A0A3Q0KQP8_SCHMA Loading...

Putative yeast nucleolar complex AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KQP8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 640 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	59.8	Low	68	Low	168 Å²	168	87.5 Å²	87.5	83%	0.828	45%	0.453	S	S	*	.				0	-57.3	0	-152	-166.3	-158.4	0	0	114.2	K3 S4 L5	M1-K3 PolarHBondContact O-N 3.43Å; M1-S4 WeakPolarHBondContact CA-OG 3.27Å; M1-S4 PolarHBondContact O-N 3.31Å; M1-S4 VanDerWaalsContact O-N 3.15Å; M1-S4 PolarHBondContact O-OG 2.88Å; M1-L5 PolarHBondContact O-N 3.27Å
2	L	64.9	Low	69	Low	33 Å²	33	87.3 Å²	87.3	17%	0.173	45%	0.453	C	S	.	.	H	α-helix	trans	-64	-41.1	-178.1	-67.3	175.3	0	0	0	113.3	S4 L5 L6 K19 K22 I23 L29	L2-S4 VanDerWaalsContact C-N 3.26Å; L2-S4 PolarHBondContact O-N 3.19Å; L2-L5 HydrophobicContact CD2-CD1 4.37Å; L2-L5 PolarHBondContact O-N 3.1Å; L2-L6 PolarHBondContact O-N 2.92Å; L2-K19 HydrophobicContact CD2-CB 4.09Å; L2-K19 HydrophobicContact CD2-CD 4.11Å; L2-K19 HydrophobicContact CD2-CG 4.49Å; L2-K22 HydrophobicContact CD1-CB 3.96Å; L2-I23 HydrophobicContact CD1-CG1 4.36Å; L2-I23 HydrophobicContact CD2-CG1 3.87Å; L2-L29 HydrophobicContact CB-CD1 4.1Å; L2-L29 HydrophobicContact CD1-CD1 4.41Å
3	K	69.4	Low	69.8	Low	143 Å²	143	81.1 Å²	81.1	62%	0.622	42%	0.421	S	S	*	.	H	α-helix	trans	-60.5	-31.9	173	-74.5	-179.8	-178.6	176.1	0	113.4	M1 K7 L29	M1-K3 PolarHBondContact O-N 3.43Å; K3-K7 VanDerWaalsContact O-CG 3.25Å; K3-K7 WeakPolarHBondContact O-CG 3.42Å; K3-K7 PolarHBondContact O-N 2.99Å; K3-L29 HydrophobicContact CD-CD2 4.34Å; K3-L29 HydrophobicContact CG-CD2 3.48Å; K3-L29 VanDerWaalsContact CG-CD2 3.48Å
4	S	70.3	Confident	70.6	Confident	62 Å²	62	88.5 Å²	88.5	43%	0.434	44%	0.441	S	S	.	.	H	α-helix	trans	-75.9	-36.2	179.7	57.4	0	0	0	0	111.3	M1 L2 L6 K7 N8	M1-S4 WeakPolarHBondContact CA-OG 3.27Å; M1-S4 PolarHBondContact O-N 3.31Å; M1-S4 VanDerWaalsContact O-N 3.15Å; M1-S4 PolarHBondContact O-OG 2.88Å; L2-S4 VanDerWaalsContact C-N 3.26Å; L2-S4 PolarHBondContact O-N 3.19Å; S4-L6 VanDerWaalsContact C-N 3.3Å; S4-L6 PolarHBondContact O-N 3.44Å; S4-K7 PolarHBondContact O-N 2.69Å; S4-N8 PolarHBondContact O-N 3.03Å; S4-N8 PolarHBondContact O-OD1 2.97Å
5	L	67.8	Low	71.1	Confident	20 Å²	20	86.5 Å²	86.5	11%	0.105	43%	0.432	C	S	.	.	H	α-helix	trans	-60.8	-38.6	174.6	-66.7	171.2	0	0	0	113	M1 L2 K7 L15 K19	M1-L5 PolarHBondContact O-N 3.27Å; L2-L5 HydrophobicContact CD2-CD1 4.37Å; L2-L5 PolarHBondContact O-N 3.1Å; L5-K7 VanDerWaalsContact C-N 3.26Å; L5-K7 PolarHBondContact O-N 3.17Å; L5-L15 HydrophobicContact CD2-CD2 3.56Å; L5-L15 HydrophobicContact CD2-CG 4.43Å; L5-K19 HydrophobicContact CD1-CD 3.36Å
6	L	68.4	Low	71.6	Confident	22 Å²	22	81.3 Å²	81.3	12%	0.115	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-5.4	177.1	-64.6	174.1	0	0	0	113.6	L2 S4 I23 F33 L36	L2-L6 PolarHBondContact O-N 2.92Å; S4-L6 VanDerWaalsContact C-N 3.3Å; S4-L6 PolarHBondContact O-N 3.44Å; L6-I23 HydrophobicContact CD1-CG2 4.45Å; L6-F33 HydrophobicContact CD1-CB 4.48Å; L6-F33 HydrophobicContact CD2-CD2 4.28Å; L6-L36 HydrophobicContact CB-CD2 4.1Å; L6-L36 HydrophobicContact CD2-CD2 3.78Å; L6-L36 WeakPolarHBondContact O-CD2 3.41Å
7	K	71.1	Confident	72.3	Confident	170 Å²	170	79.3 Å²	79.3	74%	0.739	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-9.4	178.6	-81.2	-179.1	174.9	-162.7	0	113.2	K3 S4 L5	K3-K7 VanDerWaalsContact O-CG 3.25Å; K3-K7 WeakPolarHBondContact O-CG 3.42Å; K3-K7 PolarHBondContact O-N 2.99Å; S4-K7 PolarHBondContact O-N 2.69Å; L5-K7 VanDerWaalsContact C-N 3.26Å; L5-K7 PolarHBondContact O-N 3.17Å
8	N	69.6	Low	73	Confident	79 Å²	79	81.7 Å²	81.7	42%	0.422	41%	0.411	S	S	.	.			trans	-66.4	138.7	-179.9	-70.4	-15.2	0	0	0	110.3	S4 I10	S4-N8 PolarHBondContact O-N 3.03Å; S4-N8 PolarHBondContact O-OD1 2.97Å; N8-I10 VanDerWaalsContact C-N 3.26Å; N8-I10 WeakPolarHBondContact CB-O 3.44Å; N8-I10 PolarHBondContact O-N 3.12Å
9	P	62.4	Low	73.5	Confident	134 Å²	134	79.4 Å²	79.4	87%	0.87	40%	0.398	S	S	*	.	S	Bend	trans	-64.7	-34.4	180	25.6	-33.5	0	0	0	111.7
10	I	71.8	Confident	74	Confident	119 Å²	119	75.4 Å²	75.4	61%	0.61	38%	0.378	S	S	*	.	S	Bend	trans	-108.4	116.9	170.8	-64.9	170	0	0	0	107.6	N8 D12	N8-I10 VanDerWaalsContact C-N 3.26Å; N8-I10 WeakPolarHBondContact CB-O 3.44Å; N8-I10 PolarHBondContact O-N 3.12Å; I10-D12 PolarHBondContact O-N 3.23Å
11	L	73	Confident	74.4	Confident	12 Å²	12	74.7 Å²	74.7	6%	0.063	38%	0.379	C	S	.	.			trans	-81.2	121.2	-179.3	-69.1	155.9	0	0	0	109.7	L13 I16 L36 M37 T40	L11-L13 VanDerWaalsContact C-N 3.26Å; L11-L13 HydrophobicContact CB-CD2 4.1Å; L11-L13 HydrophobicContact CB-CG 4.48Å; L11-L13 PolarHBondContact O-N 3.48Å; L11-I16 HydrophobicContact CB-CD1 4.04Å; L11-I16 HydrophobicContact CD2-CD1 3.72Å; L11-I16 HydrophobicContact CG-CD1 4.46Å; L11-L36 HydrophobicContact CD1-CD1 3.78Å; L11-L36 HydrophobicContact CD1-CD2 3.73Å; L11-L36 HydrophobicContact CD1-CG 3.45Å; L11-L36 VanDerWaalsContact CD1-CG 3.45Å; L11-L36 HydrophobicContact CD2-CD2 3.38Å; L11-L36 HydrophobicContact CD2-CG 4.14Å; L11-L36 HydrophobicContact CG-CD2 4.13Å; L11-L36 HydrophobicContact CG-CG 4.38Å; L11-M37 HydrophobicContact CD1-CE 4.01Å; L11-T40 VanDerWaalsContact CD1-OG1 3.31Å; L11-T40 WeakPolarHBondContact CD1-OG1 3.31Å
12	D	79.4	Confident	75.6	Confident	85 Å²	85	73.2 Å²	73.2	46%	0.455	37%	0.368	S	S	.	.			trans	-75.8	86.1	166.2	-173	-14.2	0	0	0	109.1	I10 R14 L15 I16	I10-D12 PolarHBondContact O-N 3.23Å; D12-R14 PolarHBondContact O-N 3.11Å; D12-R14 PolarHBondContact OD1-N 3.37Å; D12-L15 HydrophobicContact CB-CB 3.96Å; D12-L15 VanDerWaalsContact CG-CB 3.47Å; D12-L15 PolarHBondContact O-N 3.17Å; D12-L15 PolarHBondContact OD1-N 2.95Å; D12-L15 WeakPolarHBondContact OD2-CB 3.44Å; D12-I16 VanDerWaalsContact O-CG1 3.29Å; D12-I16 WeakPolarHBondContact O-CG1 3.42Å; D12-I16 PolarHBondContact O-N 2.71Å
13	L	80.4	Confident	76.3	Confident	7 Å²	7	71.6 Å²	71.6	4%	0.037	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-28.2	-178.1	-64.1	175.8	0	0	0	112.4	L11 N17 M37 T40 R48 L51 A52 N55	L11-L13 VanDerWaalsContact C-N 3.26Å; L11-L13 HydrophobicContact CB-CD2 4.1Å; L11-L13 HydrophobicContact CB-CG 4.48Å; L11-L13 PolarHBondContact O-N 3.48Å; L13-N17 WeakPolarHBondContact O-CB 3.33Å; L13-N17 PolarHBondContact O-N 3.46Å; L13-M37 HydrophobicContact CD2-CE 3.67Å; L13-M37 HydrophobicContact CD2-SD 3.74Å; L13-T40 HydrophobicContact CD1-CG2 4.08Å; L13-T40 HydrophobicContact CD2-CG2 4.31Å; L13-R48 HydrophobicContact CD1-CB 4.07Å; L13-R48 HydrophobicContact CD1-CG 4.43Å; L13-R48 WeakPolarHBondContact CD1-O 3.45Å; L13-L51 HydrophobicContact CB-CB 4.19Å; L13-L51 HydrophobicContact CD1-CB 3.66Å; L13-A52 HydrophobicContact CD1-CB 4.35Å; L13-A52 HydrophobicContact CD2-CB 4.49Å; L13-N55 PolarHBondContact O-ND2 3.06Å
14	R	81.1	Confident	77	Confident	185 Å²	185	65.5 Å²	65.5	70%	0.698	33%	0.333	S	S	*	.	H	α-helix	trans	-74.4	-43.1	177.6	-64.6	-177.8	-177.8	172.6	1.5	110.9	D12 I16 N17	D12-R14 PolarHBondContact O-N 3.11Å; D12-R14 PolarHBondContact OD1-N 3.37Å; R14-I16 VanDerWaalsContact C-N 3.32Å; R14-N17 VanDerWaalsContact O-CB 3.29Å; R14-N17 WeakPolarHBondContact O-CB 3.36Å; R14-N17 PolarHBondContact O-N 3.06Å
15	L	77.7	Confident	77.6	Confident	58 Å²	58	72.3 Å²	72.3	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-37.1	175	-175.7	61.8	0	0	0	111.9	L5 D12 N17 N18 K19	L5-L15 HydrophobicContact CD2-CD2 3.56Å; L5-L15 HydrophobicContact CD2-CG 4.43Å; D12-L15 HydrophobicContact CB-CB 3.96Å; D12-L15 VanDerWaalsContact CG-CB 3.47Å; D12-L15 PolarHBondContact O-N 3.17Å; D12-L15 PolarHBondContact OD1-N 2.95Å; D12-L15 WeakPolarHBondContact OD2-CB 3.44Å; L15-N17 VanDerWaalsContact C-N 3.35Å; L15-N18 PolarHBondContact O-N 3.31Å; L15-K19 HydrophobicContact CG-CD 4.49Å; L15-K19 PolarHBondContact O-N 3.11Å
16	I	79.2	Confident	78.4	Confident	3 Å²	3	76.7 Å²	76.7	2%	0.015	37%	0.369	C	S	.	.	H	α-helix	trans	-61	-45.5	174.4	-71.1	168.8	0	0	0	110.1	L11 D12 R14 N18 K19 I20 I23 F33 M37	L11-I16 HydrophobicContact CB-CD1 4.04Å; L11-I16 HydrophobicContact CD2-CD1 3.72Å; L11-I16 HydrophobicContact CG-CD1 4.46Å; D12-I16 VanDerWaalsContact O-CG1 3.29Å; D12-I16 WeakPolarHBondContact O-CG1 3.42Å; D12-I16 PolarHBondContact O-N 2.71Å; R14-I16 VanDerWaalsContact C-N 3.32Å; I16-N18 PolarHBondContact O-N 2.83Å; I16-N18 VanDerWaalsContact O-N 3.14Å; I16-K19 CarbonylContact O-C 3.46Å; I16-K19 WeakPolarHBondContact O-CA 3.35Å; I16-K19 PolarHBondContact O-N 3.37Å; I16-I20 HydrophobicContact CG2-CG1 4.47Å; I16-I20 WeakPolarHBondContact O-CG1 3.34Å; I16-I20 PolarHBondContact O-N 2.95Å; I16-I23 HydrophobicContact CG2-CD1 4.37Å; I16-F33 HydrophobicContact CG2-CD2 4.15Å; I16-F33 HydrophobicContact CG2-CE2 3.55Å; I16-M37 HydrophobicContact CD1-CE 3.99Å; I16-M37 HydrophobicContact CG2-SD 4.4Å
17	N	83.8	Confident	79	Confident	48 Å²	48	81.2 Å²	81.2	26%	0.257	39%	0.39	S	S	.	.	H	α-helix	trans	-49.3	-42	178.3	-169.7	-5.6	0	0	0	113	L13 R14 L15 K19 N55 K58	L13-N17 WeakPolarHBondContact O-CB 3.33Å; L13-N17 PolarHBondContact O-N 3.46Å; R14-N17 VanDerWaalsContact O-CB 3.29Å; R14-N17 WeakPolarHBondContact O-CB 3.36Å; R14-N17 PolarHBondContact O-N 3.06Å; L15-N17 VanDerWaalsContact C-N 3.35Å; N17-K19 VanDerWaalsContact C-N 3.31Å; N17-K19 PolarHBondContact O-N 3.5Å; N17-N55 WeakPolarHBondContact CA-OD1 3.48Å; N17-N55 WeakPolarHBondContact CB-OD1 3.17Å; N17-K58 PolarHBondContact O-NZ 2.81Å; N17-K58 WeakPolarHBondContact OD1-CD 3.47Å; N17-K58 WeakPolarHBondContact OD1-CE 3.46Å; N17-K58 PolarHBondContact OD1-NZ 3.3Å
18	N	83.5	Confident	79.5	Confident	123 Å²	123	81.6 Å²	81.6	66%	0.658	39%	0.392	S	S	*	.	H	α-helix	trans	-74.2	-20.9	179	-68.9	-21.9	0	0	0	113.6	L15 I16	L15-N18 PolarHBondContact O-N 3.31Å; I16-N18 PolarHBondContact O-N 2.83Å; I16-N18 VanDerWaalsContact O-N 3.14Å
19	K	82.7	Confident	80.2	Confident	37 Å²	37	78.6 Å²	78.6	16%	0.161	38%	0.375	C	S	.	.	H	α-helix	trans	-105.2	-2.6	-176.2	-68.4	178.5	-179.9	178.9	0	113.5	L2 L5 L15 I16 N17 K22 I23	L2-K19 HydrophobicContact CD2-CB 4.09Å; L2-K19 HydrophobicContact CD2-CD 4.11Å; L2-K19 HydrophobicContact CD2-CG 4.49Å; L5-K19 HydrophobicContact CD1-CD 3.36Å; L15-K19 HydrophobicContact CG-CD 4.49Å; L15-K19 PolarHBondContact O-N 3.11Å; I16-K19 CarbonylContact O-C 3.46Å; I16-K19 WeakPolarHBondContact O-CA 3.35Å; I16-K19 PolarHBondContact O-N 3.37Å; N17-K19 VanDerWaalsContact C-N 3.31Å; N17-K19 PolarHBondContact O-N 3.5Å; K19-K22 PolarHBondContact O-N 3.48Å; K19-I23 HydrophobicContact CB-CD1 4.35Å; K19-I23 WeakPolarHBondContact O-CG1 3.38Å; K19-I23 PolarHBondContact O-N 3.22Å
20	I	83.6	Confident	81.3	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-46.7	-51.1	177.9	-67.5	171.5	0	0	0	112	I16 K22 I23 L24 F33 N55 K58 A59 L62	I16-I20 HydrophobicContact CG2-CG1 4.47Å; I16-I20 WeakPolarHBondContact O-CG1 3.34Å; I16-I20 PolarHBondContact O-N 2.95Å; I20-K22 PolarHBondContact O-N 3.22Å; I20-K22 VanDerWaalsContact O-N 3.11Å; I20-I23 PolarHBondContact O-N 3.46Å; I20-L24 HydrophobicContact CG2-CD1 3.6Å; I20-L24 HydrophobicContact CG2-CG 3.98Å; I20-L24 WeakPolarHBondContact O-CG 3.48Å; I20-L24 PolarHBondContact O-N 3.49Å; I20-F33 HydrophobicContact CD1-CZ 4.32Å; I20-F33 HydrophobicContact CG1-CE2 4.18Å; I20-F33 HydrophobicContact CG1-CZ 4.08Å; I20-N55 HydrophobicContact CD1-CB 4.08Å; I20-K58 HydrophobicContact CD1-CB 4.22Å; I20-K58 HydrophobicContact CD1-CD 4.02Å; I20-K58 HydrophobicContact CD1-CG 4.22Å; I20-A59 HydrophobicContact CG2-CB 3.97Å; I20-L62 HydrophobicContact CG2-CD1 3.72Å
21	P	83.2	Confident	82	Confident	60 Å²	60	71.9 Å²	71.9	39%	0.39	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-29.2	-178.4	-22.8	33	0	0	0	113.9	R25 L62	P21-R25 WeakPolarHBondContact O-CG 3.44Å; P21-L62 HydrophobicContact CB-CD1 4.41Å; P21-L62 HydrophobicContact CG-CD1 3.87Å
22	K	84	Confident	82.7	Confident	137 Å²	137	77.8 Å²	77.8	60%	0.596	35%	0.354	S	S	*	.	H	α-helix	trans	-80.5	-32	177.7	-63.2	-176.5	178.6	-179.3	0	111.9	L2 K19 I20	L2-K22 HydrophobicContact CD1-CB 3.96Å; K19-K22 PolarHBondContact O-N 3.48Å; I20-K22 PolarHBondContact O-N 3.22Å; I20-K22 VanDerWaalsContact O-N 3.11Å
23	I	81	Confident	83.3	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-69.7	-45.4	178	-65.8	169.5	0	0	0	110.2	L2 L6 I16 K19 I20 R25 H26 L29 F33	L2-I23 HydrophobicContact CD1-CG1 4.36Å; L2-I23 HydrophobicContact CD2-CG1 3.87Å; L6-I23 HydrophobicContact CD1-CG2 4.45Å; I16-I23 HydrophobicContact CG2-CD1 4.37Å; K19-I23 HydrophobicContact CB-CD1 4.35Å; K19-I23 WeakPolarHBondContact O-CG1 3.38Å; K19-I23 PolarHBondContact O-N 3.22Å; I20-I23 PolarHBondContact O-N 3.46Å; I23-R25 PolarHBondContact O-N 3.02Å; I23-H26 PolarHBondContact O-N 3.12Å; I23-L29 HydrophobicContact CG2-CB 4.15Å; I23-F33 HydrophobicContact CD1-CD2 4.28Å; I23-F33 HydrophobicContact CG2-CB 3.75Å; I23-F33 HydrophobicContact CG2-CD2 4.22Å; I23-F33 HydrophobicContact CG2-CG 4.06Å
24	L	82.8	Confident	83.8	Confident	14 Å²	14	73.4 Å²	73.4	7%	0.073	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.5	-176.4	-64.3	178.7	0	0	0	114.3	I20 H26 E30 F33 F34 A59 L62 K63	I20-L24 HydrophobicContact CG2-CD1 3.6Å; I20-L24 HydrophobicContact CG2-CG 3.98Å; I20-L24 WeakPolarHBondContact O-CG 3.48Å; I20-L24 PolarHBondContact O-N 3.49Å; L24-H26 PolarHBondContact O-N 3.29Å; L24-E30 HydrophobicContact CD2-CG 3.96Å; L24-F33 HydrophobicContact CD2-CD1 4.49Å; L24-F34 HydrophobicContact CD2-CE2 4.15Å; L24-F34 HydrophobicContact CD2-CZ 4.48Å; L24-A59 HydrophobicContact CD1-CB 4.1Å; L24-A59 HydrophobicContact CD2-CB 4.33Å; L24-L62 HydrophobicContact CD1-CB 3.91Å; L24-L62 HydrophobicContact CD1-CD1 4.12Å; L24-K63 HydrophobicContact CD1-CB 4.49Å
25	R	83.5	Confident	84.3	Confident	206 Å²	206	71.1 Å²	71.1	78%	0.777	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-19.3	174.2	-72.3	179.3	-172.1	-155.4	-0.8	113.5	P21 I23	P21-R25 WeakPolarHBondContact O-CG 3.44Å; I23-R25 PolarHBondContact O-N 3.02Å
26	H	83.5	Confident	84.9	Confident	111 Å²	111	70.3 Å²	70.3	51%	0.514	32%	0.321	S	S	.	.	S	Bend	trans	-114.9	110.4	-177.8	-66.7	-64.8	0	0	0	110.3	I23 L24 K28 L29 E30	I23-H26 PolarHBondContact O-N 3.12Å; L24-H26 PolarHBondContact O-N 3.29Å; H26-K28 VanDerWaalsContact C-N 3.3Å; H26-K28 PolarHBondContact O-N 3.4Å; H26-K28 VanDerWaalsContact O-N 3.17Å; H26-L29 HydrophobicContact CB-CB 4.09Å; H26-L29 HydrophobicContact CB-CD1 3.9Å; H26-L29 HydrophobicContact CB-CG 3.9Å; H26-L29 WeakPolarHBondContact O-CA 3.47Å; H26-L29 WeakPolarHBondContact O-CB 3.34Å; H26-L29 PolarHBondContact O-N 3.25Å; H26-E30 PolarHBondContact O-N 3.11Å
27	E	81.1	Confident	85.5	Confident	118 Å²	118	70.1 Å²	70.1	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-54.1	-40.2	-175.4	-163.1	-160.8	149.8	0	0	113.7	L29 E30 K31	E27-L29 VanDerWaalsContact C-N 3.29Å; E27-L29 PolarHBondContact O-N 3.41Å; E27-E30 WeakPolarHBondContact O-CB 3.36Å; E27-E30 PolarHBondContact O-N 3.47Å; E27-K31 PolarHBondContact O-N 3.12Å; E27-K31 IonicContact OE1-NZ 3.71Å; E27-K31 PolarHBondContact OE1-NZ 3.16Å
28	K	81.8	Confident	86	Confident	178 Å²	178	68.1 Å²	68.1	77%	0.774	31%	0.31	S	S	*	.	H	α-helix	trans	-67	-28.7	176.9	-67	-174	-179.5	-179.5	0	113.2	H26 K32	H26-K28 VanDerWaalsContact C-N 3.3Å; H26-K28 PolarHBondContact O-N 3.4Å; H26-K28 VanDerWaalsContact O-N 3.17Å; K28-K32 WeakPolarHBondContact O-CG 3.35Å
29	L	84.1	Confident	86.4	Confident	15 Å²	15	67.9 Å²	67.9	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-83.9	-32	176.1	-60.3	-176.6	0	0	0	111.2	L2 K3 I23 H26 E27 K32 F33	L2-L29 HydrophobicContact CB-CD1 4.1Å; L2-L29 HydrophobicContact CD1-CD1 4.41Å; K3-L29 HydrophobicContact CD-CD2 4.34Å; K3-L29 HydrophobicContact CG-CD2 3.48Å; K3-L29 VanDerWaalsContact CG-CD2 3.48Å; I23-L29 HydrophobicContact CG2-CB 4.15Å; H26-L29 HydrophobicContact CB-CB 4.09Å; H26-L29 HydrophobicContact CB-CD1 3.9Å; H26-L29 HydrophobicContact CB-CG 3.9Å; H26-L29 WeakPolarHBondContact O-CA 3.47Å; H26-L29 WeakPolarHBondContact O-CB 3.34Å; H26-L29 PolarHBondContact O-N 3.25Å; E27-L29 VanDerWaalsContact C-N 3.29Å; E27-L29 PolarHBondContact O-N 3.41Å; L29-K32 PolarHBondContact O-N 3.19Å; L29-F33 VanDerWaalsContact O-CB 3.23Å; L29-F33 WeakPolarHBondContact O-CB 3.4Å; L29-F33 PolarHBondContact O-N 3.37Å
30	E	86.1	Confident	86.8	Confident	11 Å²	11	66.6 Å²	66.6	5%	0.051	30%	0.298	C	S	.	.	H	α-helix	trans	-58.1	-56.9	175.5	-176.5	-167.6	132.9	0	0	111.5	L24 H26 E27 K32 F33 F34 K63 C66	L24-E30 HydrophobicContact CD2-CG 3.96Å; H26-E30 PolarHBondContact O-N 3.11Å; E27-E30 WeakPolarHBondContact O-CB 3.36Å; E27-E30 PolarHBondContact O-N 3.47Å; E30-K32 VanDerWaalsContact C-N 3.25Å; E30-K32 PolarHBondContact O-N 2.61Å; E30-F33 WeakPolarHBondContact O-CB 3.33Å; E30-F33 PolarHBondContact O-N 2.57Å; E30-F34 HydrophobicContact CG-CD2 3.92Å; E30-F34 HydrophobicContact CG-CE2 3.67Å; E30-F34 VanDerWaalsContact O-CD2 3.28Å; E30-F34 WeakPolarHBondContact O-CD2 3.26Å; E30-F34 PolarHBondContact O-N 3.27Å; E30-K63 IonicContact OE1-NZ 2.84Å; E30-K63 IonicContact OE2-NZ 3.29Å; E30-K63 PolarHBondContact OE2-NZ 3.27Å; E30-C66 PolarHBondContact OE1-SG 3.09Å
