarHBondContact O-N 3.31Å
98	V	97.5	Very high	96.5	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.024	15%	0.145	C	C	.	.	H	α-helix	trans	-58.4	-48.4	176	168.3	0	0	0	0	111.1	L78 G94 R95 E96 R100 A101 V102 C122 Y124 A127 A128	L78-V98 HydrophobicContact CD2-CG2 4.21Å; G94-V98 WeakPolarHBondContact O-CG2 3.11Å; G94-V98 PolarHBondContact O-N 3.25Å; G94-V98 VanDerWaalsContact O-N 3.08Å; R95-V98 PolarHBondContact O-N 2.51Å; E96-V98 VanDerWaalsContact C-N 3.32Å; E96-V98 PolarHBondContact O-N 2.94Å; V98-R100 PolarHBondContact O-N 3.4Å; V98-A101 PolarHBondContact O-N 3.24Å; V98-V102 HydrophobicContact CG1-CG2 4.16Å; V98-V102 VanDerWaalsContact O-CB 3.28Å; V98-V102 WeakPolarHBondContact O-CB 3.29Å; V98-V102 VanDerWaalsContact O-CG2 3.26Å; V98-V102 WeakPolarHBondContact O-CG2 3.15Å; V98-V102 PolarHBondContact O-N 2.62Å; V98-C122 HydrophobicContact CB-CB 4.42Å; V98-C122 HydrophobicContact CG1-CB 3.85Å; V98-C122 HydrophobicContact CG2-CB 3.68Å; V98-C122 WeakPolarHBondContact CG2-O 3.34Å; V98-Y124 HydrophobicContact CG2-CD2 3.96Å; V98-A127 HydrophobicContact CB-CB 4.31Å; V98-A127 HydrophobicContact CG1-CB 4.03Å; V98-A128 HydrophobicContact CG1-CB 3.82Å
99	R	97.7	Very high	96.7	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-55.3	-50.8	177	-70.4	179.9	-167	104.6	8.5	111.6	R95 E96 N97 A103 A127 E130 G131 Q408 T409 L480	R95-R99 WeakPolarHBondContact O-CG 3.33Å; R95-R99 PolarHBondContact O-N 2.87Å; R95-R99 VanDerWaalsContact O-N 3.07Å; E96-R99 PolarHBondContact O-N 3.08Å; E96-R99 IonicContact OE2-CZ 2.72Å; E96-R99 IonicContact OE2-NH1 3.59Å; E96-R99 PolarHBondContact OE2-NH1 2.93Å; N97-R99 PolarHBondContact O-N 3.48Å; R99-A103 WeakPolarHBondContact O-CB 3.34Å; R99-A103 PolarHBondContact O-N 3.32Å; R99-A127 HydrophobicContact CG-CB 4.06Å; R99-A127 VanDerWaalsContact CG-O 3.31Å; R99-A127 WeakPolarHBondContact CG-O 3.3Å; R99-E130 HydrophobicContact CG-CB 4.29Å; R99-E130 IonicContact CZ-OE2 3.77Å; R99-E130 VanDerWaalsContact CZ-OE2 3.23Å; R99-E130 IonicContact NE-OE2 2.69Å; R99-E130 PolarHBondContact NE-OE2 3.42Å; R99-E130 IonicContact NH2-OE2 2.94Å; R99-E130 PolarHBondContact NH2-OE2 3.1Å; R99-G131 VanDerWaalsContact O-CA 3.3Å; R99-G131 WeakPolarHBondContact O-CA 3.38Å; R99-Q408 PolarHBondContact NH2-O 2.92Å; R99-T409 PolarHBondContact NE-O 3.17Å; R99-T409 PolarHBondContact NH1-O 3.49Å; R99-T409 PolarHBondContact NH2-O 3.39Å; R99-L480 HydrophobicContact CB-CD1 4.28Å; R99-L480 HydrophobicContact CB-CD2 3.94Å
100	R	96.3	Very high	96.8	Very high	93 Å²	93	18.7 Å²	18.7	35%	0.351	9%	0.093	S	C	.	.	H	α-helix	trans	-67.9	-43.2	-175.2	-66.2	174.8	80	-156.5	8.3	112.3	E57 E96 N97 V98 A104	E57-R100 IonicContact OE1-NH1 3.51Å; E96-R100 WeakPolarHBondContact O-CG 3.41Å; E96-R100 PolarHBondContact O-N 3.36Å; N97-R100 PolarHBondContact O-N 2.84Å; V98-R100 PolarHBondContact O-N 3.4Å; R100-A104 PolarHBondContact O-N 2.97Å; R100-A104 VanDerWaalsContact O-N 3.1Å
101	A	97.1	Very high	96.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.4	-47.6	179.8	0	0	0	0	0	111.4	V76 C77 L78 N97 V98 A103 A104 G105	V76-A101 HydrophobicContact CB-CB 4.03Å; V76-A101 VanDerWaalsContact CG1-O 3.26Å; V76-A101 WeakPolarHBondContact CG1-O 3.49Å; V76-A101 HydrophobicContact CG2-CB 4.06Å; C77-A101 WeakPolarHBondContact O-CB 3.03Å; L78-A101 HydrophobicContact CD2-CB 3.68Å; N97-A101 WeakPolarHBondContact O-CB 3.33Å; N97-A101 PolarHBondContact O-N 3.31Å; V98-A101 PolarHBondContact O-N 3.24Å; A101-A103 VanDerWaalsContact C-N 3.33Å; A101-A103 PolarHBondContact O-N 2.8Å; A101-A104 PolarHBondContact O-N 3.5Å; A101-G105 PolarHBondContact O-N 3.06Å
102	V	98.1	Very high	96.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-41.2	176.7	173.1	0	0	0	0	111	V98 A104 G105 V106 V119 A128 A132	V98-V102 HydrophobicContact CG1-CG2 4.16Å; V98-V102 VanDerWaalsContact O-CB 3.28Å; V98-V102 WeakPolarHBondContact O-CB 3.29Å; V98-V102 VanDerWaalsContact O-CG2 3.26Å; V98-V102 WeakPolarHBondContact O-CG2 3.15Å; V98-V102 PolarHBondContact O-N 2.62Å; V102-A104 VanDerWaalsContact C-N 3.34Å; V102-A104 PolarHBondContact O-N 3.12Å; V102-G105 PolarHBondContact O-N 2.68Å; V102-G105 VanDerWaalsContact O-N 3.15Å; V102-V106 HydrophobicContact CG1-CG2 4Å; V102-V106 WeakPolarHBondContact O-CG2 3.46Å; V102-V106 PolarHBondContact O-N 2.93Å; V102-V119 HydrophobicContact CG1-CG1 3.57Å; V102-V119 HydrophobicContact CG2-CG1 4.22Å; V102-A128 WeakPolarHBondContact CG1-O 3.41Å; V102-A128 HydrophobicContact CG2-CB 4.1Å; V102-A132 HydrophobicContact CG1-CB 3.84Å
103	A	97.5	Very high	96.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-54.8	-48.8	173.6	0	0	0	0	0	112.3	R99 A101 G105 V107 S135 P479 L480	R99-A103 WeakPolarHBondContact O-CB 3.34Å; R99-A103 PolarHBondContact O-N 3.32Å; A101-A103 VanDerWaalsContact C-N 3.33Å; A101-A103 PolarHBondContact O-N 2.8Å; A103-G105 VanDerWaalsContact C-N 3.32Å; A103-G105 PolarHBondContact O-N 3.23Å; A103-V107 WeakPolarHBondContact O-CB 3.44Å; A103-V107 VanDerWaalsContact O-CG2 3.24Å; A103-V107 WeakPolarHBondContact O-CG2 3.3Å; A103-V107 PolarHBondContact O-N 2.85Å; A103-S135 WeakPolarHBondContact CA-OG 3.02Å; A103-S135 VanDerWaalsContact CB-CB 3.47Å; A103-P479 HydrophobicContact CB-CB 4.31Å; A103-L480 HydrophobicContact CB-CD2 3.86Å
104	A	96.4	Very high	96.7	Very high	23 Å²	23	23.5 Å²	23.5	19%	0.19	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-41.4	176.6	0	0	0	0	0	112.2	G58 C60 R100 A101 V102 A108	G58-A104 WeakPolarHBondContact O-CB 3.26Å; C60-A104 HydrophobicContact CB-CB 4.19Å; R100-A104 PolarHBondContact O-N 2.97Å; R100-A104 VanDerWaalsContact O-N 3.1Å; A101-A104 PolarHBondContact O-N 3.5Å; V102-A104 VanDerWaalsContact C-N 3.34Å; V102-A104 PolarHBondContact O-N 3.12Å; A104-A108 VanDerWaalsContact O-CB 3.25Å; A104-A108 WeakPolarHBondContact O-CB 3.21Å; A104-A108 PolarHBondContact O-N 2.96Å
105	G	97.5	Very high	96.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-53.4	177.7	0	0	0	0	0	113.5	V76 A101 V102 A103 A108 L109	V76-G105 VanDerWaalsContact CG1-CA 3.47Å; A101-G105 PolarHBondContact O-N 3.06Å; V102-G105 PolarHBondContact O-N 2.68Å; V102-G105 VanDerWaalsContact O-N 3.15Å; A103-G105 VanDerWaalsContact C-N 3.32Å; A103-G105 PolarHBondContact O-N 3.23Å; G105-A108 PolarHBondContact O-N 2.81Å; G105-L109 WeakPolarHBondContact O-CG 3.45Å; G105-L109 PolarHBondContact O-N 3.25Å
106	V	97.7	Very high	96.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.5	-40.8	-176.4	179.8	0	0	0	0	111.1	V13 V102 L109 R110 I117 V119 A132 T136 I155	V13-V106 HydrophobicContact CG2-CG2 3.87Å; V102-V106 HydrophobicContact CG1-CG2 4Å; V102-V106 WeakPolarHBondContact O-CG2 3.46Å; V102-V106 PolarHBondContact O-N 2.93Å; V106-L109 PolarHBondContact O-N 2.77Å; V106-R110 WeakPolarHBondContact O-CB 3.26Å; V106-R110 PolarHBondContact O-N 3.41Å; V106-I117 HydrophobicContact CG1-CD1 3.83Å; V106-I117 HydrophobicContact CG2-CG2 4.2Å; V106-V119 HydrophobicContact CG2-CG2 3.87Å; V106-A132 HydrophobicContact CG2-CB 3.9Å; V106-T136 HydrophobicContact CB-CG2 4.33Å; V106-T136 HydrophobicContact CG1-CG2 3.3Å; V106-I155 HydrophobicContact CG1-CD1 3.85Å; V106-I155 HydrophobicContact CG1-CG1 4.33Å
107	V	96.1	Very high	96.8	Very high	32 Å²	32	27.2 Å²	27.2	19%	0.194	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-47.1	175.7	171.7	0	0	0	0	110.8	A103 L109 R110 E111	A103-V107 WeakPolarHBondContact O-CB 3.44Å; A103-V107 VanDerWaalsContact O-CG2 3.24Å; A103-V107 WeakPolarHBondContact O-CG2 3.3Å; A103-V107 PolarHBondContact O-N 2.85Å; V107-L109 PolarHBondContact O-N 3.03Å; V107-R110 WeakPolarHBondContact O-CB 3.28Å; V107-R110 PolarHBondContact O-N 2.91Å; V107-E111 WeakPolarHBondContact O-CG 3.16Å; V107-E111 PolarHBondContact O-N 3.01Å
108	A	96.5	Very high	96.8	Very high	20 Å²	20	28.4 Å²	28.4	17%	0.165	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-41.4	178.6	0	0	0	0	0	112.3	C60 I62 A104 G105 E111 V112	C60-A108 HydrophobicContact CB-CB 4.42Å; I62-A108 HydrophobicContact CD1-CB 3.84Å; I62-A108 HydrophobicContact CG1-CB 4.17Å; A104-A108 VanDerWaalsContact O-CB 3.25Å; A104-A108 WeakPolarHBondContact O-CB 3.21Å; A104-A108 PolarHBondContact O-N 2.96Å; G105-A108 PolarHBondContact O-N 2.81Å; A108-E111 PolarHBondContact O-N 2.77Å; A108-V112 PolarHBondContact O-N 2.69Å; A108-V112 VanDerWaalsContact O-N 3.13Å
109	L	97.7	Very high	96.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-38.5	176.2	-75	170.8	0	0	0	112.5	V13 I62 A72 G105 V106 V107 E111 V112 G113 M114 I117	V13-L109 HydrophobicContact CG2-CD1 3.52Å; I62-L109 HydrophobicContact CD1-CD2 3.77Å; I62-L109 HydrophobicContact CD1-CG 3.96Å; A72-L109 HydrophobicContact CB-CD2 3.75Å; G105-L109 WeakPolarHBondContact O-CG 3.45Å; G105-L109 PolarHBondContact O-N 3.25Å; V106-L109 PolarHBondContact O-N 2.77Å; V107-L109 PolarHBondContact O-N 3.03Å; L109-E111 VanDerWaalsContact C-N 3.35Å; L109-V112 VanDerWaalsContact O-CG2 3.29Å; L109-V112 WeakPolarHBondContact O-CG2 3.37Å; L109-V112 PolarHBondContact O-N 2.9Å; L109-G113 PolarHBondContact O-N 2.8Å; L109-M114 HydrophobicContact CB-CB 4.32Å; L109-M114 HydrophobicContact CB-CG 4.25Å; L109-M114 HydrophobicContact CD2-CG 4.02Å; L109-M114 VanDerWaalsContact O-CB 3.3Å; L109-M114 WeakPolarHBondContact O-CB 3.33Å; L109-M114 WeakPolarHBondContact O-CG 3.36Å; L109-M114 PolarHBondContact O-N 3.24Å; L109-I117 HydrophobicContact CB-CD1 3.68Å; L109-I117 HydrophobicContact CB-CG1 4.07Å; L109-I117 HydrophobicContact CD1-CG1 4.44Å; L109-I117 HydrophobicContact CD1-CG2 3.71Å
110	R	96.1	Very high	96.9	Very high	15 Å²	15	28.2 Å²	28.2	6%	0.057	14%	0.144	C	C	.	.	H	α-helix	trans	-62.3	-42.6	173	178.6	174.8	65.6	177.1	-4	111.4	V106 V107 V112 G113 T136 P151 V153	V106-R110 WeakPolarHBondContact O-CB 3.26Å; V106-R110 PolarHBondContact O-N 3.41Å; V107-R110 WeakPolarHBondContact O-CB 3.28Å; V107-R110 PolarHBondContact O-N 2.91Å; R110-V112 VanDerWaalsContact C-N 3.33Å; R110-V112 PolarHBondContact O-N 2.78Å; R110-G113 WeakPolarHBondContact O-CA 3.26Å; R110-G113 PolarHBondContact O-N 2.8Å; R110-T136 PolarHBondContact NH1-O 2.68Å; R110-P151 WeakPolarHBondContact CD-O 3.41Å; R110-V153 HydrophobicContact CB-CG1 3.94Å; R110-V153 HydrophobicContact CG-CG1 3.73Å
111	E	94.9	Very high	96.9	Very high	138 Å²	138	24.5 Å²	24.5	65%	0.645	13%	0.133	S	C	*	.	H	α-helix	trans	-65.2	-34.4	-178.9	-74.6	177.6	167.7	0	0	112.9	V107 A108 L109 G113	V107-E111 WeakPolarHBondContact O-CG 3.16Å; V107-E111 PolarHBondContact O-N 3.01Å; A108-E111 PolarHBondContact O-N 2.77Å; L109-E111 VanDerWaalsContact C-N 3.35Å; E111-G113 PolarHBondContact O-N 2.94Å
112	V	96.1	Very high	96.8	Very high	53 Å²	53	24.6 Å²	24.6	32%	0.321	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	7.5	172.5	-55.1	0	0	0	0	113.2	Y64 A108 L109 R110 M114	Y64-V112 WeakPolarHBondContact OH-CG1 3.24Å; A108-V112 PolarHBondContact O-N 2.69Å; A108-V112 VanDerWaalsContact O-N 3.13Å; L109-V112 VanDerWaalsContact O-CG2 3.29Å; L109-V112 WeakPolarHBondContact O-CG2 3.37Å; L109-V112 PolarHBondContact O-N 2.9Å; R110-V112 VanDerWaalsContact C-N 3.33Å; R110-V112 PolarHBondContact O-N 2.78Å; V112-M114 HydrophobicContact CG2-CE 4.44Å; V112-M114 HydrophobicContact CG2-CG 4.24Å
113	G	95.4	Very high	96.6	Very high	23 Å²	23	28 Å²	28	24%	0.237	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	23.8	169.6	0	0	0	0	0	115.3	R9 L109 R110 E111	R9-G113 WeakPolarHBondContact CD-O 3.38Å; L109-G113 PolarHBondContact O-N 2.8Å; R110-G113 WeakPolarHBondContact O-CA 3.26Å; R110-G113 PolarHBondContact O-N 2.8Å; E111-G113 PolarHBondContact O-N 2.94Å
114	M	96.5	Very high	96.5	Very high	14 Å²	14	31.2 Å²	31.2	7%	0.069	18%	0.18	C	C	.	.			trans	-69.9	136.7	167.2	-60.8	-57.8	106.9	0	0	109.8	R9 N71 A72 L109 V112 I117 V153	R9-M114 HydrophobicContact CB-CE 4.07Å; R9-M114 HydrophobicContact CB-SD 4.07Å; N71-M114 HydrophobicContact CB-CE 4.21Å; N71-M114 HydrophobicContact CB-SD 3.91Å; A72-M114 HydrophobicContact CB-CE 4.29Å; A72-M114 HydrophobicContact CB-CG 4.21Å; A72-M114 HydrophobicContact CB-SD 4.01Å; L109-M114 HydrophobicContact CB-CB 4.32Å; L109-M114 HydrophobicContact CB-CG 4.25Å; L109-M114 HydrophobicContact CD2-CG 4.02Å; L109-M114 VanDerWaalsContact O-CB 3.3Å; L109-M114 WeakPolarHBondContact O-CB 3.33Å; L109-M114 WeakPolarHBondContact O-CG 3.36Å; L109-M114 PolarHBondContact O-N 3.24Å; V112-M114 HydrophobicContact CG2-CE 4.44Å; V112-M114 HydrophobicContact CG2-CG 4.24Å; M114-I117 HydrophobicContact CB-CG1 4.09Å; M114-V153 WeakPolarHBondContact O-CG1 3.49Å
115	K	95.5	Very high	96.6	Very high	138 Å²	138	30.3 Å²	30.3	60%	0.6	17%	0.172	S	C	*	.	S	Bend	trans	-105.1	-26.9	-178	-65.3	-171.9	176.6	-174.3	0	112.8	R9 V153 D154	R9-K115 PolarHBondContact O-N 2.87Å; K115-V153 WeakPolarHBondContact O-CA 3.22Å; K115-D154 PolarHBondContact O-N 2.87Å
116	E	97.1	Very high	96.6	Very high	15 Å²	15	30.7 Å²	30.7	7%	0.07	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130	172.6	-173.8	178.3	150.7	0	0	107.2	K8 R9 I10 G11 H118 D154 R156	K8-E116 WeakPolarHBondContact CE-OE2 3.46Å; K8-E116 IonicContact NZ-OE2 3.6Å; K8-E116 PolarHBondContact NZ-OE2 2.75Å; R9-E116 PolarHBondContact O-N 2.76Å; I10-E116 CarbonylContact C-O 2.96Å; I10-E116 WeakPolarHBondContact CA-O 3.49Å; I10-E116 HydrophobicContact CG1-CB 4.34Å; I10-E116 HydrophobicContact CG2-CB 4.21Å; I10-E116 HydrophobicContact CG2-CG 4.25Å; G11-E116 PolarHBondContact N-O 3.42Å; E116-H118 IonicContact OE1-CD2 3.5Å; E116-H118 IonicContact OE1-CE1 3.74Å; E116-H118 IonicContact OE1-NE2 2.77Å; E116-H118 PolarHBondContact OE1-NE2 3.29Å; E116-D154 CarbonylContact C-O 3.54Å; E116-D154 VanDerWaalsContact CA-O 3.29Å; E116-D154 WeakPolarHBondContact CA-O 3.37Å; E116-R156 IonicContact OE1-NH1 3.76Å
117	I	98	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	119.1	-177.6	-61.6	169.2	0	0	0	108.9	G11 V13 V106 L109 M114 V119 V153 D154 I155 R156	G11-I117 WeakPolarHBondContact O-CA 3.37Å; V13-I117 HydrophobicContact CG2-CG2 4.03Å; V106-I117 HydrophobicContact CG1-CD1 3.83Å; V106-I117 HydrophobicContact CG2-CG2 4.2Å; L109-I117 HydrophobicContact CB-CD1 3.68Å; L109-I117 HydrophobicContact CB-CG1 4.07Å; L109-I117 HydrophobicContact CD1-CG1 4.44Å; L109-I117 HydrophobicContact CD1-CG2 3.71Å; M114-I117 HydrophobicContact CB-CG1 4.09Å; I117-V119 HydrophobicContact CG2-CG2 4.11Å; I117-V153 HydrophobicContact CD1-CB 4.2Å; I117-V153 HydrophobicContact CD1-CG1 4.17Å; I117-V153 HydrophobicContact CD1-CG2 4.43Å; I117-D154 PolarHBondContact N-O 3.04Å; I117-I155 WeakPolarHBondContact O-CA 3.16Å; I117-R156 PolarHBondContact O-N 3.36Å
118	H	97.8	Very high	96.7	Very high	26 Å²	26	29.2 Å²	29.2	12%	0.12	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	138	173.7	-69.9	-132.2	0	0	0	109	G11 V12 V13 F70 E116 R156 Y158	G11-H118 PolarHBondContact O-N 3.08Å; V12-H118 CarbonylContact C-O 3.54Å; V12-H118 WeakPolarHBondContact CA-O 3.33Å; V12-H118 HydrophobicContact CB-CB 4.25Å; V12-H118 HydrophobicContact CG2-CB 4Å; V13-H118 PolarHBondContact N-O 3.34Å; F70-H118 HydrophobicContact CE1-CB 3.99Å; F70-H118 AromaticContact CE1-CD2 3.96Å; F70-H118 AromaticContact CE1-CG 3.8Å; F70-H118 HydrophobicContact CZ-CB 4.29Å; E116-H118 IonicContact OE1-CD2 3.5Å; E116-H118 IonicContact OE1-CE1 3.74Å; E116-H118 IonicContact OE1-NE2 2.77Å; E116-H118 PolarHBondContact OE1-NE2 3.29Å; H118-R156 CarbonylContact C-O 3.2Å; H118-R156 VanDerWaalsContact CA-O 3.3Å; H118-R156 WeakPolarHBondContact CA-O 3.43Å; H118-Y158 HydrophobicContact CB-CD2 4Å
119	V	98.5	Very high	96.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.7	-172.7	178.8	0	0	0	0	110.3	V13 V102 V106 I117 A128 A132 I155 R156 Y158 W170	V13-V119 HydrophobicContact CG2-CG2 4.43Å; V102-V119 HydrophobicContact CG1-CG1 3.57Å; V102-V119 HydrophobicContact CG2-CG1 4.22Å; V106-V119 HydrophobicContact CG2-CG2 3.87Å; I117-V119 HydrophobicContact CG2-CG2 4.11Å; V119-A128 HydrophobicContact CG1-CB 4.31Å; V119-A132 HydrophobicContact CG2-CB 4.42Å; V119-I155 HydrophobicContact CG2-CG2 3.71Å; V119-R156 PolarHBondContact N-O 3.46Å; V119-Y158 WeakPolarHBondContact O-CB 3.3Å; V119-Y158 PolarHBondContact O-N 2.93Å; V119-W170 HydrophobicContact CB-CH2 3.52Å; V119-W170 HydrophobicContact CB-CZ3 3.83Å; V119-W170 HydrophobicContact CG1-CH2 3.82Å; V119-W170 HydrophobicContact CG1-CZ3 3.75Å; V119-W170 HydrophobicContact CG2-CH2 3.96Å
120	D	97.6	Very high	96.8	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	16%	0.159	C	C	.	.			trans	-56.9	130.7	168.8	179.5	-8.2	0	0	0	111.1	V13 G15 T31 C122	V13-D120 WeakPolarHBondContact O-CB 3.38Å; V13-D120 PolarHBondContact O-N 3.38Å; G15-D120 PolarHBondContact N-OD2 2.72Å; T31-D120 WeakPolarHBondContact CB-OD2 3.49Å; T31-D120 WeakPolarHBondContact CG2-OD2 3.3Å; T31-D120 PolarHBondContact OG1-OD2 2.97Å; D120-C122 VanDerWaalsContact CG-SG 3.6Å; D120-C122 PolarHBondContact O-N 3.3Å; D120-C122 VanDerWaalsContact O-N 3.15Å; D120-C122 PolarHBondContact O-SG 3.29Å; D120-C122 PolarHBondContact OD1-N 3.15Å
121	P	96.5	Very high	96.9	Very high	16 Å²	16	27.7 Å²	27.7	10%	0.104	16%	0.156	C	C	.	.			trans	-61.3	-19.3	175.7	25.1	-35.3	0	0	0	114	G123 Y124 A125 L157 M166	P121-G123 PolarHBondContact O-N 2.86Å; P121-Y124 CarbonylContact O-C 3.5Å; P121-Y124 PolarHBondContact O-N 3.27Å; P121-A125 HydrophobicContact CB-CB 3.84Å; P121-A125 PolarHBondContact O-N 3.26Å; P121-L157 HydrophobicContact CB-CD1 4.01Å; P121-L157 HydrophobicContact CG-CD1 4.41Å; P121-M166 HydrophobicContact CG-SD 4.47Å
122	C	95.8	Very high	97	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.014	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	29	176.4	-59	0	0	0	0	114.5	T31 L78 V98 D120 Y124	T31-C122 HydrophobicContact CG2-CB 4.44Å; L78-C122 HydrophobicContact CD1-CB 3.79Å; L78-C122 HydrophobicContact CD2-CB 4.16Å; V98-C122 HydrophobicContact CB-CB 4.42Å; V98-C122 HydrophobicContact CG1-CB 3.85Å; V98-C122 HydrophobicContact CG2-CB 3.68Å; V98-C122 WeakPolarHBondContact CG2-O 3.34Å; D120-C122 VanDerWaalsContact CG-SG 3.6Å; D120-C122 PolarHBondContact O-N 3.3Å; D120-C122 VanDerWaalsContact O-N 3.15Å; D120-C122 PolarHBondContact O-SG 3.29Å; D120-C122 PolarHBondContact OD1-N 3.15Å; C122-Y124 PolarHBondContact O-N 2.9Å
123	G	93.4	Very high	97.1	Very high	70 Å²	70	20 Å²	20	72%	0.722	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.3	-17	-175.3	0	0	0	0	0	115.3	P121	P121-G123 PolarHBondContact O-N 2.86Å
124	Y	95.9	Very high	97.2	Very high	70 Å²	70	18.9 Å²	18.9	28%	0.275	11%	0.105	S	C	.	.			trans	-134.6	78.8	-179.8	-58.8	-70.7	0	0	0	109.9	H92 R95 V98 P121 C122 D126 A127 A128	H92-Y124 AromaticContact CE1-CZ 3.66Å; H92-Y124 PolarHBondContact CE1-OH 3.21Å; R95-Y124 HydrophobicContact CG-CD1 3.79Å; R95-Y124 HydrophobicContact CG-CD2 4.18Å; R95-Y124 HydrophobicContact CG-CE1 4.06Å; R95-Y124 HydrophobicContact CG-CE2 4.44Å; R95-Y124 HydrophobicContact CG-CG 3.85Å; V98-Y124 HydrophobicContact CG2-CD2 3.96Å; P121-Y124 CarbonylContact O-C 3.5Å; P121-Y124 PolarHBondContact O-N 3.27Å; C122-Y124 PolarHBondContact O-N 2.9Å; Y124-D126 PolarHBondContact O-N 3.36Å; Y124-A127 PolarHBondContact O-N 2.99Å; Y124-A128 PolarHBondContact O-N 3.42Å
125	A	97.2	Very high	97.2	Very high	3 Å²	3	18.3 Å²	18.3	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-61.2	-31.2	-171.5	0	0	0	0	0	113.7	P121 A129 M166 L169 W170	P121-A125 HydrophobicContact CB-CB 3.84Å; P121-A125 PolarHBondContact O-N 3.26Å; A125-A129 WeakPolarHBondContact O-CB 3.29Å; A125-A129 PolarHBondContact O-N 2.91Å; A125-M166 HydrophobicContact CB-CB 4.47Å; A125-L169 HydrophobicContact CB-CB 4.04Å; A125-W170 HydrophobicContact CB-CB 4.33Å
126	D	97.7	Very high	97.2	Very high	9 Å²	9	12.6 Å²	12.6	5%	0.048	8%	0.079	C	C	.	.	H	α-helix	trans	-63.7	-50.8	171.6	56.4	-25	0	0	0	111.3	R95 Y124 A128 A129 E130 L169 G173	R95-D126 IonicContact CZ-OD2 3.62Å; R95-D126 VanDerWaalsContact CZ-OD2 3.25Å; R95-D126 IonicContact NH1-OD2 3.27Å; R95-D126 PolarHBondContact NH1-OD2 3.45Å; R95-D126 IonicContact NH2-OD1 2.63Å; R95-D126 IonicContact NH2-OD2 3.48Å; R95-D126 PolarHBondContact NH2-OD2 3.2Å; Y124-D126 PolarHBondContact O-N 3.36Å; D126-A128 VanDerWaalsContact C-N 3.33Å; D126-A128 PolarHBondContact O-N 3.24Å; D126-A129 PolarHBondContact O-N 3.45Å; D126-E130 WeakPolarHBondContact O-CG 3.44Å; D126-E130 PolarHBondContact O-N 3.26Å; D126-L169 VanDerWaalsContact CA-O 3.27Å; D126-L169 WeakPolarHBondContact CA-O 3.46Å; D126-L169 HydrophobicContact CB-CB 4.26Å; D126-L169 HydrophobicContact CB-CD2 4.45Å; D126-L169 WeakPolarHBondContact CB-O 3.31Å; D126-G173 WeakPolarHBondContact O-CA 3.49Å
127	A	97.9	Very high	97.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64	-36.5	177.2	0	0	0	0	0	112.5	R95 V98 R99 Y124 E130 G131	R95-A127 HydrophobicContact CB-CB 4.24Å; R95-A127 HydrophobicContact CG-CB 4.49Å; V98-A127 HydrophobicContact CB-CB 4.31Å; V98-A127 HydrophobicContact CG1-CB 4.03Å; R99-A127 HydrophobicContact CG-CB 4.06Å; R99-A127 VanDerWaalsContact CG-O 3.31Å; R99-A127 WeakPolarHBondContact CG-O 3.3Å; Y124-A127 PolarHBondContact O-N 2.99Å; A127-E130 PolarHBondContact O-N 3.2Å; A127-G131 PolarHBondContact O-N 2.96Å
128	A	98.3	Very high	97	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-45.9	175.1	0	0	0	0	0	111.1	V98 V102 V119 Y124 D126 G131 A132 W170	V98-A128 HydrophobicContact CG1-CB 3.82Å; V102-A128 WeakPolarHBondContact CG1-O 3.41Å; V102-A128 HydrophobicContact CG2-CB 4.1Å; V119-A128 HydrophobicContact CG1-CB 4.31Å; Y124-A128 PolarHBondContact O-N 3.42Å; D126-A128 VanDerWaalsContact C-N 3.33Å; D126-A128 PolarHBondContact O-N 3.24Å; A128-G131 PolarHBondContact O-N 3.27Å; A128-A132 WeakPolarHBondContact O-CB 3.27Å; A128-A132 PolarHBondContact O-N 2.96Å; A128-W170 HydrophobicContact CB-CE3 4.49Å; A128-W170 HydrophobicContact CB-CZ3 4.01Å
129	A	98.5	Very high	96.8	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-46.5	174.1	0	0	0	0	0	111.2	A125 D126 G131 A132 F133 W170	A125-A129 WeakPolarHBondContact O-CB 3.29Å; A125-A129 PolarHBondContact O-N 2.91Å; D126-A129 PolarHBondContact O-N 3.45Å; A129-G131 PolarHBondContact O-N 3.15Å; A129-A132 PolarHBondContact O-N 3.49Å; A129-F133 HydrophobicContact CB-CD2 4.18Å; A129-F133 HydrophobicContact CB-CE2 4.27Å; A129-F133 WeakPolarHBondContact O-CD2 3.43Å; A129-F133 PolarHBondContact O-N 3.21Å; A129-W170 HydrophobicContact CB-CD2 3.73Å; A129-W170 HydrophobicContact CB-CE3 3.65Å; A129-W170 HydrophobicContact CB-CG 4.26Å; A129-W170 HydrophobicContact CB-CH2 4.19Å; A129-W170 HydrophobicContact CB-CZ2 4.28Å; A129-W170 HydrophobicContact CB-CZ3 3.9Å; A129-W170 WeakPolarHBondContact CB-O 3.49Å
130	E	98.5	Very high	96.7	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.019	11%	0.105	C	C	.	.	H	α-helix	trans	-54.8	-49.9	176.7	-71.8	174	142.6	0	0	111.7	R99 D126 A127 A132 L134 R491	R99-E130 HydrophobicContact CG-CB 4.29Å; R99-E130 IonicContact CZ-OE2 3.77Å; R99-E130 VanDerWaalsContact CZ-OE2 3.23Å; R99-E130 IonicContact NE-OE2 2.69Å; R99-E130 PolarHBondContact NE-OE2 3.42Å; R99-E130 IonicContact NH2-OE2 2.94Å; R99-E130 PolarHBondContact NH2-OE2 3.1Å; D126-E130 WeakPolarHBondContact O-CG 3.44Å; D126-E130 PolarHBondContact O-N 3.26Å; A127-E130 PolarHBondContact O-N 3.2Å; E130-A132 VanDerWaalsContact C-N 3.34Å; E130-A132 PolarHBondContact O-N 3.01Å; E130-L134 HydrophobicContact CB-CD1 4.37Å; E130-L134 WeakPolarHBondContact O-CB 3.13Å; E130-L134 WeakPolarHBondContact O-CD1 3.33Å; E130-L134 WeakPolarHBondContact O-CG 3.33Å; E130-L134 PolarHBondContact O-N 3.05Å; E130-R491 VanDerWaalsContact CD-NH1 3.28Å; E130-R491 WeakPolarHBondContact OE1-CD 3.36Å; E130-R491 IonicContact OE1-CZ 3.83Å; E130-R491 IonicContact OE1-NH1 2.75Å; E130-R491 PolarHBondContact OE1-NH1 2.89Å; E130-R491 IonicContact OE2-NH1 3.89Å; E130-R491 PolarHBondContact OE2-NH1 3.4Å
131	G	97.8	Very high	96.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.3	-44.8	176.7	0	0	0	0	0	113.1	R99 A127 A128 A129 S135	R99-G131 VanDerWaalsContact O-CA 3.3Å; R99-G131 WeakPolarHBondContact O-CA 3.38Å; A127-G131 PolarHBondContact O-N 2.96Å; A128-G131 PolarHBondContact O-N 3.27Å; A129-G131 PolarHBondContact O-N 3.15Å; G131-S135 VanDerWaalsContact O-CB 3.26Å; G131-S135 WeakPolarHBondContact O-CB 3.5Å; G131-S135 PolarHBondContact O-N 3.06Å; G131-S135 PolarHBondContact O-OG 3.22Å
132	A	98.2	Very high	96.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.7	-48.3	-178.7	0	0	0	0	0	112.8	V102 V106 V119 A128 A129 E130 S135 T136 I155 W170	V102-A132 HydrophobicContact CG1-CB 3.84Å; V106-A132 HydrophobicContact CG2-CB 3.9Å; V119-A132 HydrophobicContact CG2-CB 4.42Å; A128-A132 WeakPolarHBondContact O-CB 3.27Å; A128-A132 PolarHBondContact O-N 2.96Å; A129-A132 PolarHBondContact O-N 3.49Å; E130-A132 VanDerWaalsContact C-N 3.34Å; E130-A132 PolarHBondContact O-N 3.01Å; A132-S135 PolarHBondContact O-OG 2.87Å; A132-T136 WeakPolarHBondContact O-CB 3.41Å; A132-T136 WeakPolarHBondContact O-CG2 3.14Å; A132-T136 PolarHBondContact O-N 2.93Å; A132-T136 PolarHBondContact O-OG1 3.01Å; A132-I155 HydrophobicContact CB-CD1 4.28Å; A132-I155 HydrophobicContact CB-CG2 3.9Å; A132-W170 HydrophobicContact CB-CH2 4.37Å
133	F	98.1	Very high	96.6	Very high	29 Å²	29	28.4 Å²	28.4	13%	0.127	16%	0.157	C	C	.	.	H	α-helix	trans	-83.4	-30	-173.1	-69.2	-72.6	0	0	0	113.5	A129 I155 W170 Y174 A177 N181	A129-F133 HydrophobicContact CB-CD2 4.18Å; A129-F133 HydrophobicContact CB-CE2 4.27Å; A129-F133 WeakPolarHBondContact O-CD2 3.43Å; A129-F133 PolarHBondContact O-N 3.21Å; F133-I155 HydrophobicContact CD1-CD1 4.05Å; F133-I155 HydrophobicContact CE1-CB 3.81Å; F133-I155 HydrophobicContact CE1-CD1 4.04Å; F133-I155 HydrophobicContact CE1-CG1 4.36Å; F133-I155 HydrophobicContact CE1-CG2 4.43Å; F133-I155 HydrophobicContact CE2-CG2 4.41Å; F133-I155 HydrophobicContact CZ-CB 3.79Å; F133-I155 HydrophobicContact CZ-CG2 4.05Å; F133-W170 HydrophobicContact CE2-CH2 4.4Å; F133-W170 AromaticContact CE2-CZ2 3.63Å; F133-W170 HydrophobicContact CE2-CZ2 3.63Å; F133-W170 HydrophobicContact CZ-CZ2 4.14Å; F133-Y174 AromaticContact CD1-CD2 3.69Å; F133-Y174 HydrophobicContact CD1-CD2 3.69Å; F133-Y174 AromaticContact CD1-CE2 3.98Å; F133-Y174 HydrophobicContact CD1-CE2 3.98Å; F133-Y174 AromaticContact CD2-CD2 3.65Å; F133-Y174 HydrophobicContact CD2-CD2 3.65Å; F133-Y174 HydrophobicContact CD2-CG 4.31Å; F133-Y174 AromaticContact CE1-CD2 3.54Å; F133-Y174 HydrophobicContact CE1-CD2 3.54Å; F133-Y174 AromaticContact CE1-CE2 3.78Å; F133-Y174 HydrophobicContact CE1-CE2 3.78Å; F133-Y174 AromaticContact CE2-CD2 3.54Å; F133-Y174 HydrophobicContact CE2-CD2 3.54Å; F133-Y174 HydrophobicContact CE2-CG 4.08Å; F133-Y174 AromaticContact CG-CD2 3.75Å; F133-Y174 HydrophobicContact CG-CD2 3.75Å; F133-Y174 HydrophobicContact CG-CE2 4.43Å; F133-Y174 AromaticContact CZ-CD2 3.48Å; F133-Y174 HydrophobicContact CZ-CD2 3.48Å; F133-Y174 VanDerWaalsContact CZ-CD2 3.48Å; F133-Y174 HydrophobicContact CZ-CE2 4.11Å; F133-Y174 HydrophobicContact CZ-CG 4.28Å; F133-A177 HydrophobicContact CB-CB 3.67Å; F133-N181 PolarHBondContact O-ND2 2.91Å
134	L	97.6	Very high	96.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-45.7	172.9	-68.8	173	0	0	0	111.3	E130 T136 A177 Q180 R184 L480 F481	E130-L134 HydrophobicContact CB-CD1 4.37Å; E130-L134 WeakPolarHBondContact O-CB 3.13Å; E130-L134 WeakPolarHBondContact O-CD1 3.33Å; E130-L134 WeakPolarHBondContact O-CG 3.33Å; E130-L134 PolarHBondContact O-N 3.05Å; L134-T136 VanDerWaalsContact C-N 3.32Å; L134-T136 PolarHBondContact O-N 3.07Å; L134-A177 HydrophobicContact CD2-CB 4.03Å; L134-A177 HydrophobicContact CG-CB 3.89Å; L134-Q180 HydrophobicContact CD2-CB 3.93Å; L134-Q180 HydrophobicContact CD2-CG 3.95Å; L134-R184 PolarHBondContact O-NH1 3.49Å; L134-L480 CarbonylContact C-O 3.57Å; L134-L480 VanDerWaalsContact O-O 3.11Å; L134-F481 HydrophobicContact CD1-CE1 4.43Å
135	S	96.4	Very high	96.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.007	17%	0.17	C	C	.	.	H	α-helix	trans	-73.7	-20.2	-174.7	64.3	0	0	0	0	114.5	A103 G131 A132 L480 N482	A103-S135 WeakPolarHBondContact CA-OG 3.02Å; A103-S135 VanDerWaalsContact CB-CB 3.47Å; G131-S135 VanDerWaalsContact O-CB 3.26Å; G131-S135 WeakPolarHBondContact O-CB 3.5Å; G131-S135 PolarHBondContact O-N 3.06Å; G131-S135 PolarHBondContact O-OG 3.22Å; A132-S135 PolarHBondContact O-OG 2.87Å; S135-L480 WeakPolarHBondContact CA-O 3.49Å; S135-L480 PolarHBondContact N-O 2.72Å; S135-N482 PolarHBondContact O-ND2 3.39Å
136	T	95.4	Very high	96.5	Very high	19 Å²	19	37.3 Å²	37.3	12%	0.117	20%	0.199	C	C	.	.	H	α-helix	trans	-95.3	-15.4	-179.4	50	0	0	0	0	114.4	V106 R110 A132 L134 V153 I155	V106-T136 HydrophobicContact CB-CG2 4.33Å; V106-T136 HydrophobicContact CG1-CG2 3.3Å; R110-T136 PolarHBondContact NH1-O 2.68Å; A132-T136 WeakPolarHBondContact O-CB 3.41Å; A132-T136 WeakPolarHBondContact O-CG2 3.14Å; A132-T136 PolarHBondContact O-N 2.93Å; A132-T136 PolarHBondContact O-OG1 3.01Å; L134-T136 VanDerWaalsContact C-N 3.32Å; L134-T136 PolarHBondContact O-N 3.07Å; T136-V153 HydrophobicContact CG2-CG2 3.99Å; T136-I155 HydrophobicContact CG2-CD1 3.9Å; T136-I155 WeakPolarHBondContact OG1-CD1 3.31Å
137	F	95.6	Very high	96.3	Very high	33 Å²	33	43.8 Å²	43.8	15%	0.145	23%	0.229	C	C	.	.			trans	-51.6	145.7	169.5	176.6	-98.4	0	0	0	111	F139 N181 R184 R185 N482	F137-F139 HydrophobicContact CE1-CB 4.15Å; F137-F139 HydrophobicContact CZ-CB 4.35Å; F137-N181 HydrophobicContact CB-CB 4.4Å; F137-N181 WeakPolarHBondContact CB-OD1 3.44Å; F137-N181 HydrophobicContact CD2-CB 3.57Å; F137-N181 HydrophobicContact CE2-CB 4.03Å; F137-N181 WeakPolarHBondContact CE2-O 3.4Å; F137-N181 HydrophobicContact CG-CB 4.07Å; F137-R184 HydrophobicContact CD1-CB 4.45Å; F137-R184 HydrophobicContact CE1-CB 3.8Å; F137-R184 HydrophobicContact CZ-CB 4.02Å; F137-R185 HydrophobicContact CE2-CB 4.16Å; F137-R185 HydrophobicContact CZ-CB 3.93Å; F137-N482 PolarHBondContact O-ND2 2.84Å; F137-N482 PolarHBondContact O-OD1 3.39Å
138	A	93.5	Very high	96.1	Very high	30 Å²	30	47.9 Å²	47.9	25%	0.248	25%	0.251	C	S	.	.			trans	-145.5	133.2	169.5	0	0	0	0	0	108.1	D140 K150	A138-D140 PolarHBondContact O-N 2.92Å; A138-K150 HydrophobicContact CB-CB 3.98Å; A138-K150 HydrophobicContact CB-CG 3.88Å
139	F	94.7	Very high	95.9	Very high	48 Å²	48	52.1 Å²	52.1	21%	0.211	27%	0.267	C	S	.	.			trans	-87.4	86	169.1	-173.4	-96.3	0	0	0	108.9	F137 E141 L142 R185 D188 M189	F137-F139 HydrophobicContact CE1-CB 4.15Å; F137-F139 HydrophobicContact CZ-CB 4.35Å; F139-E141 HydrophobicContact CE2-CG 4.23Å; F139-E141 WeakPolarHBondContact CE2-OE1 3.1Å; F139-L142 HydrophobicContact CE1-CD1 4.02Å; F139-L142 HydrophobicContact CE1-CG 4.36Å; F139-L142 HydrophobicContact CZ-CD1 3.92Å; F139-L142 HydrophobicContact CZ-CG 4.16Å; F139-R185 HydrophobicContact CD2-CG 4.32Å; F139-R185 HydrophobicContact CE2-CG 4.29Å; F139-D188 HydrophobicContact CB-CB 4.09Å; F139-D188 HydrophobicContact CD1-CB 3.83Å; F139-D188 HydrophobicContact CD2-CB 3.72Å; F139-D188 HydrophobicContact CE1-CB 4.2Å; F139-D188 HydrophobicContact CE2-CB 4.11Å; F139-D188 HydrophobicContact CG-CB 3.58Å; F139-D188 HydrophobicContact CZ-CB 4.35Å; F139-M189 HydrophobicContact CE2-CB 4.43Å; F139-M189 HydrophobicContact CE2-CE 4.28Å; F139-M189 HydrophobicContact CE2-SD 4.45Å; F139-M189 HydrophobicContact CZ-CB 4.37Å; F139-M189 HydrophobicContact CZ-CE 4.45Å; F139-M189 HydrophobicContact CZ-SD 4.06Å
140	D	95.7	Very high	95.7	Very high	26 Å²	26	57.3 Å²	57.3	14%	0.139	29%	0.289	C	S	.	.			trans	-136.4	12.2	-179.8	60.7	17.9	0	0	0	113.5	A138 L142 K143 R149 K150	A138-D140 PolarHBondContact O-N 2.92Å; D140-L142 PolarHBondContact O-N 2.84Å; D140-L142 VanDerWaalsContact O-N 3.12Å; D140-K143 HydrophobicContact CB-CD 4.03Å; D140-K143 HydrophobicContact CB-CG 4.16Å; D140-K143 WeakPolarHBondContact O-CB 3.38Å; D140-K143 PolarHBondContact O-N 3.38Å; D140-R149 HydrophobicContact CB-CB 4.44Å; D140-R149 HydrophobicContact CB-CG 4.26Å; D140-R149 VanDerWaalsContact OD2-CA 3.3Å; D140-R149 WeakPolarHBondContact OD2-CA 3.19Å; D140-R149 WeakPolarHBondContact OD2-CB 3.41Å; D140-K150 PolarHBondContact OD2-N 3.15Å
141	E	95.1	Very high	95.4	Very high	67 Å²	67	61 Å²	61	31%	0.313	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.5	179.7	65.4	-175.8	168.7	0	0	113.2	F139 R149 R185 M189	F139-E141 HydrophobicContact CE2-CG 4.23Å; F139-E141 WeakPolarHBondContact CE2-OE1 3.1Å; E141-R149 PolarHBondContact O-NH2 2.93Å; E141-R185 VanDerWaalsContact CD-NE 3.32Å; E141-R185 VanDerWaalsContact CD-NH2 3.35Å; E141-R185 IonicContact OE1-CZ 2.88Å; E141-R185 VanDerWaalsContact OE1-CZ 3.28Å; E141-R185 IonicContact OE1-NE 3.55Å; E141-R185 PolarHBondContact OE1-NE 2.88Å; E141-R185 IonicContact OE1-NH2 3.25Å; E141-R185 PolarHBondContact OE1-NH2 2.85Å; E141-R185 VanDerWaalsContact OE1-NH2 3.09Å; E141-R185 IonicContact OE2-CZ 3.23Å; E141-R185 VanDerWaalsContact OE2-CZ 3.31Å; E141-R185 IonicContact OE2-NE 2.85Å; E141-R185 PolarHBondContact OE2-NE 2.85Å; E141-R185 IonicContact OE2-NH2 2.85Å; E141-R185 PolarHBondContact OE2-NH2 3.35Å; E141-M189 WeakPolarHBondContact OE1-CE 3.33Å
142	L	96.4	Very high	95.1	Very high	89 Å²	89	67.6 Å²	67.6	47%	0.466	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-6.3	176.3	-55.5	-175.6	0	0	0	113.8	F139 D140 S144 M189 P190 L193	F139-L142 HydrophobicContact CE1-CD1 4.02Å; F139-L142 HydrophobicContact CE1-CG 4.36Å; F139-L142 HydrophobicContact CZ-CD1 3.92Å; F139-L142 HydrophobicContact CZ-CG 4.16Å; D140-L142 PolarHBondContact O-N 2.84Å; D140-L142 VanDerWaalsContact O-N 3.12Å; L142-S144 PolarHBondContact O-N 2.68Å; L142-M189 HydrophobicContact CD1-SD 4.21Å; L142-M189 HydrophobicContact CD2-SD 4.29Å; L142-P190 HydrophobicContact CD1-CG 3.71Å; L142-L193 HydrophobicContact CD1-CD1 4.13Å; L142-L193 HydrophobicContact CD2-CD1 3.88Å
143	K	96.4	Very high	95	Very high	99 Å²	99	68.6 Å²	68.6	43%	0.43	36%	0.359	S	S	.	.			trans	-74.6	125.3	172.8	-63	-167.3	-177.5	-173.7	0	109.6	D140 D148 R149	D140-K143 HydrophobicContact CB-CD 4.03Å; D140-K143 HydrophobicContact CB-CG 4.16Å; D140-K143 WeakPolarHBondContact O-CB 3.38Å; D140-K143 PolarHBondContact O-N 3.38Å; K143-D148 HydrophobicContact CD-CB 3.78Å; K143-D148 VanDerWaalsContact CD-O 3.31Å; K143-D148 WeakPolarHBondContact CD-O 3.2Å; K143-D148 PolarHBondContact NZ-O 3.29Å; K143-R149 HydrophobicContact CB-CG 4.08Å; K143-R149 VanDerWaalsContact O-CZ 3.25Å; K143-R149 PolarHBondContact O-NE 3.28Å; K143-R149 PolarHBondContact O-NH2 3.03Å
144	S	96.5	Very high	94.9	Very high	112 Å²	112	70.4 Å²	70.4	78%	0.783	37%	0.371	S	S	*	.	S	Bend	trans	-70.7	-37.8	-178.8	55.2	0	0	0	0	113.1	L142	L142-S144 PolarHBondContact O-N 2.68Å
145	K	96.4	Very high	95	Very high	114 Å²	114	71 Å²	71	50%	0.496	37%	0.374	S	S	.	.			trans	-81.9	124.7	177.3	-67.1	-175.5	-175.8	-179.9	0	110.6	E147 D148	K145-E147 VanDerWaalsContact C-N 3.28Å; K145-E147 HydrophobicContact CB-CG 4.16Å; K145-E147 PolarHBondContact O-N 3.43Å; K145-D148 HydrophobicContact CB-CB 4.27Å; K145-D148 WeakPolarHBondContact CB-OD2 3.44Å; K145-D148 PolarHBondContact O-N 3.15Å
146	V	91.5	Very high	95	Very high	104 Å²	104	76.2 Å²	76.2	63%	0.63	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-67.8	-34.2	-178.7	175.3	0	0	0	0	110.7	D148 R149	V146-D148 PolarHBondContact O-N 3.24Å; V146-R149 WeakPolarHBondContact O-CB 3.38Å; V146-R149 PolarHBondContact O-N 2.66Å; V146-R149 VanDerWaalsContact O-N 3.08Å
147	E	93	Very high	95.1	Very high	144 Å²	144	76.1 Å²	76.1	67%	0.673	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-64.9	-23.5	177	60.2	-89.7	-151.2	0	0	113.9	K145 R149	K145-E147 VanDerWaalsContact C-N 3.28Å; K145-E147 HydrophobicContact CB-CG 4.16Å; K145-E147 PolarHBondContact O-N 3.43Å; E147-R149 VanDerWaalsContact C-N 3.31Å
148	D	94.2	Very high	95.1	Very high	86 Å²	86	74.8 Å²	74.8	46%	0.46	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-84.4	-9.6	174.9	-66.4	-28.2	0	0	0	112.4	K143 K145 V146	K143-D148 HydrophobicContact CD-CB 3.78Å; K143-D148 VanDerWaalsContact CD-O 3.31Å; K143-D148 WeakPolarHBondContact CD-O 3.2Å; K143-D148 PolarHBondContact NZ-O 3.29Å; K145-D148 HydrophobicContact CB-CB 4.27Å; K145-D148 WeakPolarHBondContact CB-OD2 3.44Å; K145-D148 PolarHBondContact O-N 3.15Å; V146-D148 PolarHBondContact O-N 3.24Å