31	K	87	Confident	87.4	Confident	102 Å²	102	66.7 Å²	66.7	44%	0.443	30%	0.298	S	S	.	.	H	α-helix	trans	-57.7	-39.2	178	-66.3	-177.8	-179.5	170.5	0	112.1	E27 K35 L69	E27-K31 PolarHBondContact O-N 3.12Å; E27-K31 IonicContact OE1-NZ 3.71Å; E27-K31 PolarHBondContact OE1-NZ 3.16Å; K31-K35 WeakPolarHBondContact O-CG 3.4Å; K31-K35 PolarHBondContact O-N 3.5Å; K31-K35 VanDerWaalsContact O-N 3.13Å; K31-L69 HydrophobicContact CG-CD2 3.97Å
32	K	88	Confident	87.8	Confident	136 Å²	136	63.9 Å²	63.9	59%	0.591	28%	0.28	S	S	*	.	H	α-helix	trans	-67.6	-40.3	176.5	-72.6	-174.7	-179	-165.5	0	112.3	K28 L29 E30 L36	K28-K32 WeakPolarHBondContact O-CG 3.35Å; L29-K32 PolarHBondContact O-N 3.19Å; E30-K32 VanDerWaalsContact C-N 3.25Å; E30-K32 PolarHBondContact O-N 2.61Å; K32-L36 WeakPolarHBondContact O-CB 3.42Å; K32-L36 PolarHBondContact O-N 3.42Å
33	F	90.8	Very high	88.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-50.8	176.7	165.8	-92.5	0	0	0	110.8	L6 I16 I20 I23 L24 L29 E30 K35 L36 M37 N55 A59	L6-F33 HydrophobicContact CD1-CB 4.48Å; L6-F33 HydrophobicContact CD2-CD2 4.28Å; I16-F33 HydrophobicContact CG2-CD2 4.15Å; I16-F33 HydrophobicContact CG2-CE2 3.55Å; I20-F33 HydrophobicContact CD1-CZ 4.32Å; I20-F33 HydrophobicContact CG1-CE2 4.18Å; I20-F33 HydrophobicContact CG1-CZ 4.08Å; I23-F33 HydrophobicContact CD1-CD2 4.28Å; I23-F33 HydrophobicContact CG2-CB 3.75Å; I23-F33 HydrophobicContact CG2-CD2 4.22Å; I23-F33 HydrophobicContact CG2-CG 4.06Å; L24-F33 HydrophobicContact CD2-CD1 4.49Å; L29-F33 VanDerWaalsContact O-CB 3.23Å; L29-F33 WeakPolarHBondContact O-CB 3.4Å; L29-F33 PolarHBondContact O-N 3.37Å; E30-F33 WeakPolarHBondContact O-CB 3.33Å; E30-F33 PolarHBondContact O-N 2.57Å; F33-K35 PolarHBondContact O-N 2.8Å; F33-L36 PolarHBondContact O-N 3.39Å; F33-M37 HydrophobicContact CD1-CG 4.36Å; F33-M37 HydrophobicContact CD2-CG 3.9Å; F33-M37 HydrophobicContact CE1-CG 4Å; F33-M37 HydrophobicContact CE2-CG 3.5Å; F33-M37 VanDerWaalsContact CE2-CG 3.5Å; F33-M37 HydrophobicContact CE2-SD 3.92Å; F33-M37 HydrophobicContact CG-CG 4.32Å; F33-M37 HydrophobicContact CZ-CG 3.56Å; F33-M37 HydrophobicContact CZ-SD 4.31Å; F33-M37 WeakPolarHBondContact O-CB 3.15Å; F33-M37 WeakPolarHBondContact O-CG 3.36Å; F33-M37 PolarHBondContact O-N 2.79Å; F33-N55 HydrophobicContact CZ-CB 4.5Å; F33-A59 HydrophobicContact CE1-CB 3.6Å; F33-A59 HydrophobicContact CZ-CB 4.11Å
34	F	91.6	Very high	88.4	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.9	-49.5	178.8	-78.3	-73	0	0	0	111.7	L24 E30 L36 M37 V38 L56 A59 L60 C66 L69 C70 L73	L24-F34 HydrophobicContact CD2-CE2 4.15Å; L24-F34 HydrophobicContact CD2-CZ 4.48Å; E30-F34 HydrophobicContact CG-CD2 3.92Å; E30-F34 HydrophobicContact CG-CE2 3.67Å; E30-F34 VanDerWaalsContact O-CD2 3.28Å; E30-F34 WeakPolarHBondContact O-CD2 3.26Å; E30-F34 PolarHBondContact O-N 3.27Å; F34-L36 VanDerWaalsContact C-N 3.26Å; F34-L36 PolarHBondContact O-N 2.81Å; F34-M37 PolarHBondContact O-N 3.01Å; F34-V38 WeakPolarHBondContact O-CB 3.45Å; F34-V38 VanDerWaalsContact O-CG2 3.23Å; F34-V38 WeakPolarHBondContact O-CG2 3.46Å; F34-V38 PolarHBondContact O-N 3.19Å; F34-L56 HydrophobicContact CD1-CD2 3.57Å; F34-L56 HydrophobicContact CE1-CD2 4.02Å; F34-A59 HydrophobicContact CE1-CB 4.21Å; F34-A59 HydrophobicContact CZ-CB 4.04Å; F34-L60 HydrophobicContact CE1-CD2 4.19Å; F34-L60 HydrophobicContact CE1-CG 4.44Å; F34-L60 HydrophobicContact CZ-CD2 4.21Å; F34-C66 HydrophobicContact CE2-CB 3.6Å; F34-C66 HydrophobicContact CZ-CB 3.56Å; F34-L69 HydrophobicContact CD2-CD2 4.38Å; F34-C70 HydrophobicContact CD1-CB 3.93Å; F34-C70 HydrophobicContact CE1-CB 3.87Å; F34-L73 HydrophobicContact CB-CD1 3.83Å
35	K	91.1	Very high	88.6	Confident	136 Å²	136	69.1 Å²	69.1	59%	0.591	31%	0.307	S	S	*	.	H	α-helix	trans	-55.6	-41.5	176.8	-73.8	-174.4	178.6	-165	0	112.6	K31 F33 K39 L73	K31-K35 WeakPolarHBondContact O-CG 3.4Å; K31-K35 PolarHBondContact O-N 3.5Å; K31-K35 VanDerWaalsContact O-N 3.13Å; F33-K35 PolarHBondContact O-N 2.8Å; K35-K39 WeakPolarHBondContact O-CB 3.3Å; K35-K39 PolarHBondContact O-N 3.21Å; K35-L73 HydrophobicContact CG-CD1 3.91Å; K35-L73 HydrophobicContact CG-CD2 4.03Å
36	L	90.7	Very high	88.7	Confident	41 Å²	41	63.9 Å²	63.9	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-72.6	-44.6	-178	-170	63.4	0	0	0	112.5	L6 L11 K32 F33 F34 V38 K39 T40	L6-L36 HydrophobicContact CB-CD2 4.1Å; L6-L36 HydrophobicContact CD2-CD2 3.78Å; L6-L36 WeakPolarHBondContact O-CD2 3.41Å; L11-L36 HydrophobicContact CD1-CD1 3.78Å; L11-L36 HydrophobicContact CD1-CD2 3.73Å; L11-L36 HydrophobicContact CD1-CG 3.45Å; L11-L36 VanDerWaalsContact CD1-CG 3.45Å; L11-L36 HydrophobicContact CD2-CD2 3.38Å; L11-L36 HydrophobicContact CD2-CG 4.14Å; L11-L36 HydrophobicContact CG-CD2 4.13Å; L11-L36 HydrophobicContact CG-CG 4.38Å; K32-L36 WeakPolarHBondContact O-CB 3.42Å; K32-L36 PolarHBondContact O-N 3.42Å; F33-L36 PolarHBondContact O-N 3.39Å; F34-L36 VanDerWaalsContact C-N 3.26Å; F34-L36 PolarHBondContact O-N 2.81Å; L36-V38 VanDerWaalsContact C-N 3.34Å; L36-K39 PolarHBondContact O-N 3.33Å; L36-T40 PolarHBondContact O-N 2.91Å; L36-T40 PolarHBondContact O-OG1 3.18Å; L36-T40 VanDerWaalsContact O-OG1 3.07Å
37	M	92.2	Very high	89	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64	-39.9	176.3	-68.1	-59.2	91.3	0	0	111.7	L11 L13 I16 F33 F34 T40 W41 N55 L56	L11-M37 HydrophobicContact CD1-CE 4.01Å; L13-M37 HydrophobicContact CD2-CE 3.67Å; L13-M37 HydrophobicContact CD2-SD 3.74Å; I16-M37 HydrophobicContact CD1-CE 3.99Å; I16-M37 HydrophobicContact CG2-SD 4.4Å; F33-M37 HydrophobicContact CD1-CG 4.36Å; F33-M37 HydrophobicContact CD2-CG 3.9Å; F33-M37 HydrophobicContact CE1-CG 4Å; F33-M37 HydrophobicContact CE2-CG 3.5Å; F33-M37 VanDerWaalsContact CE2-CG 3.5Å; F33-M37 HydrophobicContact CE2-SD 3.92Å; F33-M37 HydrophobicContact CG-CG 4.32Å; F33-M37 HydrophobicContact CZ-CG 3.56Å; F33-M37 HydrophobicContact CZ-SD 4.31Å; F33-M37 WeakPolarHBondContact O-CB 3.15Å; F33-M37 WeakPolarHBondContact O-CG 3.36Å; F33-M37 PolarHBondContact O-N 2.79Å; F34-M37 PolarHBondContact O-N 3.01Å; M37-T40 PolarHBondContact O-N 3.47Å; M37-W41 VanDerWaalsContact O-CB 3.32Å; M37-W41 WeakPolarHBondContact O-CB 3.46Å; M37-W41 PolarHBondContact O-N 2.92Å; M37-N55 HydrophobicContact SD-CB 4.1Å; M37-L56 HydrophobicContact CB-CD1 4.3Å; M37-L56 HydrophobicContact CB-CD2 3.6Å; M37-L56 HydrophobicContact CB-CG 3.83Å; M37-L56 HydrophobicContact CG-CD2 4.36Å
38	V	93.2	Very high	89.4	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.036	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-42.6	175.3	172.7	0	0	0	0	111.1	F34 L36 T40 W41 S42 L56 L73 M74 A77	F34-V38 WeakPolarHBondContact O-CB 3.45Å; F34-V38 VanDerWaalsContact O-CG2 3.23Å; F34-V38 WeakPolarHBondContact O-CG2 3.46Å; F34-V38 PolarHBondContact O-N 3.19Å; L36-V38 VanDerWaalsContact C-N 3.34Å; V38-T40 PolarHBondContact O-N 2.9Å; V38-W41 HydrophobicContact CG1-CE3 4.31Å; V38-W41 PolarHBondContact O-N 3.29Å; V38-S42 VanDerWaalsContact O-CB 3.3Å; V38-S42 WeakPolarHBondContact O-CB 3.19Å; V38-S42 PolarHBondContact O-N 3.22Å; V38-S42 PolarHBondContact O-OG 3.37Å; V38-L56 HydrophobicContact CG2-CD1 4.05Å; V38-L56 HydrophobicContact CG2-CD2 4.3Å; V38-L73 HydrophobicContact CB-CB 4.47Å; V38-L73 HydrophobicContact CG1-CB 4.31Å; V38-L73 WeakPolarHBondContact CG1-O 3.43Å; V38-L73 HydrophobicContact CG2-CB 4Å; V38-M74 HydrophobicContact CG1-CG 4.27Å; V38-M74 HydrophobicContact CG2-CG 3.57Å; V38-A77 HydrophobicContact CG1-CB 3.5Å; V38-A77 VanDerWaalsContact CG1-CB 3.5Å
39	K	92.9	Very high	89.9	Confident	118 Å²	118	51.7 Å²	51.7	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-57.2	-50.3	174.4	-175.2	177.3	-179.9	178.1	0	111.1	K35 L36 W41 S42 E43	K35-K39 WeakPolarHBondContact O-CB 3.3Å; K35-K39 PolarHBondContact O-N 3.21Å; L36-K39 PolarHBondContact O-N 3.33Å; K39-W41 PolarHBondContact O-N 3.04Å; K39-S42 PolarHBondContact O-N 2.87Å; K39-S42 VanDerWaalsContact O-N 3.13Å; K39-S42 PolarHBondContact O-OG 3.06Å; K39-E43 WeakPolarHBondContact CE-OE2 3.48Å; K39-E43 WeakPolarHBondContact CG-OE2 3.41Å; K39-E43 PolarHBondContact O-N 3.46Å
40	T	91.7	Very high	90.3	Very high	10 Å²	10	54.9 Å²	54.9	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-44.1	176	-58.7	0	0	0	0	112.3	L11 L13 L36 M37 V38 S42 D44 A52	L11-T40 VanDerWaalsContact CD1-OG1 3.31Å; L11-T40 WeakPolarHBondContact CD1-OG1 3.31Å; L13-T40 HydrophobicContact CD1-CG2 4.08Å; L13-T40 HydrophobicContact CD2-CG2 4.31Å; L36-T40 PolarHBondContact O-N 2.91Å; L36-T40 PolarHBondContact O-OG1 3.18Å; L36-T40 VanDerWaalsContact O-OG1 3.07Å; M37-T40 PolarHBondContact O-N 3.47Å; V38-T40 PolarHBondContact O-N 2.9Å; T40-S42 PolarHBondContact O-N 3.46Å; T40-D44 HydrophobicContact CG2-CB 3.97Å; T40-D44 WeakPolarHBondContact CG2-OD2 3.39Å; T40-D44 WeakPolarHBondContact O-CB 3.22Å; T40-D44 PolarHBondContact O-N 2.98Å; T40-D44 VanDerWaalsContact O-N 3.17Å; T40-A52 HydrophobicContact CG2-CB 3.84Å
41	W	94.6	Very high	90.6	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-34.1	175.8	167.9	75.1	0	0	0	112.9	M37 V38 K39 R49 A52 M74 A77 F78 M96 C99 L100	M37-W41 VanDerWaalsContact O-CB 3.32Å; M37-W41 WeakPolarHBondContact O-CB 3.46Å; M37-W41 PolarHBondContact O-N 2.92Å; V38-W41 HydrophobicContact CG1-CE3 4.31Å; V38-W41 PolarHBondContact O-N 3.29Å; K39-W41 PolarHBondContact O-N 3.04Å; W41-R49 WeakPolarHBondContact O-CD 3.29Å; W41-R49 WeakPolarHBondContact O-CG 3.48Å; W41-A52 HydrophobicContact CB-CB 4.06Å; W41-M74 HydrophobicContact CD2-CE 3.99Å; W41-M74 HydrophobicContact CE3-CE 4.17Å; W41-M74 HydrophobicContact CE3-CG 4.39Å; W41-M74 HydrophobicContact CH2-CB 4.3Å; W41-M74 HydrophobicContact CH2-CE 3.79Å; W41-M74 HydrophobicContact CZ2-CE 3.59Å; W41-M74 HydrophobicContact CZ3-CB 4.03Å; W41-M74 HydrophobicContact CZ3-CE 4.09Å; W41-M74 HydrophobicContact CZ3-CG 4.25Å; W41-M74 WeakPolarHBondContact CZ3-O 3.21Å; W41-A77 HydrophobicContact CZ3-CB 4.25Å; W41-F78 HydrophobicContact CH2-CB 4.3Å; W41-M96 HydrophobicContact CD2-CE 4.5Å; W41-M96 HydrophobicContact CE3-CE 3.95Å; W41-M96 HydrophobicContact CH2-CB 3.89Å; W41-M96 HydrophobicContact CH2-CE 3.49Å; W41-M96 VanDerWaalsContact CH2-CE 3.49Å; W41-M96 HydrophobicContact CH2-CG 4.12Å; W41-M96 HydrophobicContact CZ2-CB 3.59Å; W41-M96 HydrophobicContact CZ2-CE 4.08Å; W41-M96 HydrophobicContact CZ2-CG 3.76Å; W41-M96 WeakPolarHBondContact CZ2-O 3.45Å; W41-M96 HydrophobicContact CZ3-CE 3.4Å; W41-M96 VanDerWaalsContact CZ3-CE 3.4Å; W41-C99 HydrophobicContact CZ2-CB 3.98Å; W41-L100 HydrophobicContact CH2-CD1 4.1Å; W41-L100 HydrophobicContact CH2-CG 4Å; W41-L100 HydrophobicContact CZ2-CG 4.34Å
42	S	92	Very high	90.9	Very high	1 Å²	1	52 Å²	52	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-86.1	-30.2	-173.5	77.6	0	0	0	0	114.6	V38 K39 T40 R80 N81 Q92	V38-S42 VanDerWaalsContact O-CB 3.3Å; V38-S42 WeakPolarHBondContact O-CB 3.19Å; V38-S42 PolarHBondContact O-N 3.22Å; V38-S42 PolarHBondContact O-OG 3.37Å; K39-S42 PolarHBondContact O-N 2.87Å; K39-S42 VanDerWaalsContact O-N 3.13Å; K39-S42 PolarHBondContact O-OG 3.06Å; T40-S42 PolarHBondContact O-N 3.46Å; S42-R80 PolarHBondContact OG-NH2 3.01Å; S42-N81 WeakPolarHBondContact CB-ND2 3.46Å; S42-N81 PolarHBondContact O-ND2 2.98Å; S42-N81 PolarHBondContact O-OD1 3.39Å; S42-Q92 PolarHBondContact O-NE2 2.95Å
43	E	89.9	Confident	91.2	Very high	86 Å²	86	46.4 Å²	46.4	40%	0.402	23%	0.227	S	C	.	.	H	α-helix	trans	-114.7	-29	-170.2	-69.7	172.5	175.2	0	0	114	K39 R49 R80	K39-E43 WeakPolarHBondContact CE-OE2 3.48Å; K39-E43 WeakPolarHBondContact CG-OE2 3.41Å; K39-E43 PolarHBondContact O-N 3.46Å; E43-R49 PolarHBondContact O-NH2 3.28Å; E43-R80 IonicContact OE1-CZ 2.67Å; E43-R80 VanDerWaalsContact OE1-CZ 3.22Å; E43-R80 IonicContact OE1-NH1 2.86Å; E43-R80 PolarHBondContact OE1-NH1 3.35Å; E43-R80 IonicContact OE1-NH2 2.75Å; E43-R80 PolarHBondContact OE1-NH2 3.46Å
44	D	87.6	Confident	91.3	Very high	37 Å²	37	51.3 Å²	51.3	20%	0.198	25%	0.253	C	S	.	.	S	Bend	trans	-79.6	-176.6	-163.4	-148.3	-36.9	0	0	0	113.4	T40 R48 R49	T40-D44 HydrophobicContact CG2-CB 3.97Å; T40-D44 WeakPolarHBondContact CG2-OD2 3.39Å; T40-D44 WeakPolarHBondContact O-CB 3.22Å; T40-D44 PolarHBondContact O-N 2.98Å; T40-D44 VanDerWaalsContact O-N 3.17Å; D44-R48 HydrophobicContact CB-CB 4.11Å; D44-R48 VanDerWaalsContact CG-NE 3.26Å; D44-R48 VanDerWaalsContact OD1-CD 3.26Å; D44-R48 WeakPolarHBondContact OD1-CD 3.48Å; D44-R48 IonicContact OD1-CZ 3.64Å; D44-R48 IonicContact OD1-NE 3.22Å; D44-R48 PolarHBondContact OD1-NE 3Å; D44-R48 IonicContact OD2-CZ 2.96Å; D44-R48 IonicContact OD2-NE 2.75Å; D44-R48 PolarHBondContact OD2-NE 2.84Å; D44-R48 IonicContact OD2-NH1 4Å; D44-R48 IonicContact OD2-NH2 2.71Å; D44-R48 PolarHBondContact OD2-NH2 2.71Å; D44-R49 WeakPolarHBondContact O-CG 3.49Å; D44-R49 PolarHBondContact O-NE 2.98Å; D44-R49 PolarHBondContact O-NH2 3.43Å
45	E	87.9	Confident	91.3	Very high	137 Å²	137	51.4 Å²	51.4	64%	0.64	25%	0.254	S	S	*	.			trans	-69	152.8	176.7	-64.8	179.3	173.8	0	0	112.7	S47 R48 R49	E45-S47 PolarHBondContact O-N 2.69Å; E45-R48 CarbonylContact O-C 3.57Å; E45-R48 WeakPolarHBondContact O-CA 3.44Å; E45-R48 PolarHBondContact O-N 2.96Å; E45-R49 WeakPolarHBondContact O-CG 3.45Å; E45-R49 PolarHBondContact O-N 2.67Å
46	D	85.9	Confident	91.4	Very high	96 Å²	96	44.9 Å²	44.9	51%	0.513	23%	0.225	S	C	.	.	H	α-helix	trans	-49.6	-40.9	-174.5	-69.7	-16	0	0	0	114	R48 R49 L50	D46-R48 PolarHBondContact O-N 3.04Å; D46-R49 PolarHBondContact O-N 3.31Å; D46-R49 IonicContact OD1-CZ 3.5Å; D46-R49 IonicContact OD1-NH1 2.87Å; D46-R49 PolarHBondContact OD1-NH1 3.21Å; D46-L50 WeakPolarHBondContact O-CG 3.44Å; D46-L50 PolarHBondContact O-N 3.07Å; D46-L50 VanDerWaalsContact O-N 3.15Å
47	S	88.2	Confident	91.5	Very high	73 Å²	73	44.4 Å²	44.4	51%	0.51	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-40	177.7	68.3	0	0	0	0	112.8	E45 L51	E45-S47 PolarHBondContact O-N 2.69Å; S47-L51 WeakPolarHBondContact O-CD1 3.49Å; S47-L51 PolarHBondContact O-N 3.05Å
48	R	90.1	Very high	91.5	Very high	57 Å²	57	47.9 Å²	47.9	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-78.2	-33.9	179	-68.9	-179.9	57	162.7	-9.4	111.5	L13 D44 E45 D46 L51 A52	L13-R48 HydrophobicContact CD1-CB 4.07Å; L13-R48 HydrophobicContact CD1-CG 4.43Å; L13-R48 WeakPolarHBondContact CD1-O 3.45Å; D44-R48 HydrophobicContact CB-CB 4.11Å; D44-R48 VanDerWaalsContact CG-NE 3.26Å; D44-R48 VanDerWaalsContact OD1-CD 3.26Å; D44-R48 WeakPolarHBondContact OD1-CD 3.48Å; D44-R48 IonicContact OD1-CZ 3.64Å; D44-R48 IonicContact OD1-NE 3.22Å; D44-R48 PolarHBondContact OD1-NE 3Å; D44-R48 IonicContact OD2-CZ 2.96Å; D44-R48 IonicContact OD2-NE 2.75Å; D44-R48 PolarHBondContact OD2-NE 2.84Å; D44-R48 IonicContact OD2-NH1 4Å; D44-R48 IonicContact OD2-NH2 2.71Å; D44-R48 PolarHBondContact OD2-NH2 2.71Å; E45-R48 CarbonylContact O-C 3.57Å; E45-R48 WeakPolarHBondContact O-CA 3.44Å; E45-R48 PolarHBondContact O-N 2.96Å; D46-R48 PolarHBondContact O-N 3.04Å; R48-L51 PolarHBondContact O-N 3.34Å; R48-A52 WeakPolarHBondContact O-CB 3.36Å; R48-A52 PolarHBondContact O-N 3.07Å
49	R	92.5	Very high	91.4	Very high	21 Å²	21	47.6 Å²	47.6	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-58.3	-49.2	173.3	-65.8	-174.1	-179.4	135.7	6.5	111.5	W41 E43 D44 E45 D46 A52 F53 Q92	W41-R49 WeakPolarHBondContact O-CD 3.29Å; W41-R49 WeakPolarHBondContact O-CG 3.48Å; E43-R49 PolarHBondContact O-NH2 3.28Å; D44-R49 WeakPolarHBondContact O-CG 3.49Å; D44-R49 PolarHBondContact O-NE 2.98Å; D44-R49 PolarHBondContact O-NH2 3.43Å; E45-R49 WeakPolarHBondContact O-CG 3.45Å; E45-R49 PolarHBondContact O-N 2.67Å; D46-R49 PolarHBondContact O-N 3.31Å; D46-R49 IonicContact OD1-CZ 3.5Å; D46-R49 IonicContact OD1-NH1 2.87Å; D46-R49 PolarHBondContact OD1-NH1 3.21Å; R49-A52 PolarHBondContact O-N 3.48Å; R49-F53 PolarHBondContact O-N 3.47Å; R49-Q92 VanDerWaalsContact CZ-CG 3.49Å
50	L	92.5	Very high	91.3	Very high	82 Å²	82	42.5 Å²	42.5	43%	0.429	21%	0.214	S	C	.	.	H	α-helix	trans	-63.6	-43.2	178.3	-69.2	176.8	0	0	0	111.8	D46 A52 F53 L54 L95	D46-L50 WeakPolarHBondContact O-CG 3.44Å; D46-L50 PolarHBondContact O-N 3.07Å; D46-L50 VanDerWaalsContact O-N 3.15Å; L50-A52 VanDerWaalsContact C-N 3.35Å; L50-A52 PolarHBondContact O-N 3.2Å; L50-F53 PolarHBondContact O-N 3.12Å; L50-L54 VanDerWaalsContact O-CG 3.3Å; L50-L54 WeakPolarHBondContact O-CG 3.34Å; L50-L54 PolarHBondContact O-N 3.43Å; L50-L95 HydrophobicContact CD2-CD1 4.1Å; L50-L95 HydrophobicContact CD2-CD2 4.35Å
51	L	91.8	Very high	91.2	Very high	52 Å²	52	46.6 Å²	46.6	27%	0.272	24%	0.243	S	C	.	.	H	α-helix	trans	-62	-40.7	175.2	-83.6	161	0	0	0	112.5	L13 S47 R48 L54 N55	L13-L51 HydrophobicContact CB-CB 4.19Å; L13-L51 HydrophobicContact CD1-CB 3.66Å; S47-L51 WeakPolarHBondContact O-CD1 3.49Å; S47-L51 PolarHBondContact O-N 3.05Å; R48-L51 PolarHBondContact O-N 3.34Å; L51-L54 PolarHBondContact O-N 3.32Å; L51-N55 PolarHBondContact O-N 3.36Å; L51-N55 PolarHBondContact O-ND2 3.08Å
52	A	93.2	Very high	91	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-43	175.5	0	0	0	0	0	111.2	L13 T40 W41 R48 R49 L50 N55 L56	L13-A52 HydrophobicContact CD1-CB 4.35Å; L13-A52 HydrophobicContact CD2-CB 4.49Å; T40-A52 HydrophobicContact CG2-CB 3.84Å; W41-A52 HydrophobicContact CB-CB 4.06Å; R48-A52 WeakPolarHBondContact O-CB 3.36Å; R48-A52 PolarHBondContact O-N 3.07Å; R49-A52 PolarHBondContact O-N 3.48Å; L50-A52 VanDerWaalsContact C-N 3.35Å; L50-A52 PolarHBondContact O-N 3.2Å; A52-N55 WeakPolarHBondContact O-CB 3.43Å; A52-N55 PolarHBondContact O-N 3.31Å; A52-L56 WeakPolarHBondContact O-CG 3.14Å; A52-L56 PolarHBondContact O-N 3.11Å
53	F	94.4	Very high	90.8	Very high	19 Å²	19	53.6 Å²	53.6	8%	0.083	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-46	174.5	-179.3	-113.7	0	0	0	112.5	R49 L50 N55 L56 I57 M74 C99 E102 L103	R49-F53 PolarHBondContact O-N 3.47Å; L50-F53 PolarHBondContact O-N 3.12Å; F53-N55 VanDerWaalsContact C-N 3.27Å; F53-N55 PolarHBondContact O-N 3.05Å; F53-L56 WeakPolarHBondContact O-CB 3.22Å; F53-L56 PolarHBondContact O-N 2.97Å; F53-I57 HydrophobicContact CD1-CG1 4.31Å; F53-I57 HydrophobicContact CD2-CG1 4.39Å; F53-I57 HydrophobicContact CE1-CD1 4.36Å; F53-I57 HydrophobicContact CE1-CG1 3.89Å; F53-I57 HydrophobicContact CE2-CD1 3.88Å; F53-I57 HydrophobicContact CE2-CG1 3.97Å; F53-I57 HydrophobicContact CZ-CD1 3.7Å; F53-I57 HydrophobicContact CZ-CG1 3.71Å; F53-I57 WeakPolarHBondContact O-CG1 3.34Å; F53-I57 PolarHBondContact O-N 3.11Å; F53-M74 HydrophobicContact CD2-CE 3.93Å; F53-M74 HydrophobicContact CE2-CE 4.03Å; F53-C99 HydrophobicContact CD1-CB 4.4Å; F53-C99 HydrophobicContact CD2-CB 3.8Å; F53-C99 HydrophobicContact CE1-CB 4.27Å; F53-C99 HydrophobicContact CE2-CB 3.66Å; F53-C99 WeakPolarHBondContact CE2-O 3.38Å; F53-C99 HydrophobicContact CG-CB 4.17Å; F53-C99 HydrophobicContact CZ-CB 3.9Å; F53-C99 WeakPolarHBondContact CZ-O 3.39Å; F53-E102 HydrophobicContact CE1-CG 4.48Å; F53-E102 HydrophobicContact CZ-CB 4.26Å; F53-E102 HydrophobicContact CZ-CG 4.27Å; F53-L103 HydrophobicContact CE2-CB 4.43Å
54	L	92.9	Very high	90.8	Very high	104 Å²	104	56 Å²	56	55%	0.545	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-38.1	176	-70.3	173.7	0	0	0	112.2	L50 L51 I57 K58	L50-L54 VanDerWaalsContact O-CG 3.3Å; L50-L54 WeakPolarHBondContact O-CG 3.34Å; L50-L54 PolarHBondContact O-N 3.43Å; L51-L54 PolarHBondContact O-N 3.32Å; L54-I57 PolarHBondContact O-N 3.22Å; L54-K58 WeakPolarHBondContact O-CB 3.27Å; L54-K58 PolarHBondContact O-N 2.94Å
55	N	92.2	Very high	90.8	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-37	173.9	-77.4	-23.7	0	0	0	112.4	L13 N17 I20 F33 M37 L51 A52 F53 A59	L13-N55 PolarHBondContact O-ND2 3.06Å; N17-N55 WeakPolarHBondContact CA-OD1 3.48Å; N17-N55 WeakPolarHBondContact CB-OD1 3.17Å; I20-N55 HydrophobicContact CD1-CB 4.08Å; F33-N55 HydrophobicContact CZ-CB 4.5Å; M37-N55 HydrophobicContact SD-CB 4.1Å; L51-N55 PolarHBondContact O-N 3.36Å; L51-N55 PolarHBondContact O-ND2 3.08Å; A52-N55 WeakPolarHBondContact O-CB 3.43Å; A52-N55 PolarHBondContact O-N 3.31Å; F53-N55 VanDerWaalsContact C-N 3.27Å; F53-N55 PolarHBondContact O-N 3.05Å; N55-A59 WeakPolarHBondContact O-CB 3.39Å; N55-A59 PolarHBondContact O-N 2.56Å
56	L	93.4	Very high	90.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-48.8	174.1	-70.9	169	0	0	0	111.2	F34 M37 V38 A52 F53 K58 A59 L60 M74	F34-L56 HydrophobicContact CD1-CD2 3.57Å; F34-L56 HydrophobicContact CE1-CD2 4.02Å; M37-L56 HydrophobicContact CB-CD1 4.3Å; M37-L56 HydrophobicContact CB-CD2 3.6Å; M37-L56 HydrophobicContact CB-CG 3.83Å; M37-L56 HydrophobicContact CG-CD2 4.36Å; V38-L56 HydrophobicContact CG2-CD1 4.05Å; V38-L56 HydrophobicContact CG2-CD2 4.3Å; A52-L56 WeakPolarHBondContact O-CG 3.14Å; A52-L56 PolarHBondContact O-N 3.11Å; F53-L56 WeakPolarHBondContact O-CB 3.22Å; F53-L56 PolarHBondContact O-N 2.97Å; L56-K58 VanDerWaalsContact C-N 3.31Å; L56-K58 PolarHBondContact O-N 3.48Å; L56-A59 WeakPolarHBondContact O-CB 3.32Å; L56-A59 PolarHBondContact O-N 3.17Å; L56-A59 VanDerWaalsContact O-N 3.08Å; L56-L60 WeakPolarHBondContact O-CG 3.41Å; L56-L60 PolarHBondContact O-N 2.91Å; L56-M74 HydrophobicContact CD1-CE 4.47Å; L56-M74 HydrophobicContact CD1-CG 4.35Å; L56-M74 HydrophobicContact CD1-SD 3.77Å
57	I	93.1	Very high	91.1	Very high	30 Å²	30	51.2 Å²	51.2	15%	0.154	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-43.7	177.3	-65.6	-58.3	0	0	0	111.3	F53 L54 A59 L60 S61 L103 K106	F53-I57 HydrophobicContact CD1-CG1 4.31Å; F53-I57 HydrophobicContact CD2-CG1 4.39Å; F53-I57 HydrophobicContact CE1-CD1 4.36Å; F53-I57 HydrophobicContact CE1-CG1 3.89Å; F53-I57 HydrophobicContact CE2-CD1 3.88Å; F53-I57 HydrophobicContact CE2-CG1 3.97Å; F53-I57 HydrophobicContact CZ-CD1 3.7Å; F53-I57 HydrophobicContact CZ-CG1 3.71Å; F53-I57 WeakPolarHBondContact O-CG1 3.34Å; F53-I57 PolarHBondContact O-N 3.11Å; L54-I57 PolarHBondContact O-N 3.22Å; I57-A59 VanDerWaalsContact C-N 3.34Å; I57-A59 PolarHBondContact O-N 3.49Å; I57-L60 PolarHBondContact O-N 3.21Å; I57-S61 PolarHBondContact O-N 2.75Å; I57-L103 HydrophobicContact CD1-CD1 3.59Å; I57-K106 HydrophobicContact CD1-CD 4.1Å; I57-K106 HydrophobicContact CG2-CD 4.03Å
58	K	91.7	Very high	91.3	Very high	73 Å²	73	48.6 Å²	48.6	32%	0.317	24%	0.241	S	C	.	.	H	α-helix	trans	-66.1	-34.9	175.7	-176.7	175.8	173.2	-172.4	0	112.7	N17 I20 L54 L56 L60 S61 L62	N17-K58 PolarHBondContact O-NZ 2.81Å; N17-K58 WeakPolarHBondContact OD1-CD 3.47Å; N17-K58 WeakPolarHBondContact OD1-CE 3.46Å; N17-K58 PolarHBondContact OD1-NZ 3.3Å; I20-K58 HydrophobicContact CD1-CB 4.22Å; I20-K58 HydrophobicContact CD1-CD 4.02Å; I20-K58 HydrophobicContact CD1-CG 4.22Å; L54-K58 WeakPolarHBondContact O-CB 3.27Å; L54-K58 PolarHBondContact O-N 2.94Å; L56-K58 VanDerWaalsContact C-N 3.31Å; L56-K58 PolarHBondContact O-N 3.48Å; K58-L60 VanDerWaalsContact C-N 3.35Å; K58-S61 PolarHBondContact O-OG 3.46Å; K58-L62 WeakPolarHBondContact O-CG 3.38Å; K58-L62 PolarHBondContact O-N 3.38Å
59	A	91.2	Very high	91.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-41	175.5	0	0	0	0	0	111.4	I20 L24 F33 F34 N55 L56 I57 L62 K63	I20-A59 HydrophobicContact CG2-CB 3.97Å; L24-A59 HydrophobicContact CD1-CB 4.1Å; L24-A59 HydrophobicContact CD2-CB 4.33Å; F33-A59 HydrophobicContact CE1-CB 3.6Å; F33-A59 HydrophobicContact CZ-CB 4.11Å; F34-A59 HydrophobicContact CE1-CB 4.21Å; F34-A59 HydrophobicContact CZ-CB 4.04Å; N55-A59 WeakPolarHBondContact O-CB 3.39Å; N55-A59 PolarHBondContact O-N 2.56Å; L56-A59 WeakPolarHBondContact O-CB 3.32Å; L56-A59 PolarHBondContact O-N 3.17Å; L56-A59 VanDerWaalsContact O-N 3.08Å; I57-A59 VanDerWaalsContact C-N 3.34Å; I57-A59 PolarHBondContact O-N 3.49Å; A59-L62 PolarHBondContact O-N 2.91Å; A59-K63 PolarHBondContact O-N 3.26Å
60	L	91.2	Very high	91.4	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-70.5	-30.7	178.2	-69.2	177.3	0	0	0	113.7	F34 L56 I57 K58 L62 K63 R64 C66 A67 C70 L103	F34-L60 HydrophobicContact CE1-CD2 4.19Å; F34-L60 HydrophobicContact CE1-CG 4.44Å; F34-L60 HydrophobicContact CZ-CD2 4.21Å; L56-L60 WeakPolarHBondContact O-CG 3.41Å; L56-L60 PolarHBondContact O-N 2.91Å; I57-L60 PolarHBondContact O-N 3.21Å; K58-L60 VanDerWaalsContact C-N 3.35Å; L60-L62 PolarHBondContact O-N 3.09Å; L60-K63 CarbonylContact O-C 3.42Å; L60-R64 PolarHBondContact O-N 3.45Å; L60-C66 HydrophobicContact CD2-CB 4.07Å; L60-A67 HydrophobicContact CD2-CB 4.33Å; L60-C70 HydrophobicContact CD1-CB 4.11Å; L60-C70 HydrophobicContact CD2-CB 3.97Å; L60-C70 HydrophobicContact CG-CB 4.43Å; L60-L103 HydrophobicContact CD1-CD1 3.27Å; L60-L103 HydrophobicContact CD1-CG 4.39Å
61	S	89.9	Confident	91.5	Very high	96 Å²	96	43.7 Å²	43.7	67%	0.671	22%	0.221	S	C	*	.	H	α-helix	trans	-68.6	-23.2	172.6	70.6	0	0	0	0	113	I57 K58	I57-S61 PolarHBondContact O-N 2.75Å; K58-S61 PolarHBondContact O-OG 3.46Å
62	L	89.4	Confident	91.6	Very high	92 Å²	92	43.1 Å²	43.1	48%	0.482	22%	0.216	S	C	.	.	H	α-helix	trans	-87.5	-37.3	176.1	-67.1	169.7	0	0	0	112.8	I20 P21 L24 K58 A59 L60	I20-L62 HydrophobicContact CG2-CD1 3.72Å; P21-L62 HydrophobicContact CB-CD1 4.41Å; P21-L62 HydrophobicContact CG-CD1 3.87Å; L24-L62 HydrophobicContact CD1-CB 3.91Å; L24-L62 HydrophobicContact CD1-CD1 4.12Å; K58-L62 WeakPolarHBondContact O-CG 3.38Å; K58-L62 PolarHBondContact O-N 3.38Å; A59-L62 PolarHBondContact O-N 2.91Å; L60-L62 PolarHBondContact O-N 3.09Å
63	K	88.2	Confident	91.6	Very high	58 Å²	58	44.4 Å²	44.4	25%	0.252	22%	0.223	S	C	.	.			trans	-138.1	92.8	179.9	-168.9	173.9	168.2	-173.4	0	110.2	L24 E30 A59 L60 E65 C66	L24-K63 HydrophobicContact CD1-CB 4.49Å; E30-K63 IonicContact OE1-NZ 2.84Å; E30-K63 IonicContact OE2-NZ 3.29Å; E30-K63 PolarHBondContact OE2-NZ 3.27Å; A59-K63 PolarHBondContact O-N 3.26Å; L60-K63 CarbonylContact O-C 3.42Å; K63-E65 VanDerWaalsContact C-N 3.26Å; K63-E65 VanDerWaalsContact CE-OE2 3.28Å; K63-E65 WeakPolarHBondContact CE-OE2 3.03Å; K63-E65 HydrophobicContact CG-CB 4.31Å; K63-E65 PolarHBondContact O-N 2.7Å; K63-C66 WeakPolarHBondContact CD-SG 3.37Å; K63-C66 WeakPolarHBondContact CG-SG 3.27Å; K63-C66 PolarHBondContact O-N 3.35Å
64	R	88.5	Confident	91.7	Very high	135 Å²	135	43.5 Å²	43.5	51%	0.509	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-65	-28.7	-178.4	-173.1	172.8	174.1	176.3	-3	112.9	L60 C66 A67 N107 D109	L60-R64 PolarHBondContact O-N 3.45Å; R64-C66 PolarHBondContact O-N 3.4Å; R64-A67 WeakPolarHBondContact O-CB 3.5Å; R64-A67 PolarHBondContact O-N 2.73Å; R64-N107 PolarHBondContact NE-OD1 3Å; R64-D109 IonicContact NH2-OD2 3.86Å
65	E	88.1	Confident	91.8	Very high	168 Å²	168	38.8 Å²	38.8	79%	0.785	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-56.7	-23.2	177.3	-60.8	170	179.4	0	0	113.5	K63 A67	K63-E65 VanDerWaalsContact C-N 3.26Å; K63-E65 VanDerWaalsContact CE-OE2 3.28Å; K63-E65 WeakPolarHBondContact CE-OE2 3.03Å; K63-E65 HydrophobicContact CG-CB 4.31Å; K63-E65 PolarHBondContact O-N 2.7Å; E65-A67 VanDerWaalsContact C-N 3.25Å; E65-A67 PolarHBondContact O-N 2.81Å
66	C	88.7	Confident	91.9	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.02	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-82.2	-1	178.5	-51.5	0	0	0	0	113.6	E30 F34 L60 K63 R64 G68 L69 C70	E30-C66 PolarHBondContact OE1-SG 3.09Å; F34-C66 HydrophobicContact CE2-CB 3.6Å; F34-C66 HydrophobicContact CZ-CB 3.56Å; L60-C66 HydrophobicContact CD2-CB 4.07Å; K63-C66 WeakPolarHBondContact CD-SG 3.37Å; K63-C66 WeakPolarHBondContact CG-SG 3.27Å; K63-C66 PolarHBondContact O-N 3.35Å; R64-C66 PolarHBondContact O-N 3.4Å; C66-G68 PolarHBondContact O-N 2.65Å; C66-L69 PolarHBondContact O-N 3.33Å; C66-C70 WeakPolarHBondContact O-CB 3.21Å; C66-C70 PolarHBondContact O-N 3.1Å
67	A	91.6	Very high	91.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.2	-49.8	-173.8	0	0	0	0	0	112.2	L60 R64 E65 L69 C70 I71 N107 D110	L60-A67 HydrophobicContact CD2-CB 4.33Å; R64-A67 WeakPolarHBondContact O-CB 3.5Å; R64-A67 PolarHBondContact O-N 2.73Å; E65-A67 VanDerWaalsContact C-N 3.25Å; E65-A67 PolarHBondContact O-N 2.81Å; A67-L69 PolarHBondContact O-N 3.17Å; A67-C70 PolarHBondContact O-N 2.93Å; A67-C70 VanDerWaalsContact O-N 3.14Å; A67-I71 WeakPolarHBondContact O-CB 3.46Å; A67-I71 WeakPolarHBondContact O-CG1 3.5Å; A67-I71 PolarHBondContact O-N 2.94Å; A67-N107 HydrophobicContact CB-CB 4.26Å; A67-N107 WeakPolarHBondContact CB-ND2 3.16Å; A67-D110 HydrophobicContact CB-CB 4.27Å; A67-D110 WeakPolarHBondContact CB-OD2 3.47Å
68	G	91.7	Very high	92.1	Very high	17 Å²	17	38.4 Å²	38.4	18%	0.175	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-43	-179.4	0	0	0	0	0	113	C66 C70 I71 K72 H114	C66-G68 PolarHBondContact O-N 2.65Å; G68-C70 VanDerWaalsContact C-N 3.35Å; G68-C70 PolarHBondContact O-N 2.89Å; G68-I71 PolarHBondContact O-N 3.23Å; G68-K72 WeakPolarHBondContact O-CB 3.35Å; G68-K72 PolarHBondContact O-N 3.09Å; G68-H114 WeakPolarHBondContact CA-NE2 3.33Å; G68-H114 PolarHBondContact O-CE1 2.91Å; G68-H114 PolarHBondContact O-NE2 3.35Å; G68-H114 VanDerWaalsContact O-NE2 3.15Å
69	L	91.5	Very high	92.2	Very high	55 Å²	55	35 Å²	35	29%	0.288	18%	0.179	S	C	.	.	H	α-helix	trans	-60.7	-43.9	174.6	177	64	0	0	0	111.8	K31 F34 C66 A67 L73	K31-L69 HydrophobicContact CG-CD2 3.97Å; F34-L69 HydrophobicContact CD2-CD2 4.38Å; C66-L69 PolarHBondContact O-N 3.33Å; A67-L69 PolarHBondContact O-N 3.17Å; L69-L73 HydrophobicContact CD1-CD1 3.96Å; L69-L73 HydrophobicContact CD1-CG 4.17Å; L69-L73 HydrophobicContact CG-CD1 4.03Å; L69-L73 WeakPolarHBondContact O-CB 3.08Å; L69-L73 VanDerWaalsContact O-CG 3.28Å; L69-L73 WeakPolarHBondContact O-CG 3.47Å; L69-L73 PolarHBondContact O-N 2.78Å
70	C	93.9	Very high	92.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-45.2	-179.6	-170.6	0	0	0	0	111.7	F34 L60 C66 A67 G68 L73 M74	F34-C70 HydrophobicContact CD1-CB 3.93Å; F34-C70 HydrophobicContact CE1-CB 3.87Å; L60-C70 HydrophobicContact CD1-CB 4.11Å; L60-C70 HydrophobicContact CD2-CB 3.97Å; L60-C70 HydrophobicContact CG-CB 4.43Å; C66-C70 WeakPolarHBondContact O-CB 3.21Å; C66-C70 PolarHBondContact O-N 3.1Å; A67-C70 PolarHBondContact O-N 2.93Å; A67-C70 VanDerWaalsContact O-N 3.14Å; G68-C70 VanDerWaalsContact C-N 3.35Å; G68-C70 PolarHBondContact O-N 2.89Å; C70-L73 PolarHBondContact O-N 2.87Å; C70-M74 WeakPolarHBondContact O-CB 3.47Å; C70-M74 WeakPolarHBondContact O-CG 3.42Å; C70-M74 PolarHBondContact O-N 3.12Å
71	I	94.5	Very high	92.4	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-51.9	177.5	-74.4	165.6	0	0	0	109.9	A67 G68 L73 M74 F75 L103 F104 D110 A111 H114	A67-I71 WeakPolarHBondContact O-CB 3.46Å; A67-I71 WeakPolarHBondContact O-CG1 3.5Å; A67-I71 PolarHBondContact O-N 2.94Å; G68-I71 PolarHBondContact O-N 3.23Å; I71-L73 PolarHBondContact O-N 2.94Å; I71-M74 PolarHBondContact O-N 3.33Å; I71-F75 WeakPolarHBondContact O-CB 3.27Å; I71-F75 PolarHBondContact O-N 2.94Å; I71-L103 HydrophobicContact CG1-CD2 3.81Å; I71-L103 HydrophobicContact CG1-CG 4.46Å; I71-F104 HydrophobicContact CD1-CD1 4.45Å; I71-F104 HydrophobicContact CG1-CD1 4.21Å; I71-F104 HydrophobicContact CG1-CE1 4.2Å; I71-F104 HydrophobicContact CG2-CE1 3.84Å; I71-D110 HydrophobicContact CD1-CB 4.07Å; I71-A111 HydrophobicContact CD1-CB 4.19Å; I71-H114 HydrophobicContact CG2-CB 3.79Å; I71-H114 VanDerWaalsContact CG2-CD2 3.49Å; I71-H114 WeakPolarHBondContact CG2-CD2 3.39Å
72	K	93.8	Very high	92.5	Very high	40 Å²	40	37 Å²	37	17%	0.174	17%	0.173	C	C	.	.	H	α-helix	trans	-56.2	-51.8	178.3	171.7	172.4	173.4	-165.7	0	112.5	G68 M74 F75 V76 Y118 D512	G68-K72 WeakPolarHBondContact O-CB 3.35Å; G68-K72 PolarHBondContact O-N 3.09Å; K72-M74 VanDerWaalsContact C-N 3.34Å; K72-M74 PolarHBondContact O-N 3.25Å; K72-F75 PolarHBondContact O-N 3.46Å; K72-V76 WeakPolarHBondContact O-CB 3.18Å; K72-V76 WeakPolarHBondContact O-CG2 3.47Å; K72-V76 PolarHBondContact O-N 2.84Å; K72-Y118 WeakPolarHBondContact CG-OH 3.31Å; K72-D512 IonicContact NZ-OD1 2.68Å; K72-D512 PolarHBondContact NZ-OD1 3.06Å; K72-D512 IonicContact NZ-OD2 3.65Å; K72-D512 PolarHBondContact NZ-OD2 3.47Å
73	L	94.1	Very high	92.6	Very high	28 Å²	28	37 Å²	37	15%	0.147	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-42.7	-179.1	-72.2	173.3	0	0	0	111.8	F34 K35 V38 L69 C70 I71 A77	F34-L73 HydrophobicContact CB-CD1 3.83Å; K35-L73 HydrophobicContact CG-CD1 3.91Å; K35-L73 HydrophobicContact CG-CD2 4.03Å; V38-L73 HydrophobicContact CB-CB 4.47Å; V38-L73 HydrophobicContact CG1-CB 4.31Å; V38-L73 WeakPolarHBondContact CG1-O 3.43Å; V38-L73 HydrophobicContact CG2-CB 4Å; L69-L73 HydrophobicContact CD1-CD1 3.96Å; L69-L73 HydrophobicContact CD1-CG 4.17Å; L69-L73 HydrophobicContact CG-CD1 4.03Å; L69-L73 WeakPolarHBondContact O-CB 3.08Å; L69-L73 VanDerWaalsContact O-CG 3.28Å; L69-L73 WeakPolarHBondContact O-CG 3.47Å; L69-L73 PolarHBondContact O-N 2.78Å; C70-L73 PolarHBondContact O-N 2.87Å; I71-L73 PolarHBondContact O-N 2.94Å; L73-A77 WeakPolarHBondContact O-CB 3.33Å; L73-A77 PolarHBondContact O-N 2.8Å
74	M	95.5	Very high	92.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.9	-39.4	179.3	-72.4	-175.9	64.7	0	0	112.3	V38 W41 F53 L56 C70 I71 K72 A77 F78 L100 L103	V38-M74 HydrophobicContact CG1-CG 4.27Å; V38-M74 HydrophobicContact CG2-CG 3.57Å; W41-M74 HydrophobicContact CD2-CE 3.99Å; W41-M74 HydrophobicContact CE3-CE 4.17Å; W41-M74 HydrophobicContact CE3-CG 4.39Å; W41-M74 HydrophobicContact CH2-CB 4.3Å; W41-M74 HydrophobicContact CH2-CE 3.79Å; W41-M74 HydrophobicContact CZ2-CE 3.59Å; W41-M74 HydrophobicContact CZ3-CB 4.03Å; W41-M74 HydrophobicContact CZ3-CE 4.09Å; W41-M74 HydrophobicContact CZ3-CG 4.25Å; W41-M74 WeakPolarHBondContact CZ3-O 3.21Å; F53-M74 HydrophobicContact CD2-CE 3.93Å; F53-M74 HydrophobicContact CE2-CE 4.03Å; L56-M74 HydrophobicContact CD1-CE 4.47Å; L56-M74 HydrophobicContact CD1-CG 4.35Å; L56-M74 HydrophobicContact CD1-SD 3.77Å; C70-M74 WeakPolarHBondContact O-CB 3.47Å; C70-M74 WeakPolarHBondContact O-CG 3.42Å; C70-M74 PolarHBondContact O-N 3.12Å; I71-M74 PolarHBondContact O-N 3.33Å; K72-M74 VanDerWaalsContact C-N 3.34Å; K72-M74 PolarHBondContact O-N 3.25Å; M74-A77 PolarHBondContact O-N 3.23Å; M74-F78 WeakPolarHBondContact O-CB 3.09Å; M74-F78 PolarHBondContact O-N 3.49Å; M74-L100 HydrophobicContact CB-CD2 3.55Å; M74-L100 HydrophobicContact CE-CD2 4.15Å; M74-L100 HydrophobicContact CE-CG 4.39Å; M74-L103 HydrophobicContact CE-CD2 4.34Å; M74-L103 HydrophobicContact SD-CD1 4.46Å; M74-L103 HydrophobicContact SD-CD2 3.59Å; M74-L103 VanDerWaalsContact SD-CD2 3.59Å