149	R	94.6	Very high	94.6	Very high	90 Å²	90	76.7 Å²	76.7	34%	0.34	40%	0.398	S	S	.	.	S	Bend	trans	-83.7	150.4	175.5	-57.3	-178.4	-172.1	-179.6	-3.1	110.3	D140 E141 K143 V146 E147	D140-R149 HydrophobicContact CB-CB 4.44Å; D140-R149 HydrophobicContact CB-CG 4.26Å; D140-R149 VanDerWaalsContact OD2-CA 3.3Å; D140-R149 WeakPolarHBondContact OD2-CA 3.19Å; D140-R149 WeakPolarHBondContact OD2-CB 3.41Å; E141-R149 PolarHBondContact O-NH2 2.93Å; K143-R149 HydrophobicContact CB-CG 4.08Å; K143-R149 VanDerWaalsContact O-CZ 3.25Å; K143-R149 PolarHBondContact O-NE 3.28Å; K143-R149 PolarHBondContact O-NH2 3.03Å; V146-R149 WeakPolarHBondContact O-CB 3.38Å; V146-R149 PolarHBondContact O-N 2.66Å; V146-R149 VanDerWaalsContact O-N 3.08Å; E147-R149 VanDerWaalsContact C-N 3.31Å
150	K	93.6	Very high	93.9	Very high	109 Å²	109	77.5 Å²	77.5	47%	0.474	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-67.1	134.3	174.3	-67.2	-65	-173.3	176.1	0	108.9	A138 D140 V152	A138-K150 HydrophobicContact CB-CB 3.98Å; A138-K150 HydrophobicContact CB-CG 3.88Å; D140-K150 PolarHBondContact OD2-N 3.15Å; K150-V152 PolarHBondContact O-N 2.8Å
151	P	92.3	Very high	93.1	Very high	82 Å²	82	78.1 Å²	78.1	53%	0.532	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-57.5	133.6	177.5	-25.3	33.9	0	0	0	111.6	R110	R110-P151 WeakPolarHBondContact CD-O 3.41Å
152	V	92.6	Very high	92.5	Very high	138 Å²	138	79 Å²	79	84%	0.836	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-70.1	132.8	171.1	-178.4	0	0	0	0	108.6	K150	K150-V152 PolarHBondContact O-N 2.8Å
153	V	95.1	Very high	92.3	Very high	20 Å²	20	77.8 Å²	77.8	12%	0.121	41%	0.413	C	S	.	.			trans	-119.4	135.4	177.6	-67.8	0	0	0	0	109.9	R110 M114 K115 I117 T136 I155	R110-V153 HydrophobicContact CB-CG1 3.94Å; R110-V153 HydrophobicContact CG-CG1 3.73Å; M114-V153 WeakPolarHBondContact O-CG1 3.49Å; K115-V153 WeakPolarHBondContact O-CA 3.22Å; I117-V153 HydrophobicContact CD1-CB 4.2Å; I117-V153 HydrophobicContact CD1-CG1 4.17Å; I117-V153 HydrophobicContact CD1-CG2 4.43Å; T136-V153 HydrophobicContact CG2-CG2 3.99Å; V153-I155 HydrophobicContact CG2-CD1 4.03Å; V153-I155 HydrophobicContact CG2-CG1 3.88Å
154	D	97.4	Very high	92.1	Very high	68 Å²	68	76.8 Å²	76.8	36%	0.364	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.3	171.5	-179.4	5.6	0	0	0	108.6	K115 E116 I117 R156	K115-D154 PolarHBondContact O-N 2.87Å; E116-D154 CarbonylContact C-O 3.54Å; E116-D154 VanDerWaalsContact CA-O 3.29Å; E116-D154 WeakPolarHBondContact CA-O 3.37Å; I117-D154 PolarHBondContact N-O 3.04Å; D154-R156 IonicContact OD1-NE 3.89Å; D154-R156 PolarHBondContact OD1-NE 2.92Å; D154-R156 IonicContact OD2-CZ 2.67Å; D154-R156 IonicContact OD2-NE 2.91Å; D154-R156 PolarHBondContact OD2-NE 3.4Å; D154-R156 IonicContact OD2-NH2 2.71Å; D154-R156 PolarHBondContact OD2-NH2 3.4Å
155	I	98.1	Very high	92	Very high	12 Å²	12	77.5 Å²	77.5	6%	0.062	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.5	-174.9	-53.8	171.9	0	0	0	109	V106 I117 V119 A132 F133 T136 V153 W170	V106-I155 HydrophobicContact CG1-CD1 3.85Å; V106-I155 HydrophobicContact CG1-CG1 4.33Å; I117-I155 WeakPolarHBondContact O-CA 3.16Å; V119-I155 HydrophobicContact CG2-CG2 3.71Å; A132-I155 HydrophobicContact CB-CD1 4.28Å; A132-I155 HydrophobicContact CB-CG2 3.9Å; F133-I155 HydrophobicContact CD1-CD1 4.05Å; F133-I155 HydrophobicContact CE1-CB 3.81Å; F133-I155 HydrophobicContact CE1-CD1 4.04Å; F133-I155 HydrophobicContact CE1-CG1 4.36Å; F133-I155 HydrophobicContact CE1-CG2 4.43Å; F133-I155 HydrophobicContact CE2-CG2 4.41Å; F133-I155 HydrophobicContact CZ-CB 3.79Å; F133-I155 HydrophobicContact CZ-CG2 4.05Å; T136-I155 HydrophobicContact CG2-CD1 3.9Å; T136-I155 WeakPolarHBondContact OG1-CD1 3.31Å; V153-I155 HydrophobicContact CG2-CD1 4.03Å; V153-I155 HydrophobicContact CG2-CG1 3.88Å; I155-W170 HydrophobicContact CG2-CH2 4.12Å; I155-W170 HydrophobicContact CG2-CZ2 3.96Å
156	R	97.3	Very high	91.9	Very high	111 Å²	111	75.1 Å²	75.1	42%	0.419	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.7	-175.8	-58.8	-179.5	-178.4	-163.4	-2.4	111.2	E116 I117 H118 V119 D154 Y158	E116-R156 IonicContact OE1-NH1 3.76Å; I117-R156 PolarHBondContact O-N 3.36Å; H118-R156 CarbonylContact C-O 3.2Å; H118-R156 VanDerWaalsContact CA-O 3.3Å; H118-R156 WeakPolarHBondContact CA-O 3.43Å; V119-R156 PolarHBondContact N-O 3.46Å; D154-R156 IonicContact OD1-NE 3.89Å; D154-R156 PolarHBondContact OD1-NE 2.92Å; D154-R156 IonicContact OD2-CZ 2.67Å; D154-R156 IonicContact OD2-NE 2.91Å; D154-R156 PolarHBondContact OD2-NE 3.4Å; D154-R156 IonicContact OD2-NH2 2.71Å; D154-R156 PolarHBondContact OD2-NH2 3.4Å; R156-Y158 PolarHBondContact O-N 2.95Å
157	L	97.4	Very high	92.1	Very high	16 Å²	16	74.3 Å²	74.3	8%	0.084	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	129.8	168.1	-179.6	61.7	0	0	0	109.5	P121 S159 K162 M166 E167 W170	P121-L157 HydrophobicContact CB-CD1 4.01Å; P121-L157 HydrophobicContact CG-CD1 4.41Å; L157-S159 PolarHBondContact O-N 3.39Å; L157-K162 HydrophobicContact CD2-CD 4.4Å; L157-K162 HydrophobicContact CD2-CG 3.97Å; L157-M166 HydrophobicContact CD2-CB 4.4Å; L157-E167 HydrophobicContact CD2-CG 4.25Å; L157-W170 HydrophobicContact CB-CB 4.44Å; L157-W170 HydrophobicContact CB-CD2 3.74Å; L157-W170 HydrophobicContact CB-CE3 4.18Å; L157-W170 HydrophobicContact CB-CG 3.83Å; L157-W170 HydrophobicContact CD1-CB 4.5Å; L157-W170 HydrophobicContact CD1-CD2 4.06Å; L157-W170 HydrophobicContact CD1-CE3 3.68Å; L157-W170 HydrophobicContact CD1-CG 4.41Å; L157-W170 HydrophobicContact CD1-CZ3 4.32Å; L157-W170 HydrophobicContact CD2-CB 3.99Å; L157-W170 HydrophobicContact CD2-CG 4.28Å; L157-W170 HydrophobicContact CG-CD2 4.37Å; L157-W170 HydrophobicContact CG-CE3 4.47Å; L157-W170 HydrophobicContact CG-CG 4.4Å
158	Y	95.9	Very high	92.3	Very high	5 Å²	5	71.3 Å²	71.3	2%	0.02	39%	0.394	C	S	.	.			trans	-62.8	131	175.4	-178.9	-117.4	0	0	0	110.5	V12 A33 F37 E68 F70 H118 V119 R156 E160	V12-Y158 HydrophobicContact CG2-CD2 3.86Å; V12-Y158 HydrophobicContact CG2-CE2 4.22Å; V12-Y158 HydrophobicContact CG2-CG 4.31Å; A33-Y158 HydrophobicContact CB-CD1 4.14Å; A33-Y158 HydrophobicContact CB-CE1 4.43Å; F37-Y158 HydrophobicContact CD2-CE2 4.35Å; F37-Y158 AromaticContact CD2-CZ 3.85Å; F37-Y158 WeakPolarHBondContact CD2-OH 3.39Å; E68-Y158 PolarHBondContact OE1-OH 3.01Å; E68-Y158 PolarHBondContact OE2-OH 2.8Å; F70-Y158 AromaticContact CE2-CE2 3.84Å; F70-Y158 HydrophobicContact CE2-CE2 3.84Å; F70-Y158 HydrophobicContact CZ-CD2 4.1Å; F70-Y158 AromaticContact CZ-CE2 3.76Å; F70-Y158 HydrophobicContact CZ-CE2 3.76Å; H118-Y158 HydrophobicContact CB-CD2 4Å; V119-Y158 WeakPolarHBondContact O-CB 3.3Å; V119-Y158 PolarHBondContact O-N 2.93Å; R156-Y158 PolarHBondContact O-N 2.95Å; Y158-E160 HydrophobicContact CD1-CB 4.11Å; Y158-E160 HydrophobicContact CE1-CB 3.43Å; Y158-E160 VanDerWaalsContact CE1-CB 3.43Å; Y158-E160 PolarHBondContact O-N 3.17Å
159	S	82.3	Confident	92.4	Very high	71 Å²	71	70.5 Å²	70.5	50%	0.497	39%	0.39	S	S	.	.			trans	-79	-18.4	-163	52.5	0	0	0	0	115.3	L157 G161 K162	L157-S159 PolarHBondContact O-N 3.39Å; S159-G161 PolarHBondContact O-N 2.87Å; S159-K162 WeakPolarHBondContact O-CB 3.12Å; S159-K162 PolarHBondContact O-N 3.43Å
160	E	80	Confident	92.6	Very high	65 Å²	65	67.3 Å²	67.3	30%	0.304	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	115.7	-169.4	-165.9	66.2	-165.6	0	0	113	R36 K40 Y158	R36-E160 HydrophobicContact CB-CG 4.16Å; R36-E160 PolarHBondContact NH2-O 2.85Å; K40-E160 WeakPolarHBondContact CE-OE1 3.49Å; K40-E160 WeakPolarHBondContact CE-OE2 3.3Å; K40-E160 IonicContact NZ-OE1 3.09Å; K40-E160 PolarHBondContact NZ-OE1 3.39Å; K40-E160 IonicContact NZ-OE2 2.89Å; K40-E160 PolarHBondContact NZ-OE2 3.44Å; Y158-E160 HydrophobicContact CD1-CB 4.11Å; Y158-E160 HydrophobicContact CE1-CB 3.43Å; Y158-E160 VanDerWaalsContact CE1-CB 3.43Å; Y158-E160 PolarHBondContact O-N 3.17Å
161	G	78.4	Confident	92.7	Very high	39 Å²	39	68.5 Å²	68.5	40%	0.402	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	22.5	-174.3	0	0	0	0	0	113.2	S159	S159-G161 PolarHBondContact O-N 2.87Å
162	K	83.2	Confident	93	Very high	86 Å²	86	66.7 Å²	66.7	37%	0.374	37%	0.366	S	S	.	.			trans	-60.1	132.3	172.1	-171.4	-174.6	-159.4	-132.3	0	110	L157 S159 E167	L157-K162 HydrophobicContact CD2-CD 4.4Å; L157-K162 HydrophobicContact CD2-CG 3.97Å; S159-K162 WeakPolarHBondContact O-CB 3.12Å; S159-K162 PolarHBondContact O-N 3.43Å; K162-E167 HydrophobicContact CD-CG 3.89Å; K162-E167 WeakPolarHBondContact CD-OE1 3.35Å; K162-E167 WeakPolarHBondContact CE-OE1 3.39Å; K162-E167 HydrophobicContact CG-CG 3.75Å; K162-E167 WeakPolarHBondContact CG-OE1 3.49Å; K162-E167 IonicContact NZ-OE1 3.46Å; K162-E167 PolarHBondContact NZ-OE1 3.17Å; K162-E167 IonicContact NZ-OE2 3.78Å; K162-E167 PolarHBondContact NZ-OE2 3.47Å; K162-E167 VanDerWaalsContact NZ-OE2 3.16Å
163	T	91.7	Very high	93.3	Very high	62 Å²	62	60.1 Å²	60.1	38%	0.38	33%	0.326	S	S	.	.			trans	-117.4	160.4	174.1	61.7	0	0	0	0	109.6	D165 M166 E167	T163-D165 PolarHBondContact O-N 2.91Å; T163-M166 HydrophobicContact CG2-CE 4.39Å; T163-M166 HydrophobicContact CG2-SD 4.45Å; T163-M166 PolarHBondContact O-N 3.12Å; T163-M166 VanDerWaalsContact OG1-CG 3.22Å; T163-M166 WeakPolarHBondContact OG1-CG 3.43Å; T163-M166 PolarHBondContact OG1-N 3.06Å; T163-E167 PolarHBondContact O-N 3.07Å
164	A	93.3	Very high	93.4	Very high	78 Å²	78	64.4 Å²	64.4	65%	0.645	34%	0.34	S	S	*	.	H	α-helix	trans	-58.7	-36.9	177.3	0	0	0	0	0	112.4	E167 S168	A164-E167 WeakPolarHBondContact O-CB 3.46Å; A164-E167 PolarHBondContact O-N 3.44Å; A164-S168 PolarHBondContact O-N 3.23Å
165	D	93.9	Very high	93.5	Very high	127 Å²	127	61.6 Å²	61.6	68%	0.679	33%	0.325	S	S	*	.	H	α-helix	trans	-66.3	-42.9	177.4	-65	-18.4	0	0	0	111.7	T163 E167 S168 L169	T163-D165 PolarHBondContact O-N 2.91Å; D165-E167 VanDerWaalsContact C-N 3.29Å; D165-E167 PolarHBondContact O-N 2.89Å; D165-S168 PolarHBondContact O-N 2.87Å; D165-L169 WeakPolarHBondContact O-CG 3.35Å; D165-L169 PolarHBondContact O-N 2.79Å
166	M	95.1	Very high	93.5	Very high	65 Å²	65	61.2 Å²	61.2	32%	0.32	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-37.6	175	-70.6	172	-168.3	0	0	111.9	P121 A125 L157 T163 W170	P121-M166 HydrophobicContact CG-SD 4.47Å; A125-M166 HydrophobicContact CB-CB 4.47Å; L157-M166 HydrophobicContact CD2-CB 4.4Å; T163-M166 HydrophobicContact CG2-CE 4.39Å; T163-M166 HydrophobicContact CG2-SD 4.45Å; T163-M166 PolarHBondContact O-N 3.12Å; T163-M166 VanDerWaalsContact OG1-CG 3.22Å; T163-M166 WeakPolarHBondContact OG1-CG 3.43Å; T163-M166 PolarHBondContact OG1-N 3.06Å; M166-W170 VanDerWaalsContact O-CB 3.3Å; M166-W170 WeakPolarHBondContact O-CB 3.25Å; M166-W170 PolarHBondContact O-N 3.39Å
167	E	95.6	Very high	93.5	Very high	87 Å²	87	56 Å²	56	41%	0.407	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-45.1	174.3	-77.6	-175.8	-151.1	0	0	112.6	L157 K162 T163 A164 D165 W170 K171	L157-E167 HydrophobicContact CD2-CG 4.25Å; K162-E167 HydrophobicContact CD-CG 3.89Å; K162-E167 WeakPolarHBondContact CD-OE1 3.35Å; K162-E167 WeakPolarHBondContact CE-OE1 3.39Å; K162-E167 HydrophobicContact CG-CG 3.75Å; K162-E167 WeakPolarHBondContact CG-OE1 3.49Å; K162-E167 IonicContact NZ-OE1 3.46Å; K162-E167 PolarHBondContact NZ-OE1 3.17Å; K162-E167 IonicContact NZ-OE2 3.78Å; K162-E167 PolarHBondContact NZ-OE2 3.47Å; K162-E167 VanDerWaalsContact NZ-OE2 3.16Å; T163-E167 PolarHBondContact O-N 3.07Å; A164-E167 WeakPolarHBondContact O-CB 3.46Å; A164-E167 PolarHBondContact O-N 3.44Å; D165-E167 VanDerWaalsContact C-N 3.29Å; D165-E167 PolarHBondContact O-N 2.89Å; E167-W170 PolarHBondContact O-N 2.71Å; E167-K171 WeakPolarHBondContact O-CB 3.35Å; E167-K171 PolarHBondContact O-N 2.86Å
168	S	95.7	Very high	93.6	Very high	81 Å²	81	56.9 Å²	56.9	57%	0.566	31%	0.312	S	S	*	.	H	α-helix	trans	-60.6	-47.3	177.2	-173.3	0	0	0	0	111.1	A164 D165 K171 R172	A164-S168 PolarHBondContact O-N 3.23Å; D165-S168 PolarHBondContact O-N 2.87Å; S168-K171 PolarHBondContact O-N 2.77Å; S168-R172 WeakPolarHBondContact O-CB 3.48Å; S168-R172 PolarHBondContact O-N 3.41Å
169	L	96.7	Very high	93.7	Very high	69 Å²	69	56.7 Å²	56.7	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.8	-72.2	173	0	0	0	112.5	A125 D126 D165 K171 R172 G173	A125-L169 HydrophobicContact CB-CB 4.04Å; D126-L169 VanDerWaalsContact CA-O 3.27Å; D126-L169 WeakPolarHBondContact CA-O 3.46Å; D126-L169 HydrophobicContact CB-CB 4.26Å; D126-L169 HydrophobicContact CB-CD2 4.45Å; D126-L169 WeakPolarHBondContact CB-O 3.31Å; D165-L169 WeakPolarHBondContact O-CG 3.35Å; D165-L169 PolarHBondContact O-N 2.79Å; L169-K171 PolarHBondContact O-N 2.86Å; L169-R172 WeakPolarHBondContact O-CB 3.48Å; L169-R172 PolarHBondContact O-N 2.89Å; L169-G173 PolarHBondContact O-N 3.27Å
170	W	98	Very high	94.5	Very high	23 Å²	23	53.3 Å²	53.3	9%	0.087	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-46.7	175.3	177.2	-88.8	0	0	0	111.6	V119 A125 A128 A129 A132 F133 I155 L157 M166 E167 R172 G173 Y174	V119-W170 HydrophobicContact CB-CH2 3.52Å; V119-W170 HydrophobicContact CB-CZ3 3.83Å; V119-W170 HydrophobicContact CG1-CH2 3.82Å; V119-W170 HydrophobicContact CG1-CZ3 3.75Å; V119-W170 HydrophobicContact CG2-CH2 3.96Å; A125-W170 HydrophobicContact CB-CB 4.33Å; A128-W170 HydrophobicContact CB-CE3 4.49Å; A128-W170 HydrophobicContact CB-CZ3 4.01Å; A129-W170 HydrophobicContact CB-CD2 3.73Å; A129-W170 HydrophobicContact CB-CE3 3.65Å; A129-W170 HydrophobicContact CB-CG 4.26Å; A129-W170 HydrophobicContact CB-CH2 4.19Å; A129-W170 HydrophobicContact CB-CZ2 4.28Å; A129-W170 HydrophobicContact CB-CZ3 3.9Å; A129-W170 WeakPolarHBondContact CB-O 3.49Å; A132-W170 HydrophobicContact CB-CH2 4.37Å; F133-W170 HydrophobicContact CE2-CH2 4.4Å; F133-W170 AromaticContact CE2-CZ2 3.63Å; F133-W170 HydrophobicContact CE2-CZ2 3.63Å; F133-W170 HydrophobicContact CZ-CZ2 4.14Å; I155-W170 HydrophobicContact CG2-CH2 4.12Å; I155-W170 HydrophobicContact CG2-CZ2 3.96Å; L157-W170 HydrophobicContact CB-CB 4.44Å; L157-W170 HydrophobicContact CB-CD2 3.74Å; L157-W170 HydrophobicContact CB-CE3 4.18Å; L157-W170 HydrophobicContact CB-CG 3.83Å; L157-W170 HydrophobicContact CD1-CB 4.5Å; L157-W170 HydrophobicContact CD1-CD2 4.06Å; L157-W170 HydrophobicContact CD1-CE3 3.68Å; L157-W170 HydrophobicContact CD1-CG 4.41Å; L157-W170 HydrophobicContact CD1-CZ3 4.32Å; L157-W170 HydrophobicContact CD2-CB 3.99Å; L157-W170 HydrophobicContact CD2-CG 4.28Å; L157-W170 HydrophobicContact CG-CD2 4.37Å; L157-W170 HydrophobicContact CG-CE3 4.47Å; L157-W170 HydrophobicContact CG-CG 4.4Å; M166-W170 VanDerWaalsContact O-CB 3.3Å; M166-W170 WeakPolarHBondContact O-CB 3.25Å; M166-W170 PolarHBondContact O-N 3.39Å; E167-W170 PolarHBondContact O-N 2.71Å; W170-R172 VanDerWaalsContact C-N 3.31Å; W170-R172 PolarHBondContact O-N 2.91Å; W170-G173 PolarHBondContact O-N 2.94Å; W170-Y174 PolarHBondContact O-N 2.68Å
171	K	97.5	Very high	95.4	Very high	134 Å²	134	51 Å²	51	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-60.3	-42.3	177.2	-175.2	179.7	178.2	-174.8	0	111.1	E167 S168 L169 Y174 I175	E167-K171 WeakPolarHBondContact O-CB 3.35Å; E167-K171 PolarHBondContact O-N 2.86Å; S168-K171 PolarHBondContact O-N 2.77Å; L169-K171 PolarHBondContact O-N 2.86Å; K171-Y174 WeakPolarHBondContact O-CB 3.49Å; K171-Y174 PolarHBondContact O-N 2.72Å; K171-I175 HydrophobicContact CG-CD1 4.04Å; K171-I175 WeakPolarHBondContact O-CD1 3.31Å; K171-I175 VanDerWaalsContact O-CG1 3.28Å; K171-I175 WeakPolarHBondContact O-CG1 3.32Å; K171-I175 PolarHBondContact O-N 2.94Å
172	R	97.6	Very high	96.3	Very high	44 Å²	44	50.4 Å²	50.4	17%	0.166	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-50.7	174.8	176.6	178.9	175.2	73.6	5.3	111.7	S168 L169 W170 Y174 I175 L176 L304 E498	S168-R172 WeakPolarHBondContact O-CB 3.48Å; S168-R172 PolarHBondContact O-N 3.41Å; L169-R172 WeakPolarHBondContact O-CB 3.48Å; L169-R172 PolarHBondContact O-N 2.89Å; W170-R172 VanDerWaalsContact C-N 3.31Å; W170-R172 PolarHBondContact O-N 2.91Å; R172-Y174 VanDerWaalsContact C-N 3.31Å; R172-Y174 PolarHBondContact O-N 2.8Å; R172-I175 PolarHBondContact O-N 3.25Å; R172-I175 VanDerWaalsContact O-N 3.13Å; R172-L176 HydrophobicContact CG-CD1 4.25Å; R172-L176 WeakPolarHBondContact O-CG 3.49Å; R172-L176 PolarHBondContact O-N 3.13Å; R172-L304 HydrophobicContact CB-CD2 4.38Å; R172-L304 HydrophobicContact CG-CD2 4.2Å; R172-E498 IonicContact CZ-OE1 2.66Å; R172-E498 IonicContact CZ-OE2 3.64Å; R172-E498 IonicContact NH1-OE1 2.79Å; R172-E498 PolarHBondContact NH1-OE1 3.33Å; R172-E498 IonicContact NH1-OE2 3.98Å; R172-E498 PolarHBondContact NH1-OE2 2.96Å; R172-E498 IonicContact NH2-OE1 3.16Å; R172-E498 PolarHBondContact NH2-OE1 2.71Å; R172-E498 IonicContact NH2-OE2 2.7Å; R172-E498 PolarHBondContact NH2-OE2 3.26Å
173	G	98.3	Very high	97.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-38.5	178.5	0	0	0	0	0	112.9	D126 L169 W170 A177	D126-G173 WeakPolarHBondContact O-CA 3.49Å; L169-G173 PolarHBondContact O-N 3.27Å; W170-G173 PolarHBondContact O-N 2.94Å; G173-A177 VanDerWaalsContact O-CB 3.31Å; G173-A177 WeakPolarHBondContact O-CB 3.47Å; G173-A177 PolarHBondContact O-N 3.27Å
174	Y	98.5	Very high	97.3	Very high	109 Å²	109	43.4 Å²	43.4	43%	0.427	23%	0.228	S	C	.	.	H	α-helix	trans	-59.4	-46.6	171.4	166	-107.7	0	0	0	112.3	F133 W170 K171 R172 A177 S178	F133-Y174 AromaticContact CD1-CD2 3.69Å; F133-Y174 HydrophobicContact CD1-CD2 3.69Å; F133-Y174 AromaticContact CD1-CE2 3.98Å; F133-Y174 HydrophobicContact CD1-CE2 3.98Å; F133-Y174 AromaticContact CD2-CD2 3.65Å; F133-Y174 HydrophobicContact CD2-CD2 3.65Å; F133-Y174 HydrophobicContact CD2-CG 4.31Å; F133-Y174 AromaticContact CE1-CD2 3.54Å; F133-Y174 HydrophobicContact CE1-CD2 3.54Å; F133-Y174 AromaticContact CE1-CE2 3.78Å; F133-Y174 HydrophobicContact CE1-CE2 3.78Å; F133-Y174 AromaticContact CE2-CD2 3.54Å; F133-Y174 HydrophobicContact CE2-CD2 3.54Å; F133-Y174 HydrophobicContact CE2-CG 4.08Å; F133-Y174 AromaticContact CG-CD2 3.75Å; F133-Y174 HydrophobicContact CG-CD2 3.75Å; F133-Y174 HydrophobicContact CG-CE2 4.43Å; F133-Y174 AromaticContact CZ-CD2 3.48Å; F133-Y174 HydrophobicContact CZ-CD2 3.48Å; F133-Y174 VanDerWaalsContact CZ-CD2 3.48Å; F133-Y174 HydrophobicContact CZ-CE2 4.11Å; F133-Y174 HydrophobicContact CZ-CG 4.28Å; W170-Y174 PolarHBondContact O-N 2.68Å; K171-Y174 WeakPolarHBondContact O-CB 3.49Å; K171-Y174 PolarHBondContact O-N 2.72Å; R172-Y174 VanDerWaalsContact C-N 3.31Å; R172-Y174 PolarHBondContact O-N 2.8Å; Y174-A177 PolarHBondContact O-N 2.73Å; Y174-S178 WeakPolarHBondContact CD2-OG 3.36Å; Y174-S178 WeakPolarHBondContact CE2-OG 3.43Å; Y174-S178 VanDerWaalsContact O-CB 3.24Å; Y174-S178 WeakPolarHBondContact O-CB 3.36Å; Y174-S178 PolarHBondContact O-N 3.2Å; Y174-S178 PolarHBondContact O-OG 3.12Å
175	I	98.5	Very high	97.6	Very high	9 Å²	9	43.3 Å²	43.3	5%	0.046	21%	0.212	C	C	.	.	H	α-helix	trans	-61.9	-50.6	179.3	-68.9	160.4	0	0	0	110.2	K171 R172 A177 S178 C179 I303 L304	K171-I175 HydrophobicContact CG-CD1 4.04Å; K171-I175 WeakPolarHBondContact O-CD1 3.31Å; K171-I175 VanDerWaalsContact O-CG1 3.28Å; K171-I175 WeakPolarHBondContact O-CG1 3.32Å; K171-I175 PolarHBondContact O-N 2.94Å; R172-I175 PolarHBondContact O-N 3.25Å; R172-I175 VanDerWaalsContact O-N 3.13Å; I175-A177 PolarHBondContact O-N 2.94Å; I175-S178 PolarHBondContact O-N 3.21Å; I175-C179 PolarHBondContact O-N 3.36Å; I175-C179 PolarHBondContact O-SG 3.48Å; I175-I303 HydrophobicContact CD1-CG2 3.64Å; I175-I303 HydrophobicContact CG1-CG2 3.89Å; I175-I303 HydrophobicContact CG2-CB 4.18Å; I175-I303 HydrophobicContact CG2-CD1 4.09Å; I175-I303 HydrophobicContact CG2-CG2 4.2Å; I175-L304 HydrophobicContact CB-CD2 4.32Å; I175-L304 HydrophobicContact CD1-CD2 3.61Å; I175-L304 HydrophobicContact CD1-CG 4.3Å; I175-L304 HydrophobicContact CG2-CD1 4.45Å; I175-L304 HydrophobicContact CG2-CD2 4.23Å; I175-L304 HydrophobicContact CG2-CG 4.03Å
176	L	98.5	Very high	97.8	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-59.2	-44.8	-179.7	-69.9	-178.2	0	0	0	112.1	R172 Q180 L304 R491 V494	R172-L176 HydrophobicContact CG-CD1 4.25Å; R172-L176 WeakPolarHBondContact O-CG 3.49Å; R172-L176 PolarHBondContact O-N 3.13Å; L176-Q180 WeakPolarHBondContact O-CB 3.22Å; L176-Q180 PolarHBondContact O-N 3.38Å; L176-L304 HydrophobicContact CD2-CD1 4.31Å; L176-R491 HydrophobicContact CB-CG 4.11Å; L176-V494 HydrophobicContact CD2-CB 3.94Å; L176-V494 HydrophobicContact CD2-CG1 3.63Å; L176-V494 HydrophobicContact CD2-CG2 4.33Å
177	A	98.4	Very high	97.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.3	-40.8	175.7	0	0	0	0	0	112.9	F133 L134 G173 Y174 I175 Q180 N181	F133-A177 HydrophobicContact CB-CB 3.67Å; L134-A177 HydrophobicContact CD2-CB 4.03Å; L134-A177 HydrophobicContact CG-CB 3.89Å; G173-A177 VanDerWaalsContact O-CB 3.31Å; G173-A177 WeakPolarHBondContact O-CB 3.47Å; G173-A177 PolarHBondContact O-N 3.27Å; Y174-A177 PolarHBondContact O-N 2.73Å; I175-A177 PolarHBondContact O-N 2.94Å; A177-Q180 PolarHBondContact O-N 2.75Å; A177-N181 WeakPolarHBondContact O-CB 3.34Å; A177-N181 PolarHBondContact O-N 2.79Å; A177-N181 PolarHBondContact O-ND2 3.49Å
178	S	98.3	Very high	98	Very high	36 Å²	36	30.2 Å²	30.2	25%	0.252	15%	0.145	S	C	.	.	H	α-helix	trans	-65.7	-42.4	179.3	-62.2	0	0	0	0	111.7	Y174 I175 Q180 N181 L182	Y174-S178 WeakPolarHBondContact CD2-OG 3.36Å; Y174-S178 WeakPolarHBondContact CE2-OG 3.43Å; Y174-S178 VanDerWaalsContact O-CB 3.24Å; Y174-S178 WeakPolarHBondContact O-CB 3.36Å; Y174-S178 PolarHBondContact O-N 3.2Å; Y174-S178 PolarHBondContact O-OG 3.12Å; I175-S178 PolarHBondContact O-N 3.21Å; S178-Q180 VanDerWaalsContact C-N 3.32Å; S178-Q180 PolarHBondContact O-N 3.4Å; S178-N181 WeakPolarHBondContact O-CB 3.38Å; S178-N181 PolarHBondContact O-N 3.02Å; S178-L182 PolarHBondContact O-N 3.11Å
179	C	98.7	Very high	98.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.3	-37.8	174	-62.6	0	0	0	0	110.6	I175 N181 L182 V183 A300 L490	I175-C179 PolarHBondContact O-N 3.36Å; I175-C179 PolarHBondContact O-SG 3.48Å; C179-N181 VanDerWaalsContact C-N 3.31Å; C179-N181 PolarHBondContact O-N 3.44Å; C179-L182 WeakPolarHBondContact O-CB 2.85Å; C179-L182 PolarHBondContact O-N 3.21Å; C179-L182 VanDerWaalsContact O-N 3.17Å; C179-V183 WeakPolarHBondContact O-CG2 3.17Å; C179-V183 PolarHBondContact O-N 2.91Å; C179-V183 VanDerWaalsContact O-N 3.12Å; C179-A300 HydrophobicContact CB-CB 4.09Å; C179-L490 HydrophobicContact CB-CD2 3.5Å; C179-L490 VanDerWaalsContact O-CD2 3.3Å; C179-L490 WeakPolarHBondContact O-CD2 3.27Å
180	Q	98.6	Very high	98.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66.6	-37.5	176	-177.9	167.9	-3.8	0	0	110.9	L134 L176 A177 S178 L182 V183 R184 T486 L490 R491	L134-Q180 HydrophobicContact CD2-CB 3.93Å; L134-Q180 HydrophobicContact CD2-CG 3.95Å; L176-Q180 WeakPolarHBondContact O-CB 3.22Å; L176-Q180 PolarHBondContact O-N 3.38Å; A177-Q180 PolarHBondContact O-N 2.75Å; S178-Q180 VanDerWaalsContact C-N 3.32Å; S178-Q180 PolarHBondContact O-N 3.4Å; Q180-L182 VanDerWaalsContact C-N 3.32Å; Q180-L182 PolarHBondContact O-N 2.95Å; Q180-V183 WeakPolarHBondContact O-CB 3.48Å; Q180-V183 PolarHBondContact O-N 3.07Å; Q180-R184 WeakPolarHBondContact O-CG 3.49Å; Q180-R184 PolarHBondContact O-N 3.1Å; Q180-T486 PolarHBondContact NE2-O 2.77Å; Q180-L490 HydrophobicContact CB-CB 4.25Å; Q180-L490 HydrophobicContact CB-CD2 3.94Å; Q180-L490 HydrophobicContact CG-CB 4.4Å; Q180-R491 HydrophobicContact CB-CG 4.49Å; Q180-R491 VanDerWaalsContact OE1-CG 3.26Å
181	N	98.1	Very high	98.2	Very high	18 Å²	18	24.9 Å²	24.9	10%	0.096	12%	0.116	C	C	.	.	H	α-helix	trans	-66.2	-31.4	173.5	-72.2	-22.1	0	0	0	112.9	F133 F137 A177 S178 C179 R184 R185	F133-N181 PolarHBondContact O-ND2 2.91Å; F137-N181 HydrophobicContact CB-CB 4.4Å; F137-N181 WeakPolarHBondContact CB-OD1 3.44Å; F137-N181 HydrophobicContact CD2-CB 3.57Å; F137-N181 HydrophobicContact CE2-CB 4.03Å; F137-N181 WeakPolarHBondContact CE2-O 3.4Å; F137-N181 HydrophobicContact CG-CB 4.07Å; A177-N181 WeakPolarHBondContact O-CB 3.34Å; A177-N181 PolarHBondContact O-N 2.79Å; A177-N181 PolarHBondContact O-ND2 3.49Å; S178-N181 WeakPolarHBondContact O-CB 3.38Å; S178-N181 PolarHBondContact O-N 3.02Å; C179-N181 VanDerWaalsContact C-N 3.31Å; C179-N181 PolarHBondContact O-N 3.44Å; N181-R184 PolarHBondContact O-N 3.25Å; N181-R184 PolarHBondContact OD1-NH1 3.23Å; N181-R185 WeakPolarHBondContact O-CB 3.21Å; N181-R185 PolarHBondContact O-N 3.02Å
182	L	98.5	Very high	98.2	Very high	26 Å²	26	24.3 Å²	24.3	14%	0.136	12%	0.12	C	C	.	.	H	α-helix	trans	-61.1	-48.6	168.4	174	65	0	0	0	110.4	S178 C179 Q180 R184 R185 L186 T206 L295 Y299	S178-L182 PolarHBondContact O-N 3.11Å; C179-L182 WeakPolarHBondContact O-CB 2.85Å; C179-L182 PolarHBondContact O-N 3.21Å; C179-L182 VanDerWaalsContact O-N 3.17Å; Q180-L182 VanDerWaalsContact C-N 3.32Å; Q180-L182 PolarHBondContact O-N 2.95Å; L182-R184 VanDerWaalsContact C-N 3.29Å; L182-R184 PolarHBondContact O-N 3.15Å; L182-R185 PolarHBondContact O-N 3.06Å; L182-L186 HydrophobicContact CD1-CD1 3.98Å; L182-L186 HydrophobicContact CD1-CD2 4.38Å; L182-L186 HydrophobicContact CD1-CG 4.06Å; L182-L186 HydrophobicContact CG-CD1 4Å; L182-L186 HydrophobicContact CG-CG 4.44Å; L182-L186 VanDerWaalsContact O-CG 3.29Å; L182-L186 WeakPolarHBondContact O-CG 3.43Å; L182-L186 PolarHBondContact O-N 3.38Å; L182-T206 HydrophobicContact CD2-CG2 3.96Å; L182-L295 HydrophobicContact CD2-CD2 4.39Å; L182-L295 HydrophobicContact CD2-CG 4.35Å; L182-Y299 HydrophobicContact CD2-CD1 3.81Å; L182-Y299 HydrophobicContact CD2-CE1 4.33Å
183	V	98.7	Very high	98.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.1	-44.8	176.4	-176.8	0	0	0	0	110.9	C179 Q180 L186 S187 T289 A292 L490	C179-V183 WeakPolarHBondContact O-CG2 3.17Å; C179-V183 PolarHBondContact O-N 2.91Å; C179-V183 VanDerWaalsContact O-N 3.12Å; Q180-V183 WeakPolarHBondContact O-CB 3.48Å; Q180-V183 PolarHBondContact O-N 3.07Å; V183-L186 PolarHBondContact O-N 2.69Å; V183-S187 WeakPolarHBondContact O-CB 3.27Å; V183-S187 PolarHBondContact O-N 3.33Å; V183-S187 PolarHBondContact O-OG 3.3Å; V183-T289 HydrophobicContact CG1-CG2 3.91Å; V183-A292 HydrophobicContact CB-CB 4.42Å; V183-A292 HydrophobicContact CG1-CB 3.79Å; V183-A292 WeakPolarHBondContact CG2-O 3.23Å; V183-L490 HydrophobicContact CG2-CB 4.35Å; V183-L490 HydrophobicContact CG2-CD1 4.02Å; V183-L490 HydrophobicContact CG2-CD2 3.92Å; V183-L490 HydrophobicContact CG2-CG 4.31Å
184	R	97.6	Very high	98.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.3	-50.4	175.8	-68.5	170.4	66.4	-167.9	3.1	111.5	L134 F137 Q180 N181 L182 L186 S187 D188 N482 S483 M485 T486	L134-R184 PolarHBondContact O-NH1 3.49Å; F137-R184 HydrophobicContact CD1-CB 4.45Å; F137-R184 HydrophobicContact CE1-CB 3.8Å; F137-R184 HydrophobicContact CZ-CB 4.02Å; Q180-R184 WeakPolarHBondContact O-CG 3.49Å; Q180-R184 PolarHBondContact O-N 3.1Å; N181-R184 PolarHBondContact O-N 3.25Å; N181-R184 PolarHBondContact OD1-NH1 3.23Å; L182-R184 VanDerWaalsContact C-N 3.29Å; L182-R184 PolarHBondContact O-N 3.15Å; R184-L186 PolarHBondContact O-N 2.67Å; R184-S187 PolarHBondContact O-N 2.98Å; R184-D188 WeakPolarHBondContact O-CB 3.33Å; R184-D188 PolarHBondContact O-N 2.74Å; R184-N482 PolarHBondContact NH2-OD1 3.33Å; R184-S483 PolarHBondContact NE-OG 3.48Å; R184-S483 VanDerWaalsContact NE-OG 3.17Å; R184-S483 PolarHBondContact NH2-OG 3.21Å; R184-M485 WeakPolarHBondContact CG-O 3.48Å; R184-M485 PolarHBondContact NE-O 3.12Å; R184-T486 WeakPolarHBondContact CD-O 3.42Å; R184-T486 VanDerWaalsContact CG-O 3.29Å; R184-T486 WeakPolarHBondContact CG-O 3.36Å
185	R	97.9	Very high	98.3	Very high	77 Å²	77	21.9 Å²	21.9	29%	0.291	12%	0.117	S	C	.	.	H	α-helix	trans	-57.1	-47.3	179.2	-178.7	-178.7	175.8	-84.9	-7.1	111.8	F137 F139 E141 N181 L182 S187 D188 M189	F137-R185 HydrophobicContact CE2-CB 4.16Å; F137-R185 HydrophobicContact CZ-CB 3.93Å; F139-R185 HydrophobicContact CD2-CG 4.32Å; F139-R185 HydrophobicContact CE2-CG 4.29Å; E141-R185 VanDerWaalsContact CD-NE 3.32Å; E141-R185 VanDerWaalsContact CD-NH2 3.35Å; E141-R185 IonicContact OE1-CZ 2.88Å; E141-R185 VanDerWaalsContact OE1-CZ 3.28Å; E141-R185 IonicContact OE1-NE 3.55Å; E141-R185 PolarHBondContact OE1-NE 2.88Å; E141-R185 IonicContact OE1-NH2 3.25Å; E141-R185 PolarHBondContact OE1-NH2 2.85Å; E141-R185 VanDerWaalsContact OE1-NH2 3.09Å; E141-R185 IonicContact OE2-CZ 3.23Å; E141-R185 VanDerWaalsContact OE2-CZ 3.31Å; E141-R185 IonicContact OE2-NE 2.85Å; E141-R185 PolarHBondContact OE2-NE 2.85Å; E141-R185 IonicContact OE2-NH2 2.85Å; E141-R185 PolarHBondContact OE2-NH2 3.35Å; N181-R185 WeakPolarHBondContact O-CB 3.21Å; N181-R185 PolarHBondContact O-N 3.02Å; L182-R185 PolarHBondContact O-N 3.06Å; R185-S187 VanDerWaalsContact C-N 3.34Å; R185-D188 PolarHBondContact O-N 3.22Å; R185-M189 WeakPolarHBondContact O-CB 3.34Å; R185-M189 PolarHBondContact O-N 2.92Å; R185-M189 VanDerWaalsContact O-N 3.1Å
186	L	98.6	Very high	98.3	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.3	-39.8	-179.6	-61.1	172.3	0	0	0	111.5	L182 V183 R184 M194 F199 V202 M288 A292 L295	L182-L186 HydrophobicContact CD1-CD1 3.98Å; L182-L186 HydrophobicContact CD1-CD2 4.38Å; L182-L186 HydrophobicContact CD1-CG 4.06Å; L182-L186 HydrophobicContact CG-CD1 4Å; L182-L186 HydrophobicContact CG-CG 4.44Å; L182-L186 VanDerWaalsContact O-CG 3.29Å; L182-L186 WeakPolarHBondContact O-CG 3.43Å; L182-L186 PolarHBondContact O-N 3.38Å; V183-L186 PolarHBondContact O-N 2.69Å; R184-L186 PolarHBondContact O-N 2.67Å; L186-M194 HydrophobicContact CD2-CE 3.63Å; L186-M194 HydrophobicContact CD2-SD 3.9Å; L186-F199 HydrophobicContact CD1-CE2 3.87Å; L186-V202 HydrophobicContact CD2-CG1 3.85Å; L186-M288 HydrophobicContact CB-CE 3.97Å; L186-A292 HydrophobicContact CB-CB 4.17Å; L186-A292 HydrophobicContact CD1-CB 4.15Å; L186-L295 HydrophobicContact CD1-CD2 3.8Å
187	S	98	Very high	98.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-75.4	-30	-179.5	-51.2	0	0	0	0	113.4	V183 R184 R185 T289	V183-S187 WeakPolarHBondContact O-CB 3.27Å; V183-S187 PolarHBondContact O-N 3.33Å; V183-S187 PolarHBondContact O-OG 3.3Å; R184-S187 PolarHBondContact O-N 2.98Å; R185-S187 VanDerWaalsContact C-N 3.34Å; S187-T289 VanDerWaalsContact CB-OG1 3.29Å; S187-T289 WeakPolarHBondContact CB-OG1 3.5Å; S187-T289 PolarHBondContact OG-OG1 2.98Å
188	D	96.8	Very high	98.3	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-79.9	-23.3	176	-98.4	-58.1	0	0	0	112.2	F139 R184 R185 R285 S483 S484 M485	F139-D188 HydrophobicContact CB-CB 4.09Å; F139-D188 HydrophobicContact CD1-CB 3.83Å; F139-D188 HydrophobicContact CD2-CB 3.72Å; F139-D188 HydrophobicContact CE1-CB 4.2Å; F139-D188 HydrophobicContact CE2-CB 4.11Å; F139-D188 HydrophobicContact CG-CB 3.58Å; F139-D188 HydrophobicContact CZ-CB 4.35Å; R184-D188 WeakPolarHBondContact O-CB 3.33Å; R184-D188 PolarHBondContact O-N 2.74Å; R185-D188 PolarHBondContact O-N 3.22Å; D188-R285 PolarHBondContact O-NE 3.27Å; D188-R285 IonicContact OD1-NH2 3.62Å; D188-S483 VanDerWaalsContact OD2-CB 3.25Å; D188-S483 WeakPolarHBondContact OD2-CB 3.26Å; D188-S483 PolarHBondContact OD2-OG 3.17Å; D188-S484 WeakPolarHBondContact OD1-CB 3.39Å; D188-S484 PolarHBondContact OD1-OG 3.35Å; D188-S484 PolarHBondContact OD2-N 2.67Å; D188-M485 HydrophobicContact CB-CG 4.31Å; D188-M485 PolarHBondContact OD2-N 2.92Å
189	M	98.1	Very high	98.3	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.059	14%	0.139	C	C	.	.	S	Bend	trans	-60	132.3	-179.2	-171.9	68.3	75.3	0	0	111.5	F139 E141 L142 R185 L193 M194 R285	F139-M189 HydrophobicContact CE2-CB 4.43Å; F139-M189 HydrophobicContact CE2-CE 4.28Å; F139-M189 HydrophobicContact CE2-SD 4.45Å; F139-M189 HydrophobicContact CZ-CB 4.37Å; F139-M189 HydrophobicContact CZ-CE 4.45Å; F139-M189 HydrophobicContact CZ-SD 4.06Å; E141-M189 WeakPolarHBondContact OE1-CE 3.33Å; L142-M189 HydrophobicContact CD1-SD 4.21Å; L142-M189 HydrophobicContact CD2-SD 4.29Å; R185-M189 WeakPolarHBondContact O-CB 3.34Å; R185-M189 PolarHBondContact O-N 2.92Å; R185-M189 VanDerWaalsContact O-N 3.1Å; M189-L193 HydrophobicContact CG-CB 3.88Å; M189-L193 HydrophobicContact SD-CB 3.79Å; M189-L193 HydrophobicContact SD-CD1 3.98Å; M189-M194 HydrophobicContact CB-CB 3.96Å; M189-M194 HydrophobicContact CB-CE 4.01Å; M189-M194 HydrophobicContact CB-CG 4.45Å; M189-M194 HydrophobicContact CE-CE 4.36Å; M189-M194 HydrophobicContact CG-CB 3.73Å; M189-M194 HydrophobicContact CG-CE 3.8Å; M189-R285 WeakPolarHBondContact O-CD 3.48Å
190	P	98.3	Very high	98.3	Very high	37 Å²	37	27.9 Å²	27.9	24%	0.24	14%	0.14	C	C	.	.			trans	-54.3	138.9	171.6	-27.1	36.8	0	0	0	112	L142 N192 L193 M194	L142-P190 HydrophobicContact CD1-CG 3.71Å; P190-N192 VanDerWaalsContact C-N 3.25Å; P190-N192 WeakPolarHBondContact CB-OD1 3.5Å; P190-N192 PolarHBondContact O-N 3.08Å; P190-L193 CarbonylContact O-C 3.59Å; P190-L193 WeakPolarHBondContact O-CA 3.38Å; P190-L193 PolarHBondContact O-N 2.73Å; P190-M194 PolarHBondContact O-N 3.09Å; P190-M194 VanDerWaalsContact O-N 3.08Å
191	A	98.6	Very high	98.3	Very high	13 Å²	13	31.9 Å²	31.9	11%	0.107	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-59.5	-34.7	-174.7	0	0	0	0	0	113.5	L193 M194 T195 C267 F268 R285	A191-L193 PolarHBondContact O-N 3.26Å; A191-L193 VanDerWaalsContact O-N 3.1Å; A191-M194 CarbonylContact O-C 3.35Å; A191-M194 PolarHBondContact O-N 3.1Å; A191-T195 PolarHBondContact O-N 2.97Å; A191-C267 VanDerWaalsContact CB-O 3.22Å; A191-C267 WeakPolarHBondContact CB-O 3.34Å; A191-F268 HydrophobicContact CB-CB 3.65Å; A191-F268 HydrophobicContact CB-CD2 3.89Å; A191-F268 HydrophobicContact CB-CG 4.11Å; A191-R285 HydrophobicContact CB-CB 4.27Å
192	N	98.4	Very high	98.3	Very high	121 Å²	121	32 Å²	32	65%	0.647	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-64.8	-13.7	174.7	70.7	-65.3	0	0	0	113.8	P190	P190-N192 VanDerWaalsContact C-N 3.25Å; P190-N192 WeakPolarHBondContact CB-OD1 3.5Å; P190-N192 PolarHBondContact O-N 3.08Å
193	L	98.4	Very high	98.3	Very high	78 Å²	78	30.8 Å²	30.8	41%	0.408	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-110.5	-5.4	173.7	-59.9	-179.5	0	0	0	112.6	L142 M189 P190 A191 R198	L142-L193 HydrophobicContact CD1-CD1 4.13Å; L142-L193 HydrophobicContact CD2-CD1 3.88Å; M189-L193 HydrophobicContact CG-CB 3.88Å; M189-L193 HydrophobicContact SD-CB 3.79Å; M189-L193 HydrophobicContact SD-CD1 3.98Å; P190-L193 CarbonylContact O-C 3.59Å; P190-L193 WeakPolarHBondContact O-CA 3.38Å; P190-L193 PolarHBondContact O-N 2.73Å; A191-L193 PolarHBondContact O-N 3.26Å; A191-L193 VanDerWaalsContact O-N 3.1Å; L193-R198 WeakPolarHBondContact O-CG 3.45Å
194	M	98.6	Very high	98.3	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.025	17%	0.174	C	C	.	.	S	Bend	trans	-134.4	55.9	179.8	-164.7	56.6	56.8	0	0	110.2	L186 M189 P190 A191 F199 V202 C267 M288	L186-M194 HydrophobicContact CD2-CE 3.63Å; L186-M194 HydrophobicContact CD2-SD 3.9Å; M189-M194 HydrophobicContact CB-CB 3.96Å; M189-M194 HydrophobicContact CB-CE 4.01Å; M189-M194 HydrophobicContact CB-CG 4.45Å; M189-M194 HydrophobicContact CE-CE 4.36Å; M189-M194 HydrophobicContact CG-CB 3.73Å; M189-M194 HydrophobicContact CG-CE 3.8Å; P190-M194 PolarHBondContact O-N 3.09Å; P190-M194 VanDerWaalsContact O-N 3.08Å; A191-M194 CarbonylContact O-C 3.35Å; A191-M194 PolarHBondContact O-N 3.1Å; M194-F199 HydrophobicContact CG-CD2 4.44Å; M194-F199 HydrophobicContact SD-CB 4.16Å; M194-F199 HydrophobicContact SD-CD2 4.01Å; M194-V202 HydrophobicContact CE-CG2 4.48Å; M194-C267 WeakPolarHBondContact O-CB 3.24Å; M194-C267 PolarHBondContact O-SG 2.85Å; M194-M288 HydrophobicContact CG-CE 4.5Å
195	T	98.7	Very high	98.4	Very high	19 Å²	19	39.5 Å²	39.5	12%	0.117	20%	0.201	C	C	.	.			trans	-70.7	167.4	176.4	78	0	0	0	0	111.5	A191 V197 R198 F199 E240 C267	A191-T195 PolarHBondContact O-N 2.97Å; T195-V197 VanDerWaalsContact C-N 3.31Å; T195-V197 PolarHBondContact O-N 3.42Å; T195-R198 PolarHBondContact O-N 2.89Å; T195-R198 VanDerWaalsContact O-N 3.13Å; T195-R198 PolarHBondContact OG1-N 2.88Å; T195-F199 WeakPolarHBondContact O-CB 3.16Å; T195-F199 PolarHBondContact O-N 3.21Å; T195-E240 WeakPolarHBondContact CB-OE1 3.27Å; T195-E240 HydrophobicContact CG2-CG 4.27Å; T195-E240 PolarHBondContact OG1-OE1 2.97Å; T195-C267 VanDerWaalsContact C-SG 3.53Å
196	P	98.8	Very high	98.4	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-50.2	-47.2	173.4	-32	39.6	0	0	0	113.7	F199 A200 E240 V243 C267 M318	P196-F199 PolarHBondContact O-N 3.45Å; P196-A200 PolarHBondContact O-N 3.3Å; P196-A200 VanDerWaalsContact O-N 3.14Å; P196-E240 HydrophobicContact CG-CG 4.25Å; P196-V243 HydrophobicContact CB-CB 4.37Å; P196-V243 HydrophobicContact CB-CG2 4.42Å; P196-C267 HydrophobicContact CG-CB 4.34Å; P196-C267 VanDerWaalsContact N-SG 3.41Å; P196-M318 HydrophobicContact CB-CB 3.67Å; P196-M318 HydrophobicContact CG-CB 4.35Å
197	V	98.1	Very high	98.4	Very high	50 Å²	50	37.2 Å²	37.2	30%	0.303	20%	0.196	S	C	.	.	H	α-helix	trans	-63.4	-46.6	177.2	179.8	0	0	0	0	110.5	T195 F199 A200 E201 P241 V243	T195-V197 VanDerWaalsContact C-N 3.31Å; T195-V197 PolarHBondContact O-N 3.42Å; V197-F199 VanDerWaalsContact C-N 3.33Å; V197-F199 PolarHBondContact O-N 3.23Å; V197-A200 WeakPolarHBondContact O-CB 3.29Å; V197-A200 PolarHBondContact O-N 2.86Å; V197-A200 VanDerWaalsContact O-N 3.17Å; V197-E201 WeakPolarHBondContact O-CG 3.36Å; V197-E201 PolarHBondContact O-N 3.02Å; V197-P241 HydrophobicContact CG2-CG 3.67Å; V197-V243 HydrophobicContact CG2-CG2 4.07Å
198	R	98.4	Very high	98.3	Very high	124 Å²	124	44.1 Å²	44.1	47%	0.468	23%	0.226	S	C	.	.	H	α-helix	trans	-65.8	-36.7	-178.5	-171.2	53.9	172.6	179.1	0.8	112.4	L193 T195 A200 E201 V202	L193-R198 WeakPolarHBondContact O-CG 3.45Å; T195-R198 PolarHBondContact O-N 2.89Å; T195-R198 VanDerWaalsContact O-N 3.13Å; T195-R198 PolarHBondContact OG1-N 2.88Å; R198-A200 VanDerWaalsContact C-N 3.33Å; R198-E201 WeakPolarHBondContact CD-OE2 3.3Å; R198-E201 IonicContact CZ-OE2 2.82Å; R198-E201 IonicContact NE-OE2 2.93Å; R198-E201 IonicContact NH1-OE2 2.76Å; R198-E201 PolarHBondContact NH1-OE2 2.84Å; R198-E201 PolarHBondContact O-N 3.31Å; R198-V202 VanDerWaalsContact O-CG2 3.31Å; R198-V202 WeakPolarHBondContact O-CG2 3.36Å; R198-V202 PolarHBondContact O-N 3.42Å
199	F	98.8	Very high	98.3	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-41.4	174.2	-173.9	-84.9	0	0	0	111.2	L186 M194 T195 P196 V197 V202 T203 L245 M288 A291 A292 L295 M316 M318	L186-F199 HydrophobicContact CD1-CE2 3.87Å; M194-F199 HydrophobicContact CG-CD2 4.44Å; M194-F199 HydrophobicContact SD-CB 4.16Å; M194-F199 HydrophobicContact SD-CD2 4.01Å; T195-F199 WeakPolarHBondContact O-CB 3.16Å; T195-F199 PolarHBondContact O-N 3.21Å; P196-F199 PolarHBondContact O-N 3.45Å; V197-F199 VanDerWaalsContact C-N 3.33Å; V197-F199 PolarHBondContact O-N 3.23Å; F199-V202 PolarHBondContact O-N 2.59Å; F199-T203 WeakPolarHBondContact O-CB 3.28Å; F199-T203 PolarHBondContact O-N 3.24Å; F199-T203 PolarHBondContact O-OG1 2.83Å; F199-L245 HydrophobicContact CD1-CD2 3.93Å; F199-L245 HydrophobicContact CE1-CD2 3.89Å; F199-M288 HydrophobicContact CD2-CE 3.37Å; F199-M288 HydrophobicContact CE2-CE 3.16Å; F199-M288 HydrophobicContact CZ-CE 4.25Å; F199-A291 HydrophobicContact CE1-CB 4.28Å; F199-A291 HydrophobicContact CZ-CB 4.06Å; F199-A292 HydrophobicContact CE2-CB 4.31Å; F199-L295 HydrophobicContact CZ-CB 4.33Å; F199-L295 HydrophobicContact CZ-CD2 4.22Å; F199-M316 HydrophobicContact CE1-SD 3.89Å; F199-M316 HydrophobicContact CZ-SD 4.35Å; F199-M318 HydrophobicContact CB-CE 3.83Å; F199-M318 HydrophobicContact CD1-CE 3.54Å; F199-M318 HydrophobicContact CD1-CG 4.27Å; F199-M318 HydrophobicContact CD1-SD 3.78Å; F199-M318 HydrophobicContact CD2-CE 3.99Å; F199-M318 HydrophobicContact CE1-CE 4.08Å; F199-M318 HydrophobicContact CE1-SD 3.99Å; F199-M318 HydrophobicContact CE2-CE 4.47Å; F199-M318 HydrophobicContact CG-CE 3.49Å; F199-M318 VanDerWaalsContact CG-CE 3.49Å; F199-M318 HydrophobicContact CG-SD 4.35Å
200	A	98.6	Very high	98.2	Very high	3 Å²	3	52 Å²	52	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-41.7	174.8	0	0	0	0	0	112.5	P196 V197 R198 T203 K204 T217 V243 L245	P196-A200 PolarHBondContact O-N 3.3Å; P196-A200 VanDerWaalsContact O-N 3.14Å; V197-A200 WeakPolarHBondContact O-CB 3.29Å; V197-A200 PolarHBondContact O-N 2.86Å; V197-A200 VanDerWaalsContact O-N 3.17Å; R198-A200 VanDerWaalsContact C-N 3.33Å; A200-T203 WeakPolarHBondContact O-CB 3.31Å; A200-T203 PolarHBondContact O-N 2.92Å; A200-K204 PolarHBondContact O-N 2.66Å; A200-T217 HydrophobicContact CB-CG2 3.86Å; A200-V243 HydrophobicContact CB-CG1 4.05Å; A200-L245 HydrophobicContact CB-CD1 3.94Å
201	E	98.5	Very high	98	Very high	84 Å²	84	56.5 Å²	56.5	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-47.6	174.1	-68.3	176.3	162.8	0	0	112	V197 R198 T203 K204 C205	V197-E201 WeakPolarHBondContact O-CG 3.36Å; V197-E201 PolarHBondContact O-N 3.02Å; R198-E201 WeakPolarHBondContact CD-OE2 3.3Å; R198-E201 IonicContact CZ-OE2 2.82Å; R198-E201 IonicContact NE-OE2 2.93Å; R198-E201 IonicContact NH1-OE2 2.76Å; R198-E201 PolarHBondContact NH1-OE2 2.84Å; R198-E201 PolarHBondContact O-N 3.31Å; E201-T203 PolarHBondContact O-N 3.4Å; E201-K204 PolarHBondContact O-N 3.16Å; E201-C205 PolarHBondContact O-N 3.28Å; E201-C205 PolarHBondContact O-SG 3.23Å; E201-C205 VanDerWaalsContact O-SG 3.4Å
202	V	98.6	Very high	97.9	Very high	21 Å²	21	58.7 Å²	58.7	13%	0.127	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-39.1	177.5	171.8	0	0	0	0	110.7	L186 M194 R198 F199 C205 T206	L186-V202 HydrophobicContact CD2-CG1 3.85Å; M194-V202 HydrophobicContact CE-CG2 4.48Å; R198-V202 VanDerWaalsContact O-CG2 3.31Å; R198-V202 WeakPolarHBondContact O-CG2 3.36Å; R198-V202 PolarHBondContact O-N 3.42Å; F199-V202 PolarHBondContact O-N 2.59Å; V202-C205 PolarHBondContact O-N 3.29Å; V202-T206 WeakPolarHBondContact O-CB 3.29Å; V202-T206 PolarHBondContact O-N 2.98Å; V202-T206 PolarHBondContact O-OG1 3.26Å
203	T	98.8	Very high	97.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-49.7	176.1	-59.8	0	0	0	0	111.6	F199 A200 E201 C205 T206 L207 V215 L245 I247 L295	F199-T203 WeakPolarHBondContact O-CB 3.28Å; F199-T203 PolarHBondContact O-N 3.24Å; F199-T203 PolarHBondContact O-OG1 2.83Å; A200-T203 WeakPolarHBondContact O-CB 3.31Å; A200-T203 PolarHBondContact O-N 2.92Å; E201-T203 PolarHBondContact O-N 3.4Å; T203-C205 VanDerWaalsContact C-N 3.35Å; T203-C205 PolarHBondContact O-N 2.89Å; T203-T206 PolarHBondContact O-N 2.94Å; T203-L207 HydrophobicContact CG2-CD1 4.07Å; T203-L207 PolarHBondContact O-N 3.42Å; T203-L207 VanDerWaalsContact O-N 3.11Å; T203-V215 HydrophobicContact CG2-CG1 3.95Å; T203-V215 HydrophobicContact CG2-CG2 4.47Å; T203-L245 HydrophobicContact CG2-CD1 4.5Å; T203-L245 HydrophobicContact CG2-CD2 3.71Å; T203-L245 HydrophobicContact CG2-CG 4.41Å; T203-L245 WeakPolarHBondContact OG1-CD2 3.41Å; T203-I247 HydrophobicContact CG2-CD1 3.7Å; T203-I247 HydrophobicContact CG2-CG1 4.05Å; T203-L295 HydrophobicContact CG2-CD1 3.7Å
204	K	98.5	Very high	97.8	Very high	97 Å²	97	54.3 Å²	54.3	42%	0.422	28%	0.279	S	S	.	.	H	α-helix	trans	-56.6	-47.7	174.8	-74.8	175.6	174.6	164.4	0	111.4	A200 E201 T206 L207 K208 V215 T217	A200-K204 PolarHBondContact O-N 2.66Å; E201-K204 PolarHBondContact O-N 3.16Å; K204-T206 VanDerWaalsContact C-N 3.32Å; K204-T206 PolarHBondContact O-N 2.89Å; K204-L207 PolarHBondContact O-N 3.24Å; K204-K208 WeakPolarHBondContact O-CB 3.14Å; K204-K208 PolarHBondContact O-N 2.83Å; K204-V215 HydrophobicContact CG-CB 4.12Å; K204-V215 HydrophobicContact CG-CG1 3.64Å; K204-T217 WeakPolarHBondContact CE-OG1 3.37Å; K204-T217 PolarHBondContact NZ-OG1 3.38Å
205	C	98.4	Very high	97.9	Very high	85 Å²	85	55.6 Å²	55.6	57%	0.574	29%	0.287	S	S	*	.	H	α-helix	trans	-64.3	-34.6	179.3	-70.2	0	0	0	0	113.4	E201 V202 T203 K208	E201-C205 PolarHBondContact O-N 3.28Å; E201-C205 PolarHBondContact O-SG 3.23Å; E201-C205 VanDerWaalsContact O-SG 3.4Å; V202-C205 PolarHBondContact O-N 3.29Å; T203-C205 VanDerWaalsContact C-N 3.35Å; T203-C205 PolarHBondContact O-N 2.89Å; C205-K208 WeakPolarHBondContact O-CG 3.34Å
206	T	98.5	Very high	97.9	Very high	26 Å²	26	56.5 Å²	56.5	16%	0.16	29%	0.291	C	S	.	.	H	α-helix	trans	-69.8	-36.5	179.8	-59.5	0	0	0	0	111.5	L182 V202 T203 K204 L295 Y299	L182-T206 HydrophobicContact CD2-CG2 3.96Å; V202-T206 WeakPolarHBondContact O-CB 3.29Å; V202-T206 PolarHBondContact O-N 2.98Å; V202-T206 PolarHBondContact O-OG1 3.26Å; T203-T206 PolarHBondContact O-N 2.94Å; K204-T206 VanDerWaalsContact C-N 3.32Å; K204-T206 PolarHBondContact O-N 2.89Å; T206-L295 HydrophobicContact CG2-CD1 4.39Å; T206-Y299 HydrophobicContact CG2-CD1 3.66Å; T206-Y299 HydrophobicContact CG2-CD2 3.93Å; T206-Y299 HydrophobicContact CG2-CE1 3.8Å; T206-Y299 HydrophobicContact CG2-CE2 4.04Å; T206-Y299 HydrophobicContact CG2-CG 3.73Å
207	L	98.2	Very high	97.8	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-103.1	-2.9	-172.1	-63.9	172	0	0	0	114.6	T203 K204 E209 F210 V213 V215 I247 L295 V298 Y299	T203-L207 HydrophobicContact CG2-CD1 4.07Å; T203-L207 PolarHBondContact O-N 3.42Å; T203-L207 VanDerWaalsContact O-N 3.11Å; K204-L207 PolarHBondContact O-N 3.24Å; L207-E209 PolarHBondContact O-N 3.02Å; L207-E209 VanDerWaalsContact O-N 3.07Å; L207-F210 HydrophobicContact CD2-CD2 4.16Å; L207-F210 HydrophobicContact CD2-CE2 4.33Å; L207-F210 WeakPolarHBondContact O-CD2 3.02Å; L207-F210 PolarHBondContact O-N 2.74Å; L207-F210 VanDerWaalsContact O-N 3.13Å; L207-V213 HydrophobicContact CB-CG1 4.03Å; L207-V213 HydrophobicContact CD1-CG1 3.99Å; L207-V213 HydrophobicContact CD2-CG1 4.47Å; L207-V213 HydrophobicContact CG-CG1 4.39Å; L207-V215 HydrophobicContact CB-CG2 3.97Å; L207-V215 HydrophobicContact CD1-CG2 3.84Å; L207-I247 HydrophobicContact CD1-CD1 3.84Å; L207-I247 HydrophobicContact CD1-CG1 4.32Å; L207-I247 HydrophobicContact CD1-CG2 3.71Å; L207-L295 HydrophobicContact CD1-CD1 3.81Å; L207-L295 HydrophobicContact CG-CD1 4.14Å; L207-V298 HydrophobicContact CD1-CG1 4.37Å; L207-V298 HydrophobicContact CD2-CG1 4.45Å; L207-Y299 HydrophobicContact CD2-CD2 3.97Å; L207-Y299 HydrophobicContact CD2-CG 4.37Å
208	K	97	Very high	97.9	Very high	146 Å²	146	57.6 Å²	57.6	64%	0.635	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28	-173.7	67.7	-179.4	177	142.7	0	115.8	K204 C205 F210	K204-K208 WeakPolarHBondContact O-CB 3.14Å; K204-K208 PolarHBondContact O-N 2.83Å; C205-K208 WeakPolarHBondContact O-CG 3.34Å; K208-F210 VanDerWaalsContact C-N 3.32Å
209	E	96	Very high	97.8	Very high	147 Å²	147	55.9 Å²	55.9	69%	0.687	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-7.1	-174.9	-55.9	-62.4	145.7	0	0	112.5	L207	L207-E209 PolarHBondContact O-N 3.02Å; L207-E209 VanDerWaalsContact O-N 3.07Å
210	F	96.2	Very high	97.6	Very high	34 Å²	34	59.2 Å²	59.2	15%	0.149	31%	0.314	C	S	.	.			trans	-98.9	105.6	-178.5	-55.5	-79.4	0	0	0	110.9	L207 K208 N212 V213 Y299 A302 I303	L207-F210 HydrophobicContact CD2-CD2 4.16Å; L207-F210 HydrophobicContact CD2-CE2 4.33Å; L207-F210 WeakPolarHBondContact O-CD2 3.02Å; L207-F210 PolarHBondContact O-N 2.74Å; L207-F210 VanDerWaalsContact O-N 3.13Å; K208-F210 VanDerWaalsContact C-N 3.32Å; F210-N212 PolarHBondContact O-N 2.89Å; F210-V213 HydrophobicContact CB-CB 3.92Å; F210-V213 HydrophobicContact CB-CG2 3.57Å; F210-V213 HydrophobicContact CG-CG2 4.34Å; F210-V213 PolarHBondContact O-N 3.1Å; F210-Y299 AromaticContact CE2-CD2 3.65Å; F210-Y299 HydrophobicContact CE2-CD2 3.65Å; F210-Y299 AromaticContact CE2-CE2 3.53Å; F210-Y299 HydrophobicContact CE2-CE2 3.53Å; F210-Y299 AromaticContact CZ-CD2 3.97Å; F210-Y299 HydrophobicContact CZ-CD2 3.97Å; F210-Y299 AromaticContact CZ-CE2 3.7Å; F210-Y299 HydrophobicContact CZ-CE2 3.7Å; F210-A302 HydrophobicContact CD1-CB 3.74Å; F210-A302 HydrophobicContact CD2-CB 4.1Å; F210-A302 HydrophobicContact CE1-CB 3.91Å; F210-A302 HydrophobicContact CE2-CB 4.28Å; F210-A302 HydrophobicContact CG-CB 3.85Å; F210-A302 HydrophobicContact CZ-CB 4.19Å; F210-I303 HydrophobicContact CE1-CG1 4.14Å; F210-I303 HydrophobicContact CZ-CG1 3.63Å
211	S	95	Very high	97.6	Very high	131 Å²	131	66 Å²	66	92%	0.916	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.6	-178.6	58	0	0	0	0	114.6	V213	S211-V213 VanDerWaalsContact C-N 3.34Å
212	N	95.1	Very high	97.6	Very high	59 Å²	59	63.7 Å²	63.7	32%	0.316	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	9.7	174.9	70	-42.8	0	0	0	113.2	F210 L249 K250	F210-N212 PolarHBondContact O-N 2.89Å; N212-L249 VanDerWaalsContact ND2-CD1 3.26Å; N212-L249 WeakPolarHBondContact ND2-CD1 3.29Å; N212-K250 PolarHBondContact ND2-O 3.5Å; N212-K250 PolarHBondContact O-N 2.62Å
213	V	97.8	Very high	97.6	Very high	20 Å²	20	62.7 Å²	62.7	12%	0.121	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.3	176.5	-176.8	0	0	0	0	110	L207 F210 S211 V215 I247 R248 L249 A302	L207-V213 HydrophobicContact CB-CG1 4.03Å; L207-V213 HydrophobicContact CD1-CG1 3.99Å; L207-V213 HydrophobicContact CD2-CG1 4.47Å; L207-V213 HydrophobicContact CG-CG1 4.39Å; F210-V213 HydrophobicContact CB-CB 3.92Å; F210-V213 HydrophobicContact CB-CG2 3.57Å; F210-V213 HydrophobicContact CG-CG2 4.34Å; F210-V213 PolarHBondContact O-N 3.1Å; S211-V213 VanDerWaalsContact C-N 3.34Å; V213-V215 HydrophobicContact CG1-CG2 4.3Å; V213-I247 HydrophobicContact CG1-CG2 3.68Å; V213-R248 CarbonylContact C-O 3.59Å; V213-R248 VanDerWaalsContact CA-O 3.3Å; V213-R248 WeakPolarHBondContact CA-O 3.35Å; V213-L249 HydrophobicContact CG2-CB 4.32Å; V213-L249 HydrophobicContact CG2-CD1 3.54Å; V213-A302 HydrophobicContact CG2-CB 4.14Å
214	E	98.4	Very high	97.5	Very high	87 Å²	87	68.6 Å²	68.6	41%	0.407	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.4	170.9	-176.6	179.6	-153	0	0	109	I216 I247 R248	E214-I216 HydrophobicContact CG-CD1 4.29Å; E214-I216 HydrophobicContact CG-CG1 3.9Å; E214-I247 CarbonylContact O-C 3.55Å; E214-I247 WeakPolarHBondContact O-CA 3.41Å; E214-R248 HydrophobicContact CB-CB 4.31Å; E214-R248 PolarHBondContact N-O 3.09Å; E214-R248 PolarHBondContact O-N 2.93Å; E214-R248 IonicContact OE2-NH1 3.28Å; E214-R248 PolarHBondContact OE2-NH1 2.82Å
215	V	98.7	Very high	97.5	Very high	32 Å²	32	71.2 Å²	71.2	19%	0.194	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.4	175	-177.7	0	0	0	0	108.8	T203 K204 L207 V213 L245 E246 I247	T203-V215 HydrophobicContact CG2-CG1 3.95Å; T203-V215 HydrophobicContact CG2-CG2 4.47Å; K204-V215 HydrophobicContact CG-CB 4.12Å; K204-V215 HydrophobicContact CG-CG1 3.64Å; L207-V215 HydrophobicContact CB-CG2 3.97Å; L207-V215 HydrophobicContact CD1-CG2 3.84Å; V213-V215 HydrophobicContact CG1-CG2 4.3Å; V215-L245 HydrophobicContact CG1-CD1 3.85Å; V215-E246 WeakPolarHBondContact CA-O 3.37Å; V215-I247 HydrophobicContact CG2-CG2 4.3Å
216	I	98.6	Very high	97.5	Very high	38 Å²	38	70.9 Å²	70.9	20%	0.195	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.8	-178.7	-44.7	173.3	0	0	0	108.3	E214 H218 E246	E214-I216 HydrophobicContact CG-CD1 4.29Å; E214-I216 HydrophobicContact CG-CG1 3.9Å; I216-H218 WeakPolarHBondContact CG2-CE1 3.06Å; I216-E246 HydrophobicContact CB-CB 4.29Å; I216-E246 PolarHBondContact N-O 3.34Å; I216-E246 PolarHBondContact O-N 2.96Å
217	T	98.5	Very high	97.5	Very high	47 Å²	47	77.1 Å²	77.1	29%	0.288	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110	176.9	-55.6	0	0	0	0	107.3	A200 K204 V243	A200-T217 HydrophobicContact CB-CG2 3.86Å; K204-T217 WeakPolarHBondContact CE-OG1 3.37Å; K204-T217 PolarHBondContact NZ-OG1 3.38Å; T217-V243 HydrophobicContact CG2-CG1 3.32Å
218	H	98.6	Very high	97.6	Very high	25 Å²	25	77 Å²	77	12%	0.116	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.6	178.2	-55.1	-71.9	0	0	0	110.3	I216 W222 F244 E246	I216-H218 WeakPolarHBondContact CG2-CE1 3.06Å; H218-W222 HydrophobicContact CB-CB 4.01Å; H218-W222 HydrophobicContact CB-CD2 3.41Å; H218-W222 VanDerWaalsContact CB-CD2 3.41Å; H218-W222 HydrophobicContact CB-CE3 3.35Å; H218-W222 HydrophobicContact CB-CG 3.71Å; H218-W222 HydrophobicContact CB-CZ3 3.96Å; H218-W222 AromaticContact CD2-CE2 3.89Å; H218-W222 AromaticContact CD2-CH2 3.83Å; H218-W222 AromaticContact CD2-CZ2 3.73Å; H218-W222 AromaticContact CE1-CE2 3.67Å; H218-W222 AromaticContact CE1-CZ2 3.88Å; H218-W222 AromaticContact CE1-NE1 3.58Å; H218-W222 AromaticContact CG-CD2 3.49Å; H218-W222 VanDerWaalsContact CG-CD2 3.49Å; H218-W222 AromaticContact CG-CE2 3.56Å; H218-W222 AromaticContact CG-CE3 3.75Å; H218-W222 AromaticContact CG-CG 3.9Å; H218-W222 AromaticContact CG-CZ2 3.9Å; H218-W222 AromaticContact CG-NE1 3.97Å; H218-W222 AromaticContact ND1-CD1 3.55Å; H218-W222 AromaticContact ND1-CD2 3.66Å; H218-W222 AromaticContact ND1-CE2 3.46Å; H218-W222 AromaticContact ND1-CG 3.71Å; H218-W222 AromaticContact ND1-NE1 3.37Å; H218-W222 PolarHBondContact ND1-NE1 2.94Å; H218-W222 AromaticContact NE2-CE2 3.94Å; H218-W222 AromaticContact NE2-CZ2 3.72Å; H218-F244 HydrophobicContact CB-CB 4.2Å; H218-F244 WeakPolarHBondContact CB-O 3.32Å; H218-F244 PolarHBondContact CD2-O 3.47Å; H218-F244 PolarHBondContact N-O 2.91Å; H218-F244 PolarHBondContact O-N 3.42Å; H218-E246 IonicContact CD2-OE2 3.8Å; H218-E246 IonicContact CE1-OE2 3.33Å; H218-E246 IonicContact NE2-OE2 3.76Å; H218-E246 PolarHBondContact NE2-OE2 2.9Å
219	D	96.7	Very high	97.6	Very high	88 Å²	88	71.3 Å²	71.3	47%	0.471	37%	0.367	S	S	.	.			trans	-97	-173	-177.9	61.5	20.1	0	0	0	112.3	E221 W222 A223	D219-E221 VanDerWaalsContact C-N 3.32Å; D219-E221 PolarHBondContact O-N 2.81Å; D219-E221 PolarHBondContact OD1-N 3.11Å; D219-E221 VanDerWaalsContact OD1-N 3.15Å; D219-W222 PolarHBondContact O-N 3.17Å; D219-W222 PolarHBondContact OD1-N 2.97Å; D219-A223 PolarHBondContact O-N 3.12Å; D219-A223 VanDerWaalsContact O-N 3.09Å
220	N	95.3	Very high	97.8	Very high	70 Å²	70	64.3 Å²	64.3	37%	0.374	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-35.9	178.8	-77.5	1.9	0	0	0	113.5	A223 L224 P242	N220-A223 PolarHBondContact O-N 3.12Å; N220-L224 WeakPolarHBondContact O-CB 3.38Å; N220-L224 PolarHBondContact O-N 2.78Å; N220-P242 VanDerWaalsContact OD1-CD 3.3Å; N220-P242 WeakPolarHBondContact OD1-CD 3.37Å; N220-P242 WeakPolarHBondContact OD1-CG 3.44Å; N220-P242 PolarHBondContact OD1-O 3.24Å
221	E	97.4	Very high	97.9	Very high	145 Å²	145	62.7 Å²	62.7	68%	0.678	33%	0.327	S	S	*	.	H	α-helix	trans	-66.1	-46.5	-178.9	-66.9	-174.8	176.2	0	0	109.4	D219 A223 L224 E225	D219-E221 VanDerWaalsContact C-N 3.32Å; D219-E221 PolarHBondContact O-N 2.81Å; D219-E221 PolarHBondContact OD1-N 3.11Å; D219-E221 VanDerWaalsContact OD1-N 3.15Å; E221-A223 VanDerWaalsContact C-N 3.35Å; E221-A223 PolarHBondContact O-N 3.49Å; E221-L224 WeakPolarHBondContact O-CB 3.39Å; E221-L224 PolarHBondContact O-N 2.84Å; E221-E225 WeakPolarHBondContact O-CG 2.82Å; E221-E225 PolarHBondContact O-N 2.94Å
222	W	98.6	Very high	98.1	Very high	37 Å²	37	58 Å²	58	14%	0.14	29%	0.291	C	S	.	.	H	α-helix	trans	-58.4	-44.8	173.5	179.5	93.1	0	0	0	112.5	H218 D219 L224 E225 K226 M228 F244 Y361	H218-W222 HydrophobicContact CB-CB 4.01Å; H218-W222 HydrophobicContact CB-CD2 3.41Å; H218-W222 VanDerWaalsContact CB-CD2 3.41Å; H218-W222 HydrophobicContact CB-CE3 3.35Å; H218-W222 HydrophobicContact CB-CG 3.71Å; H218-W222 HydrophobicContact CB-CZ3 3.96Å; H218-W222 AromaticContact CD2-CE2 3.89Å; H218-W222 AromaticContact CD2-CH2 3.83Å; H218-W222 AromaticContact CD2-CZ2 3.73Å; H218-W222 AromaticContact CE1-CE2 3.67Å; H218-W222 AromaticContact CE1-CZ2 3.88Å; H218-W222 AromaticContact CE1-NE1 3.58Å; H218-W222 AromaticContact CG-CD2 3.49Å; H218-W222 VanDerWaalsContact CG-CD2 3.49Å; H218-W222 AromaticContact CG-CE2 3.56Å; H218-W222 AromaticContact CG-CE3 3.75Å; H218-W222 AromaticContact CG-CG 3.9Å; H218-W222 AromaticContact CG-CZ2 3.9Å; H218-W222 AromaticContact CG-NE1 3.97Å; H218-W222 AromaticContact ND1-CD1 3.55Å; H218-W222 AromaticContact ND1-CD2 3.66Å; H218-W222 AromaticContact ND1-CE2 3.46Å; H218-W222 AromaticContact ND1-CG 3.71Å; H218-W222 AromaticContact ND1-NE1 3.37Å; H218-W222 PolarHBondContact ND1-NE1 2.94Å; H218-W222 AromaticContact NE2-CE2 3.94Å; H218-W222 AromaticContact NE2-CZ2 3.72Å; D219-W222 PolarHBondContact O-N 3.17Å; D219-W222 PolarHBondContact OD1-N 2.97Å; W222-L224 VanDerWaalsContact C-N 3.28Å; W222-L224 PolarHBondContact O-N 3.08Å; W222-E225 PolarHBondContact O-N 3.41Å; W222-K226 HydrophobicContact CD2-CG 3.92Å; W222-K226 HydrophobicContact CE3-CG 4.1Å; W222-K226 HydrophobicContact CH2-CG 3.93Å; W222-K226 HydrophobicContact CZ2-CD 4.25Å; W222-K226 HydrophobicContact CZ2-CG 3.74Å; W222-K226 HydrophobicContact CZ3-CG 4.1Å; W222-K226 WeakPolarHBondContact O-CG 3.23Å; W222-K226 PolarHBondContact O-N 3.04Å; W222-M228 HydrophobicContact CH2-CE 3.69Å; W222-M228 HydrophobicContact CH2-SD 4.38Å; W222-M228 HydrophobicContact CZ3-CE 3.66Å; W222-M228 HydrophobicContact CZ3-SD 3.73Å; W222-F244 HydrophobicContact CE3-CB 4.32Å; W222-F244 HydrophobicContact CH2-CD1 4.03Å; W222-F244 HydrophobicContact CH2-CE1 4.37Å; W222-F244 HydrophobicContact CH2-CG 4.3Å; W222-F244 HydrophobicContact CZ3-CB 3.83Å; W222-F244 AromaticContact CZ3-CD1 3.94Å; W222-F244 HydrophobicContact CZ3-CD1 3.94Å; W222-F244 HydrophobicContact CZ3-CD2 4.29Å; W222-F244 AromaticContact CZ3-CG 3.76Å; W222-F244 HydrophobicContact CZ3-CG 3.76Å; W222-Y361 HydrophobicContact CH2-CD1 4.16Å; W222-Y361 AromaticContact CH2-CE1 3.81Å; W222-Y361 HydrophobicContact CH2-CE1 3.81Å; W222-Y361 HydrophobicContact CH2-CE2 4.25Å; W222-Y361 AromaticContact CH2-CZ 3.87Å; W222-Y361 HydrophobicContact CZ2-CE1 4.06Å; W222-Y361 HydrophobicContact CZ2-CE2 4.09Å; W222-Y361 AromaticContact CZ2-CZ 3.69Å
223	A	98.5	Very high	98.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-34.4	179.3	0	0	0	0	0	112.1	D219 N220 E221 K226 K227 M228 F231 L232	D219-A223 PolarHBondContact O-N 3.12Å; D219-A223 VanDerWaalsContact O-N 3.09Å; N220-A223 PolarHBondContact O-N 3.12Å; E221-A223 VanDerWaalsContact C-N 3.35Å; E221-A223 PolarHBondContact O-N 3.49Å; A223-K226 PolarHBondContact O-N 3.26Å; A223-K227 PolarHBondContact O-N 3.38Å; A223-M228 HydrophobicContact CB-CB 4.4Å; A223-M228 HydrophobicContact CB-SD 4.41Å; A223-M228 WeakPolarHBondContact O-CB 3.42Å; A223-M228 PolarHBondContact O-N 3.22Å; A223-F231 HydrophobicContact CB-CD1 4.06Å; A223-F231 HydrophobicContact CB-CE1 3.92Å; A223-L232 HydrophobicContact CB-CD1 4.28Å; A223-L232 HydrophobicContact CB-CD2 3.88Å; A223-L232 HydrophobicContact CB-CG 4.12Å
224	L	97.9	Very high	98.3	Very high	123 Å²	123	54.6 Å²	54.6	64%	0.644	27%	0.273	S	S	*	.	H	α-helix	trans	-67.5	-44.2	174.9	-176	66.4	0	0	0	111.2	N220 E221 W222 K226 K227 L232	N220-L224 WeakPolarHBondContact O-CB 3.38Å; N220-L224 PolarHBondContact O-N 2.78Å; E221-L224 WeakPolarHBondContact O-CB 3.39Å; E221-L224 PolarHBondContact O-N 2.84Å; W222-L224 VanDerWaalsContact C-N 3.28Å; W222-L224 PolarHBondContact O-N 3.08Å; L224-K226 VanDerWaalsContact C-N 3.28Å; L224-K226 PolarHBondContact O-N 3.33Å; L224-K227 WeakPolarHBondContact O-CA 3.22Å; L224-K227 PolarHBondContact O-N 3.26Å; L224-L232 HydrophobicContact CB-CD1 4.18Å; L224-L232 HydrophobicContact CD1-CD1 4.21Å
225	E	98.5	Very high	98.3	Very high	152 Å²	152	50.4 Å²	50.4	71%	0.71	25%	0.253	S	S	*	.	H	α-helix	trans	-60.3	-37.7	174.5	-71.2	179.9	174.1	0	0	112.3	E221 W222 K227	E221-E225 WeakPolarHBondContact O-CG 2.82Å; E221-E225 PolarHBondContact O-N 2.94Å; W222-E225 PolarHBondContact O-N 3.41Å; E225-K227 PolarHBondContact O-N 3.27Å
226	K	98.5	Very high	98.3	Very high	79 Å²	79	52.9 Å²	52.9	34%	0.343	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-2.4	173.9	-67.2	-60.6	-176.9	-172.7	0	114	W222 A223 L224 M228 M337	W222-K226 HydrophobicContact CD2-CG 3.92Å; W222-K226 HydrophobicContact CE3-CG 4.1Å; W222-K226 HydrophobicContact CH2-CG 3.93Å; W222-K226 HydrophobicContact CZ2-CD 4.25Å; W222-K226 HydrophobicContact CZ2-CG 3.74Å; W222-K226 HydrophobicContact CZ3-CG 4.1Å; W222-K226 WeakPolarHBondContact O-CG 3.23Å; W222-K226 PolarHBondContact O-N 3.04Å; A223-K226 PolarHBondContact O-N 3.26Å; L224-K226 VanDerWaalsContact C-N 3.28Å; L224-K226 PolarHBondContact O-N 3.33Å; K226-M228 VanDerWaalsContact C-N 3.26Å; K226-M228 HydrophobicContact CB-CE 4.12Å; K226-M228 HydrophobicContact CB-CG 3.84Å; K226-M228 HydrophobicContact CB-SD 4.34Å; K226-M228 PolarHBondContact O-N 2.94Å; K226-M337 WeakPolarHBondContact O-CG 3.25Å
227	K	98.6	Very high	98.2	Very high	157 Å²	157	51.2 Å²	51.2	68%	0.683	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	35.9	-178	-52.9	178.2	-179.7	178.9	0	112.9	A223 L224 E225 G229 M337	A223-K227 PolarHBondContact O-N 3.38Å; L224-K227 WeakPolarHBondContact O-CA 3.22Å; L224-K227 PolarHBondContact O-N 3.26Å; E225-K227 PolarHBondContact O-N 3.27Å; K227-G229 PolarHBondContact O-N 3.06Å; K227-M337 WeakPolarHBondContact O-CA 3.12Å; K227-M337 PolarHBondContact O-N 3.28Å
228	M	98.8	Very high	98.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.245	C	C	.	.			trans	-78.7	60.2	178.3	-63.2	-173.5	166.8	0	0	111.5	W222 A223 K226 A230 F231 L232 F244 M337 D357 Y361	W222-M228 HydrophobicContact CH2-CE 3.69Å; W222-M228 HydrophobicContact CH2-SD 4.38Å; W222-M228 HydrophobicContact CZ3-CE 3.66Å; W222-M228 HydrophobicContact CZ3-SD 3.73Å; A223-M228 HydrophobicContact CB-CB 4.4Å; A223-M228 HydrophobicContact CB-SD 4.41Å; A223-M228 WeakPolarHBondContact O-CB 3.42Å; A223-M228 PolarHBondContact O-N 3.22Å; K226-M228 VanDerWaalsContact C-N 3.26Å; K226-M228 HydrophobicContact CB-CE 4.12Å; K226-M228 HydrophobicContact CB-CG 3.84Å; K226-M228 HydrophobicContact CB-SD 4.34Å; K226-M228 PolarHBondContact O-N 2.94Å; M228-A230 VanDerWaalsContact C-N 3.3Å; M228-A230 PolarHBondContact O-N 3.15Å; M228-F231 HydrophobicContact CB-CB 4.19Å; M228-F231 HydrophobicContact CB-CD1 4.18Å; M228-F231 PolarHBondContact O-N 3.01Å; M228-F231 HydrophobicContact SD-CD1 4.28Å; M228-L232 WeakPolarHBondContact O-CB 3.48Å; M228-L232 VanDerWaalsContact O-CG 3.27Å; M228-L232 WeakPolarHBondContact O-CG 3.48Å; M228-L232 PolarHBondContact O-N 3.32Å; M228-F244 HydrophobicContact CE-CD2 4.17Å; M228-F244 HydrophobicContact CE-CE2 3.87Å; M228-F244 HydrophobicContact CE-CZ 4.25Å; M228-F244 HydrophobicContact SD-CD2 3.77Å; M228-F244 HydrophobicContact SD-CE2 3.96Å; M228-M337 HydrophobicContact CE-SD 4.04Å; M228-D357 VanDerWaalsContact CA-CG 3.48Å; M228-D357 WeakPolarHBondContact CA-OD2 3.28Å; M228-D357 HydrophobicContact CB-CB 3.9Å; M228-D357 WeakPolarHBondContact CB-OD2 3.49Å; M228-D357 HydrophobicContact CG-CB 3.92Å; M228-D357 HydrophobicContact SD-CB 4.39Å; M228-Y361 HydrophobicContact CE-CD1 4.28Å; M228-Y361 HydrophobicContact CE-CD2 4.26Å; M228-Y361 HydrophobicContact CE-CG 3.83Å
229	G	98.7	Very high	98.2	Very high	26 Å²	26	55.3 Å²	55.3	27%	0.268	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-29.8	-173.1	0	0	0	0	0	113.4	K227 S233 F335 D357	K227-G229 PolarHBondContact O-N 3.06Å; G229-S233 WeakPolarHBondContact O-CB 2.95Å; G229-S233 PolarHBondContact O-N 3.25Å; G229-F335 CarbonylContact C-O 3.53Å; G229-F335 WeakPolarHBondContact CA-O 3.47Å; G229-F335 PolarHBondContact N-O 2.65Å; G229-D357 PolarHBondContact N-OD2 3.05Å
230	A	98.8	Very high	98.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.1	-46.5	177.6	0	0	0	0	0	111.1	M228 S233 V334 A336 I342 L353 D357	M228-A230 VanDerWaalsContact C-N 3.3Å; M228-A230 PolarHBondContact O-N 3.15Å; A230-S233 PolarHBondContact O-N 2.87Å; A230-S233 PolarHBondContact O-OG 3.37Å; A230-V334 HydrophobicContact CB-CG2 4.31Å; A230-A336 HydrophobicContact CB-CB 4.49Å; A230-I342 HydrophobicContact CB-CD1 3.87Å; A230-L353 HydrophobicContact CB-CB 4.26Å; A230-L353 VanDerWaalsContact CB-O 3.32Å; A230-L353 WeakPolarHBondContact CB-O 3.36Å; A230-D357 WeakPolarHBondContact CA-OD2 3.32Å; A230-D357 WeakPolarHBondContact CB-OD2 3.39Å; A230-D357 PolarHBondContact N-OD2 3.31Å
231	F	98.9	Very high	98.3	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-51.4	174.5	164.8	-123.2	0	0	0	112.3	A223 M228 S233 V234 G235 P242 F244 P317 V319 I354 D357	A223-F231 HydrophobicContact CB-CD1 4.06Å; A223-F231 HydrophobicContact CB-CE1 3.92Å; M228-F231 HydrophobicContact CB-CB 4.19Å; M228-F231 HydrophobicContact CB-CD1 4.18Å; M228-F231 PolarHBondContact O-N 3.01Å; M228-F231 HydrophobicContact SD-CD1 4.28Å; F231-S233 PolarHBondContact O-N 3.06Å; F231-V234 PolarHBondContact O-N 2.99Å; F231-V234 VanDerWaalsContact O-N 3.17Å; F231-G235 PolarHBondContact O-N 2.72Å; F231-P242 HydrophobicContact CE2-CB 4.21Å; F231-P242 HydrophobicContact CZ-CB 3.91Å; F231-F244 HydrophobicContact CD1-CD2 4.5Å; F231-F244 HydrophobicContact CE1-CB 4.16Å; F231-F244 HydrophobicContact CE1-CD2 4.33Å; F231-F244 HydrophobicContact CZ-CB 4.32Å; F231-P317 HydrophobicContact CD2-CB 3.55Å; F231-P317 HydrophobicContact CE2-CB 3.57Å; F231-P317 HydrophobicContact CG-CB 4.27Å; F231-P317 HydrophobicContact CZ-CB 4.35Å; F231-V319 HydrophobicContact CD2-CG1 3.58Å; F231-V319 HydrophobicContact CE2-CG1 3.21Å; F231-V319 HydrophobicContact CZ-CG1 4.21Å; F231-I354 HydrophobicContact CD2-CB 4.08Å; F231-I354 HydrophobicContact CD2-CG2 4.05Å; F231-D357 HydrophobicContact CB-CB 4.14Å; F231-D357 WeakPolarHBondContact CB-OD2 3.38Å; F231-D357 PolarHBondContact N-OD2 3.32Å
232	L	98.7	Very high	98.4	Very high	32 Å²	32	46.6 Å²	46.6	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-33.2	179.2	-72.1	171.8	0	0	0	112.2	A223 L224 M228 V234 G235 K236	A223-L232 HydrophobicContact CB-CD1 4.28Å; A223-L232 HydrophobicContact CB-CD2 3.88Å; A223-L232 HydrophobicContact CB-CG 4.12Å; L224-L232 HydrophobicContact CB-CD1 4.18Å; L224-L232 HydrophobicContact CD1-CD1 4.21Å; M228-L232 WeakPolarHBondContact O-CB 3.48Å; M228-L232 VanDerWaalsContact O-CG 3.27Å; M228-L232 WeakPolarHBondContact O-CG 3.48Å; M228-L232 PolarHBondContact O-N 3.32Å; L232-V234 VanDerWaalsContact C-N 3.27Å; L232-V234 PolarHBondContact O-N 2.84Å; L232-G235 PolarHBondContact O-N 3.38Å; L232-K236 WeakPolarHBondContact O-CB 3.16Å; L232-K236 PolarHBondContact O-N 2.98Å
233	S	98.8	Very high	98.4	Very high	5 Å²	5	45.4 Å²	45.4	4%	0.035	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-33.8	178.2	82.4	0	0	0	0	113.2	G229 A230 F231 K236 N328	G229-S233 WeakPolarHBondContact O-CB 2.95Å; G229-S233 PolarHBondContact O-N 3.25Å; A230-S233 PolarHBondContact O-N 2.87Å; A230-S233 PolarHBondContact O-OG 3.37Å; F231-S233 PolarHBondContact O-N 3.06Å; S233-K236 VanDerWaalsContact O-CE 3.29Å; S233-K236 WeakPolarHBondContact O-CE 3.4Å; S233-K236 WeakPolarHBondContact O-CG 3.47Å; S233-N328 WeakPolarHBondContact CB-ND2 3.49Å; S233-N328 WeakPolarHBondContact CB-OD1 3.41Å; S233-N328 PolarHBondContact O-ND2 3.12Å; S233-N328 PolarHBondContact O-OD1 3.3Å; S233-N328 VanDerWaalsContact O-OD1 3.12Å; S233-N328 PolarHBondContact OG-ND2 2.84Å
234	V	98.8	Very high	98.4	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-75.6	-52.1	178.8	179.2	0	0	0	0	109.7	F231 L232 K236 G237 V319 N321 E350 L353 I354	F231-V234 PolarHBondContact O-N 2.99Å; F231-V234 VanDerWaalsContact O-N 3.17Å; L232-V234 VanDerWaalsContact C-N 3.27Å; L232-V234 PolarHBondContact O-N 2.84Å; V234-K236 VanDerWaalsContact C-N 3.3Å; V234-K236 PolarHBondContact O-N 3.37Å; V234-G237 PolarHBondContact O-N 2.92Å; V234-V319 HydrophobicContact CG1-CB 4.45Å; V234-V319 HydrophobicContact CG1-CG2 3.74Å; V234-N321 HydrophobicContact CG1-CB 4.1Å; V234-E350 HydrophobicContact CB-CB 4.48Å; V234-E350 HydrophobicContact CG1-CB 3.73Å; V234-E350 HydrophobicContact CG1-CG 3.97Å; V234-E350 HydrophobicContact CG2-CB 3.86Å; V234-L353 HydrophobicContact CG2-CB 3.91Å; V234-L353 HydrophobicContact CG2-CD1 3.87Å; V234-L353 HydrophobicContact CG2-CG 4.5Å; V234-I354 HydrophobicContact CB-CG2 3.84Å; V234-I354 HydrophobicContact CG1-CG2 4.16Å; V234-I354 HydrophobicContact CG2-CG2 3.77Å
235	G	98.3	Very high	98.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-27.7	-174.7	0	0	0	0	0	114.4	F231 L232 G237 S238	F231-G235 PolarHBondContact O-N 2.72Å; L232-G235 PolarHBondContact O-N 3.38Å; G235-G237 PolarHBondContact O-N 3.28Å; G235-S238 PolarHBondContact O-N 3.1Å; G235-S238 VanDerWaalsContact O-N 3.15Å
236	K	98.1	Very high	98.5	Very high	83 Å²	83	32.3 Å²	32.3	36%	0.361	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.7	-179.5	77.5	-173.3	177.2	-168.9	0	113.5	L232 S233 V234 S238 K326 N328	L232-K236 WeakPolarHBondContact O-CB 3.16Å; L232-K236 PolarHBondContact O-N 2.98Å; S233-K236 VanDerWaalsContact O-CE 3.29Å; S233-K236 WeakPolarHBondContact O-CE 3.4Å; S233-K236 WeakPolarHBondContact O-CG 3.47Å; V234-K236 VanDerWaalsContact C-N 3.3Å; V234-K236 PolarHBondContact O-N 3.37Å; K236-S238 VanDerWaalsContact C-N 3.33Å; K236-K326 WeakPolarHBondContact CD-O 3.3Å; K236-K326 VanDerWaalsContact CE-O 3.25Å; K236-K326 WeakPolarHBondContact CE-O 3.42Å; K236-K326 WeakPolarHBondContact CG-O 3.35Å; K236-K326 WeakPolarHBondContact O-CD 3.49Å; K236-K326 WeakPolarHBondContact O-CE 3.42Å; K236-K326 WeakPolarHBondContact O-CG 3.47Å; K236-N328 WeakPolarHBondContact CE-OD1 3.35Å; K236-N328 PolarHBondContact NZ-OD1 3.3Å
237	G	98.3	Very high	98.5	Very high	3 Å²	3	28.6 Å²	28.6	3%	0.031	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-30.1	179.1	0	0	0	0	0	113.5	V234 G235 S324	V234-G237 PolarHBondContact O-N 2.92Å; G235-G237 PolarHBondContact O-N 3.28Å; G237-S324 VanDerWaalsContact O-CB 3.26Å; G237-S324 WeakPolarHBondContact O-CB 3.3Å; G237-S324 PolarHBondContact O-OG 2.99Å
238	S	98.4	Very high	98.5	Very high	14 Å²	14	24.9 Å²	24.9	10%	0.098	13%	0.134	C	C	.	.	S	Bend	trans	-90.8	159.6	178.7	-168.2	0	0	0	0	112.3	G235 K236 E240 E320 K326	G235-S238 PolarHBondContact O-N 3.1Å; G235-S238 VanDerWaalsContact O-N 3.15Å; K236-S238 VanDerWaalsContact C-N 3.33Å; S238-E240 PolarHBondContact OG-N 3.39Å; S238-E240 VanDerWaalsContact OG-N 3.09Å; S238-E320 PolarHBondContact OG-OE2 3.22Å; S238-K326 WeakPolarHBondContact O-CE 3.39Å; S238-K326 PolarHBondContact O-NZ 3.13Å
239	D	97.9	Very high	98.4	Very high	144 Å²	144	25.4 Å²	25.4	77%	0.77	14%	0.137	S	C	*	.	S	Bend	trans	-84.4	-15.9	165.2	-70	-29.9	0	0	0	112	K326	D239-K326 WeakPolarHBondContact OD1-CE 3.47Å; D239-K326 IonicContact OD1-NZ 2.73Å; D239-K326 PolarHBondContact OD1-NZ 2.71Å
240	E	97.9	Very high	98.3	Very high	51 Å²	51	29.9 Å²	29.9	24%	0.238	15%	0.149	C	C	.	.	S	Bend	trans	-73.9	125.2	170.8	-173	66.7	-155.6	0	0	109.7	T195 P196 S238 E320	T195-E240 WeakPolarHBondContact CB-OE1 3.27Å; T195-E240 HydrophobicContact CG2-CG 4.27Å; T195-E240 PolarHBondContact OG1-OE1 2.97Å; P196-E240 HydrophobicContact CG-CG 4.25Å; S238-E240 PolarHBondContact OG-N 3.39Å; S238-E240 VanDerWaalsContact OG-N 3.09Å; E240-E320 HydrophobicContact CB-CG 4.4Å
241	P	96.8	Very high	98.2	Very high	62 Å²	62	30.9 Å²	30.9	40%	0.403	16%	0.157	S	C	.	.	P	Polyproline II helix	trans	-70.1	134	-174.7	27.2	-33.6	0	0	0	111.2	V197	V197-P241 HydrophobicContact CG2-CG 3.67Å
242	P	98.2	Very high	97.9	Very high	8 Å²	8	37.3 Å²	37.3	5%	0.052	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-73.1	155.4	173.5	28.2	-25.8	0	0	0	110.7	N220 F231 M318 V319	N220-P242 VanDerWaalsContact OD1-CD 3.3Å; N220-P242 WeakPolarHBondContact OD1-CD 3.37Å; N220-P242 WeakPolarHBondContact OD1-CG 3.44Å; N220-P242 PolarHBondContact OD1-O 3.24Å; F231-P242 HydrophobicContact CE2-CB 4.21Å; F231-P242 HydrophobicContact CZ-CB 3.91Å; P242-M318 CarbonylContact C-O 3.49Å; P242-M318 VanDerWaalsContact CA-O 3.26Å; P242-M318 WeakPolarHBondContact CA-O 3.44Å; P242-M318 WeakPolarHBondContact CB-O 3.41Å; P242-V319 HydrophobicContact CB-CB 4.41Å; P242-V319 HydrophobicContact CB-CG1 3.79Å
243	V	98.5	Very high	97.6	Very high	11 Å²	11	44.3 Å²	44.3	7%	0.067	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.1	-175.1	168	0	0	0	0	108.3	P196 V197 A200 T217 M318	P196-V243 HydrophobicContact CB-CB 4.37Å; P196-V243 HydrophobicContact CB-CG2 4.42Å; V197-V243 HydrophobicContact CG2-CG2 4.07Å; A200-V243 HydrophobicContact CB-CG1 4.05Å; T217-V243 HydrophobicContact CG2-CG1 3.32Å; V243-M318 HydrophobicContact CB-CB 4.37Å; V243-M318 PolarHBondContact N-O 3.42Å; V243-M318 WeakPolarHBondContact O-CA 3.34Å; V243-M318 VanDerWaalsContact O-CB 3.29Å; V243-M318 WeakPolarHBondContact O-CB 3.28Å; V243-M318 PolarHBondContact O-N 3.46Å