75	F	95.4	Very high	92.8	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-51.3	177	177.5	-108.8	0	0	0	111.1	I71 K72 A77 F78 V79 Y118 L152 W153 L508	I71-F75 WeakPolarHBondContact O-CB 3.27Å; I71-F75 PolarHBondContact O-N 2.94Å; K72-F75 PolarHBondContact O-N 3.46Å; F75-A77 VanDerWaalsContact C-N 3.33Å; F75-A77 PolarHBondContact O-N 3.38Å; F75-F78 WeakPolarHBondContact O-CA 3.34Å; F75-F78 WeakPolarHBondContact O-CB 3.3Å; F75-F78 PolarHBondContact O-N 3.09Å; F75-V79 HydrophobicContact CD1-CG2 4.37Å; F75-V79 HydrophobicContact CD2-CG2 4.34Å; F75-V79 HydrophobicContact CE1-CG2 3.97Å; F75-V79 HydrophobicContact CE2-CG2 3.91Å; F75-V79 HydrophobicContact CZ-CG2 3.71Å; F75-V79 WeakPolarHBondContact O-CG2 3.41Å; F75-V79 PolarHBondContact O-N 3.17Å; F75-Y118 HydrophobicContact CB-CE2 4.42Å; F75-Y118 AromaticContact CD1-CD1 3.92Å; F75-Y118 HydrophobicContact CD1-CD1 3.92Å; F75-Y118 AromaticContact CD1-CD2 3.77Å; F75-Y118 HydrophobicContact CD1-CD2 3.77Å; F75-Y118 AromaticContact CD1-CE1 3.66Å; F75-Y118 HydrophobicContact CD1-CE1 3.66Å; F75-Y118 AromaticContact CD1-CE2 3.5Å; F75-Y118 HydrophobicContact CD1-CE2 3.5Å; F75-Y118 VanDerWaalsContact CD1-CE2 3.5Å; F75-Y118 AromaticContact CD1-CG 3.97Å; F75-Y118 HydrophobicContact CD1-CG 3.97Å; F75-Y118 AromaticContact CD1-CZ 3.44Å; F75-Y118 VanDerWaalsContact CD1-CZ 3.44Å; F75-Y118 AromaticContact CE1-CD1 3.43Å; F75-Y118 HydrophobicContact CE1-CD1 3.43Å; F75-Y118 VanDerWaalsContact CE1-CD1 3.43Å; F75-Y118 AromaticContact CE1-CD2 3.79Å; F75-Y118 HydrophobicContact CE1-CD2 3.79Å; F75-Y118 AromaticContact CE1-CE1 3.63Å; F75-Y118 HydrophobicContact CE1-CE1 3.63Å; F75-Y118 AromaticContact CE1-CE2 3.96Å; F75-Y118 HydrophobicContact CE1-CE2 3.96Å; F75-Y118 AromaticContact CE1-CG 3.51Å; F75-Y118 HydrophobicContact CE1-CG 3.51Å; F75-Y118 AromaticContact CE1-CZ 3.89Å; F75-Y118 HydrophobicContact CG-CD2 4.31Å; F75-Y118 HydrophobicContact CG-CE2 4.05Å; F75-Y118 HydrophobicContact CZ-CD1 4.32Å; F75-Y118 HydrophobicContact CZ-CD2 4.37Å; F75-Y118 HydrophobicContact CZ-CG 4.06Å; F75-L152 HydrophobicContact CD2-CD2 3.62Å; F75-L152 HydrophobicContact CE2-CD2 3.79Å; F75-W153 AromaticContact CD2-CZ2 3.85Å; F75-W153 HydrophobicContact CD2-CZ2 3.85Å; F75-W153 HydrophobicContact CE1-CZ2 4.5Å; F75-W153 AromaticContact CE2-CE2 3.88Å; F75-W153 AromaticContact CE2-CZ2 3.65Å; F75-W153 HydrophobicContact CE2-CZ2 3.65Å; F75-W153 AromaticContact CE2-NE1 3.71Å; F75-W153 HydrophobicContact CG-CZ2 4.38Å; F75-W153 HydrophobicContact CZ-CZ2 4Å; F75-W153 AromaticContact CZ-NE1 3.77Å; F75-L508 HydrophobicContact CD1-CD1 3.98Å; F75-L508 HydrophobicContact CE1-CD1 3.54Å
76	V	93.9	Very high	92.9	Very high	15 Å²	15	31 Å²	31	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-52.6	-49.5	173.6	154	0	0	0	0	111.6	K72 F78 V79 R80 E505 L508 M509	K72-V76 WeakPolarHBondContact O-CB 3.18Å; K72-V76 WeakPolarHBondContact O-CG2 3.47Å; K72-V76 PolarHBondContact O-N 2.84Å; V76-F78 VanDerWaalsContact C-N 3.29Å; V76-F78 PolarHBondContact O-N 3.42Å; V76-V79 PolarHBondContact O-N 3.41Å; V76-R80 PolarHBondContact O-N 3.36Å; V76-E505 WeakPolarHBondContact CG1-OE1 3.29Å; V76-E505 VanDerWaalsContact CG1-OE2 3.27Å; V76-E505 WeakPolarHBondContact CG1-OE2 3.41Å; V76-L508 HydrophobicContact CG2-CD1 4.27Å; V76-M509 HydrophobicContact CG2-SD 4.36Å
77	A	94.4	Very high	93	Very high	8 Å²	8	31.8 Å²	31.8	7%	0.066	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-33.2	178.8	0	0	0	0	0	113	V38 W41 L73 M74 F75 N81	V38-A77 HydrophobicContact CG1-CB 3.5Å; V38-A77 VanDerWaalsContact CG1-CB 3.5Å; W41-A77 HydrophobicContact CZ3-CB 4.25Å; L73-A77 WeakPolarHBondContact O-CB 3.33Å; L73-A77 PolarHBondContact O-N 2.8Å; M74-A77 PolarHBondContact O-N 3.23Å; F75-A77 VanDerWaalsContact C-N 3.33Å; F75-A77 PolarHBondContact O-N 3.38Å; A77-N81 PolarHBondContact O-N 3.49Å; A77-N81 PolarHBondContact O-ND2 2.88Å
78	F	96	Very high	92.9	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-49.6	173	167.1	-101.8	0	0	0	111.7	W41 M74 F75 V76 R80 N81 C82 I93 M96 R97 L100 C148 L152	W41-F78 HydrophobicContact CH2-CB 4.3Å; M74-F78 WeakPolarHBondContact O-CB 3.09Å; M74-F78 PolarHBondContact O-N 3.49Å; F75-F78 WeakPolarHBondContact O-CA 3.34Å; F75-F78 WeakPolarHBondContact O-CB 3.3Å; F75-F78 PolarHBondContact O-N 3.09Å; V76-F78 VanDerWaalsContact C-N 3.29Å; V76-F78 PolarHBondContact O-N 3.42Å; F78-R80 VanDerWaalsContact C-N 3.28Å; F78-R80 PolarHBondContact O-N 3.33Å; F78-N81 PolarHBondContact O-N 2.91Å; F78-N81 VanDerWaalsContact O-N 3.07Å; F78-C82 VanDerWaalsContact CE2-SG 3.58Å; F78-C82 PolarHBondContact O-N 3.42Å; F78-C82 PolarHBondContact O-SG 3.36Å; F78-I93 HydrophobicContact CE2-CG2 4.06Å; F78-M96 HydrophobicContact CB-CE 4.19Å; F78-M96 HydrophobicContact CD2-CB 3.88Å; F78-M96 HydrophobicContact CE2-CB 4.47Å; F78-R97 HydrophobicContact CE2-CB 4.01Å; F78-R97 HydrophobicContact CZ-CB 4.35Å; F78-L100 HydrophobicContact CB-CD1 3.51Å; F78-L100 HydrophobicContact CD1-CD1 4.04Å; F78-L100 HydrophobicContact CD2-CD1 4.08Å; F78-L100 HydrophobicContact CG-CD1 3.61Å; F78-C148 HydrophobicContact CE1-CB 4.32Å; F78-C148 HydrophobicContact CZ-CB 4.14Å; F78-L152 HydrophobicContact CD1-CD2 4.09Å; F78-L152 HydrophobicContact CE1-CB 4.09Å; F78-L152 HydrophobicContact CE1-CD2 4.03Å; F78-L152 HydrophobicContact CZ-CB 4.47Å
79	V	94.7	Very high	92.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-41.9	178	175.9	0	0	0	0	111.1	F75 V76 N81 C82 Q145 S149 L504	F75-V79 HydrophobicContact CD1-CG2 4.37Å; F75-V79 HydrophobicContact CD2-CG2 4.34Å; F75-V79 HydrophobicContact CE1-CG2 3.97Å; F75-V79 HydrophobicContact CE2-CG2 3.91Å; F75-V79 HydrophobicContact CZ-CG2 3.71Å; F75-V79 WeakPolarHBondContact O-CG2 3.41Å; F75-V79 PolarHBondContact O-N 3.17Å; V76-V79 PolarHBondContact O-N 3.41Å; V79-N81 PolarHBondContact O-N 3.23Å; V79-C82 PolarHBondContact O-N 3.28Å; V79-C82 VanDerWaalsContact O-N 3.12Å; V79-Q145 HydrophobicContact CG1-CB 4.01Å; V79-Q145 HydrophobicContact CG1-CG 4.36Å; V79-Q145 PolarHBondContact O-NE2 2.85Å; V79-S149 WeakPolarHBondContact CG2-OG 3.49Å; V79-L504 HydrophobicContact CG1-CD2 3.77Å; V79-L504 HydrophobicContact CG1-CG 4.35Å
80	R	93.3	Very high	92.8	Very high	116 Å²	116	35.6 Å²	35.6	44%	0.438	18%	0.181	S	C	.	.	H	α-helix	trans	-60.7	-40.7	175.4	-171.4	-178.8	64.7	114.9	1.3	113	S42 E43 V76 F78 C82 K83	S42-R80 PolarHBondContact OG-NH2 3.01Å; E43-R80 IonicContact OE1-CZ 2.67Å; E43-R80 VanDerWaalsContact OE1-CZ 3.22Å; E43-R80 IonicContact OE1-NH1 2.86Å; E43-R80 PolarHBondContact OE1-NH1 3.35Å; E43-R80 IonicContact OE1-NH2 2.75Å; E43-R80 PolarHBondContact OE1-NH2 3.46Å; V76-R80 PolarHBondContact O-N 3.36Å; F78-R80 VanDerWaalsContact C-N 3.28Å; F78-R80 PolarHBondContact O-N 3.33Å; R80-C82 PolarHBondContact O-N 2.92Å; R80-K83 PolarHBondContact O-N 3.5Å
81	N	92.9	Very high	92.7	Very high	34 Å²	34	38.5 Å²	38.5	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-75.2	-14.4	177.6	-79.7	-78	0	0	0	113.4	S42 A77 F78 V79 K83 M96	S42-N81 WeakPolarHBondContact CB-ND2 3.46Å; S42-N81 PolarHBondContact O-ND2 2.98Å; S42-N81 PolarHBondContact O-OD1 3.39Å; A77-N81 PolarHBondContact O-N 3.49Å; A77-N81 PolarHBondContact O-ND2 2.88Å; F78-N81 PolarHBondContact O-N 2.91Å; F78-N81 VanDerWaalsContact O-N 3.07Å; V79-N81 PolarHBondContact O-N 3.23Å; N81-K83 VanDerWaalsContact C-N 3.32Å; N81-M96 HydrophobicContact CB-CE 4.11Å; N81-M96 HydrophobicContact CB-SD 3.99Å
82	C	93.3	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	9.8	175.4	-62	0	0	0	0	113.3	F78 V79 R80 F84 W144 C148	F78-C82 VanDerWaalsContact CE2-SG 3.58Å; F78-C82 PolarHBondContact O-N 3.42Å; F78-C82 PolarHBondContact O-SG 3.36Å; V79-C82 PolarHBondContact O-N 3.28Å; V79-C82 VanDerWaalsContact O-N 3.12Å; R80-C82 PolarHBondContact O-N 2.92Å; C82-F84 PolarHBondContact O-N 3.01Å; C82-W144 WeakPolarHBondContact O-CB 3.36Å; C82-C148 HydrophobicContact CB-CB 3.72Å
83	K	90.9	Very high	92.6	Very high	93 Å²	93	38.3 Å²	38.3	40%	0.404	21%	0.205	S	C	.	.	S	Bend	trans	-57.4	-38.5	177	-173.7	166.8	-178.3	144.3	0	112	R80 N81 D501	R80-K83 PolarHBondContact O-N 3.5Å; N81-K83 VanDerWaalsContact C-N 3.32Å; K83-D501 IonicContact NZ-OD2 3.22Å; K83-D501 PolarHBondContact NZ-OD2 3.32Å
84	F	90	Very high	92.6	Very high	129 Å²	129	39.8 Å²	39.8	57%	0.566	21%	0.213	S	C	*	.			trans	-132.4	128.1	175.3	-57	-71.8	0	0	0	109.7	C82 L86 N89	C82-F84 PolarHBondContact O-N 3.01Å; F84-L86 HydrophobicContact CB-CG 4.39Å; F84-N89 PolarHBondContact O-ND2 3.14Å
85	V	91.6	Very high	92.5	Very high	12 Å²	12	42.3 Å²	42.3	7%	0.073	23%	0.226	C	C	.	.			trans	-104.2	112.6	172	-179.3	0	0	0	0	108.5	I90 I93 W144 L276	V85-I90 HydrophobicContact CG1-CB 4.4Å; V85-I90 HydrophobicContact CG1-CD1 4.42Å; V85-I90 HydrophobicContact CG1-CG1 4.38Å; V85-I93 HydrophobicContact CB-CD1 4.43Å; V85-I93 HydrophobicContact CG2-CD1 3.82Å; V85-W144 HydrophobicContact CB-CD2 3.65Å; V85-W144 HydrophobicContact CB-CE3 3.89Å; V85-W144 HydrophobicContact CB-CG 4.11Å; V85-W144 HydrophobicContact CB-CH2 4.25Å; V85-W144 HydrophobicContact CB-CZ2 4.01Å; V85-W144 HydrophobicContact CB-CZ3 4.18Å; V85-W144 HydrophobicContact CG1-CH2 4.34Å; V85-W144 HydrophobicContact CG1-CZ2 4.46Å; V85-W144 HydrophobicContact CG1-CZ3 4.36Å; V85-W144 HydrophobicContact CG2-CB 4.01Å; V85-W144 HydrophobicContact CG2-CD2 3.39Å; V85-W144 HydrophobicContact CG2-CE3 3.39Å; V85-W144 HydrophobicContact CG2-CG 3.7Å; V85-W144 HydrophobicContact CG2-CZ3 4.02Å; V85-L276 HydrophobicContact CG1-CD2 4.08Å
86	L	90.3	Very high	92.5	Very high	94 Å²	94	42.1 Å²	42.1	49%	0.492	23%	0.225	S	C	.	.			trans	-124.6	161.3	-175.6	-60	172.3	0	0	0	109.7	F84 S88 N89 I90	F84-L86 HydrophobicContact CB-CG 4.39Å; L86-S88 PolarHBondContact O-N 2.98Å; L86-S88 VanDerWaalsContact O-N 3.14Å; L86-N89 PolarHBondContact N-OD1 3.35Å; L86-N89 PolarHBondContact O-N 3.44Å; L86-N89 PolarHBondContact O-OD1 3.44Å; L86-I90 WeakPolarHBondContact O-CB 3.5Å; L86-I90 PolarHBondContact O-N 3.11Å
87	A	89.9	Confident	92.6	Very high	20 Å²	20	42.7 Å²	42.7	17%	0.165	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.7	176.3	0	0	0	0	0	113.2	L276 N413	A87-L276 HydrophobicContact CB-CD1 3.8Å; A87-N413 HydrophobicContact CB-CB 3.61Å
88	S	88.7	Confident	92.6	Very high	100 Å²	100	45.6 Å²	45.6	70%	0.699	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-36.7	179.1	54.6	0	0	0	0	113.4	L86	L86-S88 PolarHBondContact O-N 2.98Å; L86-S88 VanDerWaalsContact O-N 3.14Å
89	N	91.3	Very high	92.6	Very high	28 Å²	28	46 Å²	46	15%	0.15	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-9.8	-173.1	74.8	-1.8	0	0	0	114.2	F84 L86 A91 Q92 I93	F84-N89 PolarHBondContact O-ND2 3.14Å; L86-N89 PolarHBondContact N-OD1 3.35Å; L86-N89 PolarHBondContact O-N 3.44Å; L86-N89 PolarHBondContact O-OD1 3.44Å; N89-A91 PolarHBondContact O-N 2.98Å; N89-A91 VanDerWaalsContact O-N 3.16Å; N89-Q92 WeakPolarHBondContact O-CA 3.39Å; N89-Q92 WeakPolarHBondContact O-CB 3.44Å; N89-Q92 PolarHBondContact O-N 3.17Å; N89-I93 PolarHBondContact O-N 3.47Å
90	I	90.9	Very high	92.7	Very high	23 Å²	23	46 Å²	46	12%	0.118	24%	0.24	C	C	.	.	H	α-helix	trans	-55.5	-37	-179.8	-173.4	165.9	0	0	0	112.6	V85 L86 I93 N94 R275 L276	V85-I90 HydrophobicContact CG1-CB 4.4Å; V85-I90 HydrophobicContact CG1-CD1 4.42Å; V85-I90 HydrophobicContact CG1-CG1 4.38Å; L86-I90 WeakPolarHBondContact O-CB 3.5Å; L86-I90 PolarHBondContact O-N 3.11Å; I90-I93 PolarHBondContact O-N 3.08Å; I90-N94 WeakPolarHBondContact O-CB 3.46Å; I90-N94 PolarHBondContact O-N 2.95Å; I90-N94 PolarHBondContact O-ND2 3.34Å; I90-R275 HydrophobicContact CD1-CB 4.31Å; I90-L276 HydrophobicContact CB-CD2 4.21Å; I90-L276 HydrophobicContact CD1-CD2 3.66Å; I90-L276 HydrophobicContact CG1-CD2 4.49Å; I90-L276 HydrophobicContact CG2-CD2 4.47Å
91	A	91	Very high	92.8	Very high	61 Å²	61	40.4 Å²	40.4	50%	0.504	22%	0.22	S	C	.	.	H	α-helix	trans	-64.9	-41.3	176.2	0	0	0	0	0	111.9	N89 N94 L95	N89-A91 PolarHBondContact O-N 2.98Å; N89-A91 VanDerWaalsContact O-N 3.16Å; A91-N94 PolarHBondContact O-N 3.17Å; A91-L95 WeakPolarHBondContact O-CB 3.17Å; A91-L95 PolarHBondContact O-N 3.17Å
92	Q	92.2	Very high	92.9	Very high	34 Å²	34	43.1 Å²	43.1	16%	0.159	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-46.5	174.2	167.5	-176.7	-3.9	0	0	111.4	S42 R49 N89 N94 L95 M96	S42-Q92 PolarHBondContact O-NE2 2.95Å; R49-Q92 VanDerWaalsContact CZ-CG 3.49Å; N89-Q92 WeakPolarHBondContact O-CA 3.39Å; N89-Q92 WeakPolarHBondContact O-CB 3.44Å; N89-Q92 PolarHBondContact O-N 3.17Å; Q92-N94 VanDerWaalsContact C-N 3.31Å; Q92-N94 PolarHBondContact O-N 3.1Å; Q92-L95 WeakPolarHBondContact O-CB 3.38Å; Q92-L95 PolarHBondContact O-N 3.25Å; Q92-M96 HydrophobicContact CG-CG 4.45Å; Q92-M96 HydrophobicContact CG-SD 4.07Å; Q92-M96 WeakPolarHBondContact O-CG 3.48Å; Q92-M96 PolarHBondContact O-N 2.82Å
93	I	94	Very high	93	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-42.8	179.4	-66.5	174.1	0	0	0	110.3	F78 V85 N89 I90 M96 R97	F78-I93 HydrophobicContact CE2-CG2 4.06Å; V85-I93 HydrophobicContact CB-CD1 4.43Å; V85-I93 HydrophobicContact CG2-CD1 3.82Å; N89-I93 PolarHBondContact O-N 3.47Å; I90-I93 PolarHBondContact O-N 3.08Å; I93-M96 PolarHBondContact O-N 2.99Å; I93-R97 WeakPolarHBondContact O-CB 3.28Å; I93-R97 PolarHBondContact O-N 3.12Å
94	N	93.5	Very high	93.1	Very high	59 Å²	59	38.9 Å²	38.9	32%	0.316	21%	0.213	S	C	.	.	H	α-helix	trans	-60.6	-46.7	173.9	-72	-26.4	0	0	0	111.4	I90 A91 Q92 M96 R97 E98	I90-N94 WeakPolarHBondContact O-CB 3.46Å; I90-N94 PolarHBondContact O-N 2.95Å; I90-N94 PolarHBondContact O-ND2 3.34Å; A91-N94 PolarHBondContact O-N 3.17Å; Q92-N94 VanDerWaalsContact C-N 3.31Å; Q92-N94 PolarHBondContact O-N 3.1Å; N94-M96 VanDerWaalsContact C-N 3.34Å; N94-M96 PolarHBondContact O-N 2.79Å; N94-R97 WeakPolarHBondContact O-CB 3.48Å; N94-R97 PolarHBondContact O-N 3.2Å; N94-R97 VanDerWaalsContact OD1-CZ 3.25Å; N94-R97 PolarHBondContact OD1-NH1 3.43Å; N94-R97 PolarHBondContact OD1-NH2 3.43Å; N94-E98 WeakPolarHBondContact O-CG 3.41Å; N94-E98 PolarHBondContact O-N 3.11Å
95	L	94.2	Very high	93.2	Very high	52 Å²	52	34 Å²	34	27%	0.272	20%	0.199	S	C	.	.	H	α-helix	trans	-59	-45	176.3	178.1	64.6	0	0	0	111.8	L50 A91 Q92 R97 E98 C99	L50-L95 HydrophobicContact CD2-CD1 4.1Å; L50-L95 HydrophobicContact CD2-CD2 4.35Å; A91-L95 WeakPolarHBondContact O-CB 3.17Å; A91-L95 PolarHBondContact O-N 3.17Å; Q92-L95 WeakPolarHBondContact O-CB 3.38Å; Q92-L95 PolarHBondContact O-N 3.25Å; L95-R97 VanDerWaalsContact C-N 3.34Å; L95-R97 PolarHBondContact O-N 3.49Å; L95-E98 PolarHBondContact O-N 3.24Å; L95-C99 PolarHBondContact O-N 2.93Å; L95-C99 PolarHBondContact O-SG 2.88Å
96	M	95	Very high	93.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-42.1	178	-70.2	176.6	73.5	0	0	111.7	W41 F78 N81 Q92 I93 N94 C99 L100	W41-M96 HydrophobicContact CD2-CE 4.5Å; W41-M96 HydrophobicContact CE3-CE 3.95Å; W41-M96 HydrophobicContact CH2-CB 3.89Å; W41-M96 HydrophobicContact CH2-CE 3.49Å; W41-M96 VanDerWaalsContact CH2-CE 3.49Å; W41-M96 HydrophobicContact CH2-CG 4.12Å; W41-M96 HydrophobicContact CZ2-CB 3.59Å; W41-M96 HydrophobicContact CZ2-CE 4.08Å; W41-M96 HydrophobicContact CZ2-CG 3.76Å; W41-M96 WeakPolarHBondContact CZ2-O 3.45Å; W41-M96 HydrophobicContact CZ3-CE 3.4Å; W41-M96 VanDerWaalsContact CZ3-CE 3.4Å; F78-M96 HydrophobicContact CB-CE 4.19Å; F78-M96 HydrophobicContact CD2-CB 3.88Å; F78-M96 HydrophobicContact CE2-CB 4.47Å; N81-M96 HydrophobicContact CB-CE 4.11Å; N81-M96 HydrophobicContact CB-SD 3.99Å; Q92-M96 HydrophobicContact CG-CG 4.45Å; Q92-M96 HydrophobicContact CG-SD 4.07Å; Q92-M96 WeakPolarHBondContact O-CG 3.48Å; Q92-M96 PolarHBondContact O-N 2.82Å; I93-M96 PolarHBondContact O-N 2.99Å; N94-M96 VanDerWaalsContact C-N 3.34Å; N94-M96 PolarHBondContact O-N 2.79Å; M96-C99 PolarHBondContact O-N 2.95Å; M96-L100 PolarHBondContact O-N 3.31Å
97	R	96	Very high	93.2	Very high	26 Å²	26	34.2 Å²	34.2	10%	0.098	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-47.3	174.1	-173.9	-179.2	63.4	-110.6	-5.9	111	F78 I93 N94 L95 C99 L100 L101 L152 D155	F78-R97 HydrophobicContact CE2-CB 4.01Å; F78-R97 HydrophobicContact CZ-CB 4.35Å; I93-R97 WeakPolarHBondContact O-CB 3.28Å; I93-R97 PolarHBondContact O-N 3.12Å; N94-R97 WeakPolarHBondContact O-CB 3.48Å; N94-R97 PolarHBondContact O-N 3.2Å; N94-R97 VanDerWaalsContact OD1-CZ 3.25Å; N94-R97 PolarHBondContact OD1-NH1 3.43Å; N94-R97 PolarHBondContact OD1-NH2 3.43Å; L95-R97 VanDerWaalsContact C-N 3.34Å; L95-R97 PolarHBondContact O-N 3.49Å; R97-C99 PolarHBondContact O-N 3.31Å; R97-L100 PolarHBondContact O-N 3.09Å; R97-L101 HydrophobicContact CG-CD1 4.09Å; R97-L101 VanDerWaalsContact O-CG 3.27Å; R97-L101 WeakPolarHBondContact O-CG 3.36Å; R97-L101 PolarHBondContact O-N 3.08Å; R97-L152 HydrophobicContact CG-CD1 3.73Å; R97-D155 WeakPolarHBondContact CD-OD2 3.06Å; R97-D155 IonicContact NE-OD2 2.85Å; R97-D155 PolarHBondContact NE-OD2 2.92Å
98	E	95.2	Very high	93.4	Very high	70 Å²	70	34.5 Å²	34.5	33%	0.327	20%	0.195	S	C	.	.	H	α-helix	trans	-62.2	-42.4	177.3	-68	-53.8	139.3	0	0	112.7	N94 L95 L100 L101 E102 R159	N94-E98 WeakPolarHBondContact O-CG 3.41Å; N94-E98 PolarHBondContact O-N 3.11Å; L95-E98 PolarHBondContact O-N 3.24Å; E98-L100 PolarHBondContact O-N 3.44Å; E98-L101 PolarHBondContact O-N 2.68Å; E98-E102 PolarHBondContact O-N 3.28Å; E98-R159 IonicContact OE1-CZ 3.82Å; E98-R159 IonicContact OE1-NH2 2.75Å; E98-R159 PolarHBondContact OE1-NH2 2.79Å; E98-R159 IonicContact OE2-CZ 3.78Å; E98-R159 IonicContact OE2-NH1 2.92Å; E98-R159 PolarHBondContact OE2-NH1 3.27Å; E98-R159 IonicContact OE2-NH2 2.63Å; E98-R159 PolarHBondContact OE2-NH2 3.15Å