244	F	98.9	Very high	97.3	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.4	169.1	-164.9	-72.6	0	0	0	109.1	H218 W222 M228 F231 L315 P317 A358 Y361	H218-F244 HydrophobicContact CB-CB 4.2Å; H218-F244 WeakPolarHBondContact CB-O 3.32Å; H218-F244 PolarHBondContact CD2-O 3.47Å; H218-F244 PolarHBondContact N-O 2.91Å; H218-F244 PolarHBondContact O-N 3.42Å; W222-F244 HydrophobicContact CE3-CB 4.32Å; W222-F244 HydrophobicContact CH2-CD1 4.03Å; W222-F244 HydrophobicContact CH2-CE1 4.37Å; W222-F244 HydrophobicContact CH2-CG 4.3Å; W222-F244 HydrophobicContact CZ3-CB 3.83Å; W222-F244 AromaticContact CZ3-CD1 3.94Å; W222-F244 HydrophobicContact CZ3-CD1 3.94Å; W222-F244 HydrophobicContact CZ3-CD2 4.29Å; W222-F244 AromaticContact CZ3-CG 3.76Å; W222-F244 HydrophobicContact CZ3-CG 3.76Å; M228-F244 HydrophobicContact CE-CD2 4.17Å; M228-F244 HydrophobicContact CE-CE2 3.87Å; M228-F244 HydrophobicContact CE-CZ 4.25Å; M228-F244 HydrophobicContact SD-CD2 3.77Å; M228-F244 HydrophobicContact SD-CE2 3.96Å; F231-F244 HydrophobicContact CD1-CD2 4.5Å; F231-F244 HydrophobicContact CE1-CB 4.16Å; F231-F244 HydrophobicContact CE1-CD2 4.33Å; F231-F244 HydrophobicContact CZ-CB 4.32Å; F244-L315 HydrophobicContact CE1-CB 4.11Å; F244-L315 HydrophobicContact CE1-CD2 4.01Å; F244-L315 HydrophobicContact CZ-CB 4.03Å; F244-P317 HydrophobicContact CD2-CB 3.99Å; F244-P317 HydrophobicContact CE2-CB 4.09Å; F244-A358 HydrophobicContact CE2-CB 3.85Å; F244-A358 HydrophobicContact CZ-CB 4.02Å; F244-Y361 AromaticContact CE1-CD1 3.72Å; F244-Y361 HydrophobicContact CE1-CD1 3.72Å; F244-Y361 HydrophobicContact CE1-CE1 4.05Å; F244-Y361 AromaticContact CZ-CD1 3.75Å; F244-Y361 HydrophobicContact CZ-CD1 3.75Å
245	L	98.8	Very high	97.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.9	-176.5	-172.1	68.1	0	0	0	110.5	F199 A200 T203 V215 L315 M316	F199-L245 HydrophobicContact CD1-CD2 3.93Å; F199-L245 HydrophobicContact CE1-CD2 3.89Å; A200-L245 HydrophobicContact CB-CD1 3.94Å; T203-L245 HydrophobicContact CG2-CD1 4.5Å; T203-L245 HydrophobicContact CG2-CD2 3.71Å; T203-L245 HydrophobicContact CG2-CG 4.41Å; T203-L245 WeakPolarHBondContact OG1-CD2 3.41Å; V215-L245 HydrophobicContact CG1-CD1 3.85Å; L245-L315 WeakPolarHBondContact O-CA 2.92Å; L245-M316 HydrophobicContact CB-CB 4.28Å; L245-M316 HydrophobicContact CB-CE 4.09Å; L245-M316 HydrophobicContact CD2-CE 3.56Å; L245-M316 HydrophobicContact CD2-SD 4.18Å; L245-M316 HydrophobicContact CG-CE 3.75Å; L245-M316 PolarHBondContact N-O 3.07Å; L245-M316 PolarHBondContact O-N 3.19Å
246	E	98.9	Very high	97	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.1	177.5	175.9	179	175.5	0	0	109.6	V215 I216 H218 R248 G314 L315 Y361 F365	V215-E246 WeakPolarHBondContact CA-O 3.37Å; I216-E246 HydrophobicContact CB-CB 4.29Å; I216-E246 PolarHBondContact N-O 3.34Å; I216-E246 PolarHBondContact O-N 2.96Å; H218-E246 IonicContact CD2-OE2 3.8Å; H218-E246 IonicContact CE1-OE2 3.33Å; H218-E246 IonicContact NE2-OE2 3.76Å; H218-E246 PolarHBondContact NE2-OE2 2.9Å; E246-R248 HydrophobicContact CG-CG 4.37Å; E246-R248 IonicContact OE1-CZ 2.67Å; E246-R248 IonicContact OE1-NE 3.85Å; E246-R248 PolarHBondContact OE1-NE 3.27Å; E246-R248 IonicContact OE1-NH2 2.84Å; E246-R248 PolarHBondContact OE1-NH2 2.97Å; E246-R248 IonicContact OE2-NH2 3.31Å; E246-G314 CarbonylContact C-O 3.59Å; E246-G314 VanDerWaalsContact CA-O 3.31Å; E246-G314 WeakPolarHBondContact CA-O 3.42Å; E246-L315 HydrophobicContact CB-CD2 4.16Å; E246-L315 HydrophobicContact CG-CD2 3.86Å; E246-Y361 PolarHBondContact OE2-OH 2.91Å; E246-F365 VanDerWaalsContact OE1-CZ 3.31Å; E246-F365 WeakPolarHBondContact OE1-CZ 3.43Å
247	I	98.8	Very high	97	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132	174.7	-50	170.7	0	0	0	107.8	T203 L207 V213 E214 V215 L295 V298 I313 G314 M316	T203-I247 HydrophobicContact CG2-CD1 3.7Å; T203-I247 HydrophobicContact CG2-CG1 4.05Å; L207-I247 HydrophobicContact CD1-CD1 3.84Å; L207-I247 HydrophobicContact CD1-CG1 4.32Å; L207-I247 HydrophobicContact CD1-CG2 3.71Å; V213-I247 HydrophobicContact CG1-CG2 3.68Å; E214-I247 CarbonylContact O-C 3.55Å; E214-I247 WeakPolarHBondContact O-CA 3.41Å; V215-I247 HydrophobicContact CG2-CG2 4.3Å; I247-L295 HydrophobicContact CD1-CD1 4.25Å; I247-V298 HydrophobicContact CG2-CB 4.43Å; I247-V298 HydrophobicContact CG2-CG1 3.69Å; I247-V298 HydrophobicContact CG2-CG2 4.46Å; I247-I313 CarbonylContact O-C 3.47Å; I247-I313 VanDerWaalsContact O-CA 3.3Å; I247-I313 WeakPolarHBondContact O-CA 3.22Å; I247-G314 PolarHBondContact N-O 3.09Å; I247-G314 PolarHBondContact O-N 2.99Å; I247-M316 HydrophobicContact CD1-CE 3.43Å; I247-M316 VanDerWaalsContact CD1-CE 3.43Å; I247-M316 HydrophobicContact CG1-CE 3.69Å
248	R	98.4	Very high	97	Very high	79 Å²	79	56.7 Å²	56.7	30%	0.298	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	110.6	173.6	-58.8	176.7	-179.1	162.4	-0.3	109.6	V213 E214 E246	V213-R248 CarbonylContact C-O 3.59Å; V213-R248 VanDerWaalsContact CA-O 3.3Å; V213-R248 WeakPolarHBondContact CA-O 3.35Å; E214-R248 HydrophobicContact CB-CB 4.31Å; E214-R248 PolarHBondContact N-O 3.09Å; E214-R248 PolarHBondContact O-N 2.93Å; E214-R248 IonicContact OE2-NH1 3.28Å; E214-R248 PolarHBondContact OE2-NH1 2.82Å; E246-R248 HydrophobicContact CG-CG 4.37Å; E246-R248 IonicContact OE1-CZ 2.67Å; E246-R248 IonicContact OE1-NE 3.85Å; E246-R248 PolarHBondContact OE1-NE 3.27Å; E246-R248 IonicContact OE1-NH2 2.84Å; E246-R248 PolarHBondContact OE1-NH2 2.97Å; E246-R248 IonicContact OE2-NH2 3.31Å
249	L	97.9	Very high	97	Very high	12 Å²	12	56 Å²	56	6%	0.063	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.2	170	168.2	64.9	0	0	0	108.6	N212 V213 V298 L301 A302 D311 V312	N212-L249 VanDerWaalsContact ND2-CD1 3.26Å; N212-L249 WeakPolarHBondContact ND2-CD1 3.29Å; V213-L249 HydrophobicContact CG2-CB 4.32Å; V213-L249 HydrophobicContact CG2-CD1 3.54Å; L249-V298 HydrophobicContact CB-CG1 3.96Å; L249-V298 HydrophobicContact CD2-CG1 4.32Å; L249-L301 HydrophobicContact CD2-CB 3.66Å; L249-L301 HydrophobicContact CD2-CD1 4.38Å; L249-A302 HydrophobicContact CD1-CB 4.27Å; L249-D311 WeakPolarHBondContact O-CA 3.09Å; L249-V312 HydrophobicContact CB-CB 4.25Å; L249-V312 HydrophobicContact CD2-CB 4.38Å; L249-V312 PolarHBondContact N-O 3.42Å; L249-V312 PolarHBondContact O-N 2.8Å
250	K	96.9	Very high	97.1	Very high	119 Å²	119	49.1 Å²	49.1	52%	0.517	25%	0.254	S	S	.	.			trans	-80.7	129.7	177.5	-66.6	-177.6	179.7	175.7	0	110.8	N212 D311	N212-K250 PolarHBondContact ND2-O 3.5Å; N212-K250 PolarHBondContact O-N 2.62Å; K250-D311 WeakPolarHBondContact CA-OD1 3.48Å
251	A	95.8	Very high	97.1	Very high	21 Å²	21	46.8 Å²	46.8	17%	0.174	24%	0.243	C	C	.	.			trans	-67.5	149.6	168.6	0	0	0	0	0	110.7	K253 A254 L308 F310 D311	A251-K253 PolarHBondContact O-N 3.33Å; A251-A254 HydrophobicContact CB-CB 4.26Å; A251-L308 VanDerWaalsContact CB-O 3.25Å; A251-L308 WeakPolarHBondContact CB-O 3.46Å; A251-F310 WeakPolarHBondContact CB-O 3.17Å; A251-D311 PolarHBondContact N-OD1 3.35Å
252	K	92.6	Very high	97.2	Very high	137 Å²	137	43.8 Å²	43.8	60%	0.596	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-35.3	175.2	-62.1	-175.2	-160.6	145.4	0	111.9	H305 D307	K252-H305 PolarHBondContact NZ-O 3.21Å; K252-H305 VanDerWaalsContact NZ-O 3.15Å; K252-D307 WeakPolarHBondContact CD-OD1 3.29Å; K252-D307 WeakPolarHBondContact CE-OD1 3.39Å; K252-D307 IonicContact NZ-OD1 2.73Å; K252-D307 PolarHBondContact NZ-OD1 2.67Å
253	K	91.7	Very high	97.3	Very high	179 Å²	179	43.4 Å²	43.4	78%	0.778	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-148.1	79	177.8	-168.5	179	179.8	-179.1	0	110.7	A251 S255	A251-K253 PolarHBondContact O-N 3.33Å; K253-S255 PolarHBondContact O-N 3.45Å
254	A	93.2	Very high	97.3	Very high	53 Å²	53	43.1 Å²	43.1	44%	0.438	22%	0.219	S	C	.	.			trans	-61	131.2	173.9	0	0	0	0	0	110.8	A251	A251-A254 HydrophobicContact CB-CB 4.26Å
255	S	95.3	Very high	97.3	Very high	96 Å²	96	43 Å²	43	67%	0.671	22%	0.219	S	C	*	.			trans	-130	-6.1	174.8	59.1	0	0	0	0	112.7	K253 P309	K253-S255 PolarHBondContact O-N 3.45Å; S255-P309 PolarHBondContact N-O 3.39Å; S255-P309 PolarHBondContact OG-O 3.01Å
256	R	96.2	Very high	97.3	Very high	133 Å²	133	43 Å²	43	50%	0.502	22%	0.219	S	C	.	.	S	Bend	trans	-127.4	159.6	177.4	-59.9	179.7	-175.3	168.9	1.7	109.7	P309 F310 L500	R256-P309 HydrophobicContact CG-CB 4.5Å; R256-P309 PolarHBondContact N-O 3.5Å; R256-F310 HydrophobicContact CB-CB 4.29Å; R256-L500 PolarHBondContact NH1-O 3.15Å
257	A	97.7	Very high	97.3	Very high	45 Å²	45	43 Å²	43	37%	0.372	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-58.5	151.1	171.7	0	0	0	0	0	111.3	F310 Q366 S368	A257-F310 WeakPolarHBondContact O-CB 3.33Å; A257-Q366 WeakPolarHBondContact CB-O 3.45Å; A257-S368 PolarHBondContact O-OG 3.37Å
258	P	98.4	Very high	97.3	Very high	25 Å²	25	45 Å²	45	16%	0.162	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-61.3	158.6	-173.6	26	-35.3	0	0	0	112.7	D311 I313 F365 P367 S368	P258-D311 CarbonylContact C-O 3.58Å; P258-D311 VanDerWaalsContact CA-O 3.26Å; P258-D311 WeakPolarHBondContact CA-O 3.39Å; P258-D311 HydrophobicContact CB-CB 4.22Å; P258-I313 HydrophobicContact CB-CD1 3.84Å; P258-I313 HydrophobicContact CB-CG1 4.16Å; P258-I313 HydrophobicContact CG-CD1 4.01Å; P258-F365 HydrophobicContact CG-CB 4.3Å; P258-P367 CarbonylContact O-C 3.59Å; P258-P367 WeakPolarHBondContact O-CA 3.23Å; P258-P367 WeakPolarHBondContact O-CB 3.34Å; P258-S368 PolarHBondContact O-N 2.9Å; P258-S368 PolarHBondContact O-OG 3.48Å
259	V	98.7	Very high	97.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.2	166.4	174.3	0	0	0	0	108.5	F310 D311 V312 I313 H369 L497 L500	V259-F310 HydrophobicContact CB-CD2 3.88Å; V259-F310 HydrophobicContact CB-CE2 3.92Å; V259-F310 HydrophobicContact CG2-CD1 4.15Å; V259-F310 HydrophobicContact CG2-CD2 3.48Å; V259-F310 VanDerWaalsContact CG2-CD2 3.48Å; V259-F310 HydrophobicContact CG2-CE1 4.21Å; V259-F310 HydrophobicContact CG2-CE2 3.54Å; V259-F310 HydrophobicContact CG2-CG 3.82Å; V259-F310 HydrophobicContact CG2-CZ 3.92Å; V259-D311 PolarHBondContact N-O 3.18Å; V259-V312 WeakPolarHBondContact O-CA 3.47Å; V259-I313 PolarHBondContact O-N 3.42Å; V259-H369 HydrophobicContact CG1-CB 4.11Å; V259-H369 HydrophobicContact CG2-CB 4.13Å; V259-L497 HydrophobicContact CG1-CD2 3.71Å; V259-L500 HydrophobicContact CG2-CD1 4.2Å
260	C	98.9	Very high	97.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130	175.7	-71.6	0	0	0	0	110.6	I313 A362 P367 H369 V370 I371	C260-I313 CarbonylContact C-O 3.53Å; C260-I313 VanDerWaalsContact CA-O 3.3Å; C260-I313 WeakPolarHBondContact CA-O 3.49Å; C260-A362 HydrophobicContact CB-CB 4.03Å; C260-P367 HydrophobicContact CB-CB 4.23Å; C260-H369 PolarHBondContact N-O 3.43Å; C260-V370 HydrophobicContact CB-CG2 4.2Å; C260-V370 CarbonylContact O-C 3.58Å; C260-V370 WeakPolarHBondContact O-CA 3.33Å; C260-I371 PolarHBondContact O-N 3.13Å
261	L	99	Very high	97.4	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.1	167.9	-62	-179.4	0	0	0	108.4	V294 C297 V312 I313 G314 L315 I371 L497	L261-V294 HydrophobicContact CB-CG1 3.95Å; L261-V294 HydrophobicContact CB-CG2 4.06Å; L261-C297 HydrophobicContact CD1-CB 3.77Å; L261-V312 HydrophobicContact CD1-CG1 3.92Å; L261-V312 HydrophobicContact CG-CG1 4.16Å; L261-I313 PolarHBondContact N-O 2.87Å; L261-G314 CarbonylContact O-C 3.54Å; L261-G314 WeakPolarHBondContact O-CA 3.27Å; L261-L315 PolarHBondContact O-N 3.4Å; L261-I371 CarbonylContact C-O 3.37Å; L261-I371 VanDerWaalsContact CA-O 3.32Å; L261-I371 WeakPolarHBondContact CA-O 3.5Å; L261-I371 HydrophobicContact CD2-CB 3.91Å; L261-I371 HydrophobicContact CD2-CD1 4.31Å; L261-L497 HydrophobicContact CD1-CD1 3.81Å; L261-L497 HydrophobicContact CD2-CD1 4.16Å; L261-L497 HydrophobicContact CD2-CD2 4.11Å; L261-L497 HydrophobicContact CG-CD1 4.47Å
262	V	99	Very high	97.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131	178.9	-173.4	0	0	0	0	109.8	L315 L355 A358 L359 A362 V370 I371 D372 I373	V262-L315 CarbonylContact C-O 3.51Å; V262-L315 VanDerWaalsContact CA-O 3.28Å; V262-L315 WeakPolarHBondContact CA-O 3.42Å; V262-L315 HydrophobicContact CG2-CB 4.33Å; V262-L315 HydrophobicContact CG2-CD1 4.37Å; V262-L355 HydrophobicContact CG1-CD2 3.74Å; V262-A358 HydrophobicContact CG1-CB 3.55Å; V262-L359 HydrophobicContact CG2-CD2 4.33Å; V262-A362 HydrophobicContact CG2-CB 4.1Å; V262-V370 HydrophobicContact CG2-CG1 4.17Å; V262-I371 PolarHBondContact N-O 3.12Å; V262-D372 HydrophobicContact CB-CB 3.78Å; V262-D372 HydrophobicContact CG1-CB 4.42Å; V262-D372 CarbonylContact O-C 3.58Å; V262-D372 WeakPolarHBondContact O-CA 3.48Å; V262-I373 PolarHBondContact O-N 3.22Å
263	G	99	Very high	97.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.1	-174.5	0	0	0	0	0	112.6	G265 L315 P317	G263-G265 PolarHBondContact O-N 3.28Å; G263-L315 PolarHBondContact N-O 3.5Å; G263-P317 WeakPolarHBondContact O-CD 3.49Å
264	K	98.9	Very high	98.1	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.017	15%	0.145	C	C	.	.			trans	-59.4	123.5	170.1	-178.8	-170.3	173.2	179.7	0	109.4	V266 D287 M288 A291 E350 G351 I354 L355 I373 A374 T375 L376	K264-V266 HydrophobicContact CD-CG2 4.41Å; K264-V266 HydrophobicContact CG-CG2 4.1Å; K264-D287 WeakPolarHBondContact CE-OD1 3.28Å; K264-D287 WeakPolarHBondContact CE-OD2 3.32Å; K264-D287 IonicContact NZ-OD1 3.45Å; K264-D287 PolarHBondContact NZ-OD1 3.22Å; K264-D287 IonicContact NZ-OD2 3.68Å; K264-D287 PolarHBondContact NZ-OD2 2.73Å; K264-M288 CarbonylContact O-C 3.47Å; K264-M288 WeakPolarHBondContact O-CA 3.42Å; K264-A291 PolarHBondContact O-N 2.89Å; K264-E350 WeakPolarHBondContact CE-OE1 3.47Å; K264-E350 IonicContact NZ-OE1 2.7Å; K264-E350 PolarHBondContact NZ-OE1 3.19Å; K264-G351 VanDerWaalsContact CE-CA 3.45Å; K264-I354 HydrophobicContact CG-CD1 4.04Å; K264-L355 HydrophobicContact CB-CD1 4.35Å; K264-L355 HydrophobicContact CB-CD2 4.38Å; K264-L355 HydrophobicContact CB-CG 4.44Å; K264-I373 PolarHBondContact N-O 2.76Å; K264-A374 HydrophobicContact CB-CB 3.54Å; K264-A374 HydrophobicContact CD-CB 4.06Å; K264-A374 HydrophobicContact CG-CB 4.36Å; K264-T375 PolarHBondContact NZ-O 3.32Å; K264-T375 VanDerWaalsContact NZ-O 3.09Å; K264-L376 HydrophobicContact CD-CD1 4.47Å
265	G	98.8	Very high	98.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	52.1	-175.1	0	0	0	0	0	114.3	G263 C267 P317 M318 V319	G263-G265 PolarHBondContact O-N 3.28Å; G265-C267 PolarHBondContact O-N 2.99Å; G265-P317 VanDerWaalsContact CA-O 3.28Å; G265-P317 WeakPolarHBondContact CA-O 3.5Å; G265-P317 PolarHBondContact N-O 2.63Å; G265-M318 CarbonylContact O-C 3.2Å; G265-M318 VanDerWaalsContact O-CA 3.23Å; G265-M318 WeakPolarHBondContact O-CA 3.39Å; G265-V319 PolarHBondContact O-N 2.92Å
266	V	98.9	Very high	98.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	99.7	176.2	-174.4	0	0	0	0	109.1	K264 F268 D269 D287 M288 V319 N321 E350 I354	K264-V266 HydrophobicContact CD-CG2 4.41Å; K264-V266 HydrophobicContact CG-CG2 4.1Å; V266-F268 WeakPolarHBondContact CG1-O 3.41Å; V266-F268 PolarHBondContact O-N 3.44Å; V266-D269 HydrophobicContact CG1-CB 3.77Å; V266-D287 HydrophobicContact CB-CB 4.16Å; V266-D287 WeakPolarHBondContact CB-OD2 3.47Å; V266-D287 PolarHBondContact N-O 3.1Å; V266-D287 CarbonylContact O-C 3.59Å; V266-D287 WeakPolarHBondContact O-CA 3.24Å; V266-D287 WeakPolarHBondContact O-CB 3.49Å; V266-M288 PolarHBondContact O-N 2.84Å; V266-V319 CarbonylContact C-O 3.53Å; V266-V319 WeakPolarHBondContact CA-O 3.21Å; V266-V319 HydrophobicContact CB-CG2 4.42Å; V266-V319 HydrophobicContact CG1-CG2 4.38Å; V266-V319 HydrophobicContact CG2-CG2 3.92Å; V266-N321 HydrophobicContact CG1-CB 4.16Å; V266-E350 HydrophobicContact CG2-CG 3.98Å; V266-I354 HydrophobicContact CG2-CD1 3.66Å
267	C	98.8	Very high	98.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	-30.1	-176	-73.5	0	0	0	0	113	A191 M194 T195 P196 G265 V319 E320	A191-C267 VanDerWaalsContact CB-O 3.22Å; A191-C267 WeakPolarHBondContact CB-O 3.34Å; M194-C267 WeakPolarHBondContact O-CB 3.24Å; M194-C267 PolarHBondContact O-SG 2.85Å; T195-C267 VanDerWaalsContact C-SG 3.53Å; P196-C267 HydrophobicContact CG-CB 4.34Å; P196-C267 VanDerWaalsContact N-SG 3.41Å; G265-C267 PolarHBondContact O-N 2.99Å; C267-V319 PolarHBondContact N-O 2.77Å; C267-E320 HydrophobicContact CB-CG 4.22Å
268	F	98.8	Very high	98.5	Very high	40 Å²	40	26.2 Å²	26.2	18%	0.175	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	130.4	166.6	-169.1	-107.4	0	0	0	110.3	A191 V266 M281 M284 E320 N321 M322	A191-F268 HydrophobicContact CB-CB 3.65Å; A191-F268 HydrophobicContact CB-CD2 3.89Å; A191-F268 HydrophobicContact CB-CG 4.11Å; V266-F268 WeakPolarHBondContact CG1-O 3.41Å; V266-F268 PolarHBondContact O-N 3.44Å; F268-M281 HydrophobicContact CZ-CG 4.14Å; F268-M281 HydrophobicContact CZ-SD 4.3Å; F268-M284 HydrophobicContact CE2-CB 4.38Å; F268-E320 HydrophobicContact CB-CG 4.47Å; F268-N321 PolarHBondContact O-N 3Å; F268-M322 HydrophobicContact CD1-SD 3.77Å; F268-M322 HydrophobicContact CE1-SD 4.31Å
269	D	98.7	Very high	98.5	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	100.1	177	-175.8	23.1	0	0	0	111.4	V266 G271 K276 M284 D287 N321	V266-D269 HydrophobicContact CG1-CB 3.77Å; D269-G271 VanDerWaalsContact C-N 3.29Å; D269-G271 WeakPolarHBondContact OD1-CA 3.47Å; D269-G271 PolarHBondContact OD1-N 2.91Å; D269-K276 VanDerWaalsContact O-CE 3.24Å; D269-K276 WeakPolarHBondContact O-CE 3.41Å; D269-K276 WeakPolarHBondContact OD2-CE 3.11Å; D269-K276 IonicContact OD2-NZ 2.91Å; D269-K276 PolarHBondContact OD2-NZ 2.98Å; D269-M284 HydrophobicContact CB-CB 4.16Å; D269-M284 WeakPolarHBondContact O-CB 3.41Å; D269-M284 VanDerWaalsContact O-CG 3.23Å; D269-M284 WeakPolarHBondContact O-CG 3.49Å; D269-D287 HydrophobicContact CB-CB 4.08Å; D269-D287 VanDerWaalsContact CB-OD2 3.26Å; D269-D287 WeakPolarHBondContact CB-OD2 2.92Å; D269-N321 PolarHBondContact OD1-ND2 3.46Å
270	S	98.6	Very high	98.2	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.028	21%	0.205	C	C	.	.			trans	-83	-10.6	170.4	68.9	0	0	0	0	112.7	G272 K276 N321 P323	S270-G272 VanDerWaalsContact C-N 3.32Å; S270-G272 PolarHBondContact OG-N 2.85Å; S270-K276 PolarHBondContact O-N 2.78Å; S270-N321 WeakPolarHBondContact CB-O 3.47Å; S270-N321 PolarHBondContact N-O 2.57Å; S270-N321 VanDerWaalsContact N-O 3.09Å; S270-N321 PolarHBondContact OG-O 2.73Å; S270-P323 WeakPolarHBondContact OG-CD 3.47Å
271	G	98.5	Very high	98.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	22%	0.215	C	C	.	.			trans	84.2	-5.6	-166.3	0	0	0	0	0	115.4	D269 S274 N321 T347 D348	D269-G271 VanDerWaalsContact C-N 3.29Å; D269-G271 WeakPolarHBondContact OD1-CA 3.47Å; D269-G271 PolarHBondContact OD1-N 2.91Å; G271-S274 PolarHBondContact O-N 3.31Å; G271-N321 VanDerWaalsContact C-ND2 3.34Å; G271-N321 WeakPolarHBondContact CA-ND2 3.43Å; G271-T347 CarbonylContact O-C 3.46Å; G271-T347 WeakPolarHBondContact O-CB 3.14Å; G271-T347 PolarHBondContact O-OG1 3.32Å; G271-D348 WeakPolarHBondContact CA-OD1 3.46Å; G271-D348 PolarHBondContact O-N 2.93Å
272	G	98.6	Very high	97.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.01	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	-134.9	-177.9	0	0	0	0	0	111.8	S270 S274 L275	S270-G272 VanDerWaalsContact C-N 3.32Å; S270-G272 PolarHBondContact OG-N 2.85Å; G272-S274 VanDerWaalsContact C-N 3.29Å; G272-S274 PolarHBondContact O-N 2.84Å; G272-L275 PolarHBondContact O-N 2.8Å
273	I	98.7	Very high	97.8	Very high	82 Å²	82	38.5 Å²	38.5	42%	0.421	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-33	177.1	-64.7	-60	0	0	0	111.9	L275 P323 A327 N328 P330 T347	I273-L275 PolarHBondContact O-N 3.2Å; I273-P323 HydrophobicContact CD1-CB 4.32Å; I273-A327 HydrophobicContact CD1-CB 4.42Å; I273-A327 HydrophobicContact CG1-CB 4.2Å; I273-N328 WeakPolarHBondContact CG1-O 3.43Å; I273-P330 HydrophobicContact CG2-CG 4.33Å; I273-T347 HydrophobicContact CB-CG2 4.46Å; I273-T347 PolarHBondContact N-OG1 3.45Å; I273-T347 VanDerWaalsContact N-OG1 3.17Å
274	S	98.2	Very high	97.7	Very high	32 Å²	32	39.8 Å²	39.8	22%	0.224	25%	0.252	C	S	.	.	S	Bend	trans	-78.7	56.8	169.9	-49.5	0	0	0	0	110	G271 G272 K276 N346 T347	G271-S274 PolarHBondContact O-N 3.31Å; G272-S274 VanDerWaalsContact C-N 3.29Å; G272-S274 PolarHBondContact O-N 2.84Å; S274-K276 PolarHBondContact O-N 2.74Å; S274-N346 WeakPolarHBondContact CB-OD1 3.18Å; S274-N346 PolarHBondContact OG-OD1 3.25Å; S274-T347 VanDerWaalsContact CB-OG1 3.25Å; S274-T347 WeakPolarHBondContact CB-OG1 3.35Å; S274-T347 PolarHBondContact N-OG1 3.43Å; S274-T347 PolarHBondContact OG-N 3.36Å; S274-T347 PolarHBondContact OG-OG1 2.86Å
275	L	98.4	Very high	97.6	Very high	106 Å²	106	41.9 Å²	41.9	56%	0.555	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-57.2	130.6	-166.1	-170.1	73	0	0	0	112.5	G272 I273 P323	G272-L275 PolarHBondContact O-N 2.8Å; I273-L275 PolarHBondContact O-N 3.2Å; L275-P323 HydrophobicContact CD1-CG 4.15Å
276	K	98.1	Very high	97.6	Very high	39 Å²	39	42.1 Å²	42.1	17%	0.17	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-64.7	155	173.6	-68.9	-175.3	-158.4	-71.5	0	111.5	D269 S270 S274 M281 M284 D348	D269-K276 VanDerWaalsContact O-CE 3.24Å; D269-K276 WeakPolarHBondContact O-CE 3.41Å; D269-K276 WeakPolarHBondContact OD2-CE 3.11Å; D269-K276 IonicContact OD2-NZ 2.91Å; D269-K276 PolarHBondContact OD2-NZ 2.98Å; S270-K276 PolarHBondContact O-N 2.78Å; S274-K276 PolarHBondContact O-N 2.74Å; K276-M281 HydrophobicContact CB-CE 3.94Å; K276-M281 WeakPolarHBondContact O-CE 3.2Å; K276-M284 HydrophobicContact CD-CG 3.83Å; K276-M284 HydrophobicContact CD-SD 3.9Å; K276-M284 VanDerWaalsContact CE-SD 3.54Å; K276-D348 WeakPolarHBondContact CE-OD1 3.47Å; K276-D348 WeakPolarHBondContact CG-OD1 3.36Å; K276-D348 IonicContact NZ-OD1 2.71Å; K276-D348 PolarHBondContact NZ-OD1 2.82Å; K276-D348 IonicContact NZ-OD2 3.53Å; K276-D348 PolarHBondContact NZ-OD2 3.47Å
277	P	97.4	Very high	97.6	Very high	102 Å²	102	42.3 Å²	42.3	66%	0.662	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-60.8	151.1	168.5	-22	33.8	0	0	0	112.2	A279 M281	P277-A279 PolarHBondContact O-N 3.18Å; P277-M281 VanDerWaalsContact O-CE 3.32Å; P277-M281 WeakPolarHBondContact O-CE 3.42Å
278	S	97.1	Very high	97.6	Very high	111 Å²	111	42.4 Å²	42.4	78%	0.776	26%	0.262	S	S	*	.	S	Bend	trans	-63.1	-29.7	178.8	58.6	0	0	0	0	113.7	S280 M281	S278-S280 PolarHBondContact O-N 3.35Å; S278-S280 VanDerWaalsContact O-N 3.13Å; S278-M281 PolarHBondContact O-N 3.41Å
279	A	96.6	Very high	97.5	Very high	80 Å²	80	40.5 Å²	40.5	66%	0.661	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	117.2	-179.1	0	0	0	0	0	110.7	P277 M281	P277-A279 PolarHBondContact O-N 3.18Å; A279-M281 PolarHBondContact O-N 2.86Å
280	S	92.5	Very high	97.6	Very high	85 Å²	85	40.3 Å²	40.3	59%	0.594	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	12.5	178.9	-58.7	0	0	0	0	116	S278 G282 L283	S278-S280 PolarHBondContact O-N 3.35Å; S278-S280 VanDerWaalsContact O-N 3.13Å; S280-G282 PolarHBondContact O-N 3.4Å; S280-G282 VanDerWaalsContact O-N 3.12Å; S280-L283 VanDerWaalsContact O-CB 3.3Å; S280-L283 WeakPolarHBondContact O-CB 3.31Å; S280-L283 WeakPolarHBondContact O-CG 3.42Å; S280-L283 PolarHBondContact O-N 2.93Å
281	M	96.9	Very high	97.6	Very high	39 Å²	39	40.1 Å²	40.1	19%	0.192	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-57	-30.9	177.7	-169.6	-170.8	-64.7	0	0	112.4	F268 K276 P277 S278 A279 L283 M284	F268-M281 HydrophobicContact CZ-CG 4.14Å; F268-M281 HydrophobicContact CZ-SD 4.3Å; K276-M281 HydrophobicContact CB-CE 3.94Å; K276-M281 WeakPolarHBondContact O-CE 3.2Å; P277-M281 VanDerWaalsContact O-CE 3.32Å; P277-M281 WeakPolarHBondContact O-CE 3.42Å; S278-M281 PolarHBondContact O-N 3.41Å; A279-M281 PolarHBondContact O-N 2.86Å; M281-L283 PolarHBondContact O-N 3.12Å; M281-M284 VanDerWaalsContact O-CB 3.29Å; M281-M284 WeakPolarHBondContact O-CB 3.41Å; M281-M284 WeakPolarHBondContact O-CG 3.47Å; M281-M284 PolarHBondContact O-N 3.17Å
282	G	96	Very high	97.6	Very high	46 Å²	46	40.1 Å²	40.1	47%	0.474	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-58.5	-17.8	174.6	0	0	0	0	0	114.4	S280 M284 R285	S280-G282 PolarHBondContact O-N 3.4Å; S280-G282 VanDerWaalsContact O-N 3.12Å; G282-M284 VanDerWaalsContact C-N 3.32Å; G282-R285 PolarHBondContact O-NH1 3.18Å
283	L	95.2	Very high	97.6	Very high	35 Å²	35	40.1 Å²	40.1	18%	0.183	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-72.9	-22.3	172.7	-62.6	177.5	0	0	0	112.8	S280 M281 R285 F286 E473 M485	S280-L283 VanDerWaalsContact O-CB 3.3Å; S280-L283 WeakPolarHBondContact O-CB 3.31Å; S280-L283 WeakPolarHBondContact O-CG 3.42Å; S280-L283 PolarHBondContact O-N 2.93Å; M281-L283 PolarHBondContact O-N 3.12Å; L283-R285 PolarHBondContact O-N 2.96Å; L283-F286 HydrophobicContact CB-CD1 4.06Å; L283-F286 HydrophobicContact CB-CE1 3.75Å; L283-F286 WeakPolarHBondContact O-CD1 3.3Å; L283-F286 WeakPolarHBondContact O-CE1 3.5Å; L283-F286 WeakPolarHBondContact O-CG 3.41Å; L283-F286 PolarHBondContact O-N 3.48Å; L283-E473 WeakPolarHBondContact CD1-OE2 3.46Å; L283-M485 HydrophobicContact CD2-CE 4.22Å
284	M	97.5	Very high	97.6	Very high	26 Å²	26	36.2 Å²	36.2	13%	0.128	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-64.4	-0.8	-179.8	-60.4	-63.7	97.7	0	0	114.2	F268 D269 K276 M281 G282 F286 D287	F268-M284 HydrophobicContact CE2-CB 4.38Å; D269-M284 HydrophobicContact CB-CB 4.16Å; D269-M284 WeakPolarHBondContact O-CB 3.41Å; D269-M284 VanDerWaalsContact O-CG 3.23Å; D269-M284 WeakPolarHBondContact O-CG 3.49Å; K276-M284 HydrophobicContact CD-CG 3.83Å; K276-M284 HydrophobicContact CD-SD 3.9Å; K276-M284 VanDerWaalsContact CE-SD 3.54Å; M281-M284 VanDerWaalsContact O-CB 3.29Å; M281-M284 WeakPolarHBondContact O-CB 3.41Å; M281-M284 WeakPolarHBondContact O-CG 3.47Å; M281-M284 PolarHBondContact O-N 3.17Å; G282-M284 VanDerWaalsContact C-N 3.32Å; M284-F286 HydrophobicContact CE-CE1 3.76Å; M284-F286 HydrophobicContact CE-CE2 3.93Å; M284-F286 HydrophobicContact CE-CZ 3.27Å; M284-F286 PolarHBondContact O-N 2.9Å; M284-D287 VanDerWaalsContact O-CB 3.3Å; M284-D287 WeakPolarHBondContact O-CB 3.47Å; M284-D287 PolarHBondContact O-N 3.45Å
285	R	98.2	Very high	97.6	Very high	48 Å²	48	34.7 Å²	34.7	18%	0.181	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-60.1	-21.3	161.5	70.4	-174.6	-174.8	-84.6	-2.2	113.5	D188 M189 A191 G282 L283 D287	D188-R285 PolarHBondContact O-NE 3.27Å; D188-R285 IonicContact OD1-NH2 3.62Å; M189-R285 WeakPolarHBondContact O-CD 3.48Å; A191-R285 HydrophobicContact CB-CB 4.27Å; G282-R285 PolarHBondContact O-NH1 3.18Å; L283-R285 PolarHBondContact O-N 2.96Å; R285-D287 PolarHBondContact O-N 2.86Å
286	F	97.2	Very high	97.7	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.022	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-77.2	-5.4	175.5	68.5	-126.2	0	0	0	113.3	L283 M284 M288 T289 T375 T472 E473 M485	L283-F286 HydrophobicContact CB-CD1 4.06Å; L283-F286 HydrophobicContact CB-CE1 3.75Å; L283-F286 WeakPolarHBondContact O-CD1 3.3Å; L283-F286 WeakPolarHBondContact O-CE1 3.5Å; L283-F286 WeakPolarHBondContact O-CG 3.41Å; L283-F286 PolarHBondContact O-N 3.48Å; M284-F286 HydrophobicContact CE-CE1 3.76Å; M284-F286 HydrophobicContact CE-CE2 3.93Å; M284-F286 HydrophobicContact CE-CZ 3.27Å; M284-F286 PolarHBondContact O-N 2.9Å; F286-M288 PolarHBondContact O-N 2.62Å; F286-T289 WeakPolarHBondContact O-CB 3.03Å; F286-T289 PolarHBondContact O-N 3.09Å; F286-T289 PolarHBondContact O-OG1 3.09Å; F286-T375 HydrophobicContact CD2-CG2 3.99Å; F286-T375 HydrophobicContact CE2-CG2 4.25Å; F286-T472 HydrophobicContact CB-CG2 3.79Å; F286-T472 HydrophobicContact CD1-CG2 4.36Å; F286-T472 HydrophobicContact CD2-CG2 3.97Å; F286-T472 HydrophobicContact CG-CG2 3.8Å; F286-E473 HydrophobicContact CD1-CG 3.94Å; F286-E473 HydrophobicContact CE1-CG 3.49Å; F286-E473 VanDerWaalsContact CE1-CG 3.49Å; F286-E473 WeakPolarHBondContact CE1-OE1 3.26Å; F286-E473 HydrophobicContact CZ-CG 4.23Å; F286-M485 HydrophobicContact CB-CE 3.83Å; F286-M485 HydrophobicContact CB-CG 4.31Å; F286-M485 HydrophobicContact CB-SD 3.71Å; F286-M485 HydrophobicContact CD1-CE 3.63Å; F286-M485 HydrophobicContact CD1-SD 3.68Å; F286-M485 HydrophobicContact CG-CE 4.23Å; F286-M485 HydrophobicContact CG-SD 4.09Å
287	D	98.6	Very high	97.7	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.027	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	8.1	-165.7	-157.7	36	0	0	0	114.6	K264 V266 D269 M284 R285 T375	K264-D287 WeakPolarHBondContact CE-OD1 3.28Å; K264-D287 WeakPolarHBondContact CE-OD2 3.32Å; K264-D287 IonicContact NZ-OD1 3.45Å; K264-D287 PolarHBondContact NZ-OD1 3.22Å; K264-D287 IonicContact NZ-OD2 3.68Å; K264-D287 PolarHBondContact NZ-OD2 2.73Å; V266-D287 HydrophobicContact CB-CB 4.16Å; V266-D287 WeakPolarHBondContact CB-OD2 3.47Å; V266-D287 PolarHBondContact N-O 3.1Å; V266-D287 CarbonylContact O-C 3.59Å; V266-D287 WeakPolarHBondContact O-CA 3.24Å; V266-D287 WeakPolarHBondContact O-CB 3.49Å; D269-D287 HydrophobicContact CB-CB 4.08Å; D269-D287 VanDerWaalsContact CB-OD2 3.26Å; D269-D287 WeakPolarHBondContact CB-OD2 2.92Å; M284-D287 VanDerWaalsContact O-CB 3.3Å; M284-D287 WeakPolarHBondContact O-CB 3.47Å; M284-D287 PolarHBondContact O-N 3.45Å; R285-D287 PolarHBondContact O-N 2.86Å; D287-T375 WeakPolarHBondContact CA-OG1 3.42Å; D287-T375 PolarHBondContact O-OG1 3.05Å; D287-T375 VanDerWaalsContact OD1-CB 3.31Å; D287-T375 WeakPolarHBondContact OD1-CB 3.25Å; D287-T375 VanDerWaalsContact OD1-O 3.04Å; D287-T375 PolarHBondContact OD1-OG1 3.08Å
288	M	98.7	Very high	97.7	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	6	170.9	53.6	63.8	66.8	0	0	113.1	L186 M194 F199 K264 V266 F286 G290 A291 A292 M318	L186-M288 HydrophobicContact CB-CE 3.97Å; M194-M288 HydrophobicContact CG-CE 4.5Å; F199-M288 HydrophobicContact CD2-CE 3.37Å; F199-M288 HydrophobicContact CE2-CE 3.16Å; F199-M288 HydrophobicContact CZ-CE 4.25Å; K264-M288 CarbonylContact O-C 3.47Å; K264-M288 WeakPolarHBondContact O-CA 3.42Å; V266-M288 PolarHBondContact O-N 2.84Å; F286-M288 PolarHBondContact O-N 2.62Å; M288-G290 PolarHBondContact O-N 2.72Å; M288-G290 VanDerWaalsContact O-N 3.15Å; M288-A291 WeakPolarHBondContact O-CB 3.41Å; M288-A291 PolarHBondContact O-N 2.71Å; M288-A292 HydrophobicContact CE-CB 3.83Å; M288-A292 PolarHBondContact O-N 3.41Å; M288-A292 HydrophobicContact SD-CB 4.49Å; M288-M318 HydrophobicContact CB-CE 4.25Å
289	T	98.8	Very high	97.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.4	-30.2	-179	-62	0	0	0	0	111.7	V183 S187 F286 A292 C293 I468 T472	V183-T289 HydrophobicContact CG1-CG2 3.91Å; S187-T289 VanDerWaalsContact CB-OG1 3.29Å; S187-T289 WeakPolarHBondContact CB-OG1 3.5Å; S187-T289 PolarHBondContact OG-OG1 2.98Å; F286-T289 WeakPolarHBondContact O-CB 3.03Å; F286-T289 PolarHBondContact O-N 3.09Å; F286-T289 PolarHBondContact O-OG1 3.09Å; T289-A292 PolarHBondContact O-N 2.89Å; T289-C293 PolarHBondContact O-N 3.16Å; T289-C293 PolarHBondContact O-SG 3.44Å; T289-I468 HydrophobicContact CG2-CD1 3.54Å; T289-T472 HydrophobicContact CG2-CG2 4.05Å; T289-T472 VanDerWaalsContact OG1-CG2 3.28Å; T289-T472 WeakPolarHBondContact OG1-CG2 3.34Å
290	G	98.9	Very high	97.9	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57.3	-51.2	172.5	0	0	0	0	0	112.5	M288 C293 V294 I373	M288-G290 PolarHBondContact O-N 2.72Å; M288-G290 VanDerWaalsContact O-N 3.15Å; G290-C293 WeakPolarHBondContact O-CB 2.82Å; G290-C293 PolarHBondContact O-N 3.09Å; G290-V294 PolarHBondContact O-N 2.67Å; G290-I373 VanDerWaalsContact CA-O 3.25Å; G290-I373 WeakPolarHBondContact CA-O 3.34Å
291	A	98.9	Very high	98.1	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63	-40.2	173.4	0	0	0	0	0	112.8	F199 K264 M288 C293 V294 L295 M316 M318	F199-A291 HydrophobicContact CE1-CB 4.28Å; F199-A291 HydrophobicContact CZ-CB 4.06Å; K264-A291 PolarHBondContact O-N 2.89Å; M288-A291 WeakPolarHBondContact O-CB 3.41Å; M288-A291 PolarHBondContact O-N 2.71Å; A291-C293 VanDerWaalsContact C-N 3.3Å; A291-C293 PolarHBondContact O-N 3.22Å; A291-V294 PolarHBondContact O-N 3.07Å; A291-V294 VanDerWaalsContact O-N 3.15Å; A291-L295 PolarHBondContact O-N 3.36Å; A291-M316 HydrophobicContact CB-CB 3.84Å; A291-M316 HydrophobicContact CB-CG 3.65Å; A291-M316 HydrophobicContact CB-SD 4.05Å; A291-M316 VanDerWaalsContact O-SD 3.35Å; A291-M318 HydrophobicContact CB-CE 4.19Å; A291-M318 HydrophobicContact CB-SD 3.59Å; A291-M318 VanDerWaalsContact CB-SD 3.59Å
292	A	98.9	Very high	98.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59.6	-40.7	175	0	0	0	0	0	112	V183 L186 F199 M288 T289 L295 G296	V183-A292 HydrophobicContact CB-CB 4.42Å; V183-A292 HydrophobicContact CG1-CB 3.79Å; V183-A292 WeakPolarHBondContact CG2-O 3.23Å; L186-A292 HydrophobicContact CB-CB 4.17Å; L186-A292 HydrophobicContact CD1-CB 4.15Å; F199-A292 HydrophobicContact CE2-CB 4.31Å; M288-A292 HydrophobicContact CE-CB 3.83Å; M288-A292 PolarHBondContact O-N 3.41Å; M288-A292 HydrophobicContact SD-CB 4.49Å; T289-A292 PolarHBondContact O-N 2.89Å; A292-L295 PolarHBondContact O-N 3.42Å; A292-G296 PolarHBondContact O-N 3.37Å
293	C	98.9	Very high	98.1	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.6	-42.7	174.1	-77.9	0	0	0	0	112	T289 G290 A291 G296 C297 I373 L490 L493	T289-C293 PolarHBondContact O-N 3.16Å; T289-C293 PolarHBondContact O-SG 3.44Å; G290-C293 WeakPolarHBondContact O-CB 2.82Å; G290-C293 PolarHBondContact O-N 3.09Å; A291-C293 VanDerWaalsContact C-N 3.3Å; A291-C293 PolarHBondContact O-N 3.22Å; C293-G296 PolarHBondContact O-N 3.14Å; C293-C297 WeakPolarHBondContact O-CB 3.15Å; C293-C297 PolarHBondContact O-N 3.16Å; C293-C297 PolarHBondContact O-SG 2.94Å; C293-C297 VanDerWaalsContact O-SG 3.34Å; C293-I373 HydrophobicContact CB-CD1 4.2Å; C293-I373 HydrophobicContact CB-CG2 4.13Å; C293-L490 WeakPolarHBondContact O-CD1 3.3Å; C293-L493 HydrophobicContact CB-CD1 3.88Å
294	V	98.9	Very high	98.1	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-58.6	-50.4	175.6	174.2	0	0	0	0	111.2	L261 G290 A291 G296 C297 V298 M316 I373	L261-V294 HydrophobicContact CB-CG1 3.95Å; L261-V294 HydrophobicContact CB-CG2 4.06Å; G290-V294 PolarHBondContact O-N 2.67Å; A291-V294 PolarHBondContact O-N 3.07Å; A291-V294 VanDerWaalsContact O-N 3.15Å; V294-G296 VanDerWaalsContact C-N 3.34Å; V294-G296 PolarHBondContact O-N 3.33Å; V294-C297 PolarHBondContact O-N 3.46Å; V294-V298 PolarHBondContact O-N 3.46Å; V294-M316 HydrophobicContact CB-CG 4.02Å; V294-M316 HydrophobicContact CB-SD 3.92Å; V294-M316 HydrophobicContact CG1-CE 4.14Å; V294-M316 HydrophobicContact CG1-CG 4.07Å; V294-M316 HydrophobicContact CG1-SD 3.92Å; V294-M316 HydrophobicContact CG2-CG 4.43Å; V294-I373 HydrophobicContact CG2-CD1 3.93Å
295	L	98.9	Very high	97.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.1	-47.8	174.9	170.7	58.3	0	0	0	111.4	L182 L186 F199 T203 T206 L207 I247 A291 A292 C297 V298 Y299	L182-L295 HydrophobicContact CD2-CD2 4.39Å; L182-L295 HydrophobicContact CD2-CG 4.35Å; L186-L295 HydrophobicContact CD1-CD2 3.8Å; F199-L295 HydrophobicContact CZ-CB 4.33Å; F199-L295 HydrophobicContact CZ-CD2 4.22Å; T203-L295 HydrophobicContact CG2-CD1 3.7Å; T206-L295 HydrophobicContact CG2-CD1 4.39Å; L207-L295 HydrophobicContact CD1-CD1 3.81Å; L207-L295 HydrophobicContact CG-CD1 4.14Å; I247-L295 HydrophobicContact CD1-CD1 4.25Å; A291-L295 PolarHBondContact O-N 3.36Å; A292-L295 PolarHBondContact O-N 3.42Å; L295-C297 VanDerWaalsContact C-N 3.29Å; L295-C297 PolarHBondContact O-N 2.87Å; L295-V298 PolarHBondContact O-N 3.25Å; L295-Y299 WeakPolarHBondContact O-CB 3.24Å; L295-Y299 PolarHBondContact O-N 2.98Å
296	G	98.8	Very high	95.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.2	-39.2	179	0	0	0	0	0	112.6	A292 C293 V294 A300	A292-G296 PolarHBondContact O-N 3.37Å; C293-G296 PolarHBondContact O-N 3.14Å; V294-G296 VanDerWaalsContact C-N 3.34Å; V294-G296 PolarHBondContact O-N 3.33Å; G296-A300 WeakPolarHBondContact O-CB 3.43Å; G296-A300 PolarHBondContact O-N 3.18Å
297	C	98.6	Very high	95.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.3	-51.5	178.7	-77.9	0	0	0	0	110.8	L261 C293 V294 L295 Y299 A300 L301 L490 L493 V494 L497	L261-C297 HydrophobicContact CD1-CB 3.77Å; C293-C297 WeakPolarHBondContact O-CB 3.15Å; C293-C297 PolarHBondContact O-N 3.16Å; C293-C297 PolarHBondContact O-SG 2.94Å; C293-C297 VanDerWaalsContact O-SG 3.34Å; V294-C297 PolarHBondContact O-N 3.46Å; L295-C297 VanDerWaalsContact C-N 3.29Å; L295-C297 PolarHBondContact O-N 2.87Å; C297-Y299 VanDerWaalsContact C-N 3.27Å; C297-Y299 PolarHBondContact O-N 2.85Å; C297-A300 PolarHBondContact O-N 2.89Å; C297-L301 VanDerWaalsContact O-CG 3.27Å; C297-L301 WeakPolarHBondContact O-CG 3.29Å; C297-L301 PolarHBondContact O-N 3.27Å; C297-L490 HydrophobicContact CB-CD1 4.41Å; C297-L490 VanDerWaalsContact SG-CD1 3.53Å; C297-L493 WeakPolarHBondContact SG-CB 3.32Å; C297-V494 HydrophobicContact CB-CG2 4.35Å; C297-L497 HydrophobicContact CB-CD1 4.29Å
298	V	98.4	Very high	95	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.8	-41.2	179.2	177.9	0	0	0	0	110.8	L207 I247 L249 V294 L295 L301 A302 V312	L207-V298 HydrophobicContact CD1-CG1 4.37Å; L207-V298 HydrophobicContact CD2-CG1 4.45Å; I247-V298 HydrophobicContact CG2-CB 4.43Å; I247-V298 HydrophobicContact CG2-CG1 3.69Å; I247-V298 HydrophobicContact CG2-CG2 4.46Å; L249-V298 HydrophobicContact CB-CG1 3.96Å; L249-V298 HydrophobicContact CD2-CG1 4.32Å; V294-V298 PolarHBondContact O-N 3.46Å; L295-V298 PolarHBondContact O-N 3.25Å; V298-L301 PolarHBondContact O-N 3.22Å; V298-A302 VanDerWaalsContact O-CB 3.31Å; V298-A302 WeakPolarHBondContact O-CB 3.26Å; V298-A302 PolarHBondContact O-N 2.87Å; V298-V312 HydrophobicContact CG2-CG1 4.19Å
299	Y	98.4	Very high	94.9	Very high	68 Å²	68	23 Å²	23	27%	0.267	12%	0.115	S	C	.	.	H	α-helix	trans	-63.3	-46	177.5	-173.8	-146	0	0	0	112.1	L182 T206 L207 F210 L295 C297 L301 A302 I303	L182-Y299 HydrophobicContact CD2-CD1 3.81Å; L182-Y299 HydrophobicContact CD2-CE1 4.33Å; T206-Y299 HydrophobicContact CG2-CD1 3.66Å; T206-Y299 HydrophobicContact CG2-CD2 3.93Å; T206-Y299 HydrophobicContact CG2-CE1 3.8Å; T206-Y299 HydrophobicContact CG2-CE2 4.04Å; T206-Y299 HydrophobicContact CG2-CG 3.73Å; L207-Y299 HydrophobicContact CD2-CD2 3.97Å; L207-Y299 HydrophobicContact CD2-CG 4.37Å; F210-Y299 AromaticContact CE2-CD2 3.65Å; F210-Y299 HydrophobicContact CE2-CD2 3.65Å; F210-Y299 AromaticContact CE2-CE2 3.53Å; F210-Y299 HydrophobicContact CE2-CE2 3.53Å; F210-Y299 AromaticContact CZ-CD2 3.97Å; F210-Y299 HydrophobicContact CZ-CD2 3.97Å; F210-Y299 AromaticContact CZ-CE2 3.7Å; F210-Y299 HydrophobicContact CZ-CE2 3.7Å; L295-Y299 WeakPolarHBondContact O-CB 3.24Å; L295-Y299 PolarHBondContact O-N 2.98Å; C297-Y299 VanDerWaalsContact C-N 3.27Å; C297-Y299 PolarHBondContact O-N 2.85Å; Y299-L301 PolarHBondContact O-N 2.83Å; Y299-A302 PolarHBondContact O-N 3.36Å; Y299-I303 HydrophobicContact CD1-CD1 4.13Å; Y299-I303 HydrophobicContact CD2-CD1 3.71Å; Y299-I303 HydrophobicContact CD2-CG1 3.93Å; Y299-I303 HydrophobicContact CE1-CD1 3.94Å; Y299-I303 HydrophobicContact CE2-CD1 3.5Å; Y299-I303 HydrophobicContact CE2-CG1 3.75Å; Y299-I303 HydrophobicContact CG-CD1 4.03Å; Y299-I303 WeakPolarHBondContact O-CD1 3.3Å; Y299-I303 VanDerWaalsContact O-CG1 3.25Å; Y299-I303 WeakPolarHBondContact O-CG1 3.5Å; Y299-I303 PolarHBondContact O-N 2.95Å
300	A	98.3	Very high	94.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.3	-47.8	176.9	0	0	0	0	0	111.8	C179 G296 C297 A302 I303 L304 V494	C179-A300 HydrophobicContact CB-CB 4.09Å; G296-A300 WeakPolarHBondContact O-CB 3.43Å; G296-A300 PolarHBondContact O-N 3.18Å; C297-A300 PolarHBondContact O-N 2.89Å; A300-A302 VanDerWaalsContact C-N 3.34Å; A300-A302 PolarHBondContact O-N 3.4Å; A300-I303 PolarHBondContact O-N 3.33Å; A300-L304 WeakPolarHBondContact O-CB 3.45Å; A300-L304 VanDerWaalsContact O-CG 3.26Å; A300-L304 WeakPolarHBondContact O-CG 3.29Å; A300-L304 PolarHBondContact O-N 2.8Å; A300-V494 HydrophobicContact CB-CG1 4.15Å; A300-V494 HydrophobicContact CB-CG2 3.7Å
301	L	97.5	Very high	94.7	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-62.8	-39.6	179.3	-67.5	176.6	0	0	0	112.3	L249 C297 V298 Y299 H305 N306 L308 V312 V494 L497 E498	L249-L301 HydrophobicContact CD2-CB 3.66Å; L249-L301 HydrophobicContact CD2-CD1 4.38Å; C297-L301 VanDerWaalsContact O-CG 3.27Å; C297-L301 WeakPolarHBondContact O-CG 3.29Å; C297-L301 PolarHBondContact O-N 3.27Å; V298-L301 PolarHBondContact O-N 3.22Å; Y299-L301 PolarHBondContact O-N 2.83Å; L301-H305 PolarHBondContact O-N 3.1Å; L301-N306 WeakPolarHBondContact CD2-ND2 3.35Å; L301-L308 HydrophobicContact CD1-CD1 3.96Å; L301-L308 HydrophobicContact CD2-CD1 4.1Å; L301-V312 HydrophobicContact CD1-CG2 4.05Å; L301-V494 HydrophobicContact CD2-CG1 4.09Å; L301-L497 HydrophobicContact CD1-CB 4.37Å; L301-L497 HydrophobicContact CD1-CD1 3.79Å; L301-E498 HydrophobicContact CD2-CG 4.17Å
302	A	96.4	Very high	94.7	Very high	3 Å²	3	25.6 Å²	25.6	3%	0.025	13%	0.129	C	C	.	.	H	α-helix	trans	-64.6	-42.4	177.1	0	0	0	0	0	112.1	F210 V213 L249 V298 Y299 A300 H305	F210-A302 HydrophobicContact CD1-CB 3.74Å; F210-A302 HydrophobicContact CD2-CB 4.1Å; F210-A302 HydrophobicContact CE1-CB 3.91Å; F210-A302 HydrophobicContact CE2-CB 4.28Å; F210-A302 HydrophobicContact CG-CB 3.85Å; F210-A302 HydrophobicContact CZ-CB 4.19Å; V213-A302 HydrophobicContact CG2-CB 4.14Å; L249-A302 HydrophobicContact CD1-CB 4.27Å; V298-A302 VanDerWaalsContact O-CB 3.31Å; V298-A302 WeakPolarHBondContact O-CB 3.26Å; V298-A302 PolarHBondContact O-N 2.87Å; Y299-A302 PolarHBondContact O-N 3.36Å; A300-A302 VanDerWaalsContact C-N 3.34Å; A300-A302 PolarHBondContact O-N 3.4Å; A302-H305 PolarHBondContact O-N 3.27Å; A302-H305 PolarHBondContact O-ND1 2.97Å
303	I	96.4	Very high	94.7	Very high	42 Å²	42	26.2 Å²	26.2	22%	0.215	13%	0.132	C	C	.	.	H	α-helix	trans	-70.1	-41.5	177.7	-58.7	158.1	0	0	0	111.7	I175 F210 Y299 A300 H305	I175-I303 HydrophobicContact CD1-CG2 3.64Å; I175-I303 HydrophobicContact CG1-CG2 3.89Å; I175-I303 HydrophobicContact CG2-CB 4.18Å; I175-I303 HydrophobicContact CG2-CD1 4.09Å; I175-I303 HydrophobicContact CG2-CG2 4.2Å; F210-I303 HydrophobicContact CE1-CG1 4.14Å; F210-I303 HydrophobicContact CZ-CG1 3.63Å; Y299-I303 HydrophobicContact CD1-CD1 4.13Å; Y299-I303 HydrophobicContact CD2-CD1 3.71Å; Y299-I303 HydrophobicContact CD2-CG1 3.93Å; Y299-I303 HydrophobicContact CE1-CD1 3.94Å; Y299-I303 HydrophobicContact CE2-CD1 3.5Å; Y299-I303 HydrophobicContact CE2-CG1 3.75Å; Y299-I303 HydrophobicContact CG-CD1 4.03Å; Y299-I303 WeakPolarHBondContact O-CD1 3.3Å; Y299-I303 VanDerWaalsContact O-CG1 3.25Å; Y299-I303 WeakPolarHBondContact O-CG1 3.5Å; Y299-I303 PolarHBondContact O-N 2.95Å; A300-I303 PolarHBondContact O-N 3.33Å; I303-H305 PolarHBondContact O-CD2 2.91Å; I303-H305 VanDerWaalsContact O-CD2 3.31Å; I303-H305 PolarHBondContact O-N 3.03Å
304	L	94.3	Very high	94.7	Very high	34 Å²	34	26.2 Å²	26.2	18%	0.178	13%	0.132	C	C	.	.	H	α-helix	trans	-69.6	-11.9	-178.2	-71.3	167.2	0	0	0	112.5	R172 I175 L176 A300 N306 V494	R172-L304 HydrophobicContact CB-CD2 4.38Å; R172-L304 HydrophobicContact CG-CD2 4.2Å; I175-L304 HydrophobicContact CB-CD2 4.32Å; I175-L304 HydrophobicContact CD1-CD2 3.61Å; I175-L304 HydrophobicContact CD1-CG 4.3Å; I175-L304 HydrophobicContact CG2-CD1 4.45Å; I175-L304 HydrophobicContact CG2-CD2 4.23Å; I175-L304 HydrophobicContact CG2-CG 4.03Å; L176-L304 HydrophobicContact CD2-CD1 4.31Å; A300-L304 WeakPolarHBondContact O-CB 3.45Å; A300-L304 VanDerWaalsContact O-CG 3.26Å; A300-L304 WeakPolarHBondContact O-CG 3.29Å; A300-L304 PolarHBondContact O-N 2.8Å; L304-N306 PolarHBondContact O-N 2.8Å; L304-V494 HydrophobicContact CD1-CG1 4.32Å
305	H	78.7	Confident	94.7	Very high	121 Å²	121	26.2 Å²	26.2	56%	0.56	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	34.4	-177.3	-60.1	-63.6	0	0	0	113.1	K252 L301 A302 I303 D307	K252-H305 PolarHBondContact NZ-O 3.21Å; K252-H305 VanDerWaalsContact NZ-O 3.15Å; L301-H305 PolarHBondContact O-N 3.1Å; A302-H305 PolarHBondContact O-N 3.27Å; A302-H305 PolarHBondContact O-ND1 2.97Å; I303-H305 PolarHBondContact O-CD2 2.91Å; I303-H305 VanDerWaalsContact O-CD2 3.31Å; I303-H305 PolarHBondContact O-N 3.03Å; H305-D307 PolarHBondContact O-N 3.43Å
306	N	69.2	Low	94.7	Very high	40 Å²	40	26.2 Å²	26.2	21%	0.214	13%	0.132	C	C	.	.			trans	-57.2	129.9	-175.4	-74.3	-20.8	0	0	0	110.7	L301 L304 L308 E498	L301-N306 WeakPolarHBondContact CD2-ND2 3.35Å; L304-N306 PolarHBondContact O-N 2.8Å; N306-L308 HydrophobicContact CB-CD2 4.16Å; N306-L308 HydrophobicContact CB-CG 3.88Å; N306-L308 PolarHBondContact O-N 3.06Å; N306-E498 VanDerWaalsContact ND2-CG 3.26Å; N306-E498 WeakPolarHBondContact ND2-CG 3.43Å; N306-E498 PolarHBondContact ND2-OE1 3.39Å; N306-E498 PolarHBondContact OD1-OE1 3.43Å
307	D	86.4	Confident	94.7	Very high	126 Å²	126	26.2 Å²	26.2	67%	0.674	13%	0.132	S	C	*	.			trans	-79.9	55.8	175.1	-69.3	-31.8	0	0	0	110	K252 H305	K252-D307 WeakPolarHBondContact CD-OD1 3.29Å; K252-D307 WeakPolarHBondContact CE-OD1 3.39Å; K252-D307 IonicContact NZ-OD1 2.73Å; K252-D307 PolarHBondContact NZ-OD1 2.67Å; H305-D307 PolarHBondContact O-N 3.43Å
308	L	93.6	Very high	94.7	Very high	14 Å²	14	26.2 Å²	26.2	7%	0.073	13%	0.132	C	C	.	.			trans	-62.4	139.3	177.7	-62.7	178.1	0	0	0	109.9	A251 L301 N306 F310 V312	A251-L308 VanDerWaalsContact CB-O 3.25Å; A251-L308 WeakPolarHBondContact CB-O 3.46Å; L301-L308 HydrophobicContact CD1-CD1 3.96Å; L301-L308 HydrophobicContact CD2-CD1 4.1Å; N306-L308 HydrophobicContact CB-CD2 4.16Å; N306-L308 HydrophobicContact CB-CG 3.88Å; N306-L308 PolarHBondContact O-N 3.06Å; L308-F310 HydrophobicContact CB-CD2 4.43Å; L308-F310 HydrophobicContact CB-CE2 4.25Å; L308-F310 HydrophobicContact CB-CZ 4.39Å; L308-F310 HydrophobicContact CD1-CE2 3.88Å; L308-F310 HydrophobicContact CD1-CZ 4.33Å; L308-F310 HydrophobicContact CD2-CZ 4.14Å; L308-F310 HydrophobicContact CG-CE2 4.44Å; L308-F310 PolarHBondContact O-N 3.12Å; L308-V312 HydrophobicContact CD1-CG2 3.95Å
309	P	95.3	Very high	94.8	Very high	30 Å²	30	26.2 Å²	26.2	20%	0.195	13%	0.132	C	C	.	.	S	Bend	trans	-79.6	8.8	178.7	31.7	-33.3	0	0	0	113.3	S255 R256	S255-P309 PolarHBondContact N-O 3.39Å; S255-P309 PolarHBondContact OG-O 3.01Å; R256-P309 HydrophobicContact CG-CB 4.5Å; R256-P309 PolarHBondContact N-O 3.5Å
310	F	97.4	Very high	94.8	Very high	3 Å²	3	24 Å²	24	1%	0.013	13%	0.125	C	C	.	.	S	Bend	trans	-145.9	153.2	-176.9	49.4	-101.3	0	0	0	111.1	A251 R256 A257 V259 L308 V312 L497 L500	A251-F310 WeakPolarHBondContact CB-O 3.17Å; R256-F310 HydrophobicContact CB-CB 4.29Å; A257-F310 WeakPolarHBondContact O-CB 3.33Å; V259-F310 HydrophobicContact CB-CD2 3.88Å; V259-F310 HydrophobicContact CB-CE2 3.92Å; V259-F310 HydrophobicContact CG2-CD1 4.15Å; V259-F310 HydrophobicContact CG2-CD2 3.48Å; V259-F310 VanDerWaalsContact CG2-CD2 3.48Å; V259-F310 HydrophobicContact CG2-CE1 4.21Å; V259-F310 HydrophobicContact CG2-CE2 3.54Å; V259-F310 HydrophobicContact CG2-CG 3.82Å; V259-F310 HydrophobicContact CG2-CZ 3.92Å; L308-F310 HydrophobicContact CB-CD2 4.43Å; L308-F310 HydrophobicContact CB-CE2 4.25Å; L308-F310 HydrophobicContact CB-CZ 4.39Å; L308-F310 HydrophobicContact CD1-CE2 3.88Å; L308-F310 HydrophobicContact CD1-CZ 4.33Å; L308-F310 HydrophobicContact CD2-CZ 4.14Å; L308-F310 HydrophobicContact CG-CE2 4.44Å; L308-F310 PolarHBondContact O-N 3.12Å; F310-V312 HydrophobicContact CD2-CG2 4.04Å; F310-V312 HydrophobicContact CE2-CG2 3.89Å; F310-L497 WeakPolarHBondContact CZ-O 3.45Å; F310-L500 HydrophobicContact CE1-CB 3.74Å; F310-L500 HydrophobicContact CZ-CB 3.89Å; F310-L500 HydrophobicContact CZ-CD1 4.28Å
311	D	97.7	Very high	94.8	Very high	52 Å²	52	24.3 Å²	24.3	28%	0.278	13%	0.126	S	C	.	.			trans	-71.8	152.4	168	-65.9	-13.4	0	0	0	110.5	L249 K250 A251 P258 V259	L249-D311 WeakPolarHBondContact O-CA 3.09Å; K250-D311 WeakPolarHBondContact CA-OD1 3.48Å; A251-D311 PolarHBondContact N-OD1 3.35Å; P258-D311 CarbonylContact C-O 3.58Å; P258-D311 VanDerWaalsContact CA-O 3.26Å; P258-D311 WeakPolarHBondContact CA-O 3.39Å; P258-D311 HydrophobicContact CB-CB 4.22Å; V259-D311 PolarHBondContact N-O 3.18Å
312	V	98.5	Very high	94.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.1	174.1	179.3	0	0	0	0	109.5	L249 V259 L261 V298 L301 L308 F310	L249-V312 HydrophobicContact CB-CB 4.25Å; L249-V312 HydrophobicContact CD2-CB 4.38Å; L249-V312 PolarHBondContact N-O 3.42Å; L249-V312 PolarHBondContact O-N 2.8Å; V259-V312 WeakPolarHBondContact O-CA 3.47Å; L261-V312 HydrophobicContact CD1-CG1 3.92Å; L261-V312 HydrophobicContact CG-CG1 4.16Å; V298-V312 HydrophobicContact CG2-CG1 4.19Å; L301-V312 HydrophobicContact CD1-CG2 4.05Å; L308-V312 HydrophobicContact CD1-CG2 3.95Å; F310-V312 HydrophobicContact CD2-CG2 4.04Å; F310-V312 HydrophobicContact CE2-CG2 3.89Å
313	I	98.8	Very high	95	Very high	12 Å²	12	29.3 Å²	29.3	6%	0.062	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.8	178.9	-56.3	177.5	0	0	0	108.5	I247 P258 V259 C260 L261 L315 F365	I247-I313 CarbonylContact O-C 3.47Å; I247-I313 VanDerWaalsContact O-CA 3.3Å; I247-I313 WeakPolarHBondContact O-CA 3.22Å; P258-I313 HydrophobicContact CB-CD1 3.84Å; P258-I313 HydrophobicContact CB-CG1 4.16Å; P258-I313 HydrophobicContact CG-CD1 4.01Å; V259-I313 PolarHBondContact O-N 3.42Å; C260-I313 CarbonylContact C-O 3.53Å; C260-I313 VanDerWaalsContact CA-O 3.3Å; C260-I313 WeakPolarHBondContact CA-O 3.49Å; L261-I313 PolarHBondContact N-O 2.87Å; I313-L315 HydrophobicContact CG2-CD2 3.77Å; I313-L315 HydrophobicContact CG2-CG 4.09Å; I313-F365 HydrophobicContact CD1-CB 3.77Å; I313-F365 HydrophobicContact CD1-CD1 3.37Å; I313-F365 HydrophobicContact CD1-CD2 4.2Å; I313-F365 HydrophobicContact CD1-CE1 3.94Å; I313-F365 HydrophobicContact CD1-CG 3.51Å; I313-F365 HydrophobicContact CG2-CD2 4.43Å; I313-F365 HydrophobicContact CG2-CE2 4.23Å; I313-F365 HydrophobicContact CG2-CZ 4.3Å
314	G	98.9	Very high	95.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.2	174.6	0	0	0	0	0	111.5	E246 I247 L261	E246-G314 CarbonylContact C-O 3.59Å; E246-G314 VanDerWaalsContact CA-O 3.31Å; E246-G314 WeakPolarHBondContact CA-O 3.42Å; I247-G314 PolarHBondContact N-O 3.09Å; I247-G314 PolarHBondContact O-N 2.99Å; L261-G314 CarbonylContact O-C 3.54Å; L261-G314 WeakPolarHBondContact O-CA 3.27Å
315	L	99	Very high	95.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.5	-179.1	-54.8	175.4	0	0	0	109.8	F244 L245 E246 L261 V262 G263 I313 Y361 A362 F365	F244-L315 HydrophobicContact CE1-CB 4.11Å; F244-L315 HydrophobicContact CE1-CD2 4.01Å; F244-L315 HydrophobicContact CZ-CB 4.03Å; L245-L315 WeakPolarHBondContact O-CA 2.92Å; E246-L315 HydrophobicContact CB-CD2 4.16Å; E246-L315 HydrophobicContact CG-CD2 3.86Å; L261-L315 PolarHBondContact O-N 3.4Å; V262-L315 CarbonylContact C-O 3.51Å; V262-L315 VanDerWaalsContact CA-O 3.28Å; V262-L315 WeakPolarHBondContact CA-O 3.42Å; V262-L315 HydrophobicContact CG2-CB 4.33Å; V262-L315 HydrophobicContact CG2-CD1 4.37Å; G263-L315 PolarHBondContact N-O 3.5Å; I313-L315 HydrophobicContact CG2-CD2 3.77Å; I313-L315 HydrophobicContact CG2-CG 4.09Å; L315-Y361 HydrophobicContact CD1-CD1 4.03Å; L315-Y361 HydrophobicContact CD2-CD1 3.95Å; L315-Y361 HydrophobicContact CD2-CE1 3.94Å; L315-A362 HydrophobicContact CD1-CB 3.72Å; L315-F365 HydrophobicContact CD1-CE2 4.27Å; L315-F365 HydrophobicContact CD2-CE2 4.22Å
316	M	98.9	Very high	96.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	100.3	-176.1	-61.1	153.6	-76.7	0	0	110	F199 L245 I247 A291 V294 M318	F199-M316 HydrophobicContact CE1-SD 3.89Å; F199-M316 HydrophobicContact CZ-SD 4.35Å; L245-M316 HydrophobicContact CB-CB 4.28Å; L245-M316 HydrophobicContact CB-CE 4.09Å; L245-M316 HydrophobicContact CD2-CE 3.56Å; L245-M316 HydrophobicContact CD2-SD 4.18Å; L245-M316 HydrophobicContact CG-CE 3.75Å; L245-M316 PolarHBondContact N-O 3.07Å; L245-M316 PolarHBondContact O-N 3.19Å; I247-M316 HydrophobicContact CD1-CE 3.43Å; I247-M316 VanDerWaalsContact CD1-CE 3.43Å; I247-M316 HydrophobicContact CG1-CE 3.69Å; A291-M316 HydrophobicContact CB-CB 3.84Å; A291-M316 HydrophobicContact CB-CG 3.65Å; A291-M316 HydrophobicContact CB-SD 4.05Å; A291-M316 VanDerWaalsContact O-SD 3.35Å; V294-M316 HydrophobicContact CB-CG 4.02Å; V294-M316 HydrophobicContact CB-SD 3.92Å; V294-M316 HydrophobicContact CG1-CE 4.14Å; V294-M316 HydrophobicContact CG1-CG 4.07Å; V294-M316 HydrophobicContact CG1-SD 3.92Å; V294-M316 HydrophobicContact CG2-CG 4.43Å; M316-M318 HydrophobicContact CB-CG 4.43Å; M316-M318 HydrophobicContact CB-SD 3.78Å; M316-M318 PolarHBondContact O-N 3.45Å
317	P	98.9	Very high	97.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	112.7	167.8	29.5	-35.3	0	0	0	109.2	F231 F244 G263 G265 I354 A358	F231-P317 HydrophobicContact CD2-CB 3.55Å; F231-P317 HydrophobicContact CE2-CB 3.57Å; F231-P317 HydrophobicContact CG-CB 4.27Å; F231-P317 HydrophobicContact CZ-CB 4.35Å; F244-P317 HydrophobicContact CD2-CB 3.99Å; F244-P317 HydrophobicContact CE2-CB 4.09Å; G263-P317 WeakPolarHBondContact O-CD 3.49Å; G265-P317 VanDerWaalsContact CA-O 3.28Å; G265-P317 WeakPolarHBondContact CA-O 3.5Å; G265-P317 PolarHBondContact N-O 2.63Å; P317-I354 HydrophobicContact CB-CB 4.04Å; P317-I354 HydrophobicContact CB-CD1 4.43Å; P317-I354 HydrophobicContact CB-CG1 4.41Å; P317-I354 HydrophobicContact CG-CB 3.99Å; P317-I354 HydrophobicContact CG-CD1 4.05Å; P317-I354 HydrophobicContact CG-CG1 3.9Å; P317-A358 HydrophobicContact CG-CB 3.85Å
318	M	98.9	Very high	98.2	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122.8	-176.4	-52.9	-59.7	-56.8	0	0	110.8	P196 F199 P242 V243 G265 M288 A291 M316	P196-M318 HydrophobicContact CB-CB 3.67Å; P196-M318 HydrophobicContact CG-CB 4.35Å; F199-M318 HydrophobicContact CB-CE 3.83Å; F199-M318 HydrophobicContact CD1-CE 3.54Å; F199-M318 HydrophobicContact CD1-CG 4.27Å; F199-M318 HydrophobicContact CD1-SD 3.78Å; F199-M318 HydrophobicContact CD2-CE 3.99Å; F199-M318 HydrophobicContact CE1-CE 4.08Å; F199-M318 HydrophobicContact CE1-SD 3.99Å; F199-M318 HydrophobicContact CE2-CE 4.47Å; F199-M318 HydrophobicContact CG-CE 3.49Å; F199-M318 VanDerWaalsContact CG-CE 3.49Å; F199-M318 HydrophobicContact CG-SD 4.35Å; P242-M318 CarbonylContact C-O 3.49Å; P242-M318 VanDerWaalsContact CA-O 3.26Å; P242-M318 WeakPolarHBondContact CA-O 3.44Å; P242-M318 WeakPolarHBondContact CB-O 3.41Å; V243-M318 HydrophobicContact CB-CB 4.37Å; V243-M318 PolarHBondContact N-O 3.42Å; V243-M318 WeakPolarHBondContact O-CA 3.34Å; V243-M318 VanDerWaalsContact O-CB 3.29Å; V243-M318 WeakPolarHBondContact O-CB 3.28Å; V243-M318 PolarHBondContact O-N 3.46Å; G265-M318 CarbonylContact O-C 3.2Å; G265-M318 VanDerWaalsContact O-CA 3.23Å; G265-M318 WeakPolarHBondContact O-CA 3.39Å; M288-M318 HydrophobicContact CB-CE 4.25Å; A291-M318 HydrophobicContact CB-CE 4.19Å; A291-M318 HydrophobicContact CB-SD 3.59Å; A291-M318 VanDerWaalsContact CB-SD 3.59Å; M316-M318 HydrophobicContact CB-CG 4.43Å; M316-M318 HydrophobicContact CB-SD 3.78Å; M316-M318 PolarHBondContact O-N 3.45Å
319	V	98.8	Very high	98.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	171.9	-179	-54.8	0	0	0	0	111.6	F231 V234 P242 G265 V266 C267 I354	F231-V319 HydrophobicContact CD2-CG1 3.58Å; F231-V319 HydrophobicContact CE2-CG1 3.21Å; F231-V319 HydrophobicContact CZ-CG1 4.21Å; V234-V319 HydrophobicContact CG1-CB 4.45Å; V234-V319 HydrophobicContact CG1-CG2 3.74Å; P242-V319 HydrophobicContact CB-CB 4.41Å; P242-V319 HydrophobicContact CB-CG1 3.79Å; G265-V319 PolarHBondContact O-N 2.92Å; V266-V319 CarbonylContact C-O 3.53Å; V266-V319 WeakPolarHBondContact CA-O 3.21Å; V266-V319 HydrophobicContact CB-CG2 4.42Å; V266-V319 HydrophobicContact CG1-CG2 4.38Å; V266-V319 HydrophobicContact CG2-CG2 3.92Å; C267-V319 PolarHBondContact N-O 2.77Å; V319-I354 HydrophobicContact CG1-CG2 4.26Å; V319-I354 HydrophobicContact CG2-CD1 4.28Å; V319-I354 HydrophobicContact CG2-CG2 4.16Å
320	E	98.9	Very high	98.6	Very high	23 Å²	23	30 Å²	30	11%	0.107	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	148.9	151.1	-64.6	-177	156.2	0	0	109.4	S238 E240 C267 F268 M322	S238-E320 PolarHBondContact OG-OE2 3.22Å; E240-E320 HydrophobicContact CB-CG 4.4Å; C267-E320 HydrophobicContact CB-CG 4.22Å; F268-E320 HydrophobicContact CB-CG 4.47Å; E320-M322 HydrophobicContact CB-CG 3.99Å
321	N	98.9	Very high	98.6	Very high	6 Å²	6	31.8 Å²	31.8	3%	0.032	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	101.4	173.2	-174.1	27.9	0	0	0	109.6	V234 V266 F268 D269 S270 G271 T347 E350	V234-N321 HydrophobicContact CG1-CB 4.1Å; V266-N321 HydrophobicContact CG1-CB 4.16Å; F268-N321 PolarHBondContact O-N 3Å; D269-N321 PolarHBondContact OD1-ND2 3.46Å; S270-N321 WeakPolarHBondContact CB-O 3.47Å; S270-N321 PolarHBondContact N-O 2.57Å; S270-N321 VanDerWaalsContact N-O 3.09Å; S270-N321 PolarHBondContact OG-O 2.73Å; G271-N321 VanDerWaalsContact C-ND2 3.34Å; G271-N321 WeakPolarHBondContact CA-ND2 3.43Å; N321-T347 PolarHBondContact ND2-O 3.23Å; N321-E350 HydrophobicContact CB-CG 3.88Å
322	M	98.8	Very high	98.6	Very high	57 Å²	57	30.9 Å²	30.9	28%	0.281	20%	0.197	S	C	.	.			trans	-127.8	141.3	-168.8	-66.5	-61.5	-73.8	0	0	112.4	F268 E320 A327	F268-M322 HydrophobicContact CD1-SD 3.77Å; F268-M322 HydrophobicContact CE1-SD 4.31Å; E320-M322 HydrophobicContact CB-CG 3.99Å; M322-A327 WeakPolarHBondContact O-CB 3.32Å
323	P	98.7	Very high	98.7	Very high	55 Å²	55	34.1 Å²	34.1	36%	0.357	22%	0.216	S	C	.	.			trans	-72.1	135.8	166.9	31.2	-36.4	0	0	0	110	S270 I273 L275	S270-P323 WeakPolarHBondContact OG-CD 3.47Å; I273-P323 HydrophobicContact CD1-CB 4.32Å; L275-P323 HydrophobicContact CD1-CG 4.15Å
324	S	98.7	Very high	98.7	Very high	44 Å²	44	34.3 Å²	34.3	31%	0.308	22%	0.218	S	C	.	.	S	Bend	trans	-164.7	177.2	170.7	68.2	0	0	0	0	109.6	G237 K326 A327	G237-S324 VanDerWaalsContact O-CB 3.26Å; G237-S324 WeakPolarHBondContact O-CB 3.3Å; G237-S324 PolarHBondContact O-OG 2.99Å; S324-K326 PolarHBondContact O-N 2.81Å; S324-K326 VanDerWaalsContact O-N 3.08Å; S324-K326 WeakPolarHBondContact OG-CG 3.31Å; S324-K326 PolarHBondContact OG-N 3.34Å; S324-A327 PolarHBondContact O-N 2.72Å; S324-A327 PolarHBondContact OG-N 3.48Å
325	G	98.5	Very high	98.6	Very high	98 Å²	98	40.5 Å²	40.5	100%	1.01	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.5	174	0	0	0	0	0	114.8
326	K	98.4	Very high	98.6	Very high	96 Å²	96	40.7 Å²	40.7	42%	0.417	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-1.7	-180	53.8	176.5	-177.7	175	0	113.6	K236 S238 D239 S324	K236-K326 WeakPolarHBondContact CD-O 3.3Å; K236-K326 VanDerWaalsContact CE-O 3.25Å; K236-K326 WeakPolarHBondContact CE-O 3.42Å; K236-K326 WeakPolarHBondContact CG-O 3.35Å; K236-K326 WeakPolarHBondContact O-CD 3.49Å; K236-K326 WeakPolarHBondContact O-CE 3.42Å; K236-K326 WeakPolarHBondContact O-CG 3.47Å; S238-K326 WeakPolarHBondContact O-CE 3.39Å; S238-K326 PolarHBondContact O-NZ 3.13Å; D239-K326 WeakPolarHBondContact OD1-CE 3.47Å; D239-K326 IonicContact OD1-NZ 2.73Å; D239-K326 PolarHBondContact OD1-NZ 2.71Å; S324-K326 PolarHBondContact O-N 2.81Å; S324-K326 VanDerWaalsContact O-N 3.08Å; S324-K326 WeakPolarHBondContact OG-CG 3.31Å; S324-K326 PolarHBondContact OG-N 3.34Å
327	A	98.7	Very high	98.6	Very high	8 Å²	8	42.7 Å²	42.7	7%	0.066	26%	0.257	C	S	.	.	S	Bend	trans	-64.9	163.1	-176.7	0	0	0	0	0	113.3	I273 M322 S324	I273-A327 HydrophobicContact CD1-CB 4.42Å; I273-A327 HydrophobicContact CG1-CB 4.2Å; M322-A327 WeakPolarHBondContact O-CB 3.32Å; S324-A327 PolarHBondContact O-N 2.72Å; S324-A327 PolarHBondContact OG-N 3.48Å
328	N	98.8	Very high	98.6	Very high	6 Å²	6	46.1 Å²	46.1	3%	0.032	28%	0.275	C	S	.	.			trans	-56.6	143.7	166.6	-83.8	-20.9	0	0	0	110.6	S233 K236 I273 I344 T347	S233-N328 WeakPolarHBondContact CB-ND2 3.49Å; S233-N328 WeakPolarHBondContact CB-OD1 3.41Å; S233-N328 PolarHBondContact O-ND2 3.12Å; S233-N328 PolarHBondContact O-OD1 3.3Å; S233-N328 VanDerWaalsContact O-OD1 3.12Å; S233-N328 PolarHBondContact OG-ND2 2.84Å; K236-N328 WeakPolarHBondContact CE-OD1 3.35Å; K236-N328 PolarHBondContact NZ-OD1 3.3Å; I273-N328 WeakPolarHBondContact CG1-O 3.43Å; N328-I344 HydrophobicContact CB-CD1 4.4Å; N328-I344 VanDerWaalsContact ND2-CD1 3.31Å; N328-I344 WeakPolarHBondContact ND2-CD1 3.44Å; N328-T347 HydrophobicContact CB-CG2 3.85Å; N328-T347 WeakPolarHBondContact O-CG2 3.46Å
329	K	98.8	Very high	98.6	Very high	109 Å²	109	48.4 Å²	48.4	47%	0.474	30%	0.298	S	S	.	.			trans	-114.6	140.5	175.5	-58.2	172.2	-53.5	-50.7	0	108.5	G331 D332	K329-G331 PolarHBondContact O-N 3.3Å; K329-D332 VanDerWaalsContact CE-OD1 3.31Å; K329-D332 WeakPolarHBondContact CE-OD1 3.23Å; K329-D332 PolarHBondContact N-OD2 3.03Å; K329-D332 IonicContact NZ-OD1 2.69Å; K329-D332 PolarHBondContact NZ-OD1 2.76Å; K329-D332 IonicContact NZ-OD2 3.07Å; K329-D332 PolarHBondContact NZ-OD2 3.33Å; K329-D332 VanDerWaalsContact O-CB 3.28Å; K329-D332 WeakPolarHBondContact O-CB 3.42Å; K329-D332 PolarHBondContact O-N 2.75Å
330	P	98.3	Very high	98.6	Very high	61 Å²	61	51.1 Å²	51.1	40%	0.396	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	129	166.5	-31.1	38.8	0	0	0	111.7	I273 I344 E345 T347	I273-P330 HydrophobicContact CG2-CG 4.33Å; P330-I344 CarbonylContact C-O 3.51Å; P330-I344 VanDerWaalsContact CA-O 3.27Å; P330-I344 WeakPolarHBondContact CA-O 3.4Å; P330-E345 WeakPolarHBondContact CB-O 3.07Å; P330-T347 HydrophobicContact CG-CG2 4.44Å
331	G	97	Very high	98.6	Very high	39 Å²	39	50.7 Å²	50.7	40%	0.402	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-4.3	-175.6	0	0	0	0	0	115.5	K329 I344	K329-G331 PolarHBondContact O-N 3.3Å; G331-I344 PolarHBondContact N-O 3.42Å
332	D	98.6	Very high	98.6	Very high	34 Å²	34	50.4 Å²	50.4	18%	0.182	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	138.9	171.1	-80.1	-19.2	0	0	0	109.9	K329 I344	K329-D332 VanDerWaalsContact CE-OD1 3.31Å; K329-D332 WeakPolarHBondContact CE-OD1 3.23Å; K329-D332 PolarHBondContact N-OD2 3.03Å; K329-D332 IonicContact NZ-OD1 2.69Å; K329-D332 PolarHBondContact NZ-OD1 2.76Å; K329-D332 IonicContact NZ-OD2 3.07Å; K329-D332 PolarHBondContact NZ-OD2 3.33Å; K329-D332 VanDerWaalsContact O-CB 3.28Å; K329-D332 WeakPolarHBondContact O-CB 3.42Å; K329-D332 PolarHBondContact O-N 2.75Å; D332-I344 PolarHBondContact O-N 2.84Å
333	V	98.7	Very high	98.5	Very high	69 Å²	69	49.8 Å²	49.8	42%	0.418	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.2	170.5	-178.8	0	0	0	0	109.4	I342 E343 V431	V333-I342 WeakPolarHBondContact CA-O 3.37Å; V333-E343 HydrophobicContact CG2-CB 4.44Å; V333-V431 HydrophobicContact CG1-CG1 3.87Å; V333-V431 HydrophobicContact CG2-CG1 3.79Å
334	V	98.7	Very high	98.5	Very high	16 Å²	16	47.1 Å²	47.1	10%	0.097	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	159.8	176.5	-58.1	0	0	0	0	110.4	A230 S341 I342 I344	A230-V334 HydrophobicContact CB-CG2 4.31Å; V334-S341 CarbonylContact O-C 3.48Å; V334-S341 WeakPolarHBondContact O-CA 3.26Å; V334-I342 HydrophobicContact CG2-CB 3.99Å; V334-I342 HydrophobicContact CG2-CD1 4.43Å; V334-I342 PolarHBondContact N-O 2.87Å; V334-I342 PolarHBondContact O-N 3.25Å; V334-I344 HydrophobicContact CB-CD1 4.43Å; V334-I344 HydrophobicContact CG1-CD1 3.67Å; V334-I344 HydrophobicContact CG1-CG1 4.48Å; V334-I344 HydrophobicContact CG2-CD1 3.87Å; V334-I344 HydrophobicContact CG2-CG1 4.16Å
335	F	98.8	Very high	98.4	Very high	130 Å²	130	49.7 Å²	49.7	57%	0.57	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.5	176.2	-65.4	-90.1	0	0	0	109.4	G229 K340	G229-F335 CarbonylContact C-O 3.53Å; G229-F335 WeakPolarHBondContact CA-O 3.47Å; G229-F335 PolarHBondContact N-O 2.65Å; F335-K340 WeakPolarHBondContact CA-O 3.45Å
336	A	98.8	Very high	98.4	Very high	3 Å²	3	47.9 Å²	47.9	3%	0.025	26%	0.262	C	S	.	.			trans	-76.3	170.5	172.6	0	0	0	0	0	111.4	A230 N338 G339 K340 I342 D357 F457	A230-A336 HydrophobicContact CB-CB 4.49Å; A336-N338 PolarHBondContact O-N 3.38Å; A336-G339 WeakPolarHBondContact O-CA 3.26Å; A336-G339 PolarHBondContact O-N 2.91Å; A336-K340 PolarHBondContact N-O 3.26Å; A336-I342 HydrophobicContact CB-CD1 3.99Å; A336-D357 VanDerWaalsContact CA-OD1 3.26Å; A336-D357 WeakPolarHBondContact CA-OD1 3.48Å; A336-D357 WeakPolarHBondContact CB-OD1 3.35Å; A336-F457 HydrophobicContact CB-CD1 3.95Å; A336-F457 HydrophobicContact CB-CE1 3.54Å
337	M	98.7	Very high	98.4	Very high	43 Å²	43	43.4 Å²	43.4	21%	0.212	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.2	180	174.6	175	175.8	0	0	113	K226 K227 M228 G339 D357 C360 Y361 T364	K226-M337 WeakPolarHBondContact O-CG 3.25Å; K227-M337 WeakPolarHBondContact O-CA 3.12Å; K227-M337 PolarHBondContact O-N 3.28Å; M228-M337 HydrophobicContact CE-SD 4.04Å; M337-G339 PolarHBondContact O-N 3.03Å; M337-D357 WeakPolarHBondContact CB-OD1 3.38Å; M337-D357 PolarHBondContact N-OD1 2.84Å; M337-C360 HydrophobicContact CB-CB 3.85Å; M337-C360 HydrophobicContact CG-CB 4.04Å; M337-C360 HydrophobicContact SD-CB 4.04Å; M337-Y361 HydrophobicContact CE-CD2 4.11Å; M337-Y361 HydrophobicContact SD-CD2 4.36Å; M337-T364 HydrophobicContact CE-CG2 3.9Å
338	N	98.3	Very high	98.4	Very high	72 Å²	72	45.5 Å²	45.5	39%	0.385	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	3.8	175.7	68.8	-1.8	0	0	0	114	A336 K340 C360	A336-N338 PolarHBondContact O-N 3.38Å; N338-K340 VanDerWaalsContact C-N 3.32Å; N338-K340 PolarHBondContact O-N 3.17Å; N338-K340 WeakPolarHBondContact OD1-CB 3.38Å; N338-K340 PolarHBondContact OD1-N 3.15Å; N338-K340 VanDerWaalsContact OD1-N 3.07Å; N338-C360 VanDerWaalsContact CG-SG 3.6Å
339	G	98.4	Very high	98.3	Very high	48 Å²	48	45.7 Å²	45.7	50%	0.495	26%	0.255	S	S	.	.	S	Bend	trans	83.3	-4.2	179.9	0	0	0	0	0	115.3	A336 M337	A336-G339 WeakPolarHBondContact O-CA 3.26Å; A336-G339 PolarHBondContact O-N 2.91Å; M337-G339 PolarHBondContact O-N 3.03Å
340	K	98.6	Very high	98.3	Very high	57 Å²	57	40.7 Å²	40.7	25%	0.248	23%	0.233	C	C	.	.			trans	-65.8	137.8	175	-73.7	-173.4	176.5	176	0	110.8	F335 A336 N338 D432 E456 F457	F335-K340 WeakPolarHBondContact CA-O 3.45Å; A336-K340 PolarHBondContact N-O 3.26Å; N338-K340 VanDerWaalsContact C-N 3.32Å; N338-K340 PolarHBondContact O-N 3.17Å; N338-K340 WeakPolarHBondContact OD1-CB 3.38Å; N338-K340 PolarHBondContact OD1-N 3.15Å; N338-K340 VanDerWaalsContact OD1-N 3.07Å; K340-D432 WeakPolarHBondContact CA-OD2 3.18Å; K340-D432 HydrophobicContact CB-CB 4.34Å; K340-D432 HydrophobicContact CG-CB 4.5Å; K340-E456 PolarHBondContact NZ-O 2.94Å; K340-E456 IonicContact NZ-OE2 2.71Å; K340-E456 PolarHBondContact NZ-OE2 3.39Å; K340-F457 HydrophobicContact CB-CE1 4.01Å; K340-F457 HydrophobicContact CD-CE1 4.34Å
341	S	98.7	Very high	98.4	Very high	14 Å²	14	37.8 Å²	37.8	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	134.9	173.5	55.4	0	0	0	0	111.3	V334 D432 V433	V334-S341 CarbonylContact O-C 3.48Å; V334-S341 WeakPolarHBondContact O-CA 3.26Å; S341-D432 PolarHBondContact N-OD2 3.3Å; S341-D432 PolarHBondContact OG-N 2.7Å; S341-D432 PolarHBondContact OG-OD2 2.79Å; S341-V433 PolarHBondContact O-N 3.34Å
342	I	98.8	Very high	98.4	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119.3	177.7	-57.1	157.6	0	0	0	108.9	A230 V333 V334 A336 L353 A356 V433 N435 F453 F457	A230-I342 HydrophobicContact CB-CD1 3.87Å; V333-I342 WeakPolarHBondContact CA-O 3.37Å; V334-I342 HydrophobicContact CG2-CB 3.99Å; V334-I342 HydrophobicContact CG2-CD1 4.43Å; V334-I342 PolarHBondContact N-O 2.87Å; V334-I342 PolarHBondContact O-N 3.25Å; A336-I342 HydrophobicContact CB-CD1 3.99Å; I342-L353 HydrophobicContact CD1-CD2 4.25Å; I342-L353 HydrophobicContact CG2-CD2 3.64Å; I342-A356 HydrophobicContact CD1-CB 4.46Å; I342-V433 CarbonylContact C-O 3.58Å; I342-V433 VanDerWaalsContact CA-O 3.27Å; I342-V433 WeakPolarHBondContact CA-O 3.36Å; I342-V433 HydrophobicContact CB-CG2 4.39Å; I342-V433 HydrophobicContact CG1-CG2 3.77Å; I342-V433 HydrophobicContact CG2-CG2 4.5Å; I342-N435 HydrophobicContact CG2-CB 4.02Å; I342-F453 HydrophobicContact CD1-CZ 3.93Å; I342-F453 HydrophobicContact CG1-CE2 4.27Å; I342-F453 HydrophobicContact CG1-CZ 4.12Å; I342-F453 HydrophobicContact CG2-CE2 3.8Å; I342-F453 HydrophobicContact CG2-CZ 4Å; I342-F457 HydrophobicContact CD1-CE1 3.96Å; I342-F457 HydrophobicContact CD1-CZ 3.64Å; I342-F457 HydrophobicContact CG1-CE1 4.27Å; I342-F457 HydrophobicContact CG1-CZ 3.7Å
343	E	98.3	Very high	98.4	Very high	43 Å²	43	35.4 Å²	35.4	20%	0.201	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.8	164.1	-179.5	-174.3	-104.7	0	0	109.8	V333 E345 L428 V431 V433 S434 N435	V333-E343 HydrophobicContact CG2-CB 4.44Å; E343-E345 PolarHBondContact O-N 3.15Å; E343-L428 HydrophobicContact CB-CD1 4.28Å; E343-L428 WeakPolarHBondContact OE2-CD1 3.42Å; E343-V431 HydrophobicContact CB-CG1 4.47Å; E343-V431 HydrophobicContact CB-CG2 3.69Å; E343-V433 PolarHBondContact N-O 3.44Å; E343-S434 WeakPolarHBondContact O-CA 3.38Å; E343-N435 PolarHBondContact O-N 3.17Å; E343-N435 PolarHBondContact O-OD1 3.49Å
344	I	98.3	Very high	98.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	87	176.9	-54.8	-179.2	0	0	0	107.9	N328 P330 G331 D332 V334 T347 L353	N328-I344 HydrophobicContact CB-CD1 4.4Å; N328-I344 VanDerWaalsContact ND2-CD1 3.31Å; N328-I344 WeakPolarHBondContact ND2-CD1 3.44Å; P330-I344 CarbonylContact C-O 3.51Å; P330-I344 VanDerWaalsContact CA-O 3.27Å; P330-I344 WeakPolarHBondContact CA-O 3.4Å; G331-I344 PolarHBondContact N-O 3.42Å; D332-I344 PolarHBondContact O-N 2.84Å; V334-I344 HydrophobicContact CB-CD1 4.43Å; V334-I344 HydrophobicContact CG1-CD1 3.67Å; V334-I344 HydrophobicContact CG1-CG1 4.48Å; V334-I344 HydrophobicContact CG2-CD1 3.87Å; V334-I344 HydrophobicContact CG2-CG1 4.16Å; I344-T347 HydrophobicContact CG2-CG2 4.06Å; I344-L353 HydrophobicContact CD1-CD1 3.75Å; I344-L353 HydrophobicContact CG1-CD1 3.98Å; I344-L353 HydrophobicContact CG1-CD2 4.42Å; I344-L353 HydrophobicContact CG2-CD1 4.28Å
345	E	96.9	Very high	98.5	Very high	97 Å²	97	31.3 Å²	31.3	45%	0.453	17%	0.166	S	C	.	.	S	Bend	trans	-77.8	-37.2	177.5	-179.8	58.1	-163.6	0	0	111.5	P330 E343 N435	P330-E345 WeakPolarHBondContact CB-O 3.07Å; E343-E345 PolarHBondContact O-N 3.15Å; E345-N435 PolarHBondContact N-OD1 2.69Å
346	N	97.5	Very high	98.5	Very high	61 Å²	61	25.1 Å²	25.1	33%	0.326	14%	0.139	S	C	.	.			trans	-127.3	119.5	177.8	-170.9	-28	0	0	0	110.4	S274 D348 A349 N435 T436	S274-N346 WeakPolarHBondContact CB-OD1 3.18Å; S274-N346 PolarHBondContact OG-OD1 3.25Å; N346-D348 PolarHBondContact O-N 3.03Å; N346-D348 WeakPolarHBondContact OD1-CA 3.45Å; N346-D348 WeakPolarHBondContact OD1-CB 3.33Å; N346-D348 PolarHBondContact OD1-N 3.48Å; N346-A349 PolarHBondContact O-N 2.61Å; N346-A349 VanDerWaalsContact O-N 3.12Å; N346-N435 PolarHBondContact N-OD1 3.48Å; N346-N435 PolarHBondContact O-ND2 2.94Å; N346-T436 HydrophobicContact CB-CG2 3.56Å
347	T	98.6	Very high	98.5	Very high	2 Å²	2	25 Å²	25	1%	0.012	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.4	-178.5	63.5	0	0	0	0	113.5	G271 I273 S274 N321 N328 P330 I344 A349	G271-T347 CarbonylContact O-C 3.46Å; G271-T347 WeakPolarHBondContact O-CB 3.14Å; G271-T347 PolarHBondContact O-OG1 3.32Å; I273-T347 HydrophobicContact CB-CG2 4.46Å; I273-T347 PolarHBondContact N-OG1 3.45Å; I273-T347 VanDerWaalsContact N-OG1 3.17Å; S274-T347 VanDerWaalsContact CB-OG1 3.25Å; S274-T347 WeakPolarHBondContact CB-OG1 3.35Å; S274-T347 PolarHBondContact N-OG1 3.43Å; S274-T347 PolarHBondContact OG-N 3.36Å; S274-T347 PolarHBondContact OG-OG1 2.86Å; N321-T347 PolarHBondContact ND2-O 3.23Å; N328-T347 HydrophobicContact CB-CG2 3.85Å; N328-T347 WeakPolarHBondContact O-CG2 3.46Å; P330-T347 HydrophobicContact CG-CG2 4.44Å; I344-T347 HydrophobicContact CG2-CG2 4.06Å; T347-A349 VanDerWaalsContact C-N 3.27Å
348	D	98.3	Very high	98.5	Very high	52 Å²	52	23 Å²	23	28%	0.278	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	2.5	170.7	-158.9	47.1	0	0	0	112.7	G271 K276 N346	G271-D348 WeakPolarHBondContact CA-OD1 3.46Å; G271-D348 PolarHBondContact O-N 2.93Å; K276-D348 WeakPolarHBondContact CE-OD1 3.47Å; K276-D348 WeakPolarHBondContact CG-OD1 3.36Å; K276-D348 IonicContact NZ-OD1 2.71Å; K276-D348 PolarHBondContact NZ-OD1 2.82Å; K276-D348 IonicContact NZ-OD2 3.53Å; K276-D348 PolarHBondContact NZ-OD2 3.47Å; N346-D348 PolarHBondContact O-N 3.03Å; N346-D348 WeakPolarHBondContact OD1-CA 3.45Å; N346-D348 WeakPolarHBondContact OD1-CB 3.33Å; N346-D348 PolarHBondContact OD1-N 3.48Å