99	C	95.9	Very high	93.6	Very high	8 Å²	8	33.7 Å²	33.7	5%	0.054	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-43	174.5	-72.9	0	0	0	0	112.3	W41 F53 L95 M96 R97 L103	W41-C99 HydrophobicContact CZ2-CB 3.98Å; F53-C99 HydrophobicContact CD1-CB 4.4Å; F53-C99 HydrophobicContact CD2-CB 3.8Å; F53-C99 HydrophobicContact CE1-CB 4.27Å; F53-C99 HydrophobicContact CE2-CB 3.66Å; F53-C99 WeakPolarHBondContact CE2-O 3.38Å; F53-C99 HydrophobicContact CG-CB 4.17Å; F53-C99 HydrophobicContact CZ-CB 3.9Å; F53-C99 WeakPolarHBondContact CZ-O 3.39Å; L95-C99 PolarHBondContact O-N 2.93Å; L95-C99 PolarHBondContact O-SG 2.88Å; M96-C99 PolarHBondContact O-N 2.95Å; R97-C99 PolarHBondContact O-N 3.31Å; C99-L103 WeakPolarHBondContact O-CB 3.34Å; C99-L103 PolarHBondContact O-N 3.11Å
100	L	96.2	Very high	93.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-43.7	176.2	-85.2	168.2	0	0	0	111.8	W41 M74 F78 M96 R97 E98 E102 L103 F104 L152	W41-L100 HydrophobicContact CH2-CD1 4.1Å; W41-L100 HydrophobicContact CH2-CG 4Å; W41-L100 HydrophobicContact CZ2-CG 4.34Å; M74-L100 HydrophobicContact CB-CD2 3.55Å; M74-L100 HydrophobicContact CE-CD2 4.15Å; M74-L100 HydrophobicContact CE-CG 4.39Å; F78-L100 HydrophobicContact CB-CD1 3.51Å; F78-L100 HydrophobicContact CD1-CD1 4.04Å; F78-L100 HydrophobicContact CD2-CD1 4.08Å; F78-L100 HydrophobicContact CG-CD1 3.61Å; M96-L100 PolarHBondContact O-N 3.31Å; R97-L100 PolarHBondContact O-N 3.09Å; E98-L100 PolarHBondContact O-N 3.44Å; L100-E102 PolarHBondContact O-N 2.92Å; L100-L103 HydrophobicContact CD2-CD2 4.42Å; L100-L103 VanDerWaalsContact O-CB 3.3Å; L100-L103 WeakPolarHBondContact O-CB 3.4Å; L100-L103 PolarHBondContact O-N 3.08Å; L100-F104 HydrophobicContact CB-CE2 4.22Å; L100-F104 HydrophobicContact CB-CZ 4.07Å; L100-F104 HydrophobicContact CD2-CE1 3.99Å; L100-F104 HydrophobicContact CD2-CZ 3.9Å; L100-F104 WeakPolarHBondContact O-CD1 3.19Å; L100-F104 VanDerWaalsContact O-CD2 3.31Å; L100-F104 WeakPolarHBondContact O-CD2 3.49Å; L100-F104 WeakPolarHBondContact O-CG 3.35Å; L100-F104 PolarHBondContact O-N 3.31Å; L100-L152 HydrophobicContact CB-CD1 3.96Å; L100-L152 HydrophobicContact CD1-CD1 4.33Å; L100-L152 HydrophobicContact CD1-CD2 3.92Å
101	L	95.9	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-44.7	177.7	-67.7	169.4	0	0	0	111.4	R97 E98 L103 F104 G105 L152 D155 F156 Y160	R97-L101 HydrophobicContact CG-CD1 4.09Å; R97-L101 VanDerWaalsContact O-CG 3.27Å; R97-L101 WeakPolarHBondContact O-CG 3.36Å; R97-L101 PolarHBondContact O-N 3.08Å; E98-L101 PolarHBondContact O-N 2.68Å; L101-L103 VanDerWaalsContact C-N 3.31Å; L101-L103 PolarHBondContact O-N 3.32Å; L101-F104 HydrophobicContact CD2-CD2 4.27Å; L101-F104 PolarHBondContact O-N 3.18Å; L101-G105 PolarHBondContact O-N 3Å; L101-L152 HydrophobicContact CD2-CD1 4.11Å; L101-L152 HydrophobicContact CG-CD1 4.09Å; L101-D155 HydrophobicContact CD1-CB 3.84Å; L101-D155 HydrophobicContact CD2-CB 4.26Å; L101-F156 VanDerWaalsContact CD2-CA 3.4Å; L101-F156 HydrophobicContact CD2-CB 3.72Å; L101-F156 VanDerWaalsContact CD2-N 3.34Å; L101-Y160 PolarHBondContact O-OH 2.98Å
102	E	94.9	Very high	94.1	Very high	91 Å²	91	32.8 Å²	32.8	43%	0.425	17%	0.166	S	C	.	.	H	α-helix	trans	-63.1	-35.8	175.2	178.7	58	-148.9	0	0	112.5	F53 E98 L100 K106	F53-E102 HydrophobicContact CE1-CG 4.48Å; F53-E102 HydrophobicContact CZ-CB 4.26Å; F53-E102 HydrophobicContact CZ-CG 4.27Å; E98-E102 PolarHBondContact O-N 3.28Å; L100-E102 PolarHBondContact O-N 2.92Å; E102-K106 IonicContact OE1-NZ 3.37Å; E102-K106 PolarHBondContact OE1-NZ 2.81Å
103	L	94.5	Very high	94.3	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-49	173.3	-176.9	78.3	0	0	0	111.1	F53 I57 L60 I71 M74 C99 L100 L101 G105 K106	F53-L103 HydrophobicContact CE2-CB 4.43Å; I57-L103 HydrophobicContact CD1-CD1 3.59Å; L60-L103 HydrophobicContact CD1-CD1 3.27Å; L60-L103 HydrophobicContact CD1-CG 4.39Å; I71-L103 HydrophobicContact CG1-CD2 3.81Å; I71-L103 HydrophobicContact CG1-CG 4.46Å; M74-L103 HydrophobicContact CE-CD2 4.34Å; M74-L103 HydrophobicContact SD-CD1 4.46Å; M74-L103 HydrophobicContact SD-CD2 3.59Å; M74-L103 VanDerWaalsContact SD-CD2 3.59Å; C99-L103 WeakPolarHBondContact O-CB 3.34Å; C99-L103 PolarHBondContact O-N 3.11Å; L100-L103 HydrophobicContact CD2-CD2 4.42Å; L100-L103 VanDerWaalsContact O-CB 3.3Å; L100-L103 WeakPolarHBondContact O-CB 3.4Å; L100-L103 PolarHBondContact O-N 3.08Å; L101-L103 VanDerWaalsContact C-N 3.31Å; L101-L103 PolarHBondContact O-N 3.32Å; L103-G105 VanDerWaalsContact C-N 3.25Å; L103-G105 PolarHBondContact O-N 2.78Å; L103-K106 PolarHBondContact O-N 2.8Å; L103-K106 VanDerWaalsContact O-N 3.08Å
104	F	94.7	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.5	-39.7	-179.6	-58.4	-25.1	0	0	0	111.3	I71 L100 L101 K106 N107 L108 A111 L152 W153 F156 Y160	I71-F104 HydrophobicContact CD1-CD1 4.45Å; I71-F104 HydrophobicContact CG1-CD1 4.21Å; I71-F104 HydrophobicContact CG1-CE1 4.2Å; I71-F104 HydrophobicContact CG2-CE1 3.84Å; L100-F104 HydrophobicContact CB-CE2 4.22Å; L100-F104 HydrophobicContact CB-CZ 4.07Å; L100-F104 HydrophobicContact CD2-CE1 3.99Å; L100-F104 HydrophobicContact CD2-CZ 3.9Å; L100-F104 WeakPolarHBondContact O-CD1 3.19Å; L100-F104 VanDerWaalsContact O-CD2 3.31Å; L100-F104 WeakPolarHBondContact O-CD2 3.49Å; L100-F104 WeakPolarHBondContact O-CG 3.35Å; L100-F104 PolarHBondContact O-N 3.31Å; L101-F104 HydrophobicContact CD2-CD2 4.27Å; L101-F104 PolarHBondContact O-N 3.18Å; F104-K106 PolarHBondContact O-N 3.46Å; F104-N107 CarbonylContact O-C 3.26Å; F104-N107 VanDerWaalsContact O-C 3.26Å; F104-N107 PolarHBondContact O-N 3.48Å; F104-N107 VanDerWaalsContact O-N 3.09Å; F104-L108 WeakPolarHBondContact O-CD2 3.35Å; F104-L108 PolarHBondContact O-N 2.87Å; F104-A111 HydrophobicContact CB-CB 3.78Å; F104-A111 HydrophobicContact CD1-CB 3.94Å; F104-A111 HydrophobicContact CG-CB 4.02Å; F104-L152 HydrophobicContact CE2-CD1 4.05Å; F104-L152 HydrophobicContact CE2-CD2 4.19Å; F104-L152 HydrophobicContact CE2-CG 4.16Å; F104-L152 HydrophobicContact CZ-CD2 4.24Å; F104-W153 HydrophobicContact CE2-CH2 4.48Å; F104-W153 HydrophobicContact CE2-CZ3 4.07Å; F104-W153 HydrophobicContact CZ-CH2 4.17Å; F104-W153 HydrophobicContact CZ-CZ3 4.18Å; F104-F156 HydrophobicContact CB-CD2 3.71Å; F104-F156 HydrophobicContact CB-CE2 3.59Å; F104-F156 HydrophobicContact CD2-CB 4.27Å; F104-F156 AromaticContact CD2-CD2 3.56Å; F104-F156 HydrophobicContact CD2-CD2 3.56Å; F104-F156 HydrophobicContact CD2-CE2 4.16Å; F104-F156 HydrophobicContact CD2-CG 4.06Å; F104-F156 HydrophobicContact CG-CD2 4.02Å; F104-F156 HydrophobicContact CG-CE2 4.17Å; F104-Y160 HydrophobicContact CB-CE2 4.48Å
105	G	92.3	Very high	94.4	Very high	28 Å²	28	34.3 Å²	34.3	29%	0.289	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.4	175.9	0	0	0	0	0	115.4	L101 L103 Y160	L101-G105 PolarHBondContact O-N 3Å; L103-G105 VanDerWaalsContact C-N 3.25Å; L103-G105 PolarHBondContact O-N 2.78Å; G105-Y160 WeakPolarHBondContact CA-OH 3.26Å; G105-Y160 PolarHBondContact N-OH 3.34Å
106	K	91	Very high	94.5	Very high	96 Å²	96	36.8 Å²	36.8	42%	0.417	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-32.7	177.3	-58.6	-163	-170.4	-52	0	113	I57 E102 L103 F104	I57-K106 HydrophobicContact CD1-CD 4.1Å; I57-K106 HydrophobicContact CG2-CD 4.03Å; E102-K106 IonicContact OE1-NZ 3.37Å; E102-K106 PolarHBondContact OE1-NZ 2.81Å; L103-K106 PolarHBondContact O-N 2.8Å; L103-K106 VanDerWaalsContact O-N 3.08Å; F104-K106 PolarHBondContact O-N 3.46Å
107	N	90.5	Very high	94.5	Very high	13 Å²	13	39 Å²	39	7%	0.07	20%	0.196	C	C	.	.			trans	-137	78.2	-175.9	-66	-30.8	0	0	0	109.8	R64 A67 F104 D109 A111	R64-N107 PolarHBondContact NE-OD1 3Å; A67-N107 HydrophobicContact CB-CB 4.26Å; A67-N107 WeakPolarHBondContact CB-ND2 3.16Å; F104-N107 CarbonylContact O-C 3.26Å; F104-N107 VanDerWaalsContact O-C 3.26Å; F104-N107 PolarHBondContact O-N 3.48Å; F104-N107 VanDerWaalsContact O-N 3.09Å; N107-D109 PolarHBondContact O-N 3.26Å; N107-A111 VanDerWaalsContact O-CB 3.26Å; N107-A111 WeakPolarHBondContact O-CB 3.5Å; N107-A111 PolarHBondContact O-N 3.08Å; N107-A111 VanDerWaalsContact O-N 3.08Å
108	L	94.1	Very high	94.4	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.141	19%	0.194	C	C	.	.	H	α-helix	trans	-65.9	-35.6	-174.4	-65	173.7	0	0	0	113.2	F104 A111 Y112 F156 Y160 V163 H164 I167	F104-L108 WeakPolarHBondContact O-CD2 3.35Å; F104-L108 PolarHBondContact O-N 2.87Å; L108-A111 PolarHBondContact O-N 3.02Å; L108-Y112 VanDerWaalsContact O-CB 3.32Å; L108-Y112 WeakPolarHBondContact O-CB 3.38Å; L108-Y112 PolarHBondContact O-N 3.06Å; L108-F156 HydrophobicContact CD2-CE2 4.35Å; L108-Y160 HydrophobicContact CD2-CD1 3.68Å; L108-Y160 HydrophobicContact CD2-CD2 4.13Å; L108-Y160 HydrophobicContact CD2-CE1 4.19Å; L108-Y160 HydrophobicContact CD2-CG 3.66Å; L108-V163 HydrophobicContact CD1-CG1 4.18Å; L108-H164 HydrophobicContact CD1-CB 4.27Å; L108-I167 HydrophobicContact CB-CD1 4.22Å; L108-I167 HydrophobicContact CD2-CD1 3.77Å; L108-I167 HydrophobicContact CG-CD1 4.45Å
109	D	93.3	Very high	94.4	Very high	82 Å²	82	35.5 Å²	35.5	44%	0.439	18%	0.18	S	C	.	.	H	α-helix	trans	-63.8	-52.2	-179	-54.6	-58.3	0	0	0	111.7	R64 N107 A111 Y112 I113 H164	R64-D109 IonicContact NH2-OD2 3.86Å; N107-D109 PolarHBondContact O-N 3.26Å; D109-A111 VanDerWaalsContact C-N 3.34Å; D109-A111 PolarHBondContact O-N 3.14Å; D109-Y112 WeakPolarHBondContact O-CB 3.12Å; D109-Y112 PolarHBondContact O-N 3.17Å; D109-I113 WeakPolarHBondContact O-CG1 3.33Å; D109-I113 PolarHBondContact O-N 3.45Å; D109-H164 IonicContact OD1-NE2 2.73Å; D109-H164 PolarHBondContact OD1-NE2 2.81Å
110	D	92.4	Very high	94.4	Very high	49 Å²	49	40.4 Å²	40.4	26%	0.262	20%	0.198	S	C	.	.	H	α-helix	trans	-63.6	-42.4	177.1	-61.4	-54.1	0	0	0	110.8	A67 I71 Y112 I113 H114	A67-D110 HydrophobicContact CB-CB 4.27Å; A67-D110 WeakPolarHBondContact CB-OD2 3.47Å; I71-D110 HydrophobicContact CD1-CB 4.07Å; D110-Y112 VanDerWaalsContact C-N 3.29Å; D110-Y112 PolarHBondContact O-N 3.44Å; D110-I113 PolarHBondContact O-N 3.23Å; D110-H114 PolarHBondContact O-CD2 3.03Å; D110-H114 PolarHBondContact O-N 2.83Å; D110-H114 VanDerWaalsContact O-N 3.15Å
111	A	95.1	Very high	94.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-37.4	177.6	0	0	0	0	0	112.2	I71 F104 N107 L108 D109 H114 A115 F156	I71-A111 HydrophobicContact CD1-CB 4.19Å; F104-A111 HydrophobicContact CB-CB 3.78Å; F104-A111 HydrophobicContact CD1-CB 3.94Å; F104-A111 HydrophobicContact CG-CB 4.02Å; N107-A111 VanDerWaalsContact O-CB 3.26Å; N107-A111 WeakPolarHBondContact O-CB 3.5Å; N107-A111 PolarHBondContact O-N 3.08Å; N107-A111 VanDerWaalsContact O-N 3.08Å; L108-A111 PolarHBondContact O-N 3.02Å; D109-A111 VanDerWaalsContact C-N 3.34Å; D109-A111 PolarHBondContact O-N 3.14Å; A111-H114 PolarHBondContact O-N 3.33Å; A111-A115 VanDerWaalsContact O-CB 3.26Å; A111-A115 WeakPolarHBondContact O-CB 3.3Å; A111-A115 PolarHBondContact O-N 2.97Å; A111-F156 HydrophobicContact CB-CE2 4.08Å; A111-F156 HydrophobicContact CB-CZ 3.95Å
112	Y	96	Very high	94.3	Very high	45 Å²	45	41.9 Å²	41.9	18%	0.176	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-44.7	175.8	169.9	-100.8	0	0	0	112.1	L108 D109 D110 H114 A115 F116 L166 I167 L170	L108-Y112 VanDerWaalsContact O-CB 3.32Å; L108-Y112 WeakPolarHBondContact O-CB 3.38Å; L108-Y112 PolarHBondContact O-N 3.06Å; D109-Y112 WeakPolarHBondContact O-CB 3.12Å; D109-Y112 PolarHBondContact O-N 3.17Å; D110-Y112 VanDerWaalsContact C-N 3.29Å; D110-Y112 PolarHBondContact O-N 3.44Å; Y112-H114 VanDerWaalsContact C-N 3.33Å; Y112-H114 PolarHBondContact O-N 2.85Å; Y112-A115 WeakPolarHBondContact O-CB 3.45Å; Y112-A115 PolarHBondContact O-N 3.22Å; Y112-F116 WeakPolarHBondContact O-CB 3.49Å; Y112-F116 PolarHBondContact O-N 2.95Å; Y112-L166 HydrophobicContact CD1-CB 4.14Å; Y112-L166 HydrophobicContact CD1-CD1 4.03Å; Y112-L166 HydrophobicContact CD2-CB 3.84Å; Y112-L166 HydrophobicContact CE1-CB 4.01Å; Y112-L166 HydrophobicContact CE1-CD1 3.96Å; Y112-L166 HydrophobicContact CE1-CG 4.49Å; Y112-L166 HydrophobicContact CE2-CB 3.71Å; Y112-L166 WeakPolarHBondContact CE2-O 3.42Å; Y112-L166 HydrophobicContact CG-CB 4.05Å; Y112-I167 HydrophobicContact CD2-CG1 4.34Å; Y112-L170 HydrophobicContact CD2-CD1 3.84Å; Y112-L170 HydrophobicContact CD2-CG 4.21Å; Y112-L170 HydrophobicContact CE2-CD1 3.99Å; Y112-L170 HydrophobicContact CE2-CD2 4.02Å; Y112-L170 HydrophobicContact CE2-CG 3.85Å
113	I	95.2	Very high	94.4	Very high	96 Å²	96	39.3 Å²	39.3	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-59	-47.5	178.2	-64.3	167.5	0	0	0	110	D109 D110 F116 V117	D109-I113 WeakPolarHBondContact O-CG1 3.33Å; D109-I113 PolarHBondContact O-N 3.45Å; D110-I113 PolarHBondContact O-N 3.23Å; I113-F116 PolarHBondContact O-N 3.28Å; I113-V117 WeakPolarHBondContact O-CG2 3.47Å; I113-V117 PolarHBondContact O-N 3.23Å; I113-V117 VanDerWaalsContact O-N 3.16Å
114	H	94.3	Very high	94.4	Very high	33 Å²	33	43.2 Å²	43.2	15%	0.153	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-45.2	175.2	-74.7	-66.5	0	0	0	112.2	G68 I71 D110 A111 Y112 F116 V117 Y118	G68-H114 WeakPolarHBondContact CA-NE2 3.33Å; G68-H114 PolarHBondContact O-CE1 2.91Å; G68-H114 PolarHBondContact O-NE2 3.35Å; G68-H114 VanDerWaalsContact O-NE2 3.15Å; I71-H114 HydrophobicContact CG2-CB 3.79Å; I71-H114 VanDerWaalsContact CG2-CD2 3.49Å; I71-H114 WeakPolarHBondContact CG2-CD2 3.39Å; D110-H114 PolarHBondContact O-CD2 3.03Å; D110-H114 PolarHBondContact O-N 2.83Å; D110-H114 VanDerWaalsContact O-N 3.15Å; A111-H114 PolarHBondContact O-N 3.33Å; Y112-H114 VanDerWaalsContact C-N 3.33Å; Y112-H114 PolarHBondContact O-N 2.85Å; H114-F116 VanDerWaalsContact C-N 3.28Å; H114-F116 PolarHBondContact O-N 3.45Å; H114-V117 PolarHBondContact O-N 3.07Å; H114-Y118 HydrophobicContact CB-CD2 4.05Å; H114-Y118 HydrophobicContact CB-CE2 3.9Å; H114-Y118 AromaticContact ND1-CE2 3.89Å; H114-Y118 WeakPolarHBondContact O-CB 3.47Å; H114-Y118 WeakPolarHBondContact O-CD2 3.41Å; H114-Y118 PolarHBondContact O-N 3.06Å
115	A	95.8	Very high	94.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.6	-43.7	177.7	0	0	0	0	0	111.9	A111 Y112 T119 W153 F156 L170	A111-A115 VanDerWaalsContact O-CB 3.26Å; A111-A115 WeakPolarHBondContact O-CB 3.3Å; A111-A115 PolarHBondContact O-N 2.97Å; Y112-A115 WeakPolarHBondContact O-CB 3.45Å; Y112-A115 PolarHBondContact O-N 3.22Å; A115-T119 WeakPolarHBondContact O-CB 3.36Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 PolarHBondContact O-OG1 3.02Å; A115-W153 HydrophobicContact CB-CD2 4.25Å; A115-W153 HydrophobicContact CB-CE3 3.39Å; A115-W153 HydrophobicContact CB-CH2 4.05Å; A115-W153 HydrophobicContact CB-CZ3 3.28Å; A115-F156 HydrophobicContact CB-CD1 4.17Å; A115-F156 HydrophobicContact CB-CE1 3.8Å; A115-L170 HydrophobicContact CB-CD1 3.71Å
116	F	95.5	Very high	94.5	Very high	105 Å²	105	42.6 Å²	42.6	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-51.1	178.5	-178.9	-97.8	0	0	0	111.6	Y112 I113 H114 Y118 T119 R120 L170	Y112-F116 WeakPolarHBondContact O-CB 3.49Å; Y112-F116 PolarHBondContact O-N 2.95Å; I113-F116 PolarHBondContact O-N 3.28Å; H114-F116 VanDerWaalsContact C-N 3.28Å; H114-F116 PolarHBondContact O-N 3.45Å; F116-Y118 PolarHBondContact O-N 3.33Å; F116-T119 PolarHBondContact O-N 3.37Å; F116-R120 WeakPolarHBondContact O-CB 3.46Å; F116-R120 PolarHBondContact O-N 3.27Å; F116-L170 HydrophobicContact CD2-CD2 4.35Å
117	V	95.1	Very high	94.8	Very high	48 Å²	48	45.9 Å²	45.9	29%	0.291	22%	0.219	S	C	.	.	H	α-helix	trans	-61.4	-47	-180	175	0	0	0	0	111.4	I113 H114 R120 Q121	I113-V117 WeakPolarHBondContact O-CG2 3.47Å; I113-V117 PolarHBondContact O-N 3.23Å; I113-V117 VanDerWaalsContact O-N 3.16Å; H114-V117 PolarHBondContact O-N 3.07Å; V117-R120 WeakPolarHBondContact O-CB 3.45Å; V117-R120 PolarHBondContact O-N 3.02Å; V117-Q121 PolarHBondContact O-N 2.7Å
118	Y	95.4	Very high	95	Very high	14 Å²	14	49.9 Å²	49.9	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-35.1	-179.3	-66.5	-53.6	0	0	0	112.7	K72 F75 H114 F116 R120 Q121 L122 W153 L508	K72-Y118 WeakPolarHBondContact CG-OH 3.31Å; F75-Y118 HydrophobicContact CB-CE2 4.42Å; F75-Y118 AromaticContact CD1-CD1 3.92Å; F75-Y118 HydrophobicContact CD1-CD1 3.92Å; F75-Y118 AromaticContact CD1-CD2 3.77Å; F75-Y118 HydrophobicContact CD1-CD2 3.77Å; F75-Y118 AromaticContact CD1-CE1 3.66Å; F75-Y118 HydrophobicContact CD1-CE1 3.66Å; F75-Y118 AromaticContact CD1-CE2 3.5Å; F75-Y118 HydrophobicContact CD1-CE2 3.5Å; F75-Y118 VanDerWaalsContact CD1-CE2 3.5Å; F75-Y118 AromaticContact CD1-CG 3.97Å; F75-Y118 HydrophobicContact CD1-CG 3.97Å; F75-Y118 AromaticContact CD1-CZ 3.44Å; F75-Y118 VanDerWaalsContact CD1-CZ 3.44Å; F75-Y118 AromaticContact CE1-CD1 3.43Å; F75-Y118 HydrophobicContact CE1-CD1 3.43Å; F75-Y118 VanDerWaalsContact CE1-CD1 3.43Å; F75-Y118 AromaticContact CE1-CD2 3.79Å; F75-Y118 HydrophobicContact CE1-CD2 3.79Å; F75-Y118 AromaticContact CE1-CE1 3.63Å; F75-Y118 HydrophobicContact CE1-CE1 3.63Å; F75-Y118 AromaticContact CE1-CE2 3.96Å; F75-Y118 HydrophobicContact CE1-CE2 3.96Å; F75-Y118 AromaticContact CE1-CG 3.51Å; F75-Y118 HydrophobicContact CE1-CG 3.51Å; F75-Y118 AromaticContact CE1-CZ 3.89Å; F75-Y118 HydrophobicContact CG-CD2 4.31Å; F75-Y118 HydrophobicContact CG-CE2 4.05Å; F75-Y118 HydrophobicContact CZ-CD1 4.32Å; F75-Y118 HydrophobicContact CZ-CD2 4.37Å; F75-Y118 HydrophobicContact CZ-CG 4.06Å; H114-Y118 HydrophobicContact CB-CD2 4.05Å; H114-Y118 HydrophobicContact CB-CE2 3.9Å; H114-Y118 AromaticContact ND1-CE2 3.89Å; H114-Y118 WeakPolarHBondContact O-CB 3.47Å; H114-Y118 WeakPolarHBondContact O-CD2 3.41Å; H114-Y118 PolarHBondContact O-N 3.06Å; F116-Y118 PolarHBondContact O-N 3.33Å; Y118-R120 VanDerWaalsContact C-N 3.34Å; Y118-Q121 PolarHBondContact O-N 2.82Å; Y118-L122 WeakPolarHBondContact O-CG 3.22Å; Y118-L122 PolarHBondContact O-N 3.47Å; Y118-W153 AromaticContact CD2-CH2 3.88Å; Y118-W153 HydrophobicContact CD2-CH2 3.88Å; Y118-W153 AromaticContact CD2-CZ2 3.39Å; Y118-W153 HydrophobicContact CD2-CZ2 3.39Å; Y118-W153 HydrophobicContact CE2-CZ2 4.36Å; Y118-W153 AromaticContact CG-CZ2 3.9Å; Y118-W153 HydrophobicContact CG-CZ2 3.9Å; Y118-L508 HydrophobicContact CD1-CD1 4.31Å; Y118-L508 HydrophobicContact CD1-CD2 3.45Å; Y118-L508 VanDerWaalsContact CD1-CD2 3.45Å; Y118-L508 HydrophobicContact CD1-CG 4.42Å; Y118-L508 HydrophobicContact CE1-CD1 3.99Å; Y118-L508 HydrophobicContact CE1-CD2 3.52Å; Y118-L508 HydrophobicContact CE1-CG 4.15Å
119	T	95.5	Very high	95	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.043	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-41.6	172.6	-59.7	0	0	0	0	110.7	A115 F116 Q121 L122 A123 P173 L174 L177	A115-T119 WeakPolarHBondContact O-CB 3.36Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 PolarHBondContact O-OG1 3.02Å; F116-T119 PolarHBondContact O-N 3.37Å; T119-Q121 VanDerWaalsContact C-N 3.32Å; T119-Q121 PolarHBondContact O-N 3.25Å; T119-L122 PolarHBondContact O-N 3.5Å; T119-A123 PolarHBondContact O-N 2.93Å; T119-P173 HydrophobicContact CG2-CB 4.39Å; T119-L174 HydrophobicContact CG2-CD2 3.78Å; T119-L174 HydrophobicContact CG2-CG 4.22Å; T119-L177 HydrophobicContact CG2-CD1 3.53Å
120	R	95.7	Very high	95.1	Very high	112 Å²	112	49.1 Å²	49.1	42%	0.423	23%	0.226	S	C	.	.	H	α-helix	trans	-59.5	-42.5	173.1	-175.2	-177.3	71.2	162.2	2.8	111.4	F116 V117 Y118 L122 A123 I124 E511	F116-R120 WeakPolarHBondContact O-CB 3.46Å; F116-R120 PolarHBondContact O-N 3.27Å; V117-R120 WeakPolarHBondContact O-CB 3.45Å; V117-R120 PolarHBondContact O-N 3.02Å; Y118-R120 VanDerWaalsContact C-N 3.34Å; R120-L122 PolarHBondContact O-N 3.31Å; R120-A123 WeakPolarHBondContact O-CA 3.27Å; R120-A123 VanDerWaalsContact O-CB 3.27Å; R120-A123 WeakPolarHBondContact O-CB 3.49Å; R120-A123 PolarHBondContact O-N 3.12Å; R120-A123 VanDerWaalsContact O-N 3.12Å; R120-I124 HydrophobicContact CG-CD1 4.21Å; R120-I124 WeakPolarHBondContact O-CG1 3.46Å; R120-I124 PolarHBondContact O-N 3.33Å; R120-E511 IonicContact NH2-OE1 3.27Å; R120-E511 IonicContact NH2-OE2 3.87Å
121	Q	94	Very high	95.2	Very high	26 Å²	26	52.6 Å²	52.6	12%	0.121	24%	0.243	C	C	.	.	H	α-helix	trans	-62.6	-44.1	177.5	-172.9	59	22.2	0	0	112.3	V117 Y118 T119 A123 I124 T125 L504 L508	V117-Q121 PolarHBondContact O-N 2.7Å; Y118-Q121 PolarHBondContact O-N 2.82Å; T119-Q121 VanDerWaalsContact C-N 3.32Å; T119-Q121 PolarHBondContact O-N 3.25Å; Q121-A123 PolarHBondContact O-N 2.88Å; Q121-I124 PolarHBondContact O-N 2.82Å; Q121-T125 PolarHBondContact O-N 3.42Å; Q121-T125 PolarHBondContact O-OG1 2.81Å; Q121-L504 HydrophobicContact CG-CD1 4.37Å; Q121-L508 HydrophobicContact CG-CD2 4.13Å
122	L	95.9	Very high	95	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-38	173.6	-65.5	171.7	0	0	0	111.4	Y118 T119 R120 T125 L126 F146 L150 L177	Y118-L122 WeakPolarHBondContact O-CG 3.22Å; Y118-L122 PolarHBondContact O-N 3.47Å; T119-L122 PolarHBondContact O-N 3.5Å; R120-L122 PolarHBondContact O-N 3.31Å; L122-T125 PolarHBondContact O-N 3.17Å; L122-L126 WeakPolarHBondContact O-CB 3.4Å; L122-L126 PolarHBondContact O-N 3.26Å; L122-F146 HydrophobicContact CB-CE2 3.97Å; L122-F146 HydrophobicContact CB-CZ 4.34Å; L122-F146 HydrophobicContact CD2-CD2 3.49Å; L122-F146 VanDerWaalsContact CD2-CD2 3.49Å; L122-F146 HydrophobicContact CD2-CE2 3.59Å; L122-F146 HydrophobicContact CD2-CG 4.18Å; L122-F146 HydrophobicContact CD2-CZ 4.34Å; L122-F146 HydrophobicContact CG-CE2 4.37Å; L122-L150 HydrophobicContact CD1-CB 4.49Å; L122-L150 HydrophobicContact CD1-CD1 4.42Å; L122-L177 HydrophobicContact CB-CD1 4.25Å
123	A	96	Very high	94.6	Very high	37 Å²	37	60.1 Å²	60.1	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-64.1	-43.3	175.5	0	0	0	0	0	113.2	T119 R120 Q121 L126 R127 L177	T119-A123 PolarHBondContact O-N 2.93Å; R120-A123 WeakPolarHBondContact O-CA 3.27Å; R120-A123 VanDerWaalsContact O-CB 3.27Å; R120-A123 WeakPolarHBondContact O-CB 3.49Å; R120-A123 PolarHBondContact O-N 3.12Å; R120-A123 VanDerWaalsContact O-N 3.12Å; Q121-A123 PolarHBondContact O-N 2.88Å; A123-L126 PolarHBondContact O-N 3.48Å; A123-R127 VanDerWaalsContact O-CB 3.31Å; A123-R127 WeakPolarHBondContact O-CB 3.38Å; A123-R127 PolarHBondContact O-N 2.66Å; A123-L177 HydrophobicContact CB-CD1 4.42Å; A123-L177 HydrophobicContact CB-CD2 3.57Å; A123-L177 HydrophobicContact CB-CG 4.49Å
124	I	95.6	Very high	94.3	Very high	86 Å²	86	60 Å²	60	44%	0.441	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-46.1	177.5	-66.9	165.8	0	0	0	110.1	R120 Q121 L126 R127 K128	R120-I124 HydrophobicContact CG-CD1 4.21Å; R120-I124 WeakPolarHBondContact O-CG1 3.46Å; R120-I124 PolarHBondContact O-N 3.33Å; Q121-I124 PolarHBondContact O-N 2.82Å; I124-L126 PolarHBondContact O-N 3.01Å; I124-R127 PolarHBondContact O-N 3.28Å; I124-K128 WeakPolarHBondContact O-CB 3.48Å; I124-K128 PolarHBondContact O-N 3.37Å
125	T	94.1	Very high	94.1	Very high	4 Å²	4	63.5 Å²	63.5	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-45.4	176	-59.9	0	0	0	0	111.6	Q121 L122 K128 A129 S140 V141 F146 F502	Q121-T125 PolarHBondContact O-N 3.42Å; Q121-T125 PolarHBondContact O-OG1 2.81Å; L122-T125 PolarHBondContact O-N 3.17Å; T125-K128 WeakPolarHBondContact O-CB 3.22Å; T125-K128 PolarHBondContact O-N 3.44Å; T125-A129 PolarHBondContact O-N 3.48Å; T125-A129 VanDerWaalsContact O-N 3.11Å; T125-S140 VanDerWaalsContact CG2-OG 3.31Å; T125-S140 WeakPolarHBondContact CG2-OG 3.44Å; T125-V141 HydrophobicContact CG2-CG2 4.13Å; T125-F146 HydrophobicContact CG2-CD2 4.5Å; T125-F502 HydrophobicContact CG2-CD1 4.43Å; T125-F502 HydrophobicContact CG2-CE1 3.92Å; T125-F502 HydrophobicContact CG2-CZ 4.42Å
126	L	95.2	Very high	93.8	Very high	11 Å²	11	66.1 Å²	66.1	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-45.4	177.1	-176.9	64.5	0	0	0	111.8	L122 A123 I124 K128 A129 Y130 V141 L177 L184	L122-L126 WeakPolarHBondContact O-CB 3.4Å; L122-L126 PolarHBondContact O-N 3.26Å; A123-L126 PolarHBondContact O-N 3.48Å; I124-L126 PolarHBondContact O-N 3.01Å; L126-K128 VanDerWaalsContact C-N 3.34Å; L126-K128 PolarHBondContact O-N 3.41Å; L126-A129 WeakPolarHBondContact O-CB 3.28Å; L126-A129 PolarHBondContact O-N 3.3Å; L126-Y130 HydrophobicContact CD1-CD2 4.23Å; L126-Y130 HydrophobicContact CD1-CE2 3.87Å; L126-Y130 HydrophobicContact CG-CD2 4.17Å; L126-Y130 HydrophobicContact CG-CE2 4.04Å; L126-Y130 WeakPolarHBondContact O-CD2 3.45Å; L126-Y130 PolarHBondContact O-N 3.44Å; L126-Y130 VanDerWaalsContact O-N 3.16Å; L126-V141 HydrophobicContact CD1-CG1 3.71Å; L126-V141 HydrophobicContact CD1-CG2 4.09Å; L126-L177 HydrophobicContact CD2-CD2 3.77Å; L126-L184 HydrophobicContact CD1-CD2 4.03Å
127	R	95.9	Very high	93.7	Very high	165 Å²	165	61.7 Å²	61.7	62%	0.623	29%	0.29	S	S	*	.	H	α-helix	trans	-61.5	-42.1	177.3	-176.8	177.1	-179.3	143.3	1.3	111.4	A123 I124 A129 Y130 I131	A123-R127 VanDerWaalsContact O-CB 3.31Å; A123-R127 WeakPolarHBondContact O-CB 3.38Å; A123-R127 PolarHBondContact O-N 2.66Å; I124-R127 PolarHBondContact O-N 3.28Å; R127-A129 VanDerWaalsContact C-N 3.31Å; R127-A129 PolarHBondContact O-N 2.97Å; R127-Y130 PolarHBondContact O-N 3.41Å; R127-I131 HydrophobicContact CG-CD1 3.74Å; R127-I131 HydrophobicContact CG-CG1 4.35Å; R127-I131 WeakPolarHBondContact O-CG1 3.27Å; R127-I131 PolarHBondContact O-N 2.82Å
128	K	94.8	Very high	93.5	Very high	97 Å²	97	61.7 Å²	61.7	42%	0.422	29%	0.287	S	S	.	.	H	α-helix	trans	-56.2	-46.8	175.2	-169.7	-170.9	-179	-151	0	110.8	I124 T125 L126 Y130 I131 S132 D137	I124-K128 WeakPolarHBondContact O-CB 3.48Å; I124-K128 PolarHBondContact O-N 3.37Å; T125-K128 WeakPolarHBondContact O-CB 3.22Å; T125-K128 PolarHBondContact O-N 3.44Å; L126-K128 VanDerWaalsContact C-N 3.34Å; L126-K128 PolarHBondContact O-N 3.41Å; K128-Y130 VanDerWaalsContact C-N 3.32Å; K128-Y130 PolarHBondContact O-N 3.25Å; K128-I131 PolarHBondContact O-N 3.13Å; K128-I131 VanDerWaalsContact O-N 3.17Å; K128-S132 PolarHBondContact O-N 3.03Å; K128-S132 PolarHBondContact O-OG 2.97Å; K128-S132 VanDerWaalsContact O-OG 3.09Å; K128-D137 WeakPolarHBondContact CD-OD1 3.23Å; K128-D137 WeakPolarHBondContact CE-OD1 3.13Å; K128-D137 IonicContact NZ-OD1 3.49Å; K128-D137 PolarHBondContact NZ-OD1 2.92Å; K128-D137 IonicContact NZ-OD2 3.27Å
129	A	94.4	Very high	93.3	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-37.1	177.7	0	0	0	0	0	113.6	T125 L126 R127 K133 D137 I138 V141 L184	T125-A129 PolarHBondContact O-N 3.48Å; T125-A129 VanDerWaalsContact O-N 3.11Å; L126-A129 WeakPolarHBondContact O-CB 3.28Å; L126-A129 PolarHBondContact O-N 3.3Å; R127-A129 VanDerWaalsContact C-N 3.31Å; R127-A129 PolarHBondContact O-N 2.97Å; A129-K133 WeakPolarHBondContact O-CA 3.08Å; A129-K133 PolarHBondContact O-N 2.96Å; A129-K133 VanDerWaalsContact O-N 3.16Å; A129-D137 HydrophobicContact CB-CB 4.29Å; A129-D137 WeakPolarHBondContact CB-O 3.3Å; A129-I138 HydrophobicContact CB-CG1 4.45Å; A129-V141 HydrophobicContact CB-CG2 3.73Å; A129-L184 HydrophobicContact CB-CD1 4.47Å; A129-L184 HydrophobicContact CB-CD2 3.83Å
130	Y	94.9	Very high	93.1	Very high	93 Å²	93	65 Å²	65	37%	0.365	30%	0.304	S	S	.	.	H	α-helix	trans	-70.3	-37.6	174.5	-87.2	-77	0	0	0	113.3	L126 R127 K128 K133 G180 K183 L184	L126-Y130 HydrophobicContact CD1-CD2 4.23Å; L126-Y130 HydrophobicContact CD1-CE2 3.87Å; L126-Y130 HydrophobicContact CG-CD2 4.17Å; L126-Y130 HydrophobicContact CG-CE2 4.04Å; L126-Y130 WeakPolarHBondContact O-CD2 3.45Å; L126-Y130 PolarHBondContact O-N 3.44Å; L126-Y130 VanDerWaalsContact O-N 3.16Å; R127-Y130 PolarHBondContact O-N 3.41Å; K128-Y130 VanDerWaalsContact C-N 3.32Å; K128-Y130 PolarHBondContact O-N 3.25Å; Y130-K133 WeakPolarHBondContact O-CG 3.4Å; Y130-G180 PolarHBondContact OH-O 3.26Å; Y130-K183 VanDerWaalsContact OH-CB 3.27Å; Y130-K183 WeakPolarHBondContact OH-CB 3.16Å; Y130-L184 HydrophobicContact CD1-CD1 4.14Å; Y130-L184 HydrophobicContact CD2-CD1 4.2Å; Y130-L184 HydrophobicContact CE1-CD1 4.03Å; Y130-L184 HydrophobicContact CE2-CB 4.05Å; Y130-L184 HydrophobicContact CE2-CD1 4.09Å; Y130-L184 HydrophobicContact CG-CD1 4.22Å; Y130-L184 PolarHBondContact OH-N 3.05Å
131	I	94.8	Very high	93	Very high	122 Å²	122	59.7 Å²	59.7	63%	0.626	28%	0.284	S	S	*	.	H	α-helix	trans	-74.6	-52.9	-178	-68.1	171.2	0	0	0	110.9	R127 K128	R127-I131 HydrophobicContact CG-CD1 3.74Å; R127-I131 HydrophobicContact CG-CG1 4.35Å; R127-I131 WeakPolarHBondContact O-CG1 3.27Å; R127-I131 PolarHBondContact O-N 2.82Å; K128-I131 PolarHBondContact O-N 3.13Å; K128-I131 VanDerWaalsContact O-N 3.17Å
132	S	91.3	Very high	92.8	Very high	37 Å²	37	59 Å²	59	26%	0.259	28%	0.283	S	S	.	.	H	α-helix	trans	-75.6	-33.2	-174.3	69.4	0	0	0	0	112.3	K128 N134 D137	K128-S132 PolarHBondContact O-N 3.03Å; K128-S132 PolarHBondContact O-OG 2.97Å; K128-S132 VanDerWaalsContact O-OG 3.09Å; S132-N134 PolarHBondContact O-N 3.48Å; S132-N134 PolarHBondContact O-OD1 3.35Å; S132-N134 PolarHBondContact OG-N 3.2Å; S132-D137 WeakPolarHBondContact CB-OD2 3.47Å; S132-D137 VanDerWaalsContact OG-CB 3.29Å; S132-D137 WeakPolarHBondContact OG-CB 3.07Å; S132-D137 VanDerWaalsContact OG-CG 3.28Å; S132-D137 PolarHBondContact OG-OD2 2.93Å
133	K	87.5	Confident	92.7	Very high	166 Å²	166	60.6 Å²	60.6	72%	0.722	29%	0.291	S	S	*	.			trans	52.9	17.2	-170.3	-57.3	179.1	-179.2	173.6	0	113.5	A129 Y130	A129-K133 WeakPolarHBondContact O-CA 3.08Å; A129-K133 PolarHBondContact O-N 2.96Å; A129-K133 VanDerWaalsContact O-N 3.16Å; Y130-K133 WeakPolarHBondContact O-CG 3.4Å
134	N	89.6	Confident	92.7	Very high	93 Å²	93	60.7 Å²	60.7	50%	0.497	28%	0.283	S	S	.	.			trans	-72.8	147.1	178.1	-71.2	-16.4	0	0	0	109.9	S132 E136 D137 I138	S132-N134 PolarHBondContact O-N 3.48Å; S132-N134 PolarHBondContact O-OD1 3.35Å; S132-N134 PolarHBondContact OG-N 3.2Å; N134-E136 VanDerWaalsContact C-N 3.32Å; N134-E136 PolarHBondContact O-N 3.34Å; N134-D137 HydrophobicContact CB-CB 4.41Å; N134-D137 PolarHBondContact O-N 3.03Å; N134-I138 WeakPolarHBondContact O-CG1 3.49Å; N134-I138 PolarHBondContact O-N 2.89Å
135	K	89.3	Confident	92.7	Very high	107 Å²	107	57.7 Å²	57.7	47%	0.465	27%	0.267	S	S	.	.	H	α-helix	trans	-59.2	-43.6	-178.6	-173.7	-177.8	177	-171.5	0	111.5	I138 Q139 D450	K135-I138 PolarHBondContact O-N 3.22Å; K135-Q139 WeakPolarHBondContact O-CB 3.3Å; K135-Q139 VanDerWaalsContact O-CG 3.24Å; K135-Q139 WeakPolarHBondContact O-CG 3.48Å; K135-Q139 PolarHBondContact O-N 3.26Å; K135-D450 VanDerWaalsContact CE-O 3.31Å; K135-D450 WeakPolarHBondContact CE-O 3.33Å; K135-D450 IonicContact NZ-OD1 2.88Å; K135-D450 IonicContact NZ-OD2 3.89Å; K135-D450 PolarHBondContact NZ-OD2 2.83Å
136	E	90.5	Very high	92.8	Very high	55 Å²	55	57.6 Å²	57.6	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177.5	-76.1	159.8	-121.5	0	0	112.7	N134 I138 Q139 S140 E499 S500	N134-E136 VanDerWaalsContact C-N 3.32Å; N134-E136 PolarHBondContact O-N 3.34Å; E136-I138 VanDerWaalsContact C-N 3.33Å; E136-I138 PolarHBondContact O-N 3.32Å; E136-Q139 CarbonylContact O-C 3.55Å; E136-Q139 WeakPolarHBondContact O-CB 3.29Å; E136-Q139 PolarHBondContact O-N 3.37Å; E136-S140 PolarHBondContact O-N 3.1Å; E136-E499 WeakPolarHBondContact OE1-CB 3.42Å; E136-E499 VanDerWaalsContact OE1-CG 3.31Å; E136-E499 WeakPolarHBondContact OE1-CG 3.44Å; E136-E499 VanDerWaalsContact OE2-OE2 3.12Å; E136-S500 PolarHBondContact OE2-N 3.2Å; E136-S500 PolarHBondContact OE2-OG 3.4Å
137	D	91.9	Very high	92.9	Very high	12 Å²	12	57.3 Å²	57.3	6%	0.064	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-37.1	179.7	-69	-41.5	0	0	0	111.3	K128 A129 S132 N134 S140	K128-D137 WeakPolarHBondContact CD-OD1 3.23Å; K128-D137 WeakPolarHBondContact CE-OD1 3.13Å; K128-D137 IonicContact NZ-OD1 3.49Å; K128-D137 PolarHBondContact NZ-OD1 2.92Å; K128-D137 IonicContact NZ-OD2 3.27Å; A129-D137 HydrophobicContact CB-CB 4.29Å; A129-D137 WeakPolarHBondContact CB-O 3.3Å; S132-D137 WeakPolarHBondContact CB-OD2 3.47Å; S132-D137 VanDerWaalsContact OG-CB 3.29Å; S132-D137 WeakPolarHBondContact OG-CB 3.07Å; S132-D137 VanDerWaalsContact OG-CG 3.28Å; S132-D137 PolarHBondContact OG-OD2 2.93Å; N134-D137 HydrophobicContact CB-CB 4.41Å; N134-D137 PolarHBondContact O-N 3.03Å; D137-S140 WeakPolarHBondContact O-CB 3.48Å; D137-S140 PolarHBondContact O-N 3.22Å; D137-S140 PolarHBondContact O-OG 2.79Å
138	I	91.6	Very high	92.9	Very high	48 Å²	48	50 Å²	50	25%	0.246	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-42.4	172.5	-65	168.6	0	0	0	110.8	A129 N134 K135 E136 S140 V141 A142 L184	A129-I138 HydrophobicContact CB-CG1 4.45Å; N134-I138 WeakPolarHBondContact O-CG1 3.49Å; N134-I138 PolarHBondContact O-N 2.89Å; K135-I138 PolarHBondContact O-N 3.22Å; E136-I138 VanDerWaalsContact C-N 3.33Å; E136-I138 PolarHBondContact O-N 3.32Å; I138-S140 VanDerWaalsContact C-N 3.26Å; I138-S140 PolarHBondContact O-N 3.35Å; I138-V141 PolarHBondContact O-N 3.31Å; I138-A142 WeakPolarHBondContact O-CB 3.31Å; I138-A142 PolarHBondContact O-N 3.27Å; I138-L184 HydrophobicContact CG1-CD1 4.41Å; I138-L184 HydrophobicContact CG2-CD2 4.42Å
139	Q	91.1	Very high	93	Very high	84 Å²	84	45.4 Å²	45.4	39%	0.393	22%	0.22	S	C	.	.	H	α-helix	trans	-63.8	-30.5	176	-76.1	175.8	-12.2	0	0	112.6	K135 E136 V141 A142 N143	K135-Q139 WeakPolarHBondContact O-CB 3.3Å; K135-Q139 VanDerWaalsContact O-CG 3.24Å; K135-Q139 WeakPolarHBondContact O-CG 3.48Å; K135-Q139 PolarHBondContact O-N 3.26Å; E136-Q139 CarbonylContact O-C 3.55Å; E136-Q139 WeakPolarHBondContact O-CB 3.29Å; E136-Q139 PolarHBondContact O-N 3.37Å; Q139-V141 PolarHBondContact O-N 3.27Å; Q139-A142 CarbonylContact O-C 3.5Å; Q139-A142 PolarHBondContact O-N 3.39Å; Q139-N143 PolarHBondContact O-N 2.94Å; Q139-N143 PolarHBondContact O-ND2 3.35Å
140	S	91.2	Very high	93.1	Very high	7 Å²	7	45.5 Å²	45.5	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-26.3	175.7	82.5	0	0	0	0	113.4	T125 E136 D137 I138 N143	T125-S140 VanDerWaalsContact CG2-OG 3.31Å; T125-S140 WeakPolarHBondContact CG2-OG 3.44Å; E136-S140 PolarHBondContact O-N 3.1Å; D137-S140 WeakPolarHBondContact O-CB 3.48Å; D137-S140 PolarHBondContact O-N 3.22Å; D137-S140 PolarHBondContact O-OG 2.79Å; I138-S140 VanDerWaalsContact C-N 3.26Å; I138-S140 PolarHBondContact O-N 3.35Å; S140-N143 PolarHBondContact O-ND2 3.28Å