349	A	98.1	Very high	98.5	Very high	10 Å²	10	19.5 Å²	19.5	8%	0.083	11%	0.11	C	C	.	.			trans	-104.6	44.7	168	0	0	0	0	0	109.8	N346 T347 R352 N435 T436	N346-A349 PolarHBondContact O-N 2.61Å; N346-A349 VanDerWaalsContact O-N 3.12Å; T347-A349 VanDerWaalsContact C-N 3.27Å; A349-R352 WeakPolarHBondContact O-CG 3.46Å; A349-N435 PolarHBondContact O-ND2 3.17Å; A349-T436 HydrophobicContact CB-CG2 4.04Å
350	E	98.7	Very high	98.5	Very high	3 Å²	3	17.8 Å²	17.8	1%	0.014	9%	0.09	C	C	.	.			trans	-77.5	-35.1	-175.9	81.8	-54.8	131	0	0	113.2	V234 K264 V266 N321 R352 L353 I354	V234-E350 HydrophobicContact CB-CB 4.48Å; V234-E350 HydrophobicContact CG1-CB 3.73Å; V234-E350 HydrophobicContact CG1-CG 3.97Å; V234-E350 HydrophobicContact CG2-CB 3.86Å; K264-E350 WeakPolarHBondContact CE-OE1 3.47Å; K264-E350 IonicContact NZ-OE1 2.7Å; K264-E350 PolarHBondContact NZ-OE1 3.19Å; V266-E350 HydrophobicContact CG2-CG 3.98Å; N321-E350 HydrophobicContact CB-CG 3.88Å; E350-R352 PolarHBondContact O-N 3.05Å; E350-L353 WeakPolarHBondContact O-CA 3.49Å; E350-L353 VanDerWaalsContact O-CB 3.27Å; E350-L353 WeakPolarHBondContact O-CB 3.38Å; E350-L353 PolarHBondContact O-N 3.31Å; E350-I354 PolarHBondContact O-N 2.95Å; E350-I354 VanDerWaalsContact O-N 3.14Å
351	G	98.7	Very high	98.6	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.01	8%	0.081	C	C	.	.	H	α-helix	trans	-58.8	-36.3	-174.6	0	0	0	0	0	112.5	K264 I354 L355	K264-G351 VanDerWaalsContact CE-CA 3.45Å; G351-I354 VanDerWaalsContact O-CG1 3.31Å; G351-I354 WeakPolarHBondContact O-CG1 3.06Å; G351-L355 WeakPolarHBondContact O-CB 3.1Å; G351-L355 WeakPolarHBondContact O-CD1 3.37Å; G351-L355 WeakPolarHBondContact O-CG 3.4Å; G351-L355 PolarHBondContact O-N 2.95Å; G351-L355 VanDerWaalsContact O-N 3.16Å
352	R	98.7	Very high	98.6	Very high	21 Å²	21	15.1 Å²	15.1	8%	0.079	8%	0.076	C	C	.	.	H	α-helix	trans	-73.1	-28.1	176.1	74	-171.3	75.5	-173.7	-4	112.8	A349 E350 A356 L376 N435 F453 L454	A349-R352 WeakPolarHBondContact O-CG 3.46Å; E350-R352 PolarHBondContact O-N 3.05Å; R352-A356 WeakPolarHBondContact O-CB 3.36Å; R352-A356 PolarHBondContact O-N 3.23Å; R352-L376 HydrophobicContact CB-CD1 4.3Å; R352-N435 WeakPolarHBondContact CD-O 3.25Å; R352-N435 PolarHBondContact NE-O 2.75Å; R352-N435 PolarHBondContact NH1-O 2.99Å; R352-F453 HydrophobicContact CB-CD1 3.59Å; R352-F453 HydrophobicContact CB-CE1 3.74Å; R352-F453 HydrophobicContact CB-CG 4.49Å; R352-F453 HydrophobicContact CG-CD1 3.6Å; R352-F453 HydrophobicContact CG-CE1 3.57Å; R352-F453 HydrophobicContact CG-CG 4.2Å; R352-F453 HydrophobicContact CG-CZ 4.11Å; R352-F453 WeakPolarHBondContact O-CE1 3.37Å; R352-L454 HydrophobicContact CB-CD2 3.88Å; R352-L454 HydrophobicContact CB-CG 4.47Å
353	L	98.9	Very high	98.6	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-67.4	-48.3	176.3	-58.9	178.7	0	0	0	110.9	A230 V234 I342 I344 E350 L355 A356 N435 F453	A230-L353 HydrophobicContact CB-CB 4.26Å; A230-L353 VanDerWaalsContact CB-O 3.32Å; A230-L353 WeakPolarHBondContact CB-O 3.36Å; V234-L353 HydrophobicContact CG2-CB 3.91Å; V234-L353 HydrophobicContact CG2-CD1 3.87Å; V234-L353 HydrophobicContact CG2-CG 4.5Å; I342-L353 HydrophobicContact CD1-CD2 4.25Å; I342-L353 HydrophobicContact CG2-CD2 3.64Å; I344-L353 HydrophobicContact CD1-CD1 3.75Å; I344-L353 HydrophobicContact CG1-CD1 3.98Å; I344-L353 HydrophobicContact CG1-CD2 4.42Å; I344-L353 HydrophobicContact CG2-CD1 4.28Å; E350-L353 WeakPolarHBondContact O-CA 3.49Å; E350-L353 VanDerWaalsContact O-CB 3.27Å; E350-L353 WeakPolarHBondContact O-CB 3.38Å; E350-L353 PolarHBondContact O-N 3.31Å; L353-L355 VanDerWaalsContact C-N 3.3Å; L353-L355 PolarHBondContact O-N 2.92Å; L353-A356 WeakPolarHBondContact O-CB 3.25Å; L353-A356 PolarHBondContact O-N 2.7Å; L353-N435 HydrophobicContact CD2-CB 3.75Å; L353-N435 HydrophobicContact CG-CB 4.46Å; L353-F453 HydrophobicContact CD2-CZ 4.11Å
354	I	98.9	Very high	98.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.3	-34.9	179.1	73.3	175.3	0	0	0	111.5	F231 V234 K264 V266 P317 V319 E350 G351 A358	F231-I354 HydrophobicContact CD2-CB 4.08Å; F231-I354 HydrophobicContact CD2-CG2 4.05Å; V234-I354 HydrophobicContact CB-CG2 3.84Å; V234-I354 HydrophobicContact CG1-CG2 4.16Å; V234-I354 HydrophobicContact CG2-CG2 3.77Å; K264-I354 HydrophobicContact CG-CD1 4.04Å; V266-I354 HydrophobicContact CG2-CD1 3.66Å; P317-I354 HydrophobicContact CB-CB 4.04Å; P317-I354 HydrophobicContact CB-CD1 4.43Å; P317-I354 HydrophobicContact CB-CG1 4.41Å; P317-I354 HydrophobicContact CG-CB 3.99Å; P317-I354 HydrophobicContact CG-CD1 4.05Å; P317-I354 HydrophobicContact CG-CG1 3.9Å; V319-I354 HydrophobicContact CG1-CG2 4.26Å; V319-I354 HydrophobicContact CG2-CD1 4.28Å; V319-I354 HydrophobicContact CG2-CG2 4.16Å; E350-I354 PolarHBondContact O-N 2.95Å; E350-I354 VanDerWaalsContact O-N 3.14Å; G351-I354 VanDerWaalsContact O-CG1 3.31Å; G351-I354 WeakPolarHBondContact O-CG1 3.06Å; I354-A358 PolarHBondContact O-N 3.02Å
355	L	99	Very high	98.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-69.6	-32.1	175.8	-72.8	171	0	0	0	112.7	V262 K264 G351 L353 D357 A358 L359 A374 L376 L454	V262-L355 HydrophobicContact CG1-CD2 3.74Å; K264-L355 HydrophobicContact CB-CD1 4.35Å; K264-L355 HydrophobicContact CB-CD2 4.38Å; K264-L355 HydrophobicContact CB-CG 4.44Å; G351-L355 WeakPolarHBondContact O-CB 3.1Å; G351-L355 WeakPolarHBondContact O-CD1 3.37Å; G351-L355 WeakPolarHBondContact O-CG 3.4Å; G351-L355 PolarHBondContact O-N 2.95Å; G351-L355 VanDerWaalsContact O-N 3.16Å; L353-L355 VanDerWaalsContact C-N 3.3Å; L353-L355 PolarHBondContact O-N 2.92Å; L355-D357 VanDerWaalsContact C-N 3.34Å; L355-D357 PolarHBondContact O-N 3Å; L355-A358 PolarHBondContact O-N 2.79Å; L355-L359 VanDerWaalsContact O-CB 3.3Å; L355-L359 WeakPolarHBondContact O-CB 3.39Å; L355-L359 VanDerWaalsContact O-CG 3.25Å; L355-L359 WeakPolarHBondContact O-CG 3.31Å; L355-L359 PolarHBondContact O-N 3.17Å; L355-A374 HydrophobicContact CD1-CB 3.82Å; L355-L376 HydrophobicContact CD1-CD1 4.13Å; L355-L454 HydrophobicContact CB-CD2 3.61Å; L355-L454 HydrophobicContact CD1-CD1 4.14Å; L355-L454 HydrophobicContact CD1-CD2 4.02Å; L355-L454 HydrophobicContact CG-CD2 4.49Å
356	A	98.9	Very high	98.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-55.2	-50	178	0	0	0	0	0	111.5	I342 R352 L353 C360 F453 F457	I342-A356 HydrophobicContact CD1-CB 4.46Å; R352-A356 WeakPolarHBondContact O-CB 3.36Å; R352-A356 PolarHBondContact O-N 3.23Å; L353-A356 WeakPolarHBondContact O-CB 3.25Å; L353-A356 PolarHBondContact O-N 2.7Å; A356-C360 PolarHBondContact O-N 2.64Å; A356-C360 PolarHBondContact O-SG 3.22Å; A356-F453 HydrophobicContact CB-CE1 4.19Å; A356-F457 HydrophobicContact CB-CB 4.09Å; A356-F457 HydrophobicContact CB-CD1 3.66Å; A356-F457 HydrophobicContact CB-CD2 3.66Å; A356-F457 HydrophobicContact CB-CE1 3.96Å; A356-F457 HydrophobicContact CB-CE2 3.98Å; A356-F457 HydrophobicContact CB-CG 3.5Å; A356-F457 HydrophobicContact CB-CZ 4.12Å
357	D	98.9	Very high	98.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69.4	-37.7	178.4	-73.3	-28	0	0	0	112.5	M228 G229 A230 F231 A336 M337 L355 C360 Y361	M228-D357 VanDerWaalsContact CA-CG 3.48Å; M228-D357 WeakPolarHBondContact CA-OD2 3.28Å; M228-D357 HydrophobicContact CB-CB 3.9Å; M228-D357 WeakPolarHBondContact CB-OD2 3.49Å; M228-D357 HydrophobicContact CG-CB 3.92Å; M228-D357 HydrophobicContact SD-CB 4.39Å; G229-D357 PolarHBondContact N-OD2 3.05Å; A230-D357 WeakPolarHBondContact CA-OD2 3.32Å; A230-D357 WeakPolarHBondContact CB-OD2 3.39Å; A230-D357 PolarHBondContact N-OD2 3.31Å; F231-D357 HydrophobicContact CB-CB 4.14Å; F231-D357 WeakPolarHBondContact CB-OD2 3.38Å; F231-D357 PolarHBondContact N-OD2 3.32Å; A336-D357 VanDerWaalsContact CA-OD1 3.26Å; A336-D357 WeakPolarHBondContact CA-OD1 3.48Å; A336-D357 WeakPolarHBondContact CB-OD1 3.35Å; M337-D357 WeakPolarHBondContact CB-OD1 3.38Å; M337-D357 PolarHBondContact N-OD1 2.84Å; L355-D357 VanDerWaalsContact C-N 3.34Å; L355-D357 PolarHBondContact O-N 3Å; D357-C360 PolarHBondContact O-N 3.47Å; D357-Y361 WeakPolarHBondContact O-CB 2.6Å; D357-Y361 PolarHBondContact O-N 3.16Å
358	A	98.9	Very high	98.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.5	-37	178.1	0	0	0	0	0	112.9	F244 V262 P317 I354 L355 Y361 A362	F244-A358 HydrophobicContact CE2-CB 3.85Å; F244-A358 HydrophobicContact CZ-CB 4.02Å; V262-A358 HydrophobicContact CG1-CB 3.55Å; P317-A358 HydrophobicContact CG-CB 3.85Å; I354-A358 PolarHBondContact O-N 3.02Å; L355-A358 PolarHBondContact O-N 2.79Å; A358-Y361 PolarHBondContact O-N 3.23Å; A358-A362 WeakPolarHBondContact O-CB 3.27Å; A358-A362 PolarHBondContact O-N 3.23Å
359	L	98.9	Very high	98.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-66.9	-43.6	173.5	-74.6	171.2	0	0	0	111.2	V262 L355 Y361 A362 D363 V370 D372 L454 F457	V262-L359 HydrophobicContact CG2-CD2 4.33Å; L355-L359 VanDerWaalsContact O-CB 3.3Å; L355-L359 WeakPolarHBondContact O-CB 3.39Å; L355-L359 VanDerWaalsContact O-CG 3.25Å; L355-L359 WeakPolarHBondContact O-CG 3.31Å; L355-L359 PolarHBondContact O-N 3.17Å; L359-Y361 VanDerWaalsContact C-N 3.25Å; L359-Y361 PolarHBondContact O-N 3.42Å; L359-A362 WeakPolarHBondContact O-CB 2.98Å; L359-A362 PolarHBondContact O-N 3.06Å; L359-A362 VanDerWaalsContact O-N 3.17Å; L359-D363 PolarHBondContact O-N 3.28Å; L359-V370 HydrophobicContact CD2-CG1 3.71Å; L359-D372 HydrophobicContact CD2-CB 4.11Å; L359-L454 HydrophobicContact CD1-CB 4.08Å; L359-L454 HydrophobicContact CD1-CD2 4.09Å; L359-F457 CarbonylContact C-O 3.53Å; L359-F457 HydrophobicContact CB-CB 4.37Å; L359-F457 WeakPolarHBondContact CB-O 3.4Å
360	C	98.8	Very high	98.7	Very high	12 Å²	12	21.7 Å²	21.7	8%	0.081	11%	0.113	C	C	.	.	H	α-helix	trans	-58.7	-41	173.2	-68.8	0	0	0	0	111.2	M337 N338 A356 D357 D363 F457	M337-C360 HydrophobicContact CB-CB 3.85Å; M337-C360 HydrophobicContact CG-CB 4.04Å; M337-C360 HydrophobicContact SD-CB 4.04Å; N338-C360 VanDerWaalsContact CG-SG 3.6Å; A356-C360 PolarHBondContact O-N 2.64Å; A356-C360 PolarHBondContact O-SG 3.22Å; D357-C360 PolarHBondContact O-N 3.47Å; C360-D363 PolarHBondContact O-N 3.28Å; C360-F457 PolarHBondContact N-O 2.86Å; C360-F457 PolarHBondContact SG-O 2.78Å
361	Y	98.9	Very high	98.7	Very high	15 Å²	15	21.7 Å²	21.7	6%	0.059	11%	0.113	C	C	.	.	H	α-helix	trans	-68.7	-37.9	177.3	-171.8	-126.4	0	0	0	112.5	W222 M228 F244 E246 L315 M337 D357 A358 L359 D363 T364 F365	W222-Y361 HydrophobicContact CH2-CD1 4.16Å; W222-Y361 AromaticContact CH2-CE1 3.81Å; W222-Y361 HydrophobicContact CH2-CE1 3.81Å; W222-Y361 HydrophobicContact CH2-CE2 4.25Å; W222-Y361 AromaticContact CH2-CZ 3.87Å; W222-Y361 HydrophobicContact CZ2-CE1 4.06Å; W222-Y361 HydrophobicContact CZ2-CE2 4.09Å; W222-Y361 AromaticContact CZ2-CZ 3.69Å; M228-Y361 HydrophobicContact CE-CD1 4.28Å; M228-Y361 HydrophobicContact CE-CD2 4.26Å; M228-Y361 HydrophobicContact CE-CG 3.83Å; F244-Y361 AromaticContact CE1-CD1 3.72Å; F244-Y361 HydrophobicContact CE1-CD1 3.72Å; F244-Y361 HydrophobicContact CE1-CE1 4.05Å; F244-Y361 AromaticContact CZ-CD1 3.75Å; F244-Y361 HydrophobicContact CZ-CD1 3.75Å; E246-Y361 PolarHBondContact OE2-OH 2.91Å; L315-Y361 HydrophobicContact CD1-CD1 4.03Å; L315-Y361 HydrophobicContact CD2-CD1 3.95Å; L315-Y361 HydrophobicContact CD2-CE1 3.94Å; M337-Y361 HydrophobicContact CE-CD2 4.11Å; M337-Y361 HydrophobicContact SD-CD2 4.36Å; D357-Y361 WeakPolarHBondContact O-CB 2.6Å; D357-Y361 PolarHBondContact O-N 3.16Å; A358-Y361 PolarHBondContact O-N 3.23Å; L359-Y361 VanDerWaalsContact C-N 3.25Å; L359-Y361 PolarHBondContact O-N 3.42Å; Y361-D363 VanDerWaalsContact C-N 3.27Å; Y361-D363 PolarHBondContact O-N 3.06Å; Y361-T364 HydrophobicContact CD2-CG2 4.28Å; Y361-T364 WeakPolarHBondContact O-CB 3.26Å; Y361-T364 PolarHBondContact O-N 3.45Å; Y361-T364 VanDerWaalsContact O-N 3.08Å; Y361-T364 PolarHBondContact O-OG1 3.09Å; Y361-F365 HydrophobicContact CD1-CE2 4.05Å; Y361-F365 AromaticContact CE1-CE2 3.7Å; Y361-F365 HydrophobicContact CE1-CE2 3.7Å; Y361-F365 AromaticContact CE1-CZ 3.88Å; Y361-F365 HydrophobicContact CE1-CZ 3.88Å; Y361-F365 HydrophobicContact CE2-CE2 4.33Å; Y361-F365 HydrophobicContact CE2-CZ 4.47Å; Y361-F365 AromaticContact CZ-CE2 3.83Å; Y361-F365 AromaticContact CZ-CZ 3.75Å; Y361-F365 WeakPolarHBondContact O-CD2 3.35Å
362	A	98.9	Very high	98.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-55.5	-42.5	175.5	0	0	0	0	0	111.9	C260 V262 L315 A358 L359 T364 F365 P367 V370	C260-A362 HydrophobicContact CB-CB 4.03Å; V262-A362 HydrophobicContact CG2-CB 4.1Å; L315-A362 HydrophobicContact CD1-CB 3.72Å; A358-A362 WeakPolarHBondContact O-CB 3.27Å; A358-A362 PolarHBondContact O-N 3.23Å; L359-A362 WeakPolarHBondContact O-CB 2.98Å; L359-A362 PolarHBondContact O-N 3.06Å; L359-A362 VanDerWaalsContact O-N 3.17Å; A362-T364 PolarHBondContact O-N 2.87Å; A362-F365 PolarHBondContact O-N 3.48Å; A362-F365 VanDerWaalsContact O-N 3.12Å; A362-P367 WeakPolarHBondContact O-CD 3.47Å; A362-V370 HydrophobicContact CB-CG1 4.32Å; A362-V370 HydrophobicContact CB-CG2 4.32Å
363	D	98.6	Very high	98.7	Very high	37 Å²	37	20.6 Å²	20.6	20%	0.198	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-23.6	-179.9	-71.7	-17.6	0	0	0	113.4	L359 C360 Y361 F365 Q366 T458 E459	L359-D363 PolarHBondContact O-N 3.28Å; C360-D363 PolarHBondContact O-N 3.28Å; Y361-D363 VanDerWaalsContact C-N 3.27Å; Y361-D363 PolarHBondContact O-N 3.06Å; D363-F365 PolarHBondContact O-N 2.76Å; D363-Q366 PolarHBondContact O-N 2.8Å; D363-T458 PolarHBondContact OD1-OG1 2.78Å; D363-T458 WeakPolarHBondContact OD2-CA 3.47Å; D363-T458 PolarHBondContact OD2-OG1 2.83Å; D363-E459 PolarHBondContact OD2-N 3.05Å
364	T	98.4	Very high	98.7	Very high	75 Å²	75	20.6 Å²	20.6	46%	0.46	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.7	177.1	72.8	0	0	0	0	113.1	M337 Y361 A362 Q366	M337-T364 HydrophobicContact CE-CG2 3.9Å; Y361-T364 HydrophobicContact CD2-CG2 4.28Å; Y361-T364 WeakPolarHBondContact O-CB 3.26Å; Y361-T364 PolarHBondContact O-N 3.45Å; Y361-T364 VanDerWaalsContact O-N 3.08Å; Y361-T364 PolarHBondContact O-OG1 3.09Å; A362-T364 PolarHBondContact O-N 2.87Å; T364-Q366 VanDerWaalsContact C-N 3.28Å
365	F	98.3	Very high	98.7	Very high	41 Å²	41	20.8 Å²	20.8	18%	0.18	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.2	174.7	-61.4	-80.6	0	0	0	113.4	E246 P258 I313 L315 Y361 A362 D363	E246-F365 VanDerWaalsContact OE1-CZ 3.31Å; E246-F365 WeakPolarHBondContact OE1-CZ 3.43Å; P258-F365 HydrophobicContact CG-CB 4.3Å; I313-F365 HydrophobicContact CD1-CB 3.77Å; I313-F365 HydrophobicContact CD1-CD1 3.37Å; I313-F365 HydrophobicContact CD1-CD2 4.2Å; I313-F365 HydrophobicContact CD1-CE1 3.94Å; I313-F365 HydrophobicContact CD1-CG 3.51Å; I313-F365 HydrophobicContact CG2-CD2 4.43Å; I313-F365 HydrophobicContact CG2-CE2 4.23Å; I313-F365 HydrophobicContact CG2-CZ 4.3Å; L315-F365 HydrophobicContact CD1-CE2 4.27Å; L315-F365 HydrophobicContact CD2-CE2 4.22Å; Y361-F365 HydrophobicContact CD1-CE2 4.05Å; Y361-F365 AromaticContact CE1-CE2 3.7Å; Y361-F365 HydrophobicContact CE1-CE2 3.7Å; Y361-F365 AromaticContact CE1-CZ 3.88Å; Y361-F365 HydrophobicContact CE1-CZ 3.88Å; Y361-F365 HydrophobicContact CE2-CE2 4.33Å; Y361-F365 HydrophobicContact CE2-CZ 4.47Å; Y361-F365 AromaticContact CZ-CE2 3.83Å; Y361-F365 AromaticContact CZ-CZ 3.75Å; Y361-F365 WeakPolarHBondContact O-CD2 3.35Å; A362-F365 PolarHBondContact O-N 3.48Å; A362-F365 VanDerWaalsContact O-N 3.12Å; D363-F365 PolarHBondContact O-N 2.76Å
366	Q	98.3	Very high	98.7	Very high	160 Å²	160	21.8 Å²	21.8	75%	0.748	11%	0.114	S	C	*	.			trans	49.3	53.6	-175.6	-61	169.1	51.4	0	0	112.3	A257 D363 T364	A257-Q366 WeakPolarHBondContact CB-O 3.45Å; D363-Q366 PolarHBondContact O-N 2.8Å; T364-Q366 VanDerWaalsContact C-N 3.28Å
367	P	98.6	Very high	98.6	Very high	17 Å²	17	22.3 Å²	22.3	11%	0.11	12%	0.118	C	C	.	.			trans	-69.9	149.1	-170.4	29.5	-35.4	0	0	0	112.6	P258 C260 A362 H369 V370	P258-P367 CarbonylContact O-C 3.59Å; P258-P367 WeakPolarHBondContact O-CA 3.23Å; P258-P367 WeakPolarHBondContact O-CB 3.34Å; C260-P367 HydrophobicContact CB-CB 4.23Å; A362-P367 WeakPolarHBondContact O-CD 3.47Å; P367-H369 VanDerWaalsContact C-N 3.33Å; P367-V370 HydrophobicContact CB-CG2 4.14Å; P367-V370 HydrophobicContact CG-CG2 3.41Å; P367-V370 VanDerWaalsContact CG-CG2 3.41Å
368	S	98.3	Very high	98.4	Very high	36 Å²	36	24.8 Å²	24.8	25%	0.252	14%	0.144	S	C	.	.	S	Bend	trans	-69.2	-34.5	168.2	55.3	0	0	0	0	111.8	A257 P258 S462	A257-S368 PolarHBondContact O-OG 3.37Å; P258-S368 PolarHBondContact O-N 2.9Å; P258-S368 PolarHBondContact O-OG 3.48Å; S368-S462 VanDerWaalsContact O-CB 3.27Å; S368-S462 WeakPolarHBondContact O-CB 3.26Å
369	H	98.7	Very high	98.3	Very high	37 Å²	37	26.4 Å²	26.4	17%	0.171	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	144.4	178	-58.3	-85.2	0	0	0	111.4	V259 C260 P367 S462	V259-H369 HydrophobicContact CG1-CB 4.11Å; V259-H369 HydrophobicContact CG2-CB 4.13Å; C260-H369 PolarHBondContact N-O 3.43Å; P367-H369 VanDerWaalsContact C-N 3.33Å; H369-S462 VanDerWaalsContact CA-O 3.29Å; H369-S462 WeakPolarHBondContact CA-O 3.33Å; H369-S462 PolarHBondContact CE1-OG 2.98Å; H369-S462 WeakPolarHBondContact ND1-CB 3.31Å; H369-S462 PolarHBondContact ND1-OG 3.03Å
370	V	98.9	Very high	98.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	122.4	168.6	-178.7	0	0	0	0	108.7	C260 V262 L359 A362 P367 C460 S462 W463 M464	C260-V370 HydrophobicContact CB-CG2 4.2Å; C260-V370 CarbonylContact O-C 3.58Å; C260-V370 WeakPolarHBondContact O-CA 3.33Å; V262-V370 HydrophobicContact CG2-CG1 4.17Å; L359-V370 HydrophobicContact CD2-CG1 3.71Å; A362-V370 HydrophobicContact CB-CG1 4.32Å; A362-V370 HydrophobicContact CB-CG2 4.32Å; P367-V370 HydrophobicContact CB-CG2 4.14Å; P367-V370 HydrophobicContact CG-CG2 3.41Å; P367-V370 VanDerWaalsContact CG-CG2 3.41Å; V370-C460 HydrophobicContact CB-CB 4.3Å; V370-C460 HydrophobicContact CG2-CB 3.68Å; V370-S462 PolarHBondContact N-O 3.29Å; V370-W463 CarbonylContact O-C 3.37Å; V370-W463 VanDerWaalsContact O-CA 3.27Å; V370-W463 WeakPolarHBondContact O-CA 3.17Å; V370-M464 PolarHBondContact O-N 3.01Å
371	I	98.9	Very high	98.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112.4	174.3	-53.6	174.1	0	0	0	108	C260 L261 V262 I373 L398 M402 M464 V466 L493 L497	C260-I371 PolarHBondContact O-N 3.13Å; L261-I371 CarbonylContact C-O 3.37Å; L261-I371 VanDerWaalsContact CA-O 3.32Å; L261-I371 WeakPolarHBondContact CA-O 3.5Å; L261-I371 HydrophobicContact CD2-CB 3.91Å; L261-I371 HydrophobicContact CD2-CD1 4.31Å; V262-I371 PolarHBondContact N-O 3.12Å; I371-I373 HydrophobicContact CG2-CG1 4.45Å; I371-L398 HydrophobicContact CD1-CD1 4.23Å; I371-L398 HydrophobicContact CG1-CD2 4.32Å; I371-M402 HydrophobicContact CD1-CE 4.4Å; I371-M402 HydrophobicContact CG2-CE 4.15Å; I371-M464 CarbonylContact C-O 3.13Å; I371-M464 WeakPolarHBondContact CA-O 3.21Å; I371-V466 HydrophobicContact CG2-CG2 3.91Å; I371-L493 HydrophobicContact CG2-CD2 4.44Å; I371-L497 HydrophobicContact CD1-CD2 4.29Å
372	D	98.9	Very high	98	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.3	173.5	82.1	87.8	0	0	0	112.3	V262 L359 W463 M464 H465 V466	V262-D372 HydrophobicContact CB-CB 3.78Å; V262-D372 HydrophobicContact CG1-CB 4.42Å; V262-D372 CarbonylContact O-C 3.58Å; V262-D372 WeakPolarHBondContact O-CA 3.48Å; L359-D372 HydrophobicContact CD2-CB 4.11Å; D372-W463 PolarHBondContact OD2-NE1 2.89Å; D372-M464 PolarHBondContact N-O 3.19Å; D372-H465 IonicContact OD1-CE1 3.58Å; D372-H465 IonicContact OD1-CG 2.97Å; D372-H465 IonicContact OD1-ND1 3.9Å; D372-H465 PolarHBondContact OD1-ND1 3.13Å; D372-H465 WeakPolarHBondContact OD2-CA 3.47Å; D372-H465 WeakPolarHBondContact OD2-CB 3.36Å; D372-H465 IonicContact OD2-CG 3.26Å; D372-H465 IonicContact OD2-ND1 2.73Å; D372-V466 WeakPolarHBondContact O-CB 3.14Å; D372-V466 PolarHBondContact O-N 3.07Å
373	I	98.9	Very high	98	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	126.2	-171.5	-51.6	144.1	0	0	0	108.3	V262 K264 G290 C293 V294 I371 V466 I468 L493	V262-I373 PolarHBondContact O-N 3.22Å; K264-I373 PolarHBondContact N-O 2.76Å; G290-I373 VanDerWaalsContact CA-O 3.25Å; G290-I373 WeakPolarHBondContact CA-O 3.34Å; C293-I373 HydrophobicContact CB-CD1 4.2Å; C293-I373 HydrophobicContact CB-CG2 4.13Å; V294-I373 HydrophobicContact CG2-CD1 3.93Å; I371-I373 HydrophobicContact CG2-CG1 4.45Å; I373-V466 HydrophobicContact CG1-CB 4.32Å; I373-I468 HydrophobicContact CG2-CD1 3.96Å; I373-I468 HydrophobicContact CG2-CG1 4.29Å; I373-I468 HydrophobicContact CG2-CG2 3.83Å; I373-L493 HydrophobicContact CD1-CD1 3.59Å; I373-L493 HydrophobicContact CD1-CD2 4.19Å; I373-L493 HydrophobicContact CG1-CD1 4.04Å; I373-L493 HydrophobicContact CG1-CD2 4.16Å; I373-L493 HydrophobicContact CG2-CD1 4.44Å
374	A	98.9	Very high	97.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	141	-175.2	0	0	0	0	0	114.1	K264 L355 L376 V466 D467 I468	K264-A374 HydrophobicContact CB-CB 3.54Å; K264-A374 HydrophobicContact CD-CB 4.06Å; K264-A374 HydrophobicContact CG-CB 4.36Å; L355-A374 HydrophobicContact CD1-CB 3.82Å; A374-L376 HydrophobicContact CB-CB 3.92Å; A374-L376 HydrophobicContact CB-CD1 4.21Å; A374-L376 PolarHBondContact O-N 3.27Å; A374-V466 PolarHBondContact N-O 3.27Å; A374-D467 CarbonylContact O-C 3.55Å; A374-D467 WeakPolarHBondContact O-CA 3.01Å; A374-I468 VanDerWaalsContact C-CG1 3.45Å; A374-I468 WeakPolarHBondContact O-CG1 3.38Å; A374-I468 PolarHBondContact O-N 3.12Å
375	T	98.4	Very high	97.7	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.031	21%	0.21	C	C	.	.			trans	-74.7	70.7	159.9	40	0	0	0	0	108.8	K264 F286 D287 I468 T472	K264-T375 PolarHBondContact NZ-O 3.32Å; K264-T375 VanDerWaalsContact NZ-O 3.09Å; F286-T375 HydrophobicContact CD2-CG2 3.99Å; F286-T375 HydrophobicContact CE2-CG2 4.25Å; D287-T375 WeakPolarHBondContact CA-OG1 3.42Å; D287-T375 PolarHBondContact O-OG1 3.05Å; D287-T375 VanDerWaalsContact OD1-CB 3.31Å; D287-T375 WeakPolarHBondContact OD1-CB 3.25Å; D287-T375 VanDerWaalsContact OD1-O 3.04Å; D287-T375 PolarHBondContact OD1-OG1 3.08Å; T375-I468 HydrophobicContact CG2-CD1 4.05Å; T375-I468 HydrophobicContact CG2-CG1 3.82Å; T375-T472 HydrophobicContact CG2-CG2 4.17Å; T375-T472 WeakPolarHBondContact CG2-OG1 3.18Å
376	L	98.3	Very high	97.5	Very high	20 Å²	20	36.1 Å²	36.1	11%	0.105	22%	0.217	C	C	.	.			trans	-90.3	-43.9	-159.8	-162.7	65.1	0	0	0	113.9	K264 R352 L355 A374 A450 L454 H465 D467	K264-L376 HydrophobicContact CD-CD1 4.47Å; R352-L376 HydrophobicContact CB-CD1 4.3Å; L355-L376 HydrophobicContact CD1-CD1 4.13Å; A374-L376 HydrophobicContact CB-CB 3.92Å; A374-L376 HydrophobicContact CB-CD1 4.21Å; A374-L376 PolarHBondContact O-N 3.27Å; L376-A450 HydrophobicContact CD2-CB 3.74Å; L376-A450 HydrophobicContact CG-CB 4.36Å; L376-L454 HydrophobicContact CD2-CD1 3.75Å; L376-L454 HydrophobicContact CD2-CG 4.49Å; L376-H465 WeakPolarHBondContact CD2-NE2 3.3Å; L376-D467 PolarHBondContact N-OD1 3Å
377	T	96.9	Very high	97.2	Very high	12 Å²	12	29.7 Å²	29.7	7%	0.074	19%	0.194	C	C	.	.			trans	-135.5	136.2	-170.1	71.6	0	0	0	0	114.4	A379 M380 A447 A450 D467 A469	T377-A379 PolarHBondContact O-N 2.73Å; T377-M380 PolarHBondContact O-N 2.85Å; T377-M380 WeakPolarHBondContact OG1-CB 3.14Å; T377-M380 PolarHBondContact OG1-N 2.88Å; T377-M380 VanDerWaalsContact OG1-N 3.11Å; T377-A447 WeakPolarHBondContact OG1-CB 3.49Å; T377-A450 HydrophobicContact CG2-CB 3.56Å; T377-D467 PolarHBondContact N-OD2 2.73Å; T377-D467 PolarHBondContact OG1-OD2 3.2Å; T377-A469 WeakPolarHBondContact O-CB 3.46Å
378	G	94.8	Very high	97	Very high	52 Å²	52	29.9 Å²	29.9	54%	0.536	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-27.4	164.3	0	0	0	0	0	112.4	M380 K381 V382	G378-M380 VanDerWaalsContact C-N 3.3Å; G378-M380 PolarHBondContact O-N 3.44Å; G378-K381 WeakPolarHBondContact O-CB 3.38Å; G378-K381 PolarHBondContact O-N 3.04Å; G378-V382 PolarHBondContact O-N 3.34Å; G378-V382 VanDerWaalsContact O-N 3.15Å
379	A	97.3	Very high	97	Very high	34 Å²	34	28.2 Å²	28.2	28%	0.281	18%	0.183	S	C	.	.	H	α-helix	trans	-62.2	-33.6	175.6	0	0	0	0	0	112.9	T377 V382 A383 A447	T377-A379 PolarHBondContact O-N 2.73Å; A379-V382 PolarHBondContact O-N 2.87Å; A379-A383 WeakPolarHBondContact O-CB 3.28Å; A379-A383 PolarHBondContact O-N 2.94Å; A379-A447 HydrophobicContact CB-CB 4.28Å
380	M	98	Very high	97	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-66.6	-39.3	175.7	-169.8	55.6	73.1	0	0	112.1	T377 G378 V382 A383 L384 F392 M416 A447 D467	T377-M380 PolarHBondContact O-N 2.85Å; T377-M380 WeakPolarHBondContact OG1-CB 3.14Å; T377-M380 PolarHBondContact OG1-N 2.88Å; T377-M380 VanDerWaalsContact OG1-N 3.11Å; G378-M380 VanDerWaalsContact C-N 3.3Å; G378-M380 PolarHBondContact O-N 3.44Å; M380-V382 VanDerWaalsContact C-N 3.31Å; M380-V382 PolarHBondContact O-N 3.44Å; M380-A383 PolarHBondContact O-N 2.88Å; M380-L384 PolarHBondContact O-N 3.26Å; M380-L384 HydrophobicContact SD-CB 4.47Å; M380-L384 HydrophobicContact SD-CD1 3.61Å; M380-L384 HydrophobicContact SD-CG 3.98Å; M380-F392 HydrophobicContact CE-CE2 3.51Å; M380-F392 HydrophobicContact CE-CZ 3.95Å; M380-M416 HydrophobicContact CE-CE 4.16Å; M380-M416 HydrophobicContact CE-CG 3.94Å; M380-M416 HydrophobicContact SD-CE 4.33Å; M380-M416 HydrophobicContact SD-CG 4.48Å; M380-A447 HydrophobicContact CB-CB 4.42Å; M380-A447 HydrophobicContact CE-CB 3.63Å; M380-D467 HydrophobicContact CB-CB 4.35Å; M380-D467 WeakPolarHBondContact CB-OD2 3.38Å; M380-D467 HydrophobicContact CE-CB 3.71Å; M380-D467 HydrophobicContact CG-CB 4.03Å
381	K	95.3	Very high	97	Very high	49 Å²	49	26.5 Å²	26.5	21%	0.213	18%	0.175	C	C	.	.	H	α-helix	trans	-59	-43.2	172	-66.1	173.3	169.8	-174.1	0	111.2	G378 G385 A469 E473	G378-K381 WeakPolarHBondContact O-CB 3.38Å; G378-K381 PolarHBondContact O-N 3.04Å; K381-G385 WeakPolarHBondContact O-CA 3.17Å; K381-G385 PolarHBondContact O-N 2.94Å; K381-A469 WeakPolarHBondContact CE-O 3.47Å; K381-A469 HydrophobicContact CG-CB 4.3Å; K381-A469 WeakPolarHBondContact CG-O 3.32Å; K381-E473 IonicContact NZ-OE1 3.14Å; K381-E473 PolarHBondContact NZ-OE1 2.79Å
382	V	96.8	Very high	97	Very high	130 Å²	130	26.4 Å²	26.4	79%	0.788	17%	0.174	S	C	*	.	H	α-helix	trans	-67.6	-37.3	177.9	176.5	0	0	0	0	111.6	G378 A379 M380	G378-V382 PolarHBondContact O-N 3.34Å; G378-V382 VanDerWaalsContact O-N 3.15Å; A379-V382 PolarHBondContact O-N 2.87Å; M380-V382 VanDerWaalsContact C-N 3.31Å; M380-V382 PolarHBondContact O-N 3.44Å
383	A	97.5	Very high	97	Very high	60 Å²	60	26.7 Å²	26.7	50%	0.496	18%	0.176	S	C	.	.	H	α-helix	trans	-74.9	-50.5	-176	0	0	0	0	0	113.7	A379 M380 M416	A379-A383 WeakPolarHBondContact O-CB 3.28Å; A379-A383 PolarHBondContact O-N 2.94Å; M380-A383 PolarHBondContact O-N 2.88Å; A383-M416 HydrophobicContact CB-CE 4.41Å
384	L	96.9	Very high	97	Very high	41 Å²	41	29.7 Å²	29.7	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-117.1	-5	-170.7	-59.5	-178.3	0	0	0	113.6	M380 Y386 V388 W414 M416	M380-L384 PolarHBondContact O-N 3.26Å; M380-L384 HydrophobicContact SD-CB 4.47Å; M380-L384 HydrophobicContact SD-CD1 3.61Å; M380-L384 HydrophobicContact SD-CG 3.98Å; L384-Y386 PolarHBondContact O-N 3.31Å; L384-V388 HydrophobicContact CB-CG1 3.93Å; L384-V388 HydrophobicContact CD1-CG1 4.1Å; L384-V388 HydrophobicContact CD2-CG1 4.39Å; L384-V388 HydrophobicContact CG-CG1 4.37Å; L384-W414 HydrophobicContact CD1-CB 4.04Å; L384-W414 HydrophobicContact CD2-CG 4.48Å; L384-M416 HydrophobicContact CD1-CG 4.41Å; L384-M416 HydrophobicContact CD1-SD 3.97Å; L384-M416 HydrophobicContact CD2-SD 4.41Å; L384-M416 HydrophobicContact CG-SD 4.38Å
385	G	94.6	Very high	97	Very high	20 Å²	20	30.8 Å²	30.8	21%	0.206	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-136.3	-177.2	0	0	0	0	0	112	K381 G470	K381-G385 WeakPolarHBondContact O-CA 3.17Å; K381-G385 PolarHBondContact O-N 2.94Å; G385-G470 CarbonylContact O-C 3.55Å; G385-G470 WeakPolarHBondContact O-CA 3.27Å
386	Y	93.7	Very high	96.9	Very high	83 Å²	83	34.8 Å²	34.8	33%	0.325	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	3.7	-174.2	-45.8	-82.1	0	0	0	112.8	L384 G470 K475 R488	L384-Y386 PolarHBondContact O-N 3.31Å; Y386-G470 WeakPolarHBondContact CA-O 3.47Å; Y386-G470 WeakPolarHBondContact CD1-O 3.37Å; Y386-K475 HydrophobicContact CD1-CB 3.68Å; Y386-K475 HydrophobicContact CD1-CG 3.75Å; Y386-K475 HydrophobicContact CD2-CB 3.72Å; Y386-K475 HydrophobicContact CD2-CG 4.42Å; Y386-K475 HydrophobicContact CE1-CB 3.76Å; Y386-K475 HydrophobicContact CE1-CG 3.4Å; Y386-K475 VanDerWaalsContact CE1-CG 3.4Å; Y386-K475 HydrophobicContact CE2-CB 3.74Å; Y386-K475 HydrophobicContact CE2-CG 4.08Å; Y386-K475 HydrophobicContact CG-CB 3.71Å; Y386-K475 HydrophobicContact CG-CG 4.29Å; Y386-R488 PolarHBondContact O-NH1 2.98Å
387	G	92	Very high	96.9	Very high	24 Å²	24	39.1 Å²	39.1	25%	0.247	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-41	-174.1	0	0	0	0	0	113	R488	G387-R488 PolarHBondContact O-NH2 3.15Å
388	V	95.7	Very high	97	Very high	22 Å²	22	38.6 Å²	38.6	13%	0.133	24%	0.238	C	C	.	.	S	Bend	trans	-148.1	146.4	-164.1	63.2	0	0	0	0	111.2	L384 R412 W414 V471	L384-V388 HydrophobicContact CB-CG1 3.93Å; L384-V388 HydrophobicContact CD1-CG1 4.1Å; L384-V388 HydrophobicContact CD2-CG1 4.39Å; L384-V388 HydrophobicContact CG-CG1 4.37Å; V388-R412 HydrophobicContact CB-CB 4.15Å; V388-R412 HydrophobicContact CG2-CB 3.65Å; V388-R412 WeakPolarHBondContact CG2-O 3.27Å; V388-W414 HydrophobicContact CG1-CB 4.06Å; V388-W414 HydrophobicContact CG2-CB 3.63Å; V388-V471 WeakPolarHBondContact O-CG1 3.21Å
389	T	98.4	Very high	97.2	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	136.1	176.2	-60.1	0	0	0	0	110.7	V391 R412 V413 W414 V466 I468 V471 P489	T389-V391 HydrophobicContact CG2-CG2 4.36Å; T389-R412 PolarHBondContact N-O 3.35Å; T389-V413 CarbonylContact O-C 3.54Å; T389-V413 WeakPolarHBondContact O-CA 3.08Å; T389-W414 PolarHBondContact O-N 3.37Å; T389-V466 HydrophobicContact CG2-CG1 3.35Å; T389-I468 HydrophobicContact CG2-CG2 3.82Å; T389-V471 WeakPolarHBondContact OG1-CG2 3.31Å; T389-P489 HydrophobicContact CG2-CG 4.23Å
390	G	98.7	Very high	97.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	130.2	175	0	0	0	0	0	112	D467	G390-D467 PolarHBondContact N-O 2.97Å; G390-D467 PolarHBondContact O-N 2.96Å
391	V	98.9	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.2	-175.4	177.6	0	0	0	0	111	T389 W399 V413 W414 R415 M416 M464 H465 V466	T389-V391 HydrophobicContact CG2-CG2 4.36Å; V391-W399 HydrophobicContact CB-CE3 4.11Å; V391-W399 HydrophobicContact CB-CZ3 3.74Å; V391-W399 HydrophobicContact CG1-CE3 3.81Å; V391-W399 HydrophobicContact CG1-CZ3 3.96Å; V391-W399 HydrophobicContact CG2-CZ3 4.23Å; V391-V413 HydrophobicContact CG2-CB 3.77Å; V391-V413 HydrophobicContact CG2-CG1 3.89Å; V391-W414 PolarHBondContact N-O 3.11Å; V391-R415 CarbonylContact O-C 3.59Å; V391-R415 WeakPolarHBondContact O-CA 3.43Å; V391-M416 PolarHBondContact O-N 3.21Å; V391-M464 HydrophobicContact CG1-CE 3.76Å; V391-M464 HydrophobicContact CG1-CG 3.46Å; V391-M464 VanDerWaalsContact CG1-CG 3.46Å; V391-M464 HydrophobicContact CG1-SD 3.47Å; V391-M464 WeakPolarHBondContact CG1-SD 3.29Å; V391-H465 CarbonylContact C-O 3.53Å; V391-H465 WeakPolarHBondContact CA-O 3.27Å; V391-V466 HydrophobicContact CG2-CG1 4.3Å; V391-V466 HydrophobicContact CG2-CG2 4.46Å
392	F	98.8	Very high	97.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132.7	172.9	-59.2	-99.9	0	0	0	108.7	M380 M416 P417 L418 A447 C448 A451 M464 H465	M380-F392 HydrophobicContact CE-CE2 3.51Å; M380-F392 HydrophobicContact CE-CZ 3.95Å; F392-M416 HydrophobicContact CD1-CB 3.59Å; F392-M416 HydrophobicContact CD2-CB 3.96Å; F392-M416 HydrophobicContact CE1-CB 3.25Å; F392-M416 HydrophobicContact CE1-CG 4.37Å; F392-M416 HydrophobicContact CE2-CB 3.68Å; F392-M416 HydrophobicContact CE2-CG 4.09Å; F392-M416 HydrophobicContact CG-CB 3.93Å; F392-M416 HydrophobicContact CZ-CB 3.3Å; F392-M416 HydrophobicContact CZ-CE 4.41Å; F392-M416 HydrophobicContact CZ-CG 3.96Å; F392-P417 WeakPolarHBondContact CD1-O 3.34Å; F392-P417 WeakPolarHBondContact CE1-O 3.31Å; F392-L418 HydrophobicContact CB-CD1 4.12Å; F392-L418 HydrophobicContact CD1-CD1 4.35Å; F392-A447 HydrophobicContact CE2-CB 4.43Å; F392-A447 HydrophobicContact CZ-CB 4Å; F392-C448 HydrophobicContact CE1-CB 4.07Å; F392-A451 HydrophobicContact CB-CB 3.98Å; F392-A451 HydrophobicContact CD1-CB 3.54Å; F392-A451 HydrophobicContact CD2-CB 3.75Å; F392-A451 HydrophobicContact CE1-CB 3.83Å; F392-A451 HydrophobicContact CE2-CB 4.02Å; F392-A451 HydrophobicContact CG-CB 3.48Å; F392-A451 VanDerWaalsContact CG-CB 3.48Å; F392-A451 HydrophobicContact CZ-CB 4.06Å; F392-M464 CarbonylContact O-C 3.54Å; F392-M464 VanDerWaalsContact O-CA 3.3Å; F392-M464 WeakPolarHBondContact O-CA 3.44Å; F392-H465 HydrophobicContact CB-CB 4.31Å; F392-H465 AromaticContact CD2-CD2 3.62Å; F392-H465 PolarHBondContact N-O 2.78Å; F392-H465 PolarHBondContact O-N 2.8Å
393	S	98.6	Very high	97.5	Very high	6 Å²	6	37 Å²	37	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	142.5	177.4	-176	0	0	0	0	111.9	C395 R415 W463	S393-C395 VanDerWaalsContact C-N 3.32Å; S393-C395 PolarHBondContact OG-N 2.88Å; S393-C395 VanDerWaalsContact OG-N 3.09Å; S393-C395 PolarHBondContact OG-O 3.17Å; S393-R415 PolarHBondContact O-NH2 3.37Å; S393-W463 WeakPolarHBondContact CA-O 3.29Å; S393-W463 WeakPolarHBondContact CB-O 3.47Å; S393-W463 PolarHBondContact OG-O 3.32Å
394	N	98.2	Very high	97.5	Very high	63 Å²	63	38.1 Å²	38.1	34%	0.337	19%	0.193	S	C	.	.	S	Bend	trans	-86.3	-1.4	170.8	68.8	1.2	0	0	0	112.9	L418 C460 K461 W463	N394-L418 HydrophobicContact CB-CD2 4.06Å; N394-C460 PolarHBondContact ND2-O 2.71Å; N394-K461 PolarHBondContact OD1-O 3.17Å; N394-W463 PolarHBondContact N-O 2.98Å; N394-W463 PolarHBondContact OD1-N 3.3Å; N394-W463 PolarHBondContact OD1-O 2.93Å; N394-W463 VanDerWaalsContact OD1-O 3.06Å
395	C	98.3	Very high	97.5	Very high	24 Å²	24	36.1 Å²	36.1	16%	0.162	18%	0.183	C	C	.	.			trans	-128.2	115.1	-176.6	176.3	0	0	0	0	111.3	S393 E397 L398 W399 S462	S393-C395 VanDerWaalsContact C-N 3.32Å; S393-C395 PolarHBondContact OG-N 2.88Å; S393-C395 VanDerWaalsContact OG-N 3.09Å; S393-C395 PolarHBondContact OG-O 3.17Å; C395-E397 VanDerWaalsContact C-N 3.34Å; C395-E397 PolarHBondContact O-N 3.14Å; C395-L398 HydrophobicContact CB-CB 4.03Å; C395-L398 PolarHBondContact O-N 3.16Å; C395-L398 PolarHBondContact SG-N 3.44Å; C395-W399 PolarHBondContact O-N 3.06Å; C395-W399 VanDerWaalsContact O-N 3.07Å; C395-S462 PolarHBondContact SG-OG 3.26Å
396	D	98.2	Very high	97.7	Very high	89 Å²	89	35.2 Å²	35.2	48%	0.476	17%	0.174	S	C	.	.	H	α-helix	trans	-65.5	-36.1	-178.8	-72.5	-22.3	0	0	0	112.7	W399 K400 R415	D396-W399 WeakPolarHBondContact O-CB 3.32Å; D396-W399 PolarHBondContact O-N 3.37Å; D396-K400 WeakPolarHBondContact O-CG 3.44Å; D396-K400 PolarHBondContact O-N 3.38Å; D396-R415 IonicContact OD1-CZ 2.65Å; D396-R415 IonicContact OD1-NH1 2.76Å; D396-R415 PolarHBondContact OD1-NH1 2.89Å; D396-R415 IonicContact OD1-NH2 3.8Å; D396-R415 PolarHBondContact OD1-NH2 3.06Å
397	E	97.8	Very high	97.8	Very high	111 Å²	111	33.2 Å²	33.2	52%	0.519	17%	0.168	S	C	.	.	H	α-helix	trans	-66.3	-43.4	178.5	-66.3	-54.4	122.7	0	0	111.3	C395 W399 K400 K401	C395-E397 VanDerWaalsContact C-N 3.34Å; C395-E397 PolarHBondContact O-N 3.14Å; E397-W399 VanDerWaalsContact C-N 3.33Å; E397-W399 PolarHBondContact O-N 2.91Å; E397-K400 PolarHBondContact O-N 2.97Å; E397-K400 IonicContact OE1-NZ 3.26Å; E397-K400 PolarHBondContact OE1-NZ 3.47Å; E397-K401 WeakPolarHBondContact O-CG 3.31Å; E397-K401 PolarHBondContact O-N 3.49Å; E397-K401 VanDerWaalsContact O-N 3.14Å