141	V	92.6	Very high	93.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-87.9	-36.6	173.2	177.7	0	0	0	0	110.7	T125 L126 A129 I138 Q139 N143 F146 T181 L184	T125-V141 HydrophobicContact CG2-CG2 4.13Å; L126-V141 HydrophobicContact CD1-CG1 3.71Å; L126-V141 HydrophobicContact CD1-CG2 4.09Å; A129-V141 HydrophobicContact CB-CG2 3.73Å; I138-V141 PolarHBondContact O-N 3.31Å; Q139-V141 PolarHBondContact O-N 3.27Å; V141-N143 VanDerWaalsContact C-N 3.26Å; V141-N143 PolarHBondContact O-N 2.69Å; V141-F146 HydrophobicContact CG1-CD1 4.08Å; V141-F146 HydrophobicContact CG1-CE1 3.75Å; V141-F146 HydrophobicContact CG1-CE2 4.33Å; V141-F146 HydrophobicContact CG1-CZ 3.9Å; V141-F146 HydrophobicContact CG2-CE2 4.49Å; V141-F146 WeakPolarHBondContact O-CB 3.24Å; V141-F146 WeakPolarHBondContact O-CD1 3.44Å; V141-F146 WeakPolarHBondContact O-CG 3.25Å; V141-T181 HydrophobicContact CG1-CG2 4.06Å; V141-L184 HydrophobicContact CB-CD2 3.94Å; V141-L184 HydrophobicContact CG1-CD2 3.9Å; V141-L184 HydrophobicContact CG2-CD2 4.06Å
142	A	91.3	Very high	93.3	Very high	12 Å²	12	38 Å²	38	10%	0.099	18%	0.183	C	C	.	.	S	Bend	trans	-89.6	37.3	-174.1	0	0	0	0	0	113.8	I138 Q139 W190	I138-A142 WeakPolarHBondContact O-CB 3.31Å; I138-A142 PolarHBondContact O-N 3.27Å; Q139-A142 CarbonylContact O-C 3.5Å; Q139-A142 PolarHBondContact O-N 3.39Å; A142-W190 HydrophobicContact CB-CH2 3.46Å; A142-W190 VanDerWaalsContact CB-CH2 3.46Å; A142-W190 HydrophobicContact CB-CZ2 4.42Å; A142-W190 HydrophobicContact CB-CZ3 3.6Å
143	N	94.2	Very high	93.6	Very high	37 Å²	37	36.3 Å²	36.3	20%	0.198	17%	0.171	C	C	.	.	S	Bend	trans	-118.2	163.8	177.6	67.4	43.1	0	0	0	112	Q139 S140 V141 Q145 F146 V147 L278	Q139-N143 PolarHBondContact O-N 2.94Å; Q139-N143 PolarHBondContact O-ND2 3.35Å; S140-N143 PolarHBondContact O-ND2 3.28Å; V141-N143 VanDerWaalsContact C-N 3.26Å; V141-N143 PolarHBondContact O-N 2.69Å; N143-Q145 VanDerWaalsContact C-N 3.28Å; N143-Q145 PolarHBondContact O-N 2.91Å; N143-Q145 PolarHBondContact OD1-N 3.17Å; N143-F146 PolarHBondContact O-N 3.38Å; N143-F146 VanDerWaalsContact OD1-CB 3.3Å; N143-F146 WeakPolarHBondContact OD1-CB 3.45Å; N143-F146 PolarHBondContact OD1-N 3.02Å; N143-V147 VanDerWaalsContact O-CG2 3.29Å; N143-V147 WeakPolarHBondContact O-CG2 3.29Å; N143-V147 PolarHBondContact O-N 3.5Å; N143-V147 VanDerWaalsContact O-N 3.14Å; N143-L278 VanDerWaalsContact C-CD1 3.47Å
144	W	95.7	Very high	94	Very high	38 Å²	38	28.4 Å²	28.4	14%	0.144	14%	0.137	C	C	.	.	H	α-helix	trans	-66.2	-30.1	-177.9	-80.8	112.4	0	0	0	113	C82 V85 V147 C148 H196 R275 L278	C82-W144 WeakPolarHBondContact O-CB 3.36Å; V85-W144 HydrophobicContact CB-CD2 3.65Å; V85-W144 HydrophobicContact CB-CE3 3.89Å; V85-W144 HydrophobicContact CB-CG 4.11Å; V85-W144 HydrophobicContact CB-CH2 4.25Å; V85-W144 HydrophobicContact CB-CZ2 4.01Å; V85-W144 HydrophobicContact CB-CZ3 4.18Å; V85-W144 HydrophobicContact CG1-CH2 4.34Å; V85-W144 HydrophobicContact CG1-CZ2 4.46Å; V85-W144 HydrophobicContact CG1-CZ3 4.36Å; V85-W144 HydrophobicContact CG2-CB 4.01Å; V85-W144 HydrophobicContact CG2-CD2 3.39Å; V85-W144 HydrophobicContact CG2-CE3 3.39Å; V85-W144 HydrophobicContact CG2-CG 3.7Å; V85-W144 HydrophobicContact CG2-CZ3 4.02Å; W144-V147 PolarHBondContact O-N 2.94Å; W144-C148 WeakPolarHBondContact O-CB 3.27Å; W144-C148 PolarHBondContact O-N 3.48Å; W144-C148 PolarHBondContact O-SG 3.38Å; W144-H196 AromaticContact CH2-CE1 3.95Å; W144-H196 AromaticContact CH2-NE2 3.71Å; W144-R275 VanDerWaalsContact CH2-O 3.29Å; W144-R275 WeakPolarHBondContact CH2-O 3.37Å; W144-L278 HydrophobicContact CB-CD1 4.44Å; W144-L278 HydrophobicContact CD2-CD1 3.83Å; W144-L278 HydrophobicContact CD2-CD2 3.86Å; W144-L278 HydrophobicContact CD2-CG 3.77Å; W144-L278 VanDerWaalsContact CE2-CG 3.5Å; W144-L278 HydrophobicContact CE3-CD1 4.43Å; W144-L278 HydrophobicContact CE3-CD2 3.75Å; W144-L278 HydrophobicContact CE3-CG 4.21Å; W144-L278 HydrophobicContact CG-CD1 3.81Å; W144-L278 HydrophobicContact CG-CG 4.25Å; W144-L278 HydrophobicContact CH2-CD2 3.69Å; W144-L278 HydrophobicContact CH2-CG 4.15Å; W144-L278 HydrophobicContact CZ2-CD2 3.79Å; W144-L278 HydrophobicContact CZ2-CG 3.7Å; W144-L278 HydrophobicContact CZ3-CD2 3.67Å; W144-L278 HydrophobicContact CZ3-CG 4.39Å
145	Q	95.3	Very high	94.4	Very high	23 Å²	23	24.5 Å²	24.5	11%	0.107	12%	0.116	C	C	.	.	H	α-helix	trans	-65.5	-46	-179.9	-62.4	179.5	-72	0	0	111.1	V79 N143 S149 L504	V79-Q145 HydrophobicContact CG1-CB 4.01Å; V79-Q145 HydrophobicContact CG1-CG 4.36Å; V79-Q145 PolarHBondContact O-NE2 2.85Å; N143-Q145 VanDerWaalsContact C-N 3.28Å; N143-Q145 PolarHBondContact O-N 2.91Å; N143-Q145 PolarHBondContact OD1-N 3.17Å; Q145-S149 VanDerWaalsContact O-CB 3.24Å; Q145-S149 WeakPolarHBondContact O-CB 3.23Å; Q145-S149 PolarHBondContact O-N 3.38Å; Q145-S149 PolarHBondContact O-OG 3.46Å; Q145-L504 HydrophobicContact CB-CD2 4.46Å
146	F	96	Very high	94.7	Very high	3 Å²	3	19.4 Å²	19.4	1%	0.013	9%	0.094	C	C	.	.	H	α-helix	trans	-61.8	-51.4	174.6	-174.9	-84.6	0	0	0	110.7	L122 T125 V141 N143 C148 S149 L150 T181	L122-F146 HydrophobicContact CB-CE2 3.97Å; L122-F146 HydrophobicContact CB-CZ 4.34Å; L122-F146 HydrophobicContact CD2-CD2 3.49Å; L122-F146 VanDerWaalsContact CD2-CD2 3.49Å; L122-F146 HydrophobicContact CD2-CE2 3.59Å; L122-F146 HydrophobicContact CD2-CG 4.18Å; L122-F146 HydrophobicContact CD2-CZ 4.34Å; L122-F146 HydrophobicContact CG-CE2 4.37Å; T125-F146 HydrophobicContact CG2-CD2 4.5Å; V141-F146 HydrophobicContact CG1-CD1 4.08Å; V141-F146 HydrophobicContact CG1-CE1 3.75Å; V141-F146 HydrophobicContact CG1-CE2 4.33Å; V141-F146 HydrophobicContact CG1-CZ 3.9Å; V141-F146 HydrophobicContact CG2-CE2 4.49Å; V141-F146 WeakPolarHBondContact O-CB 3.24Å; V141-F146 WeakPolarHBondContact O-CD1 3.44Å; V141-F146 WeakPolarHBondContact O-CG 3.25Å; N143-F146 PolarHBondContact O-N 3.38Å; N143-F146 VanDerWaalsContact OD1-CB 3.3Å; N143-F146 WeakPolarHBondContact OD1-CB 3.45Å; N143-F146 PolarHBondContact OD1-N 3.02Å; F146-C148 PolarHBondContact O-N 3.12Å; F146-S149 PolarHBondContact O-N 3.48Å; F146-L150 HydrophobicContact CE1-CD2 4.09Å; F146-L150 WeakPolarHBondContact O-CB 3.41Å; F146-L150 PolarHBondContact O-N 2.82Å; F146-T181 HydrophobicContact CE1-CG2 4.17Å; F146-T181 WeakPolarHBondContact CE1-OG1 3.43Å
147	V	96.3	Very high	94.9	Very high	4 Å²	4	16.8 Å²	16.8	2%	0.024	8%	0.082	C	C	.	.	H	α-helix	trans	-63.7	-43.7	-177.7	176.3	0	0	0	0	111.8	N143 W144 L150 R151 L193 H196 M200 L278	N143-V147 VanDerWaalsContact O-CG2 3.29Å; N143-V147 WeakPolarHBondContact O-CG2 3.29Å; N143-V147 PolarHBondContact O-N 3.5Å; N143-V147 VanDerWaalsContact O-N 3.14Å; W144-V147 PolarHBondContact O-N 2.94Å; V147-L150 PolarHBondContact O-N 3.04Å; V147-R151 WeakPolarHBondContact O-CB 3.47Å; V147-R151 PolarHBondContact O-N 3.29Å; V147-L193 HydrophobicContact CG1-CD1 4.43Å; V147-L193 HydrophobicContact CG2-CD1 3.45Å; V147-L193 VanDerWaalsContact CG2-CD1 3.45Å; V147-H196 HydrophobicContact CG1-CB 4.45Å; V147-M200 HydrophobicContact CG1-CE 3.63Å; V147-M200 WeakPolarHBondContact O-CE 3.19Å; V147-L278 HydrophobicContact CB-CD2 4.32Å; V147-L278 HydrophobicContact CG1-CD2 4.16Å; V147-L278 HydrophobicContact CG2-CD1 4.47Å; V147-L278 HydrophobicContact CG2-CD2 4Å
148	C	96.3	Very high	94.9	Very high	12 Å²	12	17.5 Å²	17.5	8%	0.081	9%	0.087	C	C	.	.	H	α-helix	trans	-68.4	-36.7	177.4	-71.9	0	0	0	0	112.5	F78 C82 W144 F146 R151 L152	F78-C148 HydrophobicContact CE1-CB 4.32Å; F78-C148 HydrophobicContact CZ-CB 4.14Å; C82-C148 HydrophobicContact CB-CB 3.72Å; W144-C148 WeakPolarHBondContact O-CB 3.27Å; W144-C148 PolarHBondContact O-N 3.48Å; W144-C148 PolarHBondContact O-SG 3.38Å; F146-C148 PolarHBondContact O-N 3.12Å; C148-R151 PolarHBondContact O-N 3.25Å; C148-L152 PolarHBondContact O-N 3.1Å
149	S	96.4	Very high	95	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-64.1	-48.3	173.8	-60.4	0	0	0	0	111	V79 Q145 F146 R151 L152 W153	V79-S149 WeakPolarHBondContact CG2-OG 3.49Å; Q145-S149 VanDerWaalsContact O-CB 3.24Å; Q145-S149 WeakPolarHBondContact O-CB 3.23Å; Q145-S149 PolarHBondContact O-N 3.38Å; Q145-S149 PolarHBondContact O-OG 3.46Å; F146-S149 PolarHBondContact O-N 3.48Å; S149-R151 VanDerWaalsContact C-N 3.31Å; S149-R151 PolarHBondContact O-N 3.39Å; S149-L152 WeakPolarHBondContact O-CB 3.2Å; S149-L152 PolarHBondContact O-N 3.47Å; S149-W153 PolarHBondContact O-N 3.43Å
150	L	96.9	Very high	95.1	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-58.3	-45.2	176.2	-173.1	59.2	0	0	0	110.8	L122 F146 V147 L152 W153 C154 L174 L177 V178 M200	L122-L150 HydrophobicContact CD1-CB 4.49Å; L122-L150 HydrophobicContact CD1-CD1 4.42Å; F146-L150 HydrophobicContact CE1-CD2 4.09Å; F146-L150 WeakPolarHBondContact O-CB 3.41Å; F146-L150 PolarHBondContact O-N 2.82Å; V147-L150 PolarHBondContact O-N 3.04Å; L150-L152 PolarHBondContact O-N 2.66Å; L150-W153 PolarHBondContact O-N 3.37Å; L150-C154 PolarHBondContact O-N 2.63Å; L150-C154 PolarHBondContact O-SG 3.44Å; L150-L174 HydrophobicContact CD1-CD2 4.06Å; L150-L177 HydrophobicContact CD1-CB 4.19Å; L150-V178 HydrophobicContact CD1-CG2 4.04Å; L150-V178 HydrophobicContact CD2-CB 4.5Å; L150-V178 HydrophobicContact CD2-CG2 3.7Å; L150-V178 HydrophobicContact CG-CG2 3.92Å; L150-M200 HydrophobicContact CB-SD 4.4Å; L150-M200 HydrophobicContact CD2-SD 4.39Å; L150-M200 HydrophobicContact CG-SD 4.1Å
151	R	97.4	Very high	95.1	Very high	58 Å²	58	17.6 Å²	17.6	22%	0.219	8%	0.081	C	C	.	.	H	α-helix	trans	-57.3	-45.4	176	-164.4	174.6	-140.2	-84	3.7	112.8	V147 C148 S149 W153 C154 D155 M200	V147-R151 WeakPolarHBondContact O-CB 3.47Å; V147-R151 PolarHBondContact O-N 3.29Å; C148-R151 PolarHBondContact O-N 3.25Å; S149-R151 VanDerWaalsContact C-N 3.31Å; S149-R151 PolarHBondContact O-N 3.39Å; R151-W153 VanDerWaalsContact C-N 3.34Å; R151-W153 PolarHBondContact O-N 2.97Å; R151-C154 PolarHBondContact O-N 3.01Å; R151-D155 IonicContact NH1-OD2 3.19Å; R151-D155 PolarHBondContact NH1-OD2 3.25Å; R151-D155 WeakPolarHBondContact O-CB 3.44Å; R151-D155 VanDerWaalsContact O-CG 3.31Å; R151-D155 PolarHBondContact O-N 2.93Å; R151-M200 HydrophobicContact CB-CE 3.6Å; R151-M200 HydrophobicContact CB-CG 4.3Å; R151-M200 HydrophobicContact CB-SD 3.95Å; R151-M200 HydrophobicContact CG-CE 4Å; R151-M200 HydrophobicContact CG-CG 4.06Å; R151-M200 HydrophobicContact CG-SD 4.36Å
152	L	97.2	Very high	94.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.3	-46.1	178.9	175.5	70.7	0	0	0	111.1	F75 F78 R97 L100 L101 F104 C148 S149 L150 D155 F156	F75-L152 HydrophobicContact CD2-CD2 3.62Å; F75-L152 HydrophobicContact CE2-CD2 3.79Å; F78-L152 HydrophobicContact CD1-CD2 4.09Å; F78-L152 HydrophobicContact CE1-CB 4.09Å; F78-L152 HydrophobicContact CE1-CD2 4.03Å; F78-L152 HydrophobicContact CZ-CB 4.47Å; R97-L152 HydrophobicContact CG-CD1 3.73Å; L100-L152 HydrophobicContact CB-CD1 3.96Å; L100-L152 HydrophobicContact CD1-CD1 4.33Å; L100-L152 HydrophobicContact CD1-CD2 3.92Å; L101-L152 HydrophobicContact CD2-CD1 4.11Å; L101-L152 HydrophobicContact CG-CD1 4.09Å; F104-L152 HydrophobicContact CE2-CD1 4.05Å; F104-L152 HydrophobicContact CE2-CD2 4.19Å; F104-L152 HydrophobicContact CE2-CG 4.16Å; F104-L152 HydrophobicContact CZ-CD2 4.24Å; C148-L152 PolarHBondContact O-N 3.1Å; S149-L152 WeakPolarHBondContact O-CB 3.2Å; S149-L152 PolarHBondContact O-N 3.47Å; L150-L152 PolarHBondContact O-N 2.66Å; L152-D155 PolarHBondContact O-N 3.43Å; L152-F156 WeakPolarHBondContact O-CB 3.31Å; L152-F156 PolarHBondContact O-N 3.21Å
153	W	97.2	Very high	94.7	Very high	1 Å²	1	25.6 Å²	25.6	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-70.8	-35.1	-179.5	-61.9	121.5	0	0	0	113	F75 F104 A115 Y118 S149 L150 R151 F156 T157 L174	F75-W153 AromaticContact CD2-CZ2 3.85Å; F75-W153 HydrophobicContact CD2-CZ2 3.85Å; F75-W153 HydrophobicContact CE1-CZ2 4.5Å; F75-W153 AromaticContact CE2-CE2 3.88Å; F75-W153 AromaticContact CE2-CZ2 3.65Å; F75-W153 HydrophobicContact CE2-CZ2 3.65Å; F75-W153 AromaticContact CE2-NE1 3.71Å; F75-W153 HydrophobicContact CG-CZ2 4.38Å; F75-W153 HydrophobicContact CZ-CZ2 4Å; F75-W153 AromaticContact CZ-NE1 3.77Å; F104-W153 HydrophobicContact CE2-CH2 4.48Å; F104-W153 HydrophobicContact CE2-CZ3 4.07Å; F104-W153 HydrophobicContact CZ-CH2 4.17Å; F104-W153 HydrophobicContact CZ-CZ3 4.18Å; A115-W153 HydrophobicContact CB-CD2 4.25Å; A115-W153 HydrophobicContact CB-CE3 3.39Å; A115-W153 HydrophobicContact CB-CH2 4.05Å; A115-W153 HydrophobicContact CB-CZ3 3.28Å; Y118-W153 AromaticContact CD2-CH2 3.88Å; Y118-W153 HydrophobicContact CD2-CH2 3.88Å; Y118-W153 AromaticContact CD2-CZ2 3.39Å; Y118-W153 HydrophobicContact CD2-CZ2 3.39Å; Y118-W153 HydrophobicContact CE2-CZ2 4.36Å; Y118-W153 AromaticContact CG-CZ2 3.9Å; Y118-W153 HydrophobicContact CG-CZ2 3.9Å; S149-W153 PolarHBondContact O-N 3.43Å; L150-W153 PolarHBondContact O-N 3.37Å; R151-W153 VanDerWaalsContact C-N 3.34Å; R151-W153 PolarHBondContact O-N 2.97Å; W153-F156 HydrophobicContact CE3-CB 4.47Å; W153-F156 HydrophobicContact CE3-CD1 4Å; W153-F156 HydrophobicContact CE3-CG 4.44Å; W153-F156 HydrophobicContact CZ3-CD1 4.34Å; W153-F156 PolarHBondContact O-N 3.48Å; W153-T157 WeakPolarHBondContact O-CB 3.48Å; W153-T157 PolarHBondContact O-N 3.17Å; W153-T157 PolarHBondContact O-OG1 3.11Å; W153-L174 HydrophobicContact CB-CD1 4.15Å; W153-L174 HydrophobicContact CB-CD2 3.71Å; W153-L174 WeakPolarHBondContact O-CD1 3.3Å
154	C	97.1	Very high	94.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-45.3	170.8	-66.3	0	0	0	0	111.6	L150 R151 T157 S158 M200 M204	L150-C154 PolarHBondContact O-N 2.63Å; L150-C154 PolarHBondContact O-SG 3.44Å; R151-C154 PolarHBondContact O-N 3.01Å; C154-T157 PolarHBondContact O-N 3.01Å; C154-S158 WeakPolarHBondContact O-CB 3.39Å; C154-S158 PolarHBondContact O-N 3.29Å; C154-M200 HydrophobicContact CB-CB 4.02Å; C154-M200 HydrophobicContact CB-CG 4.45Å; C154-M204 HydrophobicContact CB-CG 3.79Å; C154-M204 HydrophobicContact CB-SD 3.65Å; C154-M204 WeakPolarHBondContact O-CG 3.2Å; C154-M204 PolarHBondContact SG-SD 2.96Å
155	D	96	Very high	94.3	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.064	15%	0.151	C	C	.	.	H	α-helix	trans	-68.3	-37.7	178	-71.1	-19.1	0	0	0	111.4	R97 L101 R151 L152 S158 R159 N203	R97-D155 WeakPolarHBondContact CD-OD2 3.06Å; R97-D155 IonicContact NE-OD2 2.85Å; R97-D155 PolarHBondContact NE-OD2 2.92Å; L101-D155 HydrophobicContact CD1-CB 3.84Å; L101-D155 HydrophobicContact CD2-CB 4.26Å; R151-D155 IonicContact NH1-OD2 3.19Å; R151-D155 PolarHBondContact NH1-OD2 3.25Å; R151-D155 WeakPolarHBondContact O-CB 3.44Å; R151-D155 VanDerWaalsContact O-CG 3.31Å; R151-D155 PolarHBondContact O-N 2.93Å; L152-D155 PolarHBondContact O-N 3.43Å; D155-S158 PolarHBondContact O-N 2.63Å; D155-R159 WeakPolarHBondContact O-CG 3.36Å; D155-R159 PolarHBondContact O-N 2.82Å; D155-R159 VanDerWaalsContact O-N 3.08Å; D155-N203 PolarHBondContact OD1-ND2 2.97Å; D155-N203 VanDerWaalsContact OD1-ND2 3.13Å
156	F	96.2	Very high	94.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-50.3	173.1	168.7	-114.8	0	0	0	111.3	L101 F104 L108 A111 A115 L152 W153 S158 R159 Y160 I167 L170	L101-F156 VanDerWaalsContact CD2-CA 3.4Å; L101-F156 HydrophobicContact CD2-CB 3.72Å; L101-F156 VanDerWaalsContact CD2-N 3.34Å; F104-F156 HydrophobicContact CB-CD2 3.71Å; F104-F156 HydrophobicContact CB-CE2 3.59Å; F104-F156 HydrophobicContact CD2-CB 4.27Å; F104-F156 AromaticContact CD2-CD2 3.56Å; F104-F156 HydrophobicContact CD2-CD2 3.56Å; F104-F156 HydrophobicContact CD2-CE2 4.16Å; F104-F156 HydrophobicContact CD2-CG 4.06Å; F104-F156 HydrophobicContact CG-CD2 4.02Å; F104-F156 HydrophobicContact CG-CE2 4.17Å; L108-F156 HydrophobicContact CD2-CE2 4.35Å; A111-F156 HydrophobicContact CB-CE2 4.08Å; A111-F156 HydrophobicContact CB-CZ 3.95Å; A115-F156 HydrophobicContact CB-CD1 4.17Å; A115-F156 HydrophobicContact CB-CE1 3.8Å; L152-F156 WeakPolarHBondContact O-CB 3.31Å; L152-F156 PolarHBondContact O-N 3.21Å; W153-F156 HydrophobicContact CE3-CB 4.47Å; W153-F156 HydrophobicContact CE3-CD1 4Å; W153-F156 HydrophobicContact CE3-CG 4.44Å; W153-F156 HydrophobicContact CZ3-CD1 4.34Å; W153-F156 PolarHBondContact O-N 3.48Å; F156-S158 VanDerWaalsContact C-N 3.29Å; F156-S158 PolarHBondContact O-N 2.75Å; F156-R159 PolarHBondContact O-N 3.39Å; F156-Y160 AromaticContact CD2-CD2 3.44Å; F156-Y160 HydrophobicContact CD2-CD2 3.44Å; F156-Y160 VanDerWaalsContact CD2-CD2 3.44Å; F156-Y160 AromaticContact CD2-CE2 3.9Å; F156-Y160 HydrophobicContact CD2-CE2 3.9Å; F156-Y160 AromaticContact CE2-CD2 3.61Å; F156-Y160 HydrophobicContact CE2-CD2 3.61Å; F156-Y160 HydrophobicContact CE2-CE2 4.21Å; F156-Y160 HydrophobicContact CE2-CG 4.39Å; F156-Y160 HydrophobicContact CG-CD2 4.45Å; F156-Y160 VanDerWaalsContact O-CD2 3.32Å; F156-Y160 WeakPolarHBondContact O-CD2 3.32Å; F156-Y160 PolarHBondContact O-N 2.9Å; F156-Y160 VanDerWaalsContact O-N 3.13Å; F156-I167 HydrophobicContact CD1-CG2 4.37Å; F156-I167 HydrophobicContact CE1-CD1 3.99Å; F156-I167 HydrophobicContact CE1-CG1 3.95Å; F156-I167 HydrophobicContact CE1-CG2 4.02Å; F156-I167 HydrophobicContact CE2-CD1 3.82Å; F156-I167 HydrophobicContact CZ-CD1 3.3Å; F156-I167 HydrophobicContact CZ-CG1 3.75Å; F156-I167 HydrophobicContact CZ-CG2 4.35Å; F156-L170 HydrophobicContact CE1-CD1 4.34Å