398	L	98.3	Very high	98	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-41.1	175.3	-174.6	57.7	0	0	0	111.2	I371 C395 K401 M402 M464 L500	I371-L398 HydrophobicContact CD1-CD1 4.23Å; I371-L398 HydrophobicContact CG1-CD2 4.32Å; C395-L398 HydrophobicContact CB-CB 4.03Å; C395-L398 PolarHBondContact O-N 3.16Å; C395-L398 PolarHBondContact SG-N 3.44Å; L398-K401 PolarHBondContact O-N 3.31Å; L398-M402 PolarHBondContact O-N 2.89Å; L398-M402 VanDerWaalsContact O-N 3.1Å; L398-M464 HydrophobicContact CB-CE 4.31Å; L398-M464 HydrophobicContact CD2-CB 3.69Å; L398-M464 HydrophobicContact CD2-CE 4.39Å; L398-M464 HydrophobicContact CG-CB 4.29Å; L398-M464 HydrophobicContact CG-CE 3.74Å; L398-M464 HydrophobicContact CG-SD 4.48Å; L398-M464 WeakPolarHBondContact O-CE 3.25Å; L398-L500 HydrophobicContact CD1-CD1 4.45Å; L398-L500 HydrophobicContact CD1-CD2 3.87Å
399	W	98.6	Very high	98	Very high	33 Å²	33	34.8 Å²	34.8	13%	0.125	17%	0.168	C	C	.	.	H	α-helix	trans	-56.9	-47.9	172.4	164.9	-107.4	0	0	0	112.6	V391 C395 D396 E397 K401 M402 H403 V413 R415 M464	V391-W399 HydrophobicContact CB-CE3 4.11Å; V391-W399 HydrophobicContact CB-CZ3 3.74Å; V391-W399 HydrophobicContact CG1-CE3 3.81Å; V391-W399 HydrophobicContact CG1-CZ3 3.96Å; V391-W399 HydrophobicContact CG2-CZ3 4.23Å; C395-W399 PolarHBondContact O-N 3.06Å; C395-W399 VanDerWaalsContact O-N 3.07Å; D396-W399 WeakPolarHBondContact O-CB 3.32Å; D396-W399 PolarHBondContact O-N 3.37Å; E397-W399 VanDerWaalsContact C-N 3.33Å; E397-W399 PolarHBondContact O-N 2.91Å; W399-K401 VanDerWaalsContact C-N 3.31Å; W399-K401 PolarHBondContact O-N 3.21Å; W399-M402 PolarHBondContact O-N 2.93Å; W399-H403 HydrophobicContact CD2-CB 4.49Å; W399-H403 HydrophobicContact CH2-CB 4.17Å; W399-H403 AromaticContact CH2-CD2 3.91Å; W399-H403 HydrophobicContact CZ2-CB 3.85Å; W399-H403 AromaticContact CZ2-CD2 3.63Å; W399-H403 AromaticContact CZ2-CG 3.87Å; W399-H403 WeakPolarHBondContact O-CB 3.11Å; W399-H403 PolarHBondContact O-N 3.44Å; W399-V413 HydrophobicContact CH2-CB 4.38Å; W399-V413 HydrophobicContact CH2-CG2 3.85Å; W399-V413 HydrophobicContact CZ3-CB 4.17Å; W399-V413 HydrophobicContact CZ3-CG2 3.79Å; W399-R415 HydrophobicContact CD2-CB 4.04Å; W399-R415 HydrophobicContact CD2-CG 3.9Å; W399-R415 HydrophobicContact CE3-CB 4.18Å; W399-R415 HydrophobicContact CE3-CG 4.12Å; W399-R415 HydrophobicContact CG-CG 4.38Å; W399-R415 HydrophobicContact CH2-CB 3.77Å; W399-R415 HydrophobicContact CZ2-CB 3.59Å; W399-R415 HydrophobicContact CZ2-CG 4.38Å; W399-R415 HydrophobicContact CZ3-CB 4.06Å; W399-R415 HydrophobicContact CZ3-CG 4.45Å; W399-M464 VanDerWaalsContact CA-CE 3.47Å; W399-M464 HydrophobicContact CB-CE 4.27Å
400	K	98.4	Very high	97.9	Very high	98 Å²	98	35.4 Å²	35.4	43%	0.426	17%	0.174	S	C	.	.	H	α-helix	trans	-57.4	-44.3	178.5	-71.9	169.8	-172.4	170.9	0	111.6	D396 E397 M402 H403 E404	D396-K400 WeakPolarHBondContact O-CG 3.44Å; D396-K400 PolarHBondContact O-N 3.38Å; E397-K400 PolarHBondContact O-N 2.97Å; E397-K400 IonicContact OE1-NZ 3.26Å; E397-K400 PolarHBondContact OE1-NZ 3.47Å; K400-M402 PolarHBondContact O-N 3.05Å; K400-H403 PolarHBondContact O-N 3.33Å; K400-E404 WeakPolarHBondContact O-CB 3.43Å; K400-E404 VanDerWaalsContact O-CG 3.28Å; K400-E404 WeakPolarHBondContact O-CG 3.39Å; K400-E404 PolarHBondContact O-N 3.28Å
401	K	98.3	Very high	97.7	Very high	66 Å²	66	35.5 Å²	35.5	29%	0.287	17%	0.174	S	C	.	.	H	α-helix	trans	-61.7	-42.7	178.1	-63.1	-61.8	-174.8	168.3	0	112.8	E397 L398 W399 A405 N499 L500	E397-K401 WeakPolarHBondContact O-CG 3.31Å; E397-K401 PolarHBondContact O-N 3.49Å; E397-K401 VanDerWaalsContact O-N 3.14Å; L398-K401 PolarHBondContact O-N 3.31Å; W399-K401 VanDerWaalsContact C-N 3.31Å; W399-K401 PolarHBondContact O-N 3.21Å; K401-A405 VanDerWaalsContact O-CB 3.29Å; K401-A405 WeakPolarHBondContact O-CB 3.28Å; K401-A405 PolarHBondContact O-N 3.34Å; K401-N499 HydrophobicContact CD-CB 3.95Å; K401-N499 WeakPolarHBondContact CD-O 3.25Å; K401-N499 VanDerWaalsContact CE-O 3.25Å; K401-N499 WeakPolarHBondContact CE-O 3.28Å; K401-N499 PolarHBondContact NZ-O 3.49Å; K401-L500 HydrophobicContact CB-CD2 4.41Å; K401-L500 HydrophobicContact CG-CD2 4.15Å
402	M	98.6	Very high	97.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-40.9	176.3	-173.4	67.8	77.8	0	0	111.8	I371 L398 W399 K400 A405 G406 V413 M464 V466 T492 L493 C496	I371-M402 HydrophobicContact CD1-CE 4.4Å; I371-M402 HydrophobicContact CG2-CE 4.15Å; L398-M402 PolarHBondContact O-N 2.89Å; L398-M402 VanDerWaalsContact O-N 3.1Å; W399-M402 PolarHBondContact O-N 2.93Å; K400-M402 PolarHBondContact O-N 3.05Å; M402-A405 PolarHBondContact O-N 2.98Å; M402-G406 PolarHBondContact O-N 2.99Å; M402-V413 HydrophobicContact CG-CB 4.41Å; M402-V413 HydrophobicContact CG-CG1 3.99Å; M402-V413 HydrophobicContact CG-CG2 4.05Å; M402-V413 HydrophobicContact SD-CG1 4.42Å; M402-M464 HydrophobicContact CB-CE 3.74Å; M402-M464 HydrophobicContact CB-SD 3.9Å; M402-M464 HydrophobicContact CE-SD 3.31Å; M402-M464 WeakPolarHBondContact CE-SD 3.35Å; M402-M464 HydrophobicContact CG-CE 4.28Å; M402-M464 HydrophobicContact CG-SD 3.84Å; M402-M464 HydrophobicContact SD-SD 4.44Å; M402-V466 HydrophobicContact CE-CG2 4.17Å; M402-T492 HydrophobicContact CG-CG2 4.48Å; M402-T492 HydrophobicContact SD-CG2 3.68Å; M402-L493 HydrophobicContact CE-CD2 3.71Å; M402-L493 HydrophobicContact SD-CD2 4.22Å; M402-C496 HydrophobicContact CE-CB 4.2Å; M402-C496 HydrophobicContact SD-CB 3.87Å
403	H	98.2	Very high	97.6	Very high	37 Å²	37	38.7 Å²	38.7	17%	0.171	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-50.1	177.9	-175.4	-114.1	0	0	0	111.9	E90 W399 K400 A405 G406 M407 V413	E90-H403 IonicContact OE1-NE2 2.67Å; E90-H403 IonicContact OE2-CD2 3.98Å; E90-H403 IonicContact OE2-CE1 2.66Å; E90-H403 IonicContact OE2-NE2 2.68Å; E90-H403 PolarHBondContact OE2-NE2 3.3Å; W399-H403 HydrophobicContact CD2-CB 4.49Å; W399-H403 HydrophobicContact CH2-CB 4.17Å; W399-H403 AromaticContact CH2-CD2 3.91Å; W399-H403 HydrophobicContact CZ2-CB 3.85Å; W399-H403 AromaticContact CZ2-CD2 3.63Å; W399-H403 AromaticContact CZ2-CG 3.87Å; W399-H403 WeakPolarHBondContact O-CB 3.11Å; W399-H403 PolarHBondContact O-N 3.44Å; K400-H403 PolarHBondContact O-N 3.33Å; H403-A405 VanDerWaalsContact C-N 3.28Å; H403-A405 PolarHBondContact O-N 3.28Å; H403-G406 PolarHBondContact O-N 2.76Å; H403-G406 VanDerWaalsContact O-N 3.08Å; H403-M407 WeakPolarHBondContact O-CG 3.43Å; H403-M407 PolarHBondContact O-N 3.27Å; H403-V413 HydrophobicContact CB-CG2 4.44Å
404	E	97.8	Very high	97.6	Very high	82 Å²	82	44.2 Å²	44.2	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-56.3	-41.9	174.1	-73.5	169.5	-175.1	0	0	111.8	K400 M407 Q408	K400-E404 WeakPolarHBondContact O-CB 3.43Å; K400-E404 VanDerWaalsContact O-CG 3.28Å; K400-E404 WeakPolarHBondContact O-CG 3.39Å; K400-E404 PolarHBondContact O-N 3.28Å; E404-M407 WeakPolarHBondContact O-CB 3.4Å; E404-M407 PolarHBondContact O-N 3.04Å; E404-Q408 WeakPolarHBondContact O-CG 3.23Å; E404-Q408 PolarHBondContact O-N 3.15Å
405	A	98.1	Very high	97.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-45.5	175.2	0	0	0	0	0	111.8	K401 M402 H403 M407 Q408 T409 T492 Q495 C496	K401-A405 VanDerWaalsContact O-CB 3.29Å; K401-A405 WeakPolarHBondContact O-CB 3.28Å; K401-A405 PolarHBondContact O-N 3.34Å; M402-A405 PolarHBondContact O-N 2.98Å; H403-A405 VanDerWaalsContact C-N 3.28Å; H403-A405 PolarHBondContact O-N 3.28Å; A405-M407 VanDerWaalsContact C-N 3.3Å; A405-M407 PolarHBondContact O-N 3.36Å; A405-Q408 PolarHBondContact O-N 3.49Å; A405-T409 WeakPolarHBondContact O-CG2 3.43Å; A405-T409 PolarHBondContact O-N 3.14Å; A405-T409 PolarHBondContact O-OG1 3.45Å; A405-T492 HydrophobicContact CB-CG2 3.98Å; A405-T492 WeakPolarHBondContact CB-O 3.37Å; A405-Q495 HydrophobicContact CB-CB 3.84Å; A405-Q495 HydrophobicContact CB-CG 3.79Å; A405-C496 HydrophobicContact CB-CB 3.99Å
406	G	97.9	Very high	97.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-38.8	176.6	0	0	0	0	0	112.9	M402 H403 Q408 T409 G410	M402-G406 PolarHBondContact O-N 2.99Å; H403-G406 PolarHBondContact O-N 2.76Å; H403-G406 VanDerWaalsContact O-N 3.08Å; G406-Q408 PolarHBondContact O-N 3.28Å; G406-T409 PolarHBondContact O-OG1 2.9Å; G406-G410 WeakPolarHBondContact O-CA 3.44Å; G406-G410 PolarHBondContact O-N 3.42Å
407	M	96	Very high	97.6	Very high	41 Å²	41	43.1 Å²	43.1	20%	0.202	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-41.7	175.9	-67.1	166.8	48.7	0	0	112.3	Y85 E90 H92 H403 E404 A405	Y85-M407 HydrophobicContact CD1-CE 4.41Å; Y85-M407 HydrophobicContact CD2-CE 3.45Å; Y85-M407 VanDerWaalsContact CD2-CE 3.45Å; Y85-M407 HydrophobicContact CE1-CE 4.09Å; Y85-M407 HydrophobicContact CE2-CB 4.2Å; Y85-M407 HydrophobicContact CE2-CE 3.05Å; Y85-M407 HydrophobicContact CE2-CG 3.76Å; Y85-M407 HydrophobicContact CE2-SD 3.82Å; Y85-M407 HydrophobicContact CG-CE 4.11Å; E90-M407 WeakPolarHBondContact O-CA 3.22Å; E90-M407 VanDerWaalsContact O-CG 3.31Å; E90-M407 WeakPolarHBondContact O-CG 3.26Å; H92-M407 PolarHBondContact N-O 2.66Å; H403-M407 WeakPolarHBondContact O-CG 3.43Å; H403-M407 PolarHBondContact O-N 3.27Å; E404-M407 WeakPolarHBondContact O-CB 3.4Å; E404-M407 PolarHBondContact O-N 3.04Å; A405-M407 VanDerWaalsContact C-N 3.3Å; A405-M407 PolarHBondContact O-N 3.36Å
408	Q	95.7	Very high	97.6	Very high	75 Å²	75	39 Å²	39	35%	0.35	18%	0.176	S	C	.	.	H	α-helix	trans	-76.5	-38.2	-177.2	-68.4	177.8	18.8	0	0	113	R99 E404 A405 G406	R99-Q408 PolarHBondContact NH2-O 2.92Å; E404-Q408 WeakPolarHBondContact O-CG 3.23Å; E404-Q408 PolarHBondContact O-N 3.15Å; A405-Q408 PolarHBondContact O-N 3.49Å; G406-Q408 PolarHBondContact O-N 3.28Å
409	T	97	Very high	97.6	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-84.1	-16.3	-177.5	68	0	0	0	0	112.4	R99 A405 G406 D411 R491 T492 Q495	R99-T409 PolarHBondContact NE-O 3.17Å; R99-T409 PolarHBondContact NH1-O 3.49Å; R99-T409 PolarHBondContact NH2-O 3.39Å; A405-T409 WeakPolarHBondContact O-CG2 3.43Å; A405-T409 PolarHBondContact O-N 3.14Å; A405-T409 PolarHBondContact O-OG1 3.45Å; G406-T409 PolarHBondContact O-OG1 2.9Å; T409-D411 PolarHBondContact O-N 3Å; T409-D411 PolarHBondContact OG1-N 3.24Å; T409-D411 VanDerWaalsContact OG1-N 3.1Å; T409-R491 HydrophobicContact CG2-CB 4.09Å; T409-R491 VanDerWaalsContact O-CZ 3.3Å; T409-R491 PolarHBondContact O-NH1 2.8Å; T409-R491 PolarHBondContact O-NH2 2.91Å; T409-T492 PolarHBondContact OG1-OG1 3.42Å; T409-Q495 HydrophobicContact CG2-CB 3.89Å; T409-Q495 HydrophobicContact CG2-CG 4.26Å
410	G	94.7	Very high	97.5	Very high	13 Å²	13	50.8 Å²	50.8	13%	0.134	23%	0.228	C	C	.	.	S	Bend	trans	73.7	-4.6	-171.2	0	0	0	0	0	113.5	G406 R412	G406-G410 WeakPolarHBondContact O-CA 3.44Å; G406-G410 PolarHBondContact O-N 3.42Å; G410-R412 PolarHBondContact O-N 2.8Å
411	D	96.2	Very high	97.4	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.011	23%	0.233	C	C	.	.			trans	-92.5	78.7	176.7	-158.6	-15.4	0	0	0	110.1	T409 R488 P489 T492	T409-D411 PolarHBondContact O-N 3Å; T409-D411 PolarHBondContact OG1-N 3.24Å; T409-D411 VanDerWaalsContact OG1-N 3.1Å; D411-R488 IonicContact OD1-CZ 3.18Å; D411-R488 VanDerWaalsContact OD1-CZ 3.26Å; D411-R488 IonicContact OD1-NE 2.72Å; D411-R488 PolarHBondContact OD1-NE 3.4Å; D411-R488 IonicContact OD1-NH2 2.8Å; D411-R488 PolarHBondContact OD1-NH2 2.69Å; D411-R488 WeakPolarHBondContact OD2-CB 3.5Å; D411-R488 WeakPolarHBondContact OD2-CG 3.14Å; D411-R488 IonicContact OD2-NE 2.68Å; D411-P489 VanDerWaalsContact OD2-CA 3.27Å; D411-P489 WeakPolarHBondContact OD2-CA 3.33Å; D411-T492 WeakPolarHBondContact CB-OG1 3.46Å; D411-T492 PolarHBondContact O-OG1 3.33Å
412	R	96.3	Very high	97.4	Very high	66 Å²	66	50.2 Å²	50.2	25%	0.249	23%	0.226	C	C	.	.			trans	-57.2	152.6	-167.9	-67	176.7	-81	-157.1	-1.9	113.5	E89 I91 V388 T389 G410	E89-R412 VanDerWaalsContact O-CD 3.27Å; E89-R412 WeakPolarHBondContact O-CD 3.39Å; E89-R412 PolarHBondContact O-NH1 2.87Å; E89-R412 IonicContact OE2-NH1 2.84Å; E89-R412 PolarHBondContact OE2-NH1 3.22Å; I91-R412 HydrophobicContact CG2-CG 3.49Å; I91-R412 VanDerWaalsContact CG2-CG 3.49Å; V388-R412 HydrophobicContact CB-CB 4.15Å; V388-R412 HydrophobicContact CG2-CB 3.65Å; V388-R412 WeakPolarHBondContact CG2-O 3.27Å; T389-R412 PolarHBondContact N-O 3.35Å; G410-R412 PolarHBondContact O-N 2.8Å
413	V	98.3	Very high	97.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152.4	168.2	-66.3	0	0	0	0	110	T389 V391 W399 M402 H403 T492	T389-V413 CarbonylContact O-C 3.54Å; T389-V413 WeakPolarHBondContact O-CA 3.08Å; V391-V413 HydrophobicContact CG2-CB 3.77Å; V391-V413 HydrophobicContact CG2-CG1 3.89Å; W399-V413 HydrophobicContact CH2-CB 4.38Å; W399-V413 HydrophobicContact CH2-CG2 3.85Å; W399-V413 HydrophobicContact CZ3-CB 4.17Å; W399-V413 HydrophobicContact CZ3-CG2 3.79Å; M402-V413 HydrophobicContact CG-CB 4.41Å; M402-V413 HydrophobicContact CG-CG1 3.99Å; M402-V413 HydrophobicContact CG-CG2 4.05Å; M402-V413 HydrophobicContact SD-CG1 4.42Å; H403-V413 HydrophobicContact CB-CG2 4.44Å; V413-T492 HydrophobicContact CG1-CG2 4.03Å
414	W	98.4	Very high	97.2	Very high	122 Å²	122	52.4 Å²	52.4	46%	0.462	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.9	178	-167.7	-97.8	0	0	0	110.3	L384 V388 T389 V391 M416	L384-W414 HydrophobicContact CD1-CB 4.04Å; L384-W414 HydrophobicContact CD2-CG 4.48Å; V388-W414 HydrophobicContact CG1-CB 4.06Å; V388-W414 HydrophobicContact CG2-CB 3.63Å; T389-W414 PolarHBondContact O-N 3.37Å; V391-W414 PolarHBondContact N-O 3.11Å; W414-M416 PolarHBondContact O-N 3.41Å
415	R	98.7	Very high	97.1	Very high	88 Å²	88	48.7 Å²	48.7	33%	0.332	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.9	-177.3	-156.6	175.5	-176	176.6	0.4	110.9	V391 S393 D396 W399	V391-R415 CarbonylContact O-C 3.59Å; V391-R415 WeakPolarHBondContact O-CA 3.43Å; S393-R415 PolarHBondContact O-NH2 3.37Å; D396-R415 IonicContact OD1-CZ 2.65Å; D396-R415 IonicContact OD1-NH1 2.76Å; D396-R415 PolarHBondContact OD1-NH1 2.89Å; D396-R415 IonicContact OD1-NH2 3.8Å; D396-R415 PolarHBondContact OD1-NH2 3.06Å; W399-R415 HydrophobicContact CD2-CB 4.04Å; W399-R415 HydrophobicContact CD2-CG 3.9Å; W399-R415 HydrophobicContact CE3-CB 4.18Å; W399-R415 HydrophobicContact CE3-CG 4.12Å; W399-R415 HydrophobicContact CG-CG 4.38Å; W399-R415 HydrophobicContact CH2-CB 3.77Å; W399-R415 HydrophobicContact CZ2-CB 3.59Å; W399-R415 HydrophobicContact CZ2-CG 4.38Å; W399-R415 HydrophobicContact CZ3-CB 4.06Å; W399-R415 HydrophobicContact CZ3-CG 4.45Å
416	M	98.8	Very high	97	Very high	25 Å²	25	48.7 Å²	48.7	12%	0.123	22%	0.22	C	C	.	.			trans	-109.5	149.3	174.5	-62.4	-65.1	-75.5	0	0	110.3	M380 A383 L384 V391 F392 W414	M380-M416 HydrophobicContact CE-CE 4.16Å; M380-M416 HydrophobicContact CE-CG 3.94Å; M380-M416 HydrophobicContact SD-CE 4.33Å; M380-M416 HydrophobicContact SD-CG 4.48Å; A383-M416 HydrophobicContact CB-CE 4.41Å; L384-M416 HydrophobicContact CD1-CG 4.41Å; L384-M416 HydrophobicContact CD1-SD 3.97Å; L384-M416 HydrophobicContact CD2-SD 4.41Å; L384-M416 HydrophobicContact CG-SD 4.38Å; V391-M416 PolarHBondContact O-N 3.21Å; F392-M416 HydrophobicContact CD1-CB 3.59Å; F392-M416 HydrophobicContact CD2-CB 3.96Å; F392-M416 HydrophobicContact CE1-CB 3.25Å; F392-M416 HydrophobicContact CE1-CG 4.37Å; F392-M416 HydrophobicContact CE2-CB 3.68Å; F392-M416 HydrophobicContact CE2-CG 4.09Å; F392-M416 HydrophobicContact CG-CB 3.93Å; F392-M416 HydrophobicContact CZ-CB 3.3Å; F392-M416 HydrophobicContact CZ-CE 4.41Å; F392-M416 HydrophobicContact CZ-CG 3.96Å; W414-M416 PolarHBondContact O-N 3.41Å
417	P	98.3	Very high	96.9	Very high	39 Å²	39	52 Å²	52	25%	0.253	24%	0.235	S	C	.	.			trans	-76.3	134.4	-171.2	29.6	-35.4	0	0	0	112.7	F392 F419 Y422	F392-P417 WeakPolarHBondContact CD1-O 3.34Å; F392-P417 WeakPolarHBondContact CE1-O 3.31Å; P417-F419 HydrophobicContact CB-CD1 4.25Å; P417-F419 HydrophobicContact CB-CD2 3.84Å; P417-F419 HydrophobicContact CB-CE1 4.01Å; P417-F419 HydrophobicContact CB-CE2 3.58Å; P417-F419 HydrophobicContact CB-CG 4.17Å; P417-F419 HydrophobicContact CB-CZ 3.67Å; P417-Y422 HydrophobicContact CB-CE2 4.09Å; P417-Y422 HydrophobicContact CG-CE2 3.87Å
418	L	97.4	Very high	96.8	Very high	25 Å²	25	52.2 Å²	52.2	13%	0.131	24%	0.236	C	C	.	.			trans	-112.7	55.5	176.4	-165.8	76.1	0	0	0	111.4	F392 N394 A451 K455 W463	F392-L418 HydrophobicContact CB-CD1 4.12Å; F392-L418 HydrophobicContact CD1-CD1 4.35Å; N394-L418 HydrophobicContact CB-CD2 4.06Å; L418-A451 HydrophobicContact CD1-CB 3.95Å; L418-K455 HydrophobicContact CD1-CD 4.39Å; L418-K455 HydrophobicContact CD2-CD 3.96Å; L418-K455 HydrophobicContact CD2-CG 4.5Å; L418-K455 HydrophobicContact CG-CD 4.09Å; L418-W463 HydrophobicContact CD1-CH2 4.35Å; L418-W463 HydrophobicContact CD1-CZ3 4.02Å; L418-W463 HydrophobicContact CD2-CE3 4.26Å; L418-W463 HydrophobicContact CD2-CZ3 3.73Å
419	F	97.8	Very high	96.6	Very high	129 Å²	129	58.7 Å²	58.7	57%	0.566	27%	0.267	S	S	*	.			trans	-83.2	151.4	-174.1	-58.8	-26.4	0	0	0	113.5	P417 H421 Y422	P417-F419 HydrophobicContact CB-CD1 4.25Å; P417-F419 HydrophobicContact CB-CD2 3.84Å; P417-F419 HydrophobicContact CB-CE1 4.01Å; P417-F419 HydrophobicContact CB-CE2 3.58Å; P417-F419 HydrophobicContact CB-CG 4.17Å; P417-F419 HydrophobicContact CB-CZ 3.67Å; F419-H421 HydrophobicContact CB-CB 4.41Å; F419-H421 PolarHBondContact O-N 2.91Å; F419-H421 VanDerWaalsContact O-N 3.16Å; F419-Y422 HydrophobicContact CB-CD2 4.01Å; F419-Y422 HydrophobicContact CB-CE2 4.07Å; F419-Y422 HydrophobicContact CD2-CE2 4.03Å; F419-Y422 HydrophobicContact CG-CE2 4.32Å; F419-Y422 PolarHBondContact O-N 3.09Å; F419-Y422 VanDerWaalsContact O-N 3.09Å
420	K	96.9	Very high	96.4	Very high	152 Å²	152	63.1 Å²	63.1	66%	0.661	30%	0.297	S	S	*	.	H	α-helix	trans	-55	-32.2	173.2	-173.9	179.6	177.7	-175.7	0	112.5	Y422 S423 E424	K420-Y422 PolarHBondContact O-N 2.8Å; K420-S423 WeakPolarHBondContact O-CB 3.14Å; K420-S423 PolarHBondContact O-N 3.42Å; K420-E424 WeakPolarHBondContact CE-OE1 3.15Å; K420-E424 HydrophobicContact CG-CG 4.42Å; K420-E424 PolarHBondContact O-N 3.34Å
421	H	96.8	Very high	96.5	Very high	113 Å²	113	63.2 Å²	63.2	52%	0.523	30%	0.295	S	S	.	.	H	α-helix	trans	-48.8	-45.3	175.1	175	71.5	0	0	0	112.5	F419 E424 C425	F419-H421 HydrophobicContact CB-CB 4.41Å; F419-H421 PolarHBondContact O-N 2.91Å; F419-H421 VanDerWaalsContact O-N 3.16Å; H421-E424 PolarHBondContact O-N 3.08Å; H421-C425 PolarHBondContact O-N 3.31Å; H421-C425 PolarHBondContact O-SG 2.67Å
422	Y	97.6	Very high	96.6	Very high	39 Å²	39	67 Å²	67	15%	0.153	32%	0.316	C	S	.	.	H	α-helix	trans	-74.1	-30.4	180	-54.1	-62.1	0	0	0	112.7	P417 F419 K420 E424 C425 A445 C448 T449 A452	P417-Y422 HydrophobicContact CB-CE2 4.09Å; P417-Y422 HydrophobicContact CG-CE2 3.87Å; F419-Y422 HydrophobicContact CB-CD2 4.01Å; F419-Y422 HydrophobicContact CB-CE2 4.07Å; F419-Y422 HydrophobicContact CD2-CE2 4.03Å; F419-Y422 HydrophobicContact CG-CE2 4.32Å; F419-Y422 PolarHBondContact O-N 3.09Å; F419-Y422 VanDerWaalsContact O-N 3.09Å; K420-Y422 PolarHBondContact O-N 2.8Å; Y422-E424 VanDerWaalsContact C-N 3.34Å; Y422-C425 WeakPolarHBondContact O-CB 3.26Å; Y422-C425 PolarHBondContact O-N 2.75Å; Y422-A445 HydrophobicContact CD1-CB 4.14Å; Y422-A445 HydrophobicContact CE1-CB 3.66Å; Y422-C448 HydrophobicContact CD1-CB 3.67Å; Y422-C448 HydrophobicContact CD2-CB 3.63Å; Y422-C448 HydrophobicContact CE1-CB 3.7Å; Y422-C448 HydrophobicContact CE2-CB 3.66Å; Y422-C448 HydrophobicContact CG-CB 3.63Å; Y422-T449 HydrophobicContact CD1-CG2 4.33Å; Y422-A452 VanDerWaalsContact C-CB 3.47Å
423	S	96.2	Very high	96.7	Very high	8 Å²	8	64 Å²	64	6%	0.056	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-39.4	172.5	-61	0	0	0	0	111.6	K420 C425 V426 K427	K420-S423 WeakPolarHBondContact O-CB 3.14Å; K420-S423 PolarHBondContact O-N 3.42Å; S423-C425 PolarHBondContact O-N 3.24Å; S423-V426 VanDerWaalsContact O-CG2 3.28Å; S423-V426 WeakPolarHBondContact O-CG2 3.29Å; S423-V426 PolarHBondContact O-N 2.93Å; S423-K427 PolarHBondContact O-N 3.31Å
424	E	96	Very high	96.6	Very high	74 Å²	74	64 Å²	64	35%	0.346	31%	0.305	S	S	.	.	H	α-helix	trans	-68.1	-20	175.7	-59.6	-54.4	149.1	0	0	113	K420 H421 Y422 V426 K427 K438	K420-E424 WeakPolarHBondContact CE-OE1 3.15Å; K420-E424 HydrophobicContact CG-CG 4.42Å; K420-E424 PolarHBondContact O-N 3.34Å; H421-E424 PolarHBondContact O-N 3.08Å; Y422-E424 VanDerWaalsContact C-N 3.34Å; E424-V426 VanDerWaalsContact C-N 3.33Å; E424-K427 IonicContact OE1-NZ 2.57Å; E424-K438 WeakPolarHBondContact O-CE 3.27Å; E424-K438 PolarHBondContact O-NZ 3.21Å
425	C	96.3	Very high	96.6	Very high	4 Å²	4	58.2 Å²	58.2	3%	0.027	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.6	177.4	-62.9	0	0	0	0	113.2	H421 Y422 S423 S437 K438 F441 T449	H421-C425 PolarHBondContact O-N 3.31Å; H421-C425 PolarHBondContact O-SG 2.67Å; Y422-C425 WeakPolarHBondContact O-CB 3.26Å; Y422-C425 PolarHBondContact O-N 2.75Å; S423-C425 PolarHBondContact O-N 3.24Å; C425-S437 CarbonylContact O-C 3.6Å; C425-S437 WeakPolarHBondContact O-CA 3.48Å; C425-K438 WeakPolarHBondContact O-CG 3.1Å; C425-K438 PolarHBondContact O-N 3.13Å; C425-F441 HydrophobicContact CB-CD2 3.95Å; C425-F441 HydrophobicContact CB-CE2 4.49Å; C425-F441 HydrophobicContact CB-CG 4.34Å; C425-T449 HydrophobicContact CB-CG2 3.95Å
426	V	96.5	Very high	96.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-12.2	-176.9	-61.7	0	0	0	0	113.9	S423 E424 V433 S434	S423-V426 VanDerWaalsContact O-CG2 3.28Å; S423-V426 WeakPolarHBondContact O-CG2 3.29Å; S423-V426 PolarHBondContact O-N 2.93Å; E424-V426 VanDerWaalsContact C-N 3.33Å; V426-V433 CarbonylContact O-C 3.49Å; V426-V433 WeakPolarHBondContact O-CA 3.37Å; V426-S434 PolarHBondContact O-N 3.02Å
427	K	95.6	Very high	96.3	Very high	72 Å²	72	55 Å²	55	31%	0.313	28%	0.275	S	S	.	.			trans	-77.7	138.1	177.9	-73	179.2	177	-179.9	0	112.6	S423 E424 K438	S423-K427 PolarHBondContact O-N 3.31Å; E424-K427 IonicContact OE1-NZ 2.57Å; K427-K438 WeakPolarHBondContact O-CE 3.34Å; K427-K438 PolarHBondContact O-NZ 2.77Å
428	L	93	Very high	95.9	Very high	45 Å²	45	56.2 Å²	56.2	24%	0.236	28%	0.277	C	S	.	.			trans	-113	172.5	173.7	-67.1	177.7	0	0	0	111.7	E343 V431 K438	E343-L428 HydrophobicContact CB-CD1 4.28Å; E343-L428 WeakPolarHBondContact OE2-CD1 3.42Å; L428-V431 CarbonylContact C-O 3.5Å; L428-V431 HydrophobicContact CB-CG2 3.83Å; L428-V431 HydrophobicContact CD1-CG2 3.74Å; L428-V431 HydrophobicContact CG-CG2 4.28Å; L428-V431 PolarHBondContact N-O 3.01Å; L428-K438 HydrophobicContact CD2-CG 3.82Å
429	E	92.9	Very high	95.4	Very high	211 Å²	211	60.8 Å²	60.8	99%	0.986	31%	0.308	S	S	*	.	S	Bend	trans	-84.5	-32.2	173.1	-67.8	-175.3	173.4	0	0	111.8
430	S	92.6	Very high	95	Very high	96 Å²	96	58.8 Å²	58.8	67%	0.671	32%	0.315	S	S	*	.	S	Bend	trans	-85	-25.6	-176.7	48.9	0	0	0	0	114.1
431	V	96.7	Very high	94.7	Very high	15 Å²	15	55.3 Å²	55.3	9%	0.091	30%	0.3	C	S	.	.	S	Bend	trans	-142.2	163.6	-179.9	-62.5	0	0	0	0	109.5	V333 E343 L428 V433	V333-V431 HydrophobicContact CG1-CG1 3.87Å; V333-V431 HydrophobicContact CG2-CG1 3.79Å; E343-V431 HydrophobicContact CB-CG1 4.47Å; E343-V431 HydrophobicContact CB-CG2 3.69Å; L428-V431 CarbonylContact C-O 3.5Å; L428-V431 HydrophobicContact CB-CG2 3.83Å; L428-V431 HydrophobicContact CD1-CG2 3.74Å; L428-V431 HydrophobicContact CG-CG2 4.28Å; L428-V431 PolarHBondContact N-O 3.01Å; V431-V433 WeakPolarHBondContact CG2-O 3.27Å; V431-V433 PolarHBondContact O-N 3.4Å
432	D	97.8	Very high	94.2	Very high	83 Å²	83	53.3 Å²	53.3	44%	0.444	30%	0.303	S	S	.	.	S	Bend	trans	-63.8	-45	-177.5	-59.3	-61.1	0	0	0	111.8	K340 S341	K340-D432 WeakPolarHBondContact CA-OD2 3.18Å; K340-D432 HydrophobicContact CB-CB 4.34Å; K340-D432 HydrophobicContact CG-CB 4.5Å; S341-D432 PolarHBondContact N-OD2 3.3Å; S341-D432 PolarHBondContact OG-N 2.7Å; S341-D432 PolarHBondContact OG-OD2 2.79Å
433	V	97.6	Very high	93.7	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	153.4	179	-64.9	0	0	0	0	112.5	S341 I342 E343 V426 V431 F453 E456 F457	S341-V433 PolarHBondContact O-N 3.34Å; I342-V433 CarbonylContact C-O 3.58Å; I342-V433 VanDerWaalsContact CA-O 3.27Å; I342-V433 WeakPolarHBondContact CA-O 3.36Å; I342-V433 HydrophobicContact CB-CG2 4.39Å; I342-V433 HydrophobicContact CG1-CG2 3.77Å; I342-V433 HydrophobicContact CG2-CG2 4.5Å; E343-V433 PolarHBondContact N-O 3.44Å; V426-V433 CarbonylContact O-C 3.49Å; V426-V433 WeakPolarHBondContact O-CA 3.37Å; V431-V433 WeakPolarHBondContact CG2-O 3.27Å; V431-V433 PolarHBondContact O-N 3.4Å; V433-F453 HydrophobicContact CB-CD2 4.35Å; V433-F453 HydrophobicContact CB-CE2 4.35Å; V433-F453 HydrophobicContact CG2-CD2 4.17Å; V433-F453 HydrophobicContact CG2-CE2 3.73Å; V433-E456 HydrophobicContact CG1-CB 4.42Å; V433-E456 HydrophobicContact CG1-CG 4.05Å; V433-F457 HydrophobicContact CG2-CE2 4.23Å; V433-F457 HydrophobicContact CG2-CZ 3.82Å
434	S	97.3	Very high	93.6	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.021	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	145.4	164.9	-174.4	0	0	0	0	109.7	E343 V426 T436 F453	E343-S434 WeakPolarHBondContact O-CA 3.38Å; V426-S434 PolarHBondContact O-N 3.02Å; S434-T436 WeakPolarHBondContact CB-O 3.38Å; S434-T436 PolarHBondContact O-N 3.17Å; S434-T436 PolarHBondContact OG-N 3.48Å; S434-F453 VanDerWaalsContact O-CD2 3.26Å; S434-F453 WeakPolarHBondContact O-CD2 3.36Å
435	N	97.7	Very high	93.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	36%	0.358	C	S	.	.	S	Bend	trans	-72.4	-4.5	175	84	-29.4	0	0	0	112.9	I342 E343 E345 N346 A349 R352 L353 F453	I342-N435 HydrophobicContact CG2-CB 4.02Å; E343-N435 PolarHBondContact O-N 3.17Å; E343-N435 PolarHBondContact O-OD1 3.49Å; E345-N435 PolarHBondContact N-OD1 2.69Å; N346-N435 PolarHBondContact N-OD1 3.48Å; N346-N435 PolarHBondContact O-ND2 2.94Å; A349-N435 PolarHBondContact O-ND2 3.17Å; R352-N435 WeakPolarHBondContact CD-O 3.25Å; R352-N435 PolarHBondContact NE-O 2.75Å; R352-N435 PolarHBondContact NH1-O 2.99Å; L353-N435 HydrophobicContact CD2-CB 3.75Å; L353-N435 HydrophobicContact CG-CB 4.46Å; N435-F453 HydrophobicContact CB-CE2 4.21Å
436	T	96.5	Very high	93.6	Very high	30 Å²	30	57.2 Å²	57.2	18%	0.184	37%	0.368	C	S	.	.	S	Bend	trans	-126.5	177.1	168.2	63	0	0	0	0	110.9	N346 A349 S434	N346-T436 HydrophobicContact CB-CG2 3.56Å; A349-T436 HydrophobicContact CB-CG2 4.04Å; S434-T436 WeakPolarHBondContact CB-O 3.38Å; S434-T436 PolarHBondContact O-N 3.17Å; S434-T436 PolarHBondContact OG-N 3.48Å
437	S	94.1	Very high	93.7	Very high	16 Å²	16	57.4 Å²	57.4	11%	0.112	37%	0.369	C	S	.	.			trans	-72.6	149.5	171.8	55.9	0	0	0	0	110.2	C425 F441	C425-S437 CarbonylContact O-C 3.6Å; C425-S437 WeakPolarHBondContact O-CA 3.48Å; S437-F441 PolarHBondContact OG-O 3.34Å
438	K	91.2	Very high	93.9	Very high	64 Å²	64	54.4 Å²	54.4	28%	0.278	36%	0.357	S	S	.	.			trans	-46.7	151	171.1	-69.4	167.9	-178	170.4	0	110.6	E424 C425 K427 L428 A440 F441 A442	E424-K438 WeakPolarHBondContact O-CE 3.27Å; E424-K438 PolarHBondContact O-NZ 3.21Å; C425-K438 WeakPolarHBondContact O-CG 3.1Å; C425-K438 PolarHBondContact O-N 3.13Å; K427-K438 WeakPolarHBondContact O-CE 3.34Å; K427-K438 PolarHBondContact O-NZ 2.77Å; L428-K438 HydrophobicContact CD2-CG 3.82Å; K438-A440 PolarHBondContact O-N 3.45Å; K438-F441 HydrophobicContact CB-CD2 4.1Å; K438-F441 HydrophobicContact CD-CD2 4.41Å; K438-F441 HydrophobicContact CD-CE2 4.26Å; K438-F441 CarbonylContact O-C 3.45Å; K438-F441 PolarHBondContact O-N 3.18Å; K438-A442 PolarHBondContact O-N 2.88Å
439	P	86.8	Confident	94.1	Very high	120 Å²	120	52.5 Å²	52.5	78%	0.779	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-48.6	-36.3	176.4	-30.8	35.8	0	0	0	114.4	F441 A442	P439-F441 PolarHBondContact O-N 2.99Å; P439-F441 VanDerWaalsContact O-N 3.17Å; P439-A442 WeakPolarHBondContact O-CB 3.4Å; P439-A442 PolarHBondContact O-N 3.08Å
440	A	89.5	Confident	94.4	Very high	87 Å²	87	42.5 Å²	42.5	72%	0.719	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-63	-18.5	177.6	0	0	0	0	0	115	K438	K438-A440 PolarHBondContact O-N 3.45Å
441	F	89.5	Confident	94.6	Very high	79 Å²	79	37.9 Å²	37.9	35%	0.346	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-122.9	16.5	-179.7	-53.2	-70.1	0	0	0	112.2	C425 S437 K438 P439 G443 A444	C425-F441 HydrophobicContact CB-CD2 3.95Å; C425-F441 HydrophobicContact CB-CE2 4.49Å; C425-F441 HydrophobicContact CB-CG 4.34Å; S437-F441 PolarHBondContact OG-O 3.34Å; K438-F441 HydrophobicContact CB-CD2 4.1Å; K438-F441 HydrophobicContact CD-CD2 4.41Å; K438-F441 HydrophobicContact CD-CE2 4.26Å; K438-F441 CarbonylContact O-C 3.45Å; K438-F441 PolarHBondContact O-N 3.18Å; P439-F441 PolarHBondContact O-N 2.99Å; P439-F441 VanDerWaalsContact O-N 3.17Å; F441-G443 PolarHBondContact O-N 3.22Å; F441-A444 PolarHBondContact O-N 2.94Å
442	A	86.6	Confident	94.7	Very high	72 Å²	72	37.2 Å²	37.2	60%	0.595	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	132.9	-178.1	0	0	0	0	0	111	K438 P439 A444	K438-A442 PolarHBondContact O-N 2.88Å; P439-A442 WeakPolarHBondContact O-CB 3.4Å; P439-A442 PolarHBondContact O-N 3.08Å; A442-A444 PolarHBondContact O-N 2.88Å
443	G	87.5	Confident	94.7	Very high	86 Å²	86	33.3 Å²	33.3	89%	0.887	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.4	-9.1	179.7	0	0	0	0	0	115.8	F441	F441-G443 PolarHBondContact O-N 3.22Å
444	A	93.8	Very high	94.8	Very high	54 Å²	54	33.2 Å²	33.2	45%	0.446	24%	0.243	S	C	.	.	S	Bend	trans	-92.2	137.7	177	0	0	0	0	0	111.8	F441 A442 G446	F441-A444 PolarHBondContact O-N 2.94Å; A442-A444 PolarHBondContact O-N 2.88Å; A444-G446 VanDerWaalsContact C-N 3.27Å; A444-G446 PolarHBondContact O-N 2.9Å; A444-G446 VanDerWaalsContact O-N 3.11Å
445	A	96.1	Very high	94.8	Very high	45 Å²	45	36.5 Å²	36.5	37%	0.372	26%	0.257	S	S	.	.	S	Bend	trans	49.2	41.1	171.5	0	0	0	0	0	114.9	Y422 A447 C448 T449	Y422-A445 HydrophobicContact CD1-CB 4.14Å; Y422-A445 HydrophobicContact CE1-CB 3.66Å; A445-A447 PolarHBondContact O-N 2.95Å; A445-A447 VanDerWaalsContact O-N 3.12Å; A445-C448 HydrophobicContact CB-CB 4.23Å; A445-C448 PolarHBondContact O-N 3.06Å; A445-T449 PolarHBondContact O-N 2.92Å; A445-T449 PolarHBondContact O-OG1 2.8Å; A445-T449 VanDerWaalsContact O-OG1 3.12Å
446	G	96.9	Very high	94.9	Very high	22 Å²	22	38.4 Å²	38.4	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-53.7	-36.1	-172.5	0	0	0	0	0	114.8	A444 T449 A450	A444-G446 VanDerWaalsContact C-N 3.27Å; A444-G446 PolarHBondContact O-N 2.9Å; A444-G446 VanDerWaalsContact O-N 3.11Å; G446-T449 WeakPolarHBondContact CA-OG1 3.25Å; G446-T449 PolarHBondContact O-OG1 3.41Å; G446-A450 VanDerWaalsContact O-CB 3.27Å; G446-A450 WeakPolarHBondContact O-CB 3.3Å; G446-A450 PolarHBondContact O-N 3.15Å
447	A	98.2	Very high	95	Very high	4 Å²	4	37.1 Å²	37.1	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-43.5	175.9	0	0	0	0	0	112.2	T377 A379 M380 F392 A445 A450 A451	T377-A447 WeakPolarHBondContact OG1-CB 3.49Å; A379-A447 HydrophobicContact CB-CB 4.28Å; M380-A447 HydrophobicContact CB-CB 4.42Å; M380-A447 HydrophobicContact CE-CB 3.63Å; F392-A447 HydrophobicContact CE2-CB 4.43Å; F392-A447 HydrophobicContact CZ-CB 4Å; A445-A447 PolarHBondContact O-N 2.95Å; A445-A447 VanDerWaalsContact O-N 3.12Å; A447-A450 PolarHBondContact O-N 3.24Å; A447-A451 PolarHBondContact O-N 3.37Å
448	C	98.6	Very high	95.2	Very high	9 Å²	9	37.1 Å²	37.1	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-70.9	-36.7	-178.9	-50.7	0	0	0	0	112.1	F392 Y422 A445 A452	F392-C448 HydrophobicContact CE1-CB 4.07Å; Y422-C448 HydrophobicContact CD1-CB 3.67Å; Y422-C448 HydrophobicContact CD2-CB 3.63Å; Y422-C448 HydrophobicContact CE1-CB 3.7Å; Y422-C448 HydrophobicContact CE2-CB 3.66Å; Y422-C448 HydrophobicContact CG-CB 3.63Å; A445-C448 HydrophobicContact CB-CB 4.23Å; A445-C448 PolarHBondContact O-N 3.06Å; C448-A452 VanDerWaalsContact O-CB 3.3Å; C448-A452 WeakPolarHBondContact O-CB 3.36Å; C448-A452 PolarHBondContact O-N 2.79Å
449	T	98	Very high	95.4	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.031	29%	0.285	C	S	.	.	H	α-helix	trans	-70.8	-35.9	175.2	51.8	0	0	0	0	111.6	Y422 C425 A445 G446 A452 F453	Y422-T449 HydrophobicContact CD1-CG2 4.33Å; C425-T449 HydrophobicContact CB-CG2 3.95Å; A445-T449 PolarHBondContact O-N 2.92Å; A445-T449 PolarHBondContact O-OG1 2.8Å; A445-T449 VanDerWaalsContact O-OG1 3.12Å; G446-T449 WeakPolarHBondContact CA-OG1 3.25Å; G446-T449 PolarHBondContact O-OG1 3.41Å; T449-A452 PolarHBondContact O-N 2.77Å; T449-F453 PolarHBondContact O-N 3.27Å
450	A	98.4	Very high	95.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-47	170.7	0	0	0	0	0	112.3	L376 T377 G446 A447 A452 F453 L454	L376-A450 HydrophobicContact CD2-CB 3.74Å; L376-A450 HydrophobicContact CG-CB 4.36Å; T377-A450 HydrophobicContact CG2-CB 3.56Å; G446-A450 VanDerWaalsContact O-CB 3.27Å; G446-A450 WeakPolarHBondContact O-CB 3.3Å; G446-A450 PolarHBondContact O-N 3.15Å; A447-A450 PolarHBondContact O-N 3.24Å; A450-A452 VanDerWaalsContact C-N 3.29Å; A450-A452 PolarHBondContact O-N 2.91Å; A450-F453 WeakPolarHBondContact O-CB 3.3Å; A450-F453 PolarHBondContact O-N 2.8Å; A450-L454 WeakPolarHBondContact O-CG 3.3Å; A450-L454 PolarHBondContact O-N 2.89Å
451	A	98.7	Very high	96.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-37.7	174.7	0	0	0	0	0	112	F392 L418 A447 L454 K455 W463	F392-A451 HydrophobicContact CB-CB 3.98Å; F392-A451 HydrophobicContact CD1-CB 3.54Å; F392-A451 HydrophobicContact CD2-CB 3.75Å; F392-A451 HydrophobicContact CE1-CB 3.83Å; F392-A451 HydrophobicContact CE2-CB 4.02Å; F392-A451 HydrophobicContact CG-CB 3.48Å; F392-A451 VanDerWaalsContact CG-CB 3.48Å; F392-A451 HydrophobicContact CZ-CB 4.06Å; L418-A451 HydrophobicContact CD1-CB 3.95Å; A447-A451 PolarHBondContact O-N 3.37Å; A451-L454 PolarHBondContact O-N 2.77Å; A451-K455 PolarHBondContact O-N 3.45Å; A451-W463 WeakPolarHBondContact O-CH2 3.32Å
452	A	98.1	Very high	96.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-36	175.9	0	0	0	0	0	112.9	Y422 C448 T449 A450 K455	Y422-A452 VanDerWaalsContact C-CB 3.47Å; C448-A452 VanDerWaalsContact O-CB 3.3Å; C448-A452 WeakPolarHBondContact O-CB 3.36Å; C448-A452 PolarHBondContact O-N 2.79Å; T449-A452 PolarHBondContact O-N 2.77Å; A450-A452 VanDerWaalsContact C-N 3.29Å; A450-A452 PolarHBondContact O-N 2.91Å; A452-K455 WeakPolarHBondContact O-CB 3.4Å
453	F	98.4	Very high	97.3	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-50.6	169.8	174.3	-81.3	0	0	0	110.8	I342 R352 L353 A356 V433 S434 N435 T449 A450 K455 E456 F457	I342-F453 HydrophobicContact CD1-CZ 3.93Å; I342-F453 HydrophobicContact CG1-CE2 4.27Å; I342-F453 HydrophobicContact CG1-CZ 4.12Å; I342-F453 HydrophobicContact CG2-CE2 3.8Å; I342-F453 HydrophobicContact CG2-CZ 4Å; R352-F453 HydrophobicContact CB-CD1 3.59Å; R352-F453 HydrophobicContact CB-CE1 3.74Å; R352-F453 HydrophobicContact CB-CG 4.49Å; R352-F453 HydrophobicContact CG-CD1 3.6Å; R352-F453 HydrophobicContact CG-CE1 3.57Å; R352-F453 HydrophobicContact CG-CG 4.2Å; R352-F453 HydrophobicContact CG-CZ 4.11Å; R352-F453 WeakPolarHBondContact O-CE1 3.37Å; L353-F453 HydrophobicContact CD2-CZ 4.11Å; A356-F453 HydrophobicContact CB-CE1 4.19Å; V433-F453 HydrophobicContact CB-CD2 4.35Å; V433-F453 HydrophobicContact CB-CE2 4.35Å; V433-F453 HydrophobicContact CG2-CD2 4.17Å; V433-F453 HydrophobicContact CG2-CE2 3.73Å; S434-F453 VanDerWaalsContact O-CD2 3.26Å; S434-F453 WeakPolarHBondContact O-CD2 3.36Å; N435-F453 HydrophobicContact CB-CE2 4.21Å; T449-F453 PolarHBondContact O-N 3.27Å; A450-F453 WeakPolarHBondContact O-CB 3.3Å; A450-F453 PolarHBondContact O-N 2.8Å; F453-K455 VanDerWaalsContact C-N 3.26Å; F453-K455 PolarHBondContact O-N 2.91Å; F453-E456 WeakPolarHBondContact O-CB 3.4Å; F453-E456 PolarHBondContact O-N 2.7Å; F453-F457 HydrophobicContact CD1-CD2 4.24Å; F453-F457 AromaticContact CD1-CE2 3.89Å; F453-F457 HydrophobicContact CD1-CE2 3.89Å; F453-F457 HydrophobicContact CD2-CE2 4.27Å; F453-F457 AromaticContact CE1-CD2 3.93Å; F453-F457 HydrophobicContact CE1-CD2 3.93Å; F453-F457 AromaticContact CE1-CE2 3.43Å; F453-F457 HydrophobicContact CE1-CE2 3.43Å; F453-F457 VanDerWaalsContact CE1-CE2 3.43Å; F453-F457 HydrophobicContact CE1-CZ 4.28Å; F453-F457 AromaticContact CE2-CE2 3.88Å; F453-F457 HydrophobicContact CE2-CE2 3.88Å; F453-F457 HydrophobicContact CE2-CZ 4.29Å; F453-F457 HydrophobicContact CG-CE2 4.29Å; F453-F457 HydrophobicContact CZ-CD2 4.36Å; F453-F457 AromaticContact CZ-CE2 3.44Å; F453-F457 HydrophobicContact CZ-CE2 3.44Å; F453-F457 VanDerWaalsContact CZ-CE2 3.44Å; F453-F457 AromaticContact CZ-CZ 3.89Å; F453-F457 HydrophobicContact CZ-CZ 3.89Å; F453-F457 VanDerWaalsContact O-CD2 3.23Å; F453-F457 WeakPolarHBondContact O-CD2 3.32Å; F453-F457 WeakPolarHBondContact O-CE2 3.32Å
454	L	98.8	Very high	97.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-37.5	-178.7	-68	179	0	0	0	112.8	R352 L355 L359 L376 A450 A451 E456 F457 W463 H465	R352-L454 HydrophobicContact CB-CD2 3.88Å; R352-L454 HydrophobicContact CB-CG 4.47Å; L355-L454 HydrophobicContact CB-CD2 3.61Å; L355-L454 HydrophobicContact CD1-CD1 4.14Å; L355-L454 HydrophobicContact CD1-CD2 4.02Å; L355-L454 HydrophobicContact CG-CD2 4.49Å; L359-L454 HydrophobicContact CD1-CB 4.08Å; L359-L454 HydrophobicContact CD1-CD2 4.09Å; L376-L454 HydrophobicContact CD2-CD1 3.75Å; L376-L454 HydrophobicContact CD2-CG 4.49Å; A450-L454 WeakPolarHBondContact O-CG 3.3Å; A450-L454 PolarHBondContact O-N 2.89Å; A451-L454 PolarHBondContact O-N 2.77Å; L454-E456 PolarHBondContact O-N 2.67Å; L454-E456 VanDerWaalsContact O-N 3.08Å; L454-F457 PolarHBondContact O-N 3.34Å; L454-W463 HydrophobicContact CB-CH2 4Å; L454-W463 HydrophobicContact CB-CZ2 3.75Å; L454-H465 HydrophobicContact CD1-CB 4.46Å; L454-H465 WeakPolarHBondContact CD1-ND1 3.45Å
455	K	98.2	Very high	98.1	Very high	73 Å²	73	29.3 Å²	29.3	32%	0.317	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-56.1	-25.4	176.9	-169	-174.7	179.6	-179.2	0	113.2	L418 A451 A452 F453 F457 W463	L418-K455 HydrophobicContact CD1-CD 4.39Å; L418-K455 HydrophobicContact CD2-CD 3.96Å; L418-K455 HydrophobicContact CD2-CG 4.5Å; L418-K455 HydrophobicContact CG-CD 4.09Å; A451-K455 PolarHBondContact O-N 3.45Å; A452-K455 WeakPolarHBondContact O-CB 3.4Å; F453-K455 VanDerWaalsContact C-N 3.26Å; F453-K455 PolarHBondContact O-N 2.91Å; K455-F457 PolarHBondContact O-N 3.36Å; K455-W463 HydrophobicContact CB-CH2 3.94Å; K455-W463 HydrophobicContact CB-CZ3 3.64Å; K455-W463 HydrophobicContact CG-CE3 4.42Å; K455-W463 HydrophobicContact CG-CZ3 3.85Å
456	E	98.1	Very high	98.3	Very high	40 Å²	40	27.2 Å²	27.2	19%	0.187	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-74.6	-8.6	179.4	-64.3	-66.9	149.8	0	0	113.4	K340 V433 F453 L454	K340-E456 PolarHBondContact NZ-O 2.94Å; K340-E456 IonicContact NZ-OE2 2.71Å; K340-E456 PolarHBondContact NZ-OE2 3.39Å; V433-E456 HydrophobicContact CG1-CB 4.42Å; V433-E456 HydrophobicContact CG1-CG 4.05Å; F453-E456 WeakPolarHBondContact O-CB 3.4Å; F453-E456 PolarHBondContact O-N 2.7Å; L454-E456 PolarHBondContact O-N 2.67Å; L454-E456 VanDerWaalsContact O-N 3.08Å
457	F	98.7	Very high	98.3	Very high	3 Å²	3	26.1 Å²	26.1	1%	0.013	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-119	12.9	-173.2	-60.6	-80.5	0	0	0	113.9	A336 K340 I342 A356 L359 C360 V433 F453 L454 K455	A336-F457 HydrophobicContact CB-CD1 3.95Å; A336-F457 HydrophobicContact CB-CE1 3.54Å; K340-F457 HydrophobicContact CB-CE1 4.01Å; K340-F457 HydrophobicContact CD-CE1 4.34Å; I342-F457 HydrophobicContact CD1-CE1 3.96Å; I342-F457 HydrophobicContact CD1-CZ 3.64Å; I342-F457 HydrophobicContact CG1-CE1 4.27Å; I342-F457 HydrophobicContact CG1-CZ 3.7Å; A356-F457 HydrophobicContact CB-CB 4.09Å; A356-F457 HydrophobicContact CB-CD1 3.66Å; A356-F457 HydrophobicContact CB-CD2 3.66Å; A356-F457 HydrophobicContact CB-CE1 3.96Å; A356-F457 HydrophobicContact CB-CE2 3.98Å; A356-F457 HydrophobicContact CB-CG 3.5Å; A356-F457 HydrophobicContact CB-CZ 4.12Å; L359-F457 CarbonylContact C-O 3.53Å; L359-F457 HydrophobicContact CB-CB 4.37Å; L359-F457 WeakPolarHBondContact CB-O 3.4Å; C360-F457 PolarHBondContact N-O 2.86Å; C360-F457 PolarHBondContact SG-O 2.78Å; V433-F457 HydrophobicContact CG2-CE2 4.23Å; V433-F457 HydrophobicContact CG2-CZ 3.82Å; F453-F457 HydrophobicContact CD1-CD2 4.24Å; F453-F457 AromaticContact CD1-CE2 3.89Å; F453-F457 HydrophobicContact CD1-CE2 3.89Å; F453-F457 HydrophobicContact CD2-CE2 4.27Å; F453-F457 AromaticContact CE1-CD2 3.93Å; F453-F457 HydrophobicContact CE1-CD2 3.93Å; F453-F457 AromaticContact CE1-CE2 3.43Å; F453-F457 HydrophobicContact CE1-CE2 3.43Å; F453-F457 VanDerWaalsContact CE1-CE2 3.43Å; F453-F457 HydrophobicContact CE1-CZ 4.28Å; F453-F457 AromaticContact CE2-CE2 3.88Å; F453-F457 HydrophobicContact CE2-CE2 3.88Å; F453-F457 HydrophobicContact CE2-CZ 4.29Å; F453-F457 HydrophobicContact CG-CE2 4.29Å; F453-F457 HydrophobicContact CZ-CD2 4.36Å; F453-F457 AromaticContact CZ-CE2 3.44Å; F453-F457 HydrophobicContact CZ-CE2 3.44Å; F453-F457 VanDerWaalsContact CZ-CE2 3.44Å; F453-F457 AromaticContact CZ-CZ 3.89Å; F453-F457 HydrophobicContact CZ-CZ 3.89Å; F453-F457 VanDerWaalsContact O-CD2 3.23Å; F453-F457 WeakPolarHBondContact O-CD2 3.32Å; F453-F457 WeakPolarHBondContact O-CE2 3.32Å; L454-F457 PolarHBondContact O-N 3.34Å; K455-F457 PolarHBondContact O-N 3.36Å
458	T	98.1	Very high	98.4	Very high	16 Å²	16	26 Å²	26	10%	0.098	12%	0.122	C	C	.	.			trans	-138.1	137.3	167.5	-179.2	0	0	0	0	111.3	D363 C460 W463	D363-T458 PolarHBondContact OD1-OG1 2.78Å; D363-T458 WeakPolarHBondContact OD2-CA 3.47Å; D363-T458 PolarHBondContact OD2-OG1 2.83Å; T458-C460 WeakPolarHBondContact OG1-CB 3.31Å; T458-C460 PolarHBondContact OG1-N 2.76Å; T458-C460 VanDerWaalsContact OG1-N 3.12Å; T458-W463 HydrophobicContact CG2-CB 4.16Å; T458-W463 HydrophobicContact CG2-CD2 3.74Å; T458-W463 HydrophobicContact CG2-CE3 4.26Å; T458-W463 HydrophobicContact CG2-CG 3.67Å
459	E	96.7	Very high	98.3	Very high	184 Å²	184	25.7 Å²	25.7	86%	0.86	12%	0.121	S	C	*	.			trans	-96.1	-2.3	171.6	-58.4	-162.1	149.9	0	0	112.2	D363 K461	D363-E459 PolarHBondContact OD2-N 3.05Å; E459-K461 PolarHBondContact O-N 3.12Å
460	C	97.9	Very high	98.2	Very high	13 Å²	13	25.5 Å²	25.5	9%	0.088	12%	0.12	C	C	.	.			trans	-61.3	122.2	179.9	-172.9	0	0	0	0	111	V370 N394 T458 S462 W463	V370-C460 HydrophobicContact CB-CB 4.3Å; V370-C460 HydrophobicContact CG2-CB 3.68Å; N394-C460 PolarHBondContact ND2-O 2.71Å; T458-C460 WeakPolarHBondContact OG1-CB 3.31Å; T458-C460 PolarHBondContact OG1-N 2.76Å; T458-C460 VanDerWaalsContact OG1-N 3.12Å; C460-S462 PolarHBondContact O-N 2.92Å; C460-S462 VanDerWaalsContact O-N 3.17Å; C460-S462 PolarHBondContact SG-N 3.36Å; C460-W463 HydrophobicContact CB-CB 4.44Å
461	K	97.6	Very high	98.1	Very high	188 Å²	188	25.6 Å²	25.6	82%	0.817	12%	0.12	S	C	*	.	S	Bend	trans	-67.1	-14.2	178.3	-64.7	-175.6	-179.8	177.6	0	113.4	N394 E459	N394-K461 PolarHBondContact OD1-O 3.17Å; E459-K461 PolarHBondContact O-N 3.12Å
462	S	98.4	Very high	98	Very high	13 Å²	13	25.6 Å²	25.6	9%	0.091	12%	0.12	C	C	.	.	S	Bend	trans	-129.1	68.5	-177.4	-154	0	0	0	0	110.3	S368 H369 V370 C395 C460	S368-S462 VanDerWaalsContact O-CB 3.27Å; S368-S462 WeakPolarHBondContact O-CB 3.26Å; H369-S462 VanDerWaalsContact CA-O 3.29Å; H369-S462 WeakPolarHBondContact CA-O 3.33Å; H369-S462 PolarHBondContact CE1-OG 2.98Å; H369-S462 WeakPolarHBondContact ND1-CB 3.31Å; H369-S462 PolarHBondContact ND1-OG 3.03Å; V370-S462 PolarHBondContact N-O 3.29Å; C395-S462 PolarHBondContact SG-OG 3.26Å; C460-S462 PolarHBondContact O-N 2.92Å; C460-S462 VanDerWaalsContact O-N 3.17Å; C460-S462 PolarHBondContact SG-N 3.36Å
463	W	98.8	Very high	97.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	143.7	-177.3	168.8	65.5	0	0	0	111.9	V370 D372 S393 N394 L418 A451 L454 K455 T458 C460 H465	V370-W463 CarbonylContact O-C 3.37Å; V370-W463 VanDerWaalsContact O-CA 3.27Å; V370-W463 WeakPolarHBondContact O-CA 3.17Å; D372-W463 PolarHBondContact OD2-NE1 2.89Å; S393-W463 WeakPolarHBondContact CA-O 3.29Å; S393-W463 WeakPolarHBondContact CB-O 3.47Å; S393-W463 PolarHBondContact OG-O 3.32Å; N394-W463 PolarHBondContact N-O 2.98Å; N394-W463 PolarHBondContact OD1-N 3.3Å; N394-W463 PolarHBondContact OD1-O 2.93Å; N394-W463 VanDerWaalsContact OD1-O 3.06Å; L418-W463 HydrophobicContact CD1-CH2 4.35Å; L418-W463 HydrophobicContact CD1-CZ3 4.02Å; L418-W463 HydrophobicContact CD2-CE3 4.26Å; L418-W463 HydrophobicContact CD2-CZ3 3.73Å; A451-W463 WeakPolarHBondContact O-CH2 3.32Å; L454-W463 HydrophobicContact CB-CH2 4Å; L454-W463 HydrophobicContact CB-CZ2 3.75Å; K455-W463 HydrophobicContact CB-CH2 3.94Å; K455-W463 HydrophobicContact CB-CZ3 3.64Å; K455-W463 HydrophobicContact CG-CE3 4.42Å; K455-W463 HydrophobicContact CG-CZ3 3.85Å; T458-W463 HydrophobicContact CG2-CB 4.16Å; T458-W463 HydrophobicContact CG2-CD2 3.74Å; T458-W463 HydrophobicContact CG2-CE3 4.26Å; T458-W463 HydrophobicContact CG2-CG 3.67Å; C460-W463 HydrophobicContact CB-CB 4.44Å; W463-H465 HydrophobicContact CH2-CB 4.08Å; W463-H465 HydrophobicContact CZ2-CB 3.58Å
464	M	98.9	Very high	97.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	127.6	175.4	180	179	-75.3	0	0	110.9	V370 I371 D372 V391 F392 L398 W399 M402 V466	V370-M464 PolarHBondContact O-N 3.01Å; I371-M464 CarbonylContact C-O 3.13Å; I371-M464 WeakPolarHBondContact CA-O 3.21Å; D372-M464 PolarHBondContact N-O 3.19Å; V391-M464 HydrophobicContact CG1-CE 3.76Å; V391-M464 HydrophobicContact CG1-CG 3.46Å; V391-M464 VanDerWaalsContact CG1-CG 3.46Å; V391-M464 HydrophobicContact CG1-SD 3.47Å; V391-M464 WeakPolarHBondContact CG1-SD 3.29Å; F392-M464 CarbonylContact O-C 3.54Å; F392-M464 VanDerWaalsContact O-CA 3.3Å; F392-M464 WeakPolarHBondContact O-CA 3.44Å; L398-M464 HydrophobicContact CB-CE 4.31Å; L398-M464 HydrophobicContact CD2-CB 3.69Å; L398-M464 HydrophobicContact CD2-CE 4.39Å; L398-M464 HydrophobicContact CG-CB 4.29Å; L398-M464 HydrophobicContact CG-CE 3.74Å; L398-M464 HydrophobicContact CG-SD 4.48Å; L398-M464 WeakPolarHBondContact O-CE 3.25Å; W399-M464 VanDerWaalsContact CA-CE 3.47Å; W399-M464 HydrophobicContact CB-CE 4.27Å; M402-M464 HydrophobicContact CB-CE 3.74Å; M402-M464 HydrophobicContact CB-SD 3.9Å; M402-M464 HydrophobicContact CE-SD 3.31Å; M402-M464 WeakPolarHBondContact CE-SD 3.35Å; M402-M464 HydrophobicContact CG-CE 4.28Å; M402-M464 HydrophobicContact CG-SD 3.84Å; M402-M464 HydrophobicContact SD-SD 4.44Å; M464-V466 HydrophobicContact CG-CG2 4.02Å; M464-V466 HydrophobicContact SD-CG2 4.17Å
465	H	98.9	Very high	96.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.7	168.5	170.1	57	0	0	0	110.5	D372 L376 V391 F392 L454 W463	D372-H465 IonicContact OD1-CE1 3.58Å; D372-H465 IonicContact OD1-CG 2.97Å; D372-H465 IonicContact OD1-ND1 3.9Å; D372-H465 PolarHBondContact OD1-ND1 3.13Å; D372-H465 WeakPolarHBondContact OD2-CA 3.47Å; D372-H465 WeakPolarHBondContact OD2-CB 3.36Å; D372-H465 IonicContact OD2-CG 3.26Å; D372-H465 IonicContact OD2-ND1 2.73Å; L376-H465 WeakPolarHBondContact CD2-NE2 3.3Å; V391-H465 CarbonylContact C-O 3.53Å; V391-H465 WeakPolarHBondContact CA-O 3.27Å; F392-H465 HydrophobicContact CB-CB 4.31Å; F392-H465 AromaticContact CD2-CD2 3.62Å; F392-H465 PolarHBondContact N-O 2.78Å; F392-H465 PolarHBondContact O-N 2.8Å; L454-H465 HydrophobicContact CD1-CB 4.46Å; L454-H465 WeakPolarHBondContact CD1-ND1 3.45Å; W463-H465 HydrophobicContact CH2-CB 4.08Å; W463-H465 HydrophobicContact CZ2-CB 3.58Å
466	V	98.9	Very high	95.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	98.5	-177.5	-172.8	0	0	0	0	108.7	I371 D372 I373 A374 T389 V391 M402 M464 I468 P489	I371-V466 HydrophobicContact CG2-CG2 3.91Å; D372-V466 WeakPolarHBondContact O-CB 3.14Å; D372-V466 PolarHBondContact O-N 3.07Å; I373-V466 HydrophobicContact CG1-CB 4.32Å; A374-V466 PolarHBondContact N-O 3.27Å; T389-V466 HydrophobicContact CG2-CG1 3.35Å; V391-V466 HydrophobicContact CG2-CG1 4.3Å; V391-V466 HydrophobicContact CG2-CG2 4.46Å; M402-V466 HydrophobicContact CE-CG2 4.17Å; M464-V466 HydrophobicContact CG-CG2 4.02Å; M464-V466 HydrophobicContact SD-CG2 4.17Å; V466-I468 HydrophobicContact CG1-CG2 3.76Å; V466-I468 PolarHBondContact O-N 2.73Å; V466-P489 HydrophobicContact CG1-CG 4.25Å
467	D	98.9	Very high	93.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.4	176.7	-167.9	-19.3	0	0	0	109.9	A374 L376 T377 M380 G390 A469	A374-D467 CarbonylContact O-C 3.55Å; A374-D467 WeakPolarHBondContact O-CA 3.01Å; L376-D467 PolarHBondContact N-OD1 3Å; T377-D467 PolarHBondContact N-OD2 2.73Å; T377-D467 PolarHBondContact OG1-OD2 3.2Å; M380-D467 HydrophobicContact CB-CB 4.35Å; M380-D467 WeakPolarHBondContact CB-OD2 3.38Å; M380-D467 HydrophobicContact CE-CB 3.71Å; M380-D467 HydrophobicContact CG-CB 4.03Å; G390-D467 PolarHBondContact N-O 2.97Å; G390-D467 PolarHBondContact O-N 2.96Å; D467-A469 VanDerWaalsContact OD1-CB 3.24Å; D467-A469 WeakPolarHBondContact OD1-CB 3Å; D467-A469 PolarHBondContact OD1-N 3.07Å
468	I	98.7	Very high	92	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.			trans	-98.1	4.1	-174.9	64.4	162.9	0	0	0	112.8	T289 I373 A374 T375 T389 V466 G470 V471 T472 P489	T289-I468 HydrophobicContact CG2-CD1 3.54Å; I373-I468 HydrophobicContact CG2-CD1 3.96Å; I373-I468 HydrophobicContact CG2-CG1 4.29Å; I373-I468 HydrophobicContact CG2-CG2 3.83Å; A374-I468 VanDerWaalsContact C-CG1 3.45Å; A374-I468 WeakPolarHBondContact O-CG1 3.38Å; A374-I468 PolarHBondContact O-N 3.12Å; T375-I468 HydrophobicContact CG2-CD1 4.05Å; T375-I468 HydrophobicContact CG2-CG1 3.82Å; T389-I468 HydrophobicContact CG2-CG2 3.82Å; V466-I468 HydrophobicContact CG1-CG2 3.76Å; V466-I468 PolarHBondContact O-N 2.73Å; I468-G470 PolarHBondContact O-N 2.98Å; I468-G470 VanDerWaalsContact O-N 3.09Å; I468-V471 HydrophobicContact CB-CG2 3.93Å; I468-V471 HydrophobicContact CG2-CG2 4.45Å; I468-V471 WeakPolarHBondContact O-CG2 3.42Å; I468-V471 PolarHBondContact O-N 3.48Å; I468-T472 PolarHBondContact O-N 3.17Å; I468-T472 VanDerWaalsContact O-N 3.08Å; I468-T472 PolarHBondContact O-OG1 2.85Å; I468-T472 VanDerWaalsContact O-OG1 3.1Å; I468-P489 HydrophobicContact CG2-CG 4.13Å
469	A	97.3	Very high	90.7	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.033	22%	0.216	C	C	.	.	H	α-helix	trans	-54	-36.9	-177.3	0	0	0	0	0	112.3	T377 K381 D467	T377-A469 WeakPolarHBondContact O-CB 3.46Å; K381-A469 WeakPolarHBondContact CE-O 3.47Å; K381-A469 HydrophobicContact CG-CB 4.3Å; K381-A469 WeakPolarHBondContact CG-O 3.32Å; D467-A469 VanDerWaalsContact OD1-CB 3.24Å; D467-A469 WeakPolarHBondContact OD1-CB 3Å; D467-A469 PolarHBondContact OD1-N 3.07Å
470	G	95.6	Very high	90.2	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-41.1	174.5	0	0	0	0	0	114.3	G385 Y386 I468	G385-G470 CarbonylContact O-C 3.55Å; G385-G470 WeakPolarHBondContact O-CA 3.27Å; Y386-G470 WeakPolarHBondContact CA-O 3.47Å; Y386-G470 WeakPolarHBondContact CD1-O 3.37Å; I468-G470 PolarHBondContact O-N 2.98Å; I468-G470 VanDerWaalsContact O-N 3.09Å
471	V	96.2	Very high	89.7	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-103.6	-13.8	-165.6	-63.3	0	0	0	0	114.4	V388 T389 I468 E473 T486 R488	V388-V471 WeakPolarHBondContact O-CG1 3.21Å; T389-V471 WeakPolarHBondContact OG1-CG2 3.31Å; I468-V471 HydrophobicContact CB-CG2 3.93Å; I468-V471 HydrophobicContact CG2-CG2 4.45Å; I468-V471 WeakPolarHBondContact O-CG2 3.42Å; I468-V471 PolarHBondContact O-N 3.48Å; V471-E473 PolarHBondContact O-N 2.95Å; V471-T486 WeakPolarHBondContact O-CG2 3.43Å; V471-T486 PolarHBondContact O-OG1 3.35Å; V471-R488 HydrophobicContact CB-CB 4.09Å; V471-R488 HydrophobicContact CG2-CB 3.88Å
472	T	96.1	Very high	89.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-44.1	-178.7	-65.9	0	0	0	0	112.6	F286 T289 T375 I468 M485 T486	F286-T472 HydrophobicContact CB-CG2 3.79Å; F286-T472 HydrophobicContact CD1-CG2 4.36Å; F286-T472 HydrophobicContact CD2-CG2 3.97Å; F286-T472 HydrophobicContact CG-CG2 3.8Å; T289-T472 HydrophobicContact CG2-CG2 4.05Å; T289-T472 VanDerWaalsContact OG1-CG2 3.28Å; T289-T472 WeakPolarHBondContact OG1-CG2 3.34Å; T375-T472 HydrophobicContact CG2-CG2 4.17Å; T375-T472 WeakPolarHBondContact CG2-OG1 3.18Å; I468-T472 PolarHBondContact O-N 3.17Å; I468-T472 VanDerWaalsContact O-N 3.08Å; I468-T472 PolarHBondContact O-OG1 2.85Å; I468-T472 VanDerWaalsContact O-OG1 3.1Å; T472-M485 HydrophobicContact CG2-SD 4.23Å; T472-M485 CarbonylContact O-C 3.45Å; T472-M485 VanDerWaalsContact O-CA 3.29Å; T472-M485 WeakPolarHBondContact O-CA 3.36Å; T472-T486 PolarHBondContact O-N 3.19Å; T472-T486 PolarHBondContact O-OG1 3.4Å
473	E	93.6	Very high	88.4	Confident	18 Å²	18	26.8 Å²	26.8	8%	0.084	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-81.8	137.6	178.9	-68.9	179.8	-110.8	0	0	111.9	L283 F286 K381 V471 K475 M485	L283-E473 WeakPolarHBondContact CD1-OE2 3.46Å; F286-E473 HydrophobicContact CD1-CG 3.94Å; F286-E473 HydrophobicContact CE1-CG 3.49Å; F286-E473 VanDerWaalsContact CE1-CG 3.49Å; F286-E473 WeakPolarHBondContact CE1-OE1 3.26Å; F286-E473 HydrophobicContact CZ-CG 4.23Å; K381-E473 IonicContact NZ-OE1 3.14Å; K381-E473 PolarHBondContact NZ-OE1 2.79Å; V471-E473 PolarHBondContact O-N 2.95Å; E473-K475 HydrophobicContact CB-CG 4.21Å; E473-K475 PolarHBondContact O-N 3.4Å; E473-K475 VanDerWaalsContact O-N 3.15Å; E473-K475 WeakPolarHBondContact OE2-CE 3.42Å; E473-K475 IonicContact OE2-NZ 2.84Å; E473-M485 HydrophobicContact CG-SD 4.43Å
474	N	90	Very high	88.1	Confident	38 Å²	38	29.4 Å²	29.4	20%	0.203	17%	0.172	C	C	.	.			trans	-82	90.3	173.9	-173.2	17.9	0	0	0	110.6	C476 F481 S483 S484 T486	N474-C476 PolarHBondContact OD1-O 2.93Å; N474-C476 VanDerWaalsContact OD1-O 3.06Å; N474-F481 HydrophobicContact CB-CB 4.49Å; N474-F481 WeakPolarHBondContact ND2-CB 3.34Å; N474-F481 PolarHBondContact ND2-O 2.82Å; N474-S483 WeakPolarHBondContact CB-O 3.43Å; N474-S483 PolarHBondContact ND2-O 2.81Å; N474-S484 WeakPolarHBondContact CB-O 3.46Å; N474-S484 PolarHBondContact N-O 2.74Å; N474-T486 HydrophobicContact CB-CG2 3.76Å
475	K	84.2	Confident	88	Confident	112 Å²	112	29.4 Å²	29.4	49%	0.487	17%	0.172	S	C	.	.			trans	-111.4	-28.1	177.3	-64.2	-67.9	-171.3	178.7	0	114.1	Y386 E473	Y386-K475 HydrophobicContact CD1-CB 3.68Å; Y386-K475 HydrophobicContact CD1-CG 3.75Å; Y386-K475 HydrophobicContact CD2-CB 3.72Å; Y386-K475 HydrophobicContact CD2-CG 4.42Å; Y386-K475 HydrophobicContact CE1-CB 3.76Å; Y386-K475 HydrophobicContact CE1-CG 3.4Å; Y386-K475 VanDerWaalsContact CE1-CG 3.4Å; Y386-K475 HydrophobicContact CE2-CB 3.74Å; Y386-K475 HydrophobicContact CE2-CG 4.08Å; Y386-K475 HydrophobicContact CG-CB 3.71Å; Y386-K475 HydrophobicContact CG-CG 4.29Å; E473-K475 HydrophobicContact CB-CG 4.21Å; E473-K475 PolarHBondContact O-N 3.4Å; E473-K475 VanDerWaalsContact O-N 3.15Å; E473-K475 WeakPolarHBondContact OE2-CE 3.42Å; E473-K475 IonicContact OE2-NZ 2.84Å
476	C	67.1	Low	87.8	Confident	53 Å²	53	29.5 Å²	29.5	36%	0.358	17%	0.173	S	C	.	.	S	Bend	trans	-79.4	119.8	167.9	-67.9	0	0	0	0	106.7	N474 Q478	N474-C476 PolarHBondContact OD1-O 2.93Å; N474-C476 VanDerWaalsContact OD1-O 3.06Å; C476-Q478 HydrophobicContact CB-CG 3.99Å; C476-Q478 PolarHBondContact O-N 3.07Å
477	S	63.5	Low	87.7	Confident	128 Å²	128	29.5 Å²	29.5	90%	0.895	17%	0.173	S	C	*	.			trans	-63.2	62.6	177.6	-51	0	0	0	0	112.5
478	Q	67.1	Low	87.7	Confident	51 Å²	51	30 Å²	30	24%	0.238	18%	0.175	C	C	.	.			trans	-77.5	132.2	-179.5	-67.9	-155.9	-8.3	0	0	108.6	C476 L480 F481	C476-Q478 HydrophobicContact CB-CG 3.99Å; C476-Q478 PolarHBondContact O-N 3.07Å; Q478-L480 PolarHBondContact O-N 3.47Å; Q478-F481 HydrophobicContact CB-CD2 4.04Å; Q478-F481 PolarHBondContact O-N 3.21Å; Q478-F481 VanDerWaalsContact O-N 3.12Å; Q478-F481 VanDerWaalsContact OE1-CE2 3.28Å
479	P	70.6	Confident	87.7	Confident	55 Å²	55	30 Å²	30	36%	0.357	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-22.1	178.8	-23.7	32.1	0	0	0	113.9	A103	A103-P479 HydrophobicContact CB-CB 4.31Å
480	L	86.8	Confident	87.7	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.016	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-27.1	-177.1	-62.5	172.8	0	0	0	113.7	R99 A103 L134 S135 Q478	R99-L480 HydrophobicContact CB-CD1 4.28Å; R99-L480 HydrophobicContact CB-CD2 3.94Å; A103-L480 HydrophobicContact CB-CD2 3.86Å; L134-L480 CarbonylContact C-O 3.57Å; L134-L480 VanDerWaalsContact O-O 3.11Å; S135-L480 WeakPolarHBondContact CA-O 3.49Å; S135-L480 PolarHBondContact N-O 2.72Å; Q478-L480 PolarHBondContact O-N 3.47Å
481	F	87.3	Confident	87.9	Confident	12 Å²	12	30.1 Å²	30.1	5%	0.053	17%	0.174	C	C	.	.			trans	-121.6	122.7	-171.8	-49.8	-53.4	0	0	0	110	L134 N474 Q478 T486 R488	L134-F481 HydrophobicContact CD1-CE1 4.43Å; N474-F481 HydrophobicContact CB-CB 4.49Å; N474-F481 WeakPolarHBondContact ND2-CB 3.34Å; N474-F481 PolarHBondContact ND2-O 2.82Å; Q478-F481 HydrophobicContact CB-CD2 4.04Å; Q478-F481 PolarHBondContact O-N 3.21Å; Q478-F481 VanDerWaalsContact O-N 3.12Å; Q478-F481 VanDerWaalsContact OE1-CE2 3.28Å; F481-T486 HydrophobicContact CD2-CG2 4.02Å; F481-T486 HydrophobicContact CE2-CG2 4.48Å; F481-T486 HydrophobicContact CG-CG2 4.26Å; F481-R488 HydrophobicContact CE2-CG 4.39Å; F481-R488 HydrophobicContact CZ-CG 4.1Å
482	N	83.8	Confident	88	Confident	72 Å²	72	30 Å²	30	39%	0.385	17%	0.173	S	C	.	.			trans	-127.1	7.9	-174.5	63.5	-2	0	0	0	112.9	S135 F137 R184	S135-N482 PolarHBondContact O-ND2 3.39Å; F137-N482 PolarHBondContact O-ND2 2.84Å; F137-N482 PolarHBondContact O-OD1 3.39Å; R184-N482 PolarHBondContact NH2-OD1 3.33Å
483	S	85.2	Confident	88.1	Confident	15 Å²	15	30.1 Å²	30.1	11%	0.105	17%	0.174	C	C	.	.	S	Bend	trans	-112.3	174.9	171.7	63.5	0	0	0	0	109.9	R184 D188 N474 M485	R184-S483 PolarHBondContact NE-OG 3.48Å; R184-S483 VanDerWaalsContact NE-OG 3.17Å; R184-S483 PolarHBondContact NH2-OG 3.21Å; D188-S483 VanDerWaalsContact OD2-CB 3.25Å; D188-S483 WeakPolarHBondContact OD2-CB 3.26Å; D188-S483 PolarHBondContact OD2-OG 3.17Å; N474-S483 WeakPolarHBondContact CB-O 3.43Å; N474-S483 PolarHBondContact ND2-O 2.81Å; S483-M485 VanDerWaalsContact C-N 3.34Å; S483-M485 PolarHBondContact OG-O 3.08Å
484	S	91.9	Very high	88.3	Confident	54 Å²	54	29.3 Å²	29.3	38%	0.378	17%	0.17	S	C	.	.	S	Bend	trans	-69.8	-34.3	-179.2	-16.6	0	0	0	0	111.8	D188 N474	D188-S484 WeakPolarHBondContact OD1-CB 3.39Å; D188-S484 PolarHBondContact OD1-OG 3.35Å; D188-S484 PolarHBondContact OD2-N 2.67Å; N474-S484 WeakPolarHBondContact CB-O 3.46Å; N474-S484 PolarHBondContact N-O 2.74Å
485	M	95.5	Very high	88.7	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-105.4	145.1	179.3	-48.1	-49.4	163.8	0	0	111.9	R184 D188 L283 F286 T472 E473 S483	R184-M485 WeakPolarHBondContact CG-O 3.48Å; R184-M485 PolarHBondContact NE-O 3.12Å; D188-M485 HydrophobicContact CB-CG 4.31Å; D188-M485 PolarHBondContact OD2-N 2.92Å; L283-M485 HydrophobicContact CD2-CE 4.22Å; F286-M485 HydrophobicContact CB-CE 3.83Å; F286-M485 HydrophobicContact CB-CG 4.31Å; F286-M485 HydrophobicContact CB-SD 3.71Å; F286-M485 HydrophobicContact CD1-CE 3.63Å; F286-M485 HydrophobicContact CD1-SD 3.68Å; F286-M485 HydrophobicContact CG-CE 4.23Å; F286-M485 HydrophobicContact CG-SD 4.09Å; T472-M485 HydrophobicContact CG2-SD 4.23Å; T472-M485 CarbonylContact O-C 3.45Å; T472-M485 VanDerWaalsContact O-CA 3.29Å; T472-M485 WeakPolarHBondContact O-CA 3.36Å; E473-M485 HydrophobicContact CG-SD 4.43Å; S483-M485 VanDerWaalsContact C-N 3.34Å; S483-M485 PolarHBondContact OG-O 3.08Å
486	T	96.4	Very high	89.4	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.018	14%	0.142	C	C	.	.			trans	-96.3	-22.5	-175.2	67.6	0	0	0	0	113.4	Q180 R184 V471 T472 N474 F481 R488	Q180-T486 PolarHBondContact NE2-O 2.77Å; R184-T486 WeakPolarHBondContact CD-O 3.42Å; R184-T486 VanDerWaalsContact CG-O 3.29Å; R184-T486 WeakPolarHBondContact CG-O 3.36Å; V471-T486 WeakPolarHBondContact O-CG2 3.43Å; V471-T486 PolarHBondContact O-OG1 3.35Å; T472-T486 PolarHBondContact O-N 3.19Å; T472-T486 PolarHBondContact O-OG1 3.4Å; N474-T486 HydrophobicContact CB-CG2 3.76Å; F481-T486 HydrophobicContact CD2-CG2 4.02Å; F481-T486 HydrophobicContact CE2-CG2 4.48Å; F481-T486 HydrophobicContact CG-CG2 4.26Å; T486-R488 PolarHBondContact O-N 2.87Å; T486-R488 WeakPolarHBondContact OG1-CB 3.45Å; T486-R488 WeakPolarHBondContact OG1-CD 3.2Å; T486-R488 VanDerWaalsContact OG1-CG 3.23Å; T486-R488 WeakPolarHBondContact OG1-CG 3.5Å; T486-R488 PolarHBondContact OG1-N 3.36Å
487	G	97.1	Very high	90.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.125	C	C	.	.			trans	65.2	17.1	-174.2	0	0	0	0	0	114.5	L490	G487-L490 WeakPolarHBondContact O-CB 3.45Å; G487-L490 PolarHBondContact O-N 2.82Å
488	R	97.9	Very high	92.4	Very high	11 Å²	11	16.4 Å²	16.4	4%	0.042	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	149.6	178.9	-62.5	173.4	63.3	-166.6	-2	110.9	Y386 G387 D411 V471 F481 T486	Y386-R488 PolarHBondContact O-NH1 2.98Å; G387-R488 PolarHBondContact O-NH2 3.15Å; D411-R488 IonicContact OD1-CZ 3.18Å; D411-R488 VanDerWaalsContact OD1-CZ 3.26Å; D411-R488 IonicContact OD1-NE 2.72Å; D411-R488 PolarHBondContact OD1-NE 3.4Å; D411-R488 IonicContact OD1-NH2 2.8Å; D411-R488 PolarHBondContact OD1-NH2 2.69Å; D411-R488 WeakPolarHBondContact OD2-CB 3.5Å; D411-R488 WeakPolarHBondContact OD2-CG 3.14Å; D411-R488 IonicContact OD2-NE 2.68Å; V471-R488 HydrophobicContact CB-CB 4.09Å; V471-R488 HydrophobicContact CG2-CB 3.88Å; F481-R488 HydrophobicContact CE2-CG 4.39Å; F481-R488 HydrophobicContact CZ-CG 4.1Å; T486-R488 PolarHBondContact O-N 2.87Å; T486-R488 WeakPolarHBondContact OG1-CB 3.45Å; T486-R488 WeakPolarHBondContact OG1-CD 3.2Å; T486-R488 VanDerWaalsContact OG1-CG 3.23Å; T486-R488 WeakPolarHBondContact OG1-CG 3.5Å; T486-R488 PolarHBondContact OG1-N 3.36Å
489	P	97.9	Very high	93.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	cis	-104.8	48.9	2.3	40.1	-36.2	0	0	0	113.5	T389 D411 V466 I468 R491 T492 L493	T389-P489 HydrophobicContact CG2-CG 4.23Å; D411-P489 VanDerWaalsContact OD2-CA 3.27Å; D411-P489 WeakPolarHBondContact OD2-CA 3.33Å; V466-P489 HydrophobicContact CG1-CG 4.25Å; I468-P489 HydrophobicContact CG2-CG 4.13Å; P489-R491 VanDerWaalsContact C-N 3.31Å; P489-R491 PolarHBondContact O-N 2.67Å; P489-R491 VanDerWaalsContact O-N 3.1Å; P489-T492 WeakPolarHBondContact O-CB 3.44Å; P489-T492 PolarHBondContact O-N 3.36Å; P489-L493 HydrophobicContact CG-CD1 4.26Å; P489-L493 HydrophobicContact CG-CG 4.14Å; P489-L493 PolarHBondContact O-N 2.84Å
490	L	98.6	Very high	94.8	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-49.1	-47.4	-168	-176.5	75.4	0	0	0	114.3	C179 Q180 V183 C293 C297 G487 T492 L493 V494	C179-L490 HydrophobicContact CB-CD2 3.5Å; C179-L490 VanDerWaalsContact O-CD2 3.3Å; C179-L490 WeakPolarHBondContact O-CD2 3.27Å; Q180-L490 HydrophobicContact CB-CB 4.25Å; Q180-L490 HydrophobicContact CB-CD2 3.94Å; Q180-L490 HydrophobicContact CG-CB 4.4Å; V183-L490 HydrophobicContact CG2-CB 4.35Å; V183-L490 HydrophobicContact CG2-CD1 4.02Å; V183-L490 HydrophobicContact CG2-CD2 3.92Å; V183-L490 HydrophobicContact CG2-CG 4.31Å; C293-L490 WeakPolarHBondContact O-CD1 3.3Å; C297-L490 HydrophobicContact CB-CD1 4.41Å; C297-L490 VanDerWaalsContact SG-CD1 3.53Å; G487-L490 WeakPolarHBondContact O-CB 3.45Å; G487-L490 PolarHBondContact O-N 2.82Å; L490-T492 VanDerWaalsContact C-N 3.29Å; L490-T492 PolarHBondContact O-N 3.09Å; L490-L493 WeakPolarHBondContact O-CB 3.5Å; L490-L493 PolarHBondContact O-N 3.48Å; L490-L493 VanDerWaalsContact O-N 3.12Å; L490-V494 HydrophobicContact CD1-CG2 4.49Å; L490-V494 HydrophobicContact CG-CG2 4.41Å; L490-V494 WeakPolarHBondContact O-CG2 3.31Å; L490-V494 PolarHBondContact O-N 2.91Å
491	R	98.4	Very high	95.2	Very high	5 Å²	5	15.4 Å²	15.4	2%	0.019	8%	0.084	C	C	.	.	H	α-helix	trans	-63.6	-38	-175.7	-60.2	-178.4	-64	109.6	8.1	111.5	E130 L176 Q180 T409 P489 Q495	E130-R491 VanDerWaalsContact CD-NH1 3.28Å; E130-R491 WeakPolarHBondContact OE1-CD 3.36Å; E130-R491 IonicContact OE1-CZ 3.83Å; E130-R491 IonicContact OE1-NH1 2.75Å; E130-R491 PolarHBondContact OE1-NH1 2.89Å; E130-R491 IonicContact OE2-NH1 3.89Å; E130-R491 PolarHBondContact OE2-NH1 3.4Å; L176-R491 HydrophobicContact CB-CG 4.11Å; Q180-R491 HydrophobicContact CB-CG 4.49Å; Q180-R491 VanDerWaalsContact OE1-CG 3.26Å; T409-R491 HydrophobicContact CG2-CB 4.09Å; T409-R491 VanDerWaalsContact O-CZ 3.3Å; T409-R491 PolarHBondContact O-NH1 2.8Å; T409-R491 PolarHBondContact O-NH2 2.91Å; P489-R491 VanDerWaalsContact C-N 3.31Å; P489-R491 PolarHBondContact O-N 2.67Å; P489-R491 VanDerWaalsContact O-N 3.1Å; R491-Q495 VanDerWaalsContact O-CB 3.32Å; R491-Q495 WeakPolarHBondContact O-CB 3.41Å; R491-Q495 PolarHBondContact O-N 3.47Å
492	T	98.6	Very high	95.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-41.4	173.2	-63.3	0	0	0	0	112	M402 A405 T409 D411 V413 P489 L490 Q495 C496	M402-T492 HydrophobicContact CG-CG2 4.48Å; M402-T492 HydrophobicContact SD-CG2 3.68Å; A405-T492 HydrophobicContact CB-CG2 3.98Å; A405-T492 WeakPolarHBondContact CB-O 3.37Å; T409-T492 PolarHBondContact OG1-OG1 3.42Å; D411-T492 WeakPolarHBondContact CB-OG1 3.46Å; D411-T492 PolarHBondContact O-OG1 3.33Å; V413-T492 HydrophobicContact CG1-CG2 4.03Å; P489-T492 WeakPolarHBondContact O-CB 3.44Å; P489-T492 PolarHBondContact O-N 3.36Å; L490-T492 VanDerWaalsContact C-N 3.29Å; L490-T492 PolarHBondContact O-N 3.09Å; T492-Q495 PolarHBondContact O-N 2.96Å; T492-C496 VanDerWaalsContact O-CB 3.23Å; T492-C496 WeakPolarHBondContact O-CB 3.37Å; T492-C496 PolarHBondContact O-N 3.36Å
493	L	98.7	Very high	96.3	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.01	7%	0.069	C	C	.	.	H	α-helix	trans	-62.4	-46	177.3	-64.9	169.2	0	0	0	111.6	C293 C297 I371 I373 M402 P489 L490 C496 L497	C293-L493 HydrophobicContact CB-CD1 3.88Å; C297-L493 WeakPolarHBondContact SG-CB 3.32Å; I371-L493 HydrophobicContact CG2-CD2 4.44Å; I373-L493 HydrophobicContact CD1-CD1 3.59Å; I373-L493 HydrophobicContact CD1-CD2 4.19Å; I373-L493 HydrophobicContact CG1-CD1 4.04Å; I373-L493 HydrophobicContact CG1-CD2 4.16Å; I373-L493 HydrophobicContact CG2-CD1 4.44Å; M402-L493 HydrophobicContact CE-CD2 3.71Å; M402-L493 HydrophobicContact SD-CD2 4.22Å; P489-L493 HydrophobicContact CG-CD1 4.26Å; P489-L493 HydrophobicContact CG-CG 4.14Å; P489-L493 PolarHBondContact O-N 2.84Å; L490-L493 WeakPolarHBondContact O-CB 3.5Å; L490-L493 PolarHBondContact O-N 3.48Å; L490-L493 VanDerWaalsContact O-N 3.12Å; L493-C496 PolarHBondContact O-N 3.33Å; L493-L497 WeakPolarHBondContact O-CG 3.5Å; L493-L497 PolarHBondContact O-N 2.87Å; L493-L497 VanDerWaalsContact O-N 3.07Å
494	V	98.4	Very high	97	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.2	-48	176.9	177.6	0	0	0	0	110.9	L176 C297 A300 L301 L304 L490 C496 L497 E498	L176-V494 HydrophobicContact CD2-CB 3.94Å; L176-V494 HydrophobicContact CD2-CG1 3.63Å; L176-V494 HydrophobicContact CD2-CG2 4.33Å; C297-V494 HydrophobicContact CB-CG2 4.35Å; A300-V494 HydrophobicContact CB-CG1 4.15Å; A300-V494 HydrophobicContact CB-CG2 3.7Å; L301-V494 HydrophobicContact CD2-CG1 4.09Å; L304-V494 HydrophobicContact CD1-CG1 4.32Å; L490-V494 HydrophobicContact CD1-CG2 4.49Å; L490-V494 HydrophobicContact CG-CG2 4.41Å; L490-V494 WeakPolarHBondContact O-CG2 3.31Å; L490-V494 PolarHBondContact O-N 2.91Å; V494-C496 VanDerWaalsContact C-N 3.3Å; V494-C496 PolarHBondContact O-N 3.22Å; V494-L497 PolarHBondContact O-N 2.78Å; V494-E498 WeakPolarHBondContact O-CG 3.38Å; V494-E498 PolarHBondContact O-N 3.48Å; V494-E498 VanDerWaalsContact O-N 3.09Å
495	Q	97.9	Very high	97.3	Very high	22 Å²	22	9.6 Å²	9.6	10%	0.103	5%	0.047	C	C	.	.	H	α-helix	trans	-63.8	-35.5	178.7	-174.9	65.2	64.1	0	0	112.2	A405 T409 R491 T492 E498 N499	A405-Q495 HydrophobicContact CB-CB 3.84Å; A405-Q495 HydrophobicContact CB-CG 3.79Å; T409-Q495 HydrophobicContact CG2-CB 3.89Å; T409-Q495 HydrophobicContact CG2-CG 4.26Å; R491-Q495 VanDerWaalsContact O-CB 3.32Å; R491-Q495 WeakPolarHBondContact O-CB 3.41Å; R491-Q495 PolarHBondContact O-N 3.47Å; T492-Q495 PolarHBondContact O-N 2.96Å; Q495-E498 WeakPolarHBondContact CA-OE2 3.48Å; Q495-E498 PolarHBondContact O-N 3.18Å; Q495-N499 PolarHBondContact NE2-OD1 2.93Å; Q495-N499 PolarHBondContact O-N 2.96Å; Q495-N499 VanDerWaalsContact O-N 3.12Å; Q495-N499 PolarHBondContact O-ND2 3.38Å; Q495-N499 PolarHBondContact O-OD1 3.18Å
496	C	98.1	Very high	97.4	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.1	-45.9	174.4	-178.4	0	0	0	0	110.8	M402 A405 T492 L493 V494 E498 N499 L500	M402-C496 HydrophobicContact CE-CB 4.2Å; M402-C496 HydrophobicContact SD-CB 3.87Å; A405-C496 HydrophobicContact CB-CB 3.99Å; T492-C496 VanDerWaalsContact O-CB 3.23Å; T492-C496 WeakPolarHBondContact O-CB 3.37Å; T492-C496 PolarHBondContact O-N 3.36Å; L493-C496 PolarHBondContact O-N 3.33Å; V494-C496 VanDerWaalsContact C-N 3.3Å; V494-C496 PolarHBondContact O-N 3.22Å; C496-E498 VanDerWaalsContact C-N 3.31Å; C496-E498 PolarHBondContact O-N 2.96Å; C496-N499 PolarHBondContact O-N 3.3Å; C496-N499 VanDerWaalsContact O-N 3.13Å; C496-L500 PolarHBondContact O-N 3.37Å
497	L	97.7	Very high	97.5	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-63.6	-35.9	179.2	-69.6	165.2	0	0	0	112.4	V259 L261 C297 L301 F310 I371 L493 V494 N499 L500	V259-L497 HydrophobicContact CG1-CD2 3.71Å; L261-L497 HydrophobicContact CD1-CD1 3.81Å; L261-L497 HydrophobicContact CD2-CD1 4.16Å; L261-L497 HydrophobicContact CD2-CD2 4.11Å; L261-L497 HydrophobicContact CG-CD1 4.47Å; C297-L497 HydrophobicContact CB-CD1 4.29Å; L301-L497 HydrophobicContact CD1-CB 4.37Å; L301-L497 HydrophobicContact CD1-CD1 3.79Å; F310-L497 WeakPolarHBondContact CZ-O 3.45Å; I371-L497 HydrophobicContact CD1-CD2 4.29Å; L493-L497 WeakPolarHBondContact O-CG 3.5Å; L493-L497 PolarHBondContact O-N 2.87Å; L493-L497 VanDerWaalsContact O-N 3.07Å; V494-L497 PolarHBondContact O-N 2.78Å; L497-N499 VanDerWaalsContact C-N 3.3Å; L497-L500 HydrophobicContact CD2-CD1 4.14Å; L497-L500 PolarHBondContact O-N 2.97Å
498	E	95.8	Very high	97.5	Very high	37 Å²	37	11.6 Å²	11.6	17%	0.173	6%	0.057	C	C	.	.	H	α-helix	trans	-72.1	-23.8	175.2	-69.2	166.1	139.2	0	0	113.3	R172 L301 N306 V494 Q495 C496 L500	R172-E498 IonicContact CZ-OE1 2.66Å; R172-E498 IonicContact CZ-OE2 3.64Å; R172-E498 IonicContact NH1-OE1 2.79Å; R172-E498 PolarHBondContact NH1-OE1 3.33Å; R172-E498 IonicContact NH1-OE2 3.98Å; R172-E498 PolarHBondContact NH1-OE2 2.96Å; R172-E498 IonicContact NH2-OE1 3.16Å; R172-E498 PolarHBondContact NH2-OE1 2.71Å; R172-E498 IonicContact NH2-OE2 2.7Å; R172-E498 PolarHBondContact NH2-OE2 3.26Å; L301-E498 HydrophobicContact CD2-CG 4.17Å; N306-E498 VanDerWaalsContact ND2-CG 3.26Å; N306-E498 WeakPolarHBondContact ND2-CG 3.43Å; N306-E498 PolarHBondContact ND2-OE1 3.39Å; N306-E498 PolarHBondContact OD1-OE1 3.43Å; V494-E498 WeakPolarHBondContact O-CG 3.38Å; V494-E498 PolarHBondContact O-N 3.48Å; V494-E498 VanDerWaalsContact O-N 3.09Å; Q495-E498 WeakPolarHBondContact CA-OE2 3.48Å; Q495-E498 PolarHBondContact O-N 3.18Å; C496-E498 VanDerWaalsContact C-N 3.31Å; C496-E498 PolarHBondContact O-N 2.96Å; E498-L500 VanDerWaalsContact C-N 3.34Å
499	N	95.1	Very high	97.5	Very high	36 Å²	36	11.7 Å²	11.7	19%	0.193	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-8.9	178.6	-66.7	-11.5	0	0	0	113.2	K401 Q495 C496 L497	K401-N499 HydrophobicContact CD-CB 3.95Å; K401-N499 WeakPolarHBondContact CD-O 3.25Å; K401-N499 VanDerWaalsContact CE-O 3.25Å; K401-N499 WeakPolarHBondContact CE-O 3.28Å; K401-N499 PolarHBondContact NZ-O 3.49Å; Q495-N499 PolarHBondContact NE2-OD1 2.93Å; Q495-N499 PolarHBondContact O-N 2.96Å; Q495-N499 VanDerWaalsContact O-N 3.12Å; Q495-N499 PolarHBondContact O-ND2 3.38Å; Q495-N499 PolarHBondContact O-OD1 3.18Å; C496-N499 PolarHBondContact O-N 3.3Å; C496-N499 VanDerWaalsContact O-N 3.13Å; L497-N499 VanDerWaalsContact C-N 3.3Å
500	L	94.3	Very high	97.4	Very high	36 Å²	36	12.7 Å²	12.7	19%	0.188	6%	0.063	C	C	.	.			trans	-79.6	0	174.5	-66.3	176.4	0	0	0	111	R256 V259 F310 L398 K401 C496 L497 E498	R256-L500 PolarHBondContact NH1-O 3.15Å; V259-L500 HydrophobicContact CG2-CD1 4.2Å; F310-L500 HydrophobicContact CE1-CB 3.74Å; F310-L500 HydrophobicContact CZ-CB 3.89Å; F310-L500 HydrophobicContact CZ-CD1 4.28Å; L398-L500 HydrophobicContact CD1-CD1 4.45Å; L398-L500 HydrophobicContact CD1-CD2 3.87Å; K401-L500 HydrophobicContact CB-CD2 4.41Å; K401-L500 HydrophobicContact CG-CD2 4.15Å; C496-L500 PolarHBondContact O-N 3.37Å; L497-L500 HydrophobicContact CD2-CD1 4.14Å; L497-L500 PolarHBondContact O-N 2.97Å; E498-L500 VanDerWaalsContact C-N 3.34Å

Retrieved 500 of 500 residues in 503.3 ms (Link to these results)

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