157	T	94.8	Very high	94.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-39.6	177.4	-56.5	0	0	0	0	110.8	W153 C154 R159 A161 I167 I171 L174	W153-T157 WeakPolarHBondContact O-CB 3.48Å; W153-T157 PolarHBondContact O-N 3.17Å; W153-T157 PolarHBondContact O-OG1 3.11Å; C154-T157 PolarHBondContact O-N 3.01Å; T157-R159 VanDerWaalsContact C-N 3.33Å; T157-R159 PolarHBondContact O-N 3.07Å; T157-A161 HydrophobicContact CG2-CB 4.28Å; T157-A161 WeakPolarHBondContact O-CB 3.35Å; T157-A161 PolarHBondContact O-N 3.24Å; T157-I167 HydrophobicContact CG2-CG2 4.33Å; T157-I171 HydrophobicContact CG2-CB 4.39Å; T157-I171 HydrophobicContact CG2-CD1 4.24Å; T157-I171 HydrophobicContact CG2-CG1 3.29Å; T157-L174 WeakPolarHBondContact OG1-CD1 3Å
158	S	93	Very high	93.9	Very high	26 Å²	26	35.5 Å²	35.5	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-39.4	178.7	-176.7	0	0	0	0	113.4	C154 D155 F156 N203 R235	C154-S158 WeakPolarHBondContact O-CB 3.39Å; C154-S158 PolarHBondContact O-N 3.29Å; D155-S158 PolarHBondContact O-N 2.63Å; F156-S158 VanDerWaalsContact C-N 3.29Å; F156-S158 PolarHBondContact O-N 2.75Å; S158-N203 WeakPolarHBondContact CB-O 3.47Å; S158-N203 PolarHBondContact OG-O 3.23Å; S158-R235 VanDerWaalsContact O-CZ 3.31Å; S158-R235 PolarHBondContact O-NE 3.03Å; S158-R235 VanDerWaalsContact O-NE 3.11Å; S158-R235 PolarHBondContact O-NH2 3.17Å
159	R	92.5	Very high	93.8	Very high	105 Å²	105	38 Å²	38	40%	0.396	21%	0.205	S	C	.	.	H	α-helix	trans	-77.4	-38.1	-179.2	-70.6	-176.7	-170	-169.1	3.9	113.9	E98 D155 F156 T157	E98-R159 IonicContact OE1-CZ 3.82Å; E98-R159 IonicContact OE1-NH2 2.75Å; E98-R159 PolarHBondContact OE1-NH2 2.79Å; E98-R159 IonicContact OE2-CZ 3.78Å; E98-R159 IonicContact OE2-NH1 2.92Å; E98-R159 PolarHBondContact OE2-NH1 3.27Å; E98-R159 IonicContact OE2-NH2 2.63Å; E98-R159 PolarHBondContact OE2-NH2 3.15Å; D155-R159 WeakPolarHBondContact O-CG 3.36Å; D155-R159 PolarHBondContact O-N 2.82Å; D155-R159 VanDerWaalsContact O-N 3.08Å; F156-R159 PolarHBondContact O-N 3.39Å; T157-R159 VanDerWaalsContact C-N 3.33Å; T157-R159 PolarHBondContact O-N 3.07Å
160	Y	93.4	Very high	93.7	Very high	32 Å²	32	38.1 Å²	38.1	13%	0.125	21%	0.205	C	C	.	.	H	α-helix	trans	-113.3	-3.5	-166.5	-58.7	-68	0	0	0	115	L101 F104 G105 L108 F156 D162 V163 H164	L101-Y160 PolarHBondContact O-OH 2.98Å; F104-Y160 HydrophobicContact CB-CE2 4.48Å; G105-Y160 WeakPolarHBondContact CA-OH 3.26Å; G105-Y160 PolarHBondContact N-OH 3.34Å; L108-Y160 HydrophobicContact CD2-CD1 3.68Å; L108-Y160 HydrophobicContact CD2-CD2 4.13Å; L108-Y160 HydrophobicContact CD2-CE1 4.19Å; L108-Y160 HydrophobicContact CD2-CG 3.66Å; F156-Y160 AromaticContact CD2-CD2 3.44Å; F156-Y160 HydrophobicContact CD2-CD2 3.44Å; F156-Y160 VanDerWaalsContact CD2-CD2 3.44Å; F156-Y160 AromaticContact CD2-CE2 3.9Å; F156-Y160 HydrophobicContact CD2-CE2 3.9Å; F156-Y160 AromaticContact CE2-CD2 3.61Å; F156-Y160 HydrophobicContact CE2-CD2 3.61Å; F156-Y160 HydrophobicContact CE2-CE2 4.21Å; F156-Y160 HydrophobicContact CE2-CG 4.39Å; F156-Y160 HydrophobicContact CG-CD2 4.45Å; F156-Y160 VanDerWaalsContact O-CD2 3.32Å; F156-Y160 WeakPolarHBondContact O-CD2 3.32Å; F156-Y160 PolarHBondContact O-N 2.9Å; F156-Y160 VanDerWaalsContact O-N 3.13Å; Y160-D162 PolarHBondContact O-N 3.32Å; Y160-V163 PolarHBondContact O-N 2.92Å; Y160-V163 VanDerWaalsContact O-N 3.07Å; Y160-H164 PolarHBondContact O-N 3.49Å
161	A	90.9	Very high	93.6	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.033	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.4	178.7	0	0	0	0	0	114.2	T157 V163 K168 I171	T157-A161 HydrophobicContact CG2-CB 4.28Å; T157-A161 WeakPolarHBondContact O-CB 3.35Å; T157-A161 PolarHBondContact O-N 3.24Å; A161-V163 VanDerWaalsContact C-N 3.34Å; A161-K168 HydrophobicContact CB-CB 4.23Å; A161-K168 HydrophobicContact CB-CG 4.4Å; A161-I171 HydrophobicContact CB-CD1 4.02Å
162	D	86.7	Confident	93.4	Very high	75 Å²	75	41.9 Å²	41.9	40%	0.401	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-20.6	177.7	-71.3	11.6	0	0	0	112.3	Y160 R235 N241	Y160-D162 PolarHBondContact O-N 3.32Å; D162-R235 WeakPolarHBondContact OD1-CD 3.33Å; D162-R235 IonicContact OD1-NH1 4Å; D162-R235 PolarHBondContact OD1-NH1 3.09Å; D162-R235 WeakPolarHBondContact OD2-CD 3.21Å; D162-R235 WeakPolarHBondContact OD2-CG 3.2Å; D162-N241 PolarHBondContact OD2-ND2 3.5Å
163	V	89.6	Confident	93.4	Very high	106 Å²	106	44.2 Å²	44.2	64%	0.642	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	-34.5	-176.8	-176.5	0	0	0	0	111.2	L108 Y160 A161	L108-V163 HydrophobicContact CD1-CG1 4.18Å; Y160-V163 PolarHBondContact O-N 2.92Å; Y160-V163 VanDerWaalsContact O-N 3.07Å; A161-V163 VanDerWaalsContact C-N 3.34Å
164	H	90.3	Very high	93.4	Very high	36 Å²	36	44.1 Å²	44.1	17%	0.167	24%	0.24	C	C	.	.			trans	-132	116.6	-169.5	-161.9	-96.9	0	0	0	112.5	L108 D109 Y160 L166 I167 K168	L108-H164 HydrophobicContact CD1-CB 4.27Å; D109-H164 IonicContact OD1-NE2 2.73Å; D109-H164 PolarHBondContact OD1-NE2 2.81Å; Y160-H164 PolarHBondContact O-N 3.49Å; H164-L166 VanDerWaalsContact C-N 3.32Å; H164-L166 PolarHBondContact O-N 2.95Å; H164-I167 HydrophobicContact CB-CB 4.18Å; H164-I167 HydrophobicContact CB-CD1 3.78Å; H164-I167 HydrophobicContact CB-CG1 4.02Å; H164-I167 PolarHBondContact O-N 3.38Å; H164-K168 PolarHBondContact O-N 3.38Å; H164-K168 VanDerWaalsContact O-N 3.1Å
165	A	91.2	Very high	93.4	Very high	84 Å²	84	44.8 Å²	44.8	69%	0.694	25%	0.245	S	C	*	.	H	α-helix	trans	-59.5	-38.2	-175.9	0	0	0	0	0	113.4	I167 K168 S169	A165-I167 VanDerWaalsContact C-N 3.32Å; A165-I167 PolarHBondContact O-N 3.33Å; A165-K168 WeakPolarHBondContact O-CB 3.5Å; A165-K168 PolarHBondContact O-N 3.23Å; A165-S169 PolarHBondContact O-N 3.28Å
166	L	93.4	Very high	93.4	Very high	85 Å²	85	49.5 Å²	49.5	45%	0.445	27%	0.267	S	S	.	.	H	α-helix	trans	-68.2	-32.3	177.4	-56.1	-179.4	0	0	0	112	Y112 H164 K168 S169	Y112-L166 HydrophobicContact CD1-CB 4.14Å; Y112-L166 HydrophobicContact CD1-CD1 4.03Å; Y112-L166 HydrophobicContact CD2-CB 3.84Å; Y112-L166 HydrophobicContact CE1-CB 4.01Å; Y112-L166 HydrophobicContact CE1-CD1 3.96Å; Y112-L166 HydrophobicContact CE1-CG 4.49Å; Y112-L166 HydrophobicContact CE2-CB 3.71Å; Y112-L166 WeakPolarHBondContact CE2-O 3.42Å; Y112-L166 HydrophobicContact CG-CB 4.05Å; H164-L166 VanDerWaalsContact C-N 3.32Å; H164-L166 PolarHBondContact O-N 2.95Å; L166-K168 VanDerWaalsContact C-N 3.32Å; L166-S169 PolarHBondContact O-N 3.32Å; L166-S169 PolarHBondContact O-OG 3.42Å
167	I	93.5	Very high	93.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-71.3	-35.8	176.4	-64.6	172.5	0	0	0	109.6	L108 Y112 F156 T157 H164 A165 S169 L170	L108-I167 HydrophobicContact CB-CD1 4.22Å; L108-I167 HydrophobicContact CD2-CD1 3.77Å; L108-I167 HydrophobicContact CG-CD1 4.45Å; Y112-I167 HydrophobicContact CD2-CG1 4.34Å; F156-I167 HydrophobicContact CD1-CG2 4.37Å; F156-I167 HydrophobicContact CE1-CD1 3.99Å; F156-I167 HydrophobicContact CE1-CG1 3.95Å; F156-I167 HydrophobicContact CE1-CG2 4.02Å; F156-I167 HydrophobicContact CE2-CD1 3.82Å; F156-I167 HydrophobicContact CZ-CD1 3.3Å; F156-I167 HydrophobicContact CZ-CG1 3.75Å; F156-I167 HydrophobicContact CZ-CG2 4.35Å; T157-I167 HydrophobicContact CG2-CG2 4.33Å; H164-I167 HydrophobicContact CB-CB 4.18Å; H164-I167 HydrophobicContact CB-CD1 3.78Å; H164-I167 HydrophobicContact CB-CG1 4.02Å; H164-I167 PolarHBondContact O-N 3.38Å; A165-I167 VanDerWaalsContact C-N 3.32Å; A165-I167 PolarHBondContact O-N 3.33Å; I167-S169 PolarHBondContact O-N 2.93Å; I167-L170 WeakPolarHBondContact O-CB 3.35Å; I167-L170 PolarHBondContact O-N 2.98Å; I167-L170 VanDerWaalsContact O-N 3.1Å
168	K	92.2	Very high	93.6	Very high	108 Å²	108	50.1 Å²	50.1	47%	0.47	27%	0.27	S	S	.	.	H	α-helix	trans	-58.9	-33.1	174.2	-166.1	174.3	179.3	173.5	0	112.6	A161 H164 A165 L166 L170 I171	A161-K168 HydrophobicContact CB-CB 4.23Å; A161-K168 HydrophobicContact CB-CG 4.4Å; H164-K168 PolarHBondContact O-N 3.38Å; H164-K168 VanDerWaalsContact O-N 3.1Å; A165-K168 WeakPolarHBondContact O-CB 3.5Å; A165-K168 PolarHBondContact O-N 3.23Å; L166-K168 VanDerWaalsContact C-N 3.32Å; K168-L170 VanDerWaalsContact C-N 3.26Å; K168-L170 PolarHBondContact O-N 3.18Å; K168-I171 HydrophobicContact CG-CD1 3.92Å; K168-I171 WeakPolarHBondContact O-CB 3.49Å; K168-I171 WeakPolarHBondContact O-CD1 3.35Å; K168-I171 VanDerWaalsContact O-CG1 3.26Å; K168-I171 WeakPolarHBondContact O-CG1 3.47Å; K168-I171 PolarHBondContact O-N 3.17Å
169	S	93.6	Very high	93.8	Very high	63 Å²	63	51.4 Å²	51.4	44%	0.441	27%	0.271	S	S	.	.	H	α-helix	trans	-69.3	-21.6	178	73.5	0	0	0	0	113.4	A165 L166 I167 I171 P173	A165-S169 PolarHBondContact O-N 3.28Å; L166-S169 PolarHBondContact O-N 3.32Å; L166-S169 PolarHBondContact O-OG 3.42Å; I167-S169 PolarHBondContact O-N 2.93Å; S169-I171 PolarHBondContact O-N 3.37Å; S169-P173 WeakPolarHBondContact O-CD 3.25Å
170	L	95	Very high	93.9	Very high	5 Å²	5	47 Å²	47	3%	0.026	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.2	175	-64	175.9	0	0	0	113.6	Y112 A115 F116 F156 I167 K168 H172 P173 L174	Y112-L170 HydrophobicContact CD2-CD1 3.84Å; Y112-L170 HydrophobicContact CD2-CG 4.21Å; Y112-L170 HydrophobicContact CE2-CD1 3.99Å; Y112-L170 HydrophobicContact CE2-CD2 4.02Å; Y112-L170 HydrophobicContact CE2-CG 3.85Å; A115-L170 HydrophobicContact CB-CD1 3.71Å; F116-L170 HydrophobicContact CD2-CD2 4.35Å; F156-L170 HydrophobicContact CE1-CD1 4.34Å; I167-L170 WeakPolarHBondContact O-CB 3.35Å; I167-L170 PolarHBondContact O-N 2.98Å; I167-L170 VanDerWaalsContact O-N 3.1Å; K168-L170 VanDerWaalsContact C-N 3.26Å; K168-L170 PolarHBondContact O-N 3.18Å; L170-H172 VanDerWaalsContact C-N 3.3Å; L170-H172 PolarHBondContact O-N 3.16Å; L170-P173 WeakPolarHBondContact O-CD 3.17Å; L170-L174 HydrophobicContact CB-CD1 4.15Å; L170-L174 VanDerWaalsContact O-CB 3.32Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 VanDerWaalsContact O-CG 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.22Å; L170-L174 PolarHBondContact O-N 3.37Å
171	I	94.2	Very high	94.1	Very high	16 Å²	16	45.5 Å²	45.5	8%	0.082	25%	0.252	C	S	.	.	H	α-helix	trans	-56.7	-45.5	179.2	-69	173.5	0	0	0	111.3	T157 A161 K168 S169 S175 M204 L243	T157-I171 HydrophobicContact CG2-CB 4.39Å; T157-I171 HydrophobicContact CG2-CD1 4.24Å; T157-I171 HydrophobicContact CG2-CG1 3.29Å; A161-I171 HydrophobicContact CB-CD1 4.02Å; K168-I171 HydrophobicContact CG-CD1 3.92Å; K168-I171 WeakPolarHBondContact O-CB 3.49Å; K168-I171 WeakPolarHBondContact O-CD1 3.35Å; K168-I171 VanDerWaalsContact O-CG1 3.26Å; K168-I171 WeakPolarHBondContact O-CG1 3.47Å; K168-I171 PolarHBondContact O-N 3.17Å; S169-I171 PolarHBondContact O-N 3.37Å; I171-S175 VanDerWaalsContact O-CB 3.29Å; I171-S175 WeakPolarHBondContact O-CB 3.35Å; I171-S175 PolarHBondContact O-N 3.37Å; I171-S175 PolarHBondContact O-OG 3.2Å; I171-M204 HydrophobicContact CB-CE 4.23Å; I171-M204 HydrophobicContact CG1-CE 4.44Å; I171-M204 HydrophobicContact CG2-CE 3.99Å; I171-M204 WeakPolarHBondContact O-CE 3.27Å; I171-L243 HydrophobicContact CD1-CD2 4.22Å; I171-L243 HydrophobicContact CG2-CD1 4.26Å; I171-L243 HydrophobicContact CG2-CD2 3.48Å; I171-L243 VanDerWaalsContact CG2-CD2 3.48Å
172	H	94	Very high	94.3	Very high	121 Å²	121	45.9 Å²	45.9	56%	0.56	25%	0.254	S	S	*	.	H	α-helix	trans	-68.6	-53	-176.1	177.1	-94.7	0	0	0	112.1	L170 L174 S175 Q176	L170-H172 VanDerWaalsContact C-N 3.3Å; L170-H172 PolarHBondContact O-N 3.16Å; H172-L174 VanDerWaalsContact C-N 3.34Å; H172-L174 PolarHBondContact O-N 3.03Å; H172-S175 PolarHBondContact O-N 3.3Å; H172-Q176 PolarHBondContact CE1-NE2 2.85Å; H172-Q176 PolarHBondContact CE1-OE1 3.31Å; H172-Q176 WeakPolarHBondContact O-CG 3.37Å; H172-Q176 PolarHBondContact O-N 2.75Å
173	P	96.5	Very high	94.7	Very high	49 Å²	49	47.4 Å²	47.4	32%	0.318	26%	0.257	S	S	.	.	H	α-helix	trans	-54.7	-45.2	174.3	-26.7	33.7	0	0	0	113.5	T119 S169 L170 Q176 L177	T119-P173 HydrophobicContact CG2-CB 4.39Å; S169-P173 WeakPolarHBondContact O-CD 3.25Å; L170-P173 WeakPolarHBondContact O-CD 3.17Å; P173-Q176 PolarHBondContact O-N 2.87Å; P173-L177 WeakPolarHBondContact O-CG 3.45Å; P173-L177 PolarHBondContact O-N 3.02Å
174	L	97.3	Very high	94.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-41.4	179.3	-72.8	169.4	0	0	0	111.9	T119 L150 W153 T157 L170 H172 Q176 L177 V178 M204	T119-L174 HydrophobicContact CG2-CD2 3.78Å; T119-L174 HydrophobicContact CG2-CG 4.22Å; L150-L174 HydrophobicContact CD1-CD2 4.06Å; W153-L174 HydrophobicContact CB-CD1 4.15Å; W153-L174 HydrophobicContact CB-CD2 3.71Å; W153-L174 WeakPolarHBondContact O-CD1 3.3Å; T157-L174 WeakPolarHBondContact OG1-CD1 3Å; L170-L174 HydrophobicContact CB-CD1 4.15Å; L170-L174 VanDerWaalsContact O-CB 3.32Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 VanDerWaalsContact O-CG 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.22Å; L170-L174 PolarHBondContact O-N 3.37Å; H172-L174 VanDerWaalsContact C-N 3.34Å; H172-L174 PolarHBondContact O-N 3.03Å; L174-Q176 PolarHBondContact O-N 3.18Å; L174-L177 PolarHBondContact O-N 2.72Å; L174-V178 VanDerWaalsContact O-CG2 3.23Å; L174-V178 WeakPolarHBondContact O-CG2 3.35Å; L174-V178 PolarHBondContact O-N 3.33Å; L174-M204 HydrophobicContact CB-CE 3.77Å; L174-M204 HydrophobicContact CB-SD 4.06Å
175	S	96.7	Very high	94.9	Very high	14 Å²	14	42.1 Å²	42.1	10%	0.098	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-46.9	175.8	-58.5	0	0	0	0	110.7	I171 H172 L177 V178 Y179	I171-S175 VanDerWaalsContact O-CB 3.29Å; I171-S175 WeakPolarHBondContact O-CB 3.35Å; I171-S175 PolarHBondContact O-N 3.37Å; I171-S175 PolarHBondContact O-OG 3.2Å; H172-S175 PolarHBondContact O-N 3.3Å; S175-L177 VanDerWaalsContact C-N 3.33Å; S175-L177 PolarHBondContact O-N 3.48Å; S175-V178 PolarHBondContact O-N 3.03Å; S175-Y179 WeakPolarHBondContact O-CD2 3.41Å; S175-Y179 PolarHBondContact O-N 3.25Å
176	Q	96.5	Very high	94.8	Very high	111 Å²	111	46.3 Å²	46.3	52%	0.519	23%	0.228	S	C	.	.	H	α-helix	trans	-58.8	-42.7	176.7	-73	-177	-40	0	0	112.2	H172 P173 L174 Y179 G180	H172-Q176 PolarHBondContact CE1-NE2 2.85Å; H172-Q176 PolarHBondContact CE1-OE1 3.31Å; H172-Q176 WeakPolarHBondContact O-CG 3.37Å; H172-Q176 PolarHBondContact O-N 2.75Å; P173-Q176 PolarHBondContact O-N 2.87Å; L174-Q176 PolarHBondContact O-N 3.18Å; Q176-Y179 PolarHBondContact O-N 3.01Å; Q176-G180 PolarHBondContact O-N 3.41Å
177	L	97.1	Very high	94.6	Very high	13 Å²	13	43.5 Å²	43.5	7%	0.068	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-43.1	176	-71.6	176.7	0	0	0	112.6	T119 L122 A123 L126 L150 P173 L174 S175 G180 T181	T119-L177 HydrophobicContact CG2-CD1 3.53Å; L122-L177 HydrophobicContact CB-CD1 4.25Å; A123-L177 HydrophobicContact CB-CD1 4.42Å; A123-L177 HydrophobicContact CB-CD2 3.57Å; A123-L177 HydrophobicContact CB-CG 4.49Å; L126-L177 HydrophobicContact CD2-CD2 3.77Å; L150-L177 HydrophobicContact CD1-CB 4.19Å; P173-L177 WeakPolarHBondContact O-CG 3.45Å; P173-L177 PolarHBondContact O-N 3.02Å; L174-L177 PolarHBondContact O-N 2.72Å; S175-L177 VanDerWaalsContact C-N 3.33Å; S175-L177 PolarHBondContact O-N 3.48Å; L177-G180 PolarHBondContact O-N 2.64Å; L177-T181 WeakPolarHBondContact O-CB 3.49Å; L177-T181 PolarHBondContact O-N 3.39Å; L177-T181 PolarHBondContact O-OG1 2.88Å
178	V	97.3	Very high	94.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-46.1	177.6	178.9	0	0	0	0	110.4	L150 L174 S175 G180 T181 I182 C197 L201	L150-V178 HydrophobicContact CD1-CG2 4.04Å; L150-V178 HydrophobicContact CD2-CB 4.5Å; L150-V178 HydrophobicContact CD2-CG2 3.7Å; L150-V178 HydrophobicContact CG-CG2 3.92Å; L174-V178 VanDerWaalsContact O-CG2 3.23Å; L174-V178 WeakPolarHBondContact O-CG2 3.35Å; L174-V178 PolarHBondContact O-N 3.33Å; S175-V178 PolarHBondContact O-N 3.03Å; V178-G180 VanDerWaalsContact C-N 3.34Å; V178-G180 PolarHBondContact O-N 3.35Å; V178-T181 WeakPolarHBondContact O-CB 3.5Å; V178-T181 PolarHBondContact O-N 3.21Å; V178-I182 HydrophobicContact CG1-CD1 4.32Å; V178-I182 WeakPolarHBondContact O-CG1 3.45Å; V178-I182 PolarHBondContact O-N 3.44Å; V178-C197 HydrophobicContact CG1-CB 3.53Å; V178-C197 WeakPolarHBondContact CG1-O 3.43Å; V178-L201 HydrophobicContact CB-CD2 3.79Å; V178-L201 HydrophobicContact CB-CG 4.23Å; V178-L201 HydrophobicContact CG1-CD1 3.93Å; V178-L201 HydrophobicContact CG1-CD2 3.81Å; V178-L201 HydrophobicContact CG1-CG 3.66Å; V178-L201 HydrophobicContact CG2-CD2 4.2Å
179	Y	96.7	Very high	94.6	Very high	52 Å²	52	43.7 Å²	43.7	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-43	174.2	-81.9	-69.9	0	0	0	112.3	S175 Q176 T181 I182 K183 L201 I245 P246 I250	S175-Y179 WeakPolarHBondContact O-CD2 3.41Å; S175-Y179 PolarHBondContact O-N 3.25Å; Q176-Y179 PolarHBondContact O-N 3.01Å; Y179-T181 VanDerWaalsContact C-N 3.3Å; Y179-T181 PolarHBondContact O-N 3.1Å; Y179-I182 PolarHBondContact O-N 3.33Å; Y179-K183 WeakPolarHBondContact O-CB 3.34Å; Y179-K183 WeakPolarHBondContact O-CG 3.49Å; Y179-K183 PolarHBondContact O-N 3.21Å; Y179-L201 HydrophobicContact CE1-CD1 4.4Å; Y179-L201 HydrophobicContact CE2-CD1 4.23Å; Y179-I245 HydrophobicContact CE2-CG2 4.07Å; Y179-I245 WeakPolarHBondContact OH-CG2 3.43Å; Y179-P246 PolarHBondContact OH-O 3.31Å; Y179-I250 HydrophobicContact CD1-CD1 3.64Å; Y179-I250 HydrophobicContact CE1-CD1 3.4Å
180	G	96	Very high	94.7	Very high	12 Å²	12	42.1 Å²	42.1	12%	0.124	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-36.3	176.4	0	0	0	0	0	112.3	Y130 Q176 L177 V178 K183 L184	Y130-G180 PolarHBondContact OH-O 3.26Å; Q176-G180 PolarHBondContact O-N 3.41Å; L177-G180 PolarHBondContact O-N 2.64Å; V178-G180 VanDerWaalsContact C-N 3.34Å; V178-G180 PolarHBondContact O-N 3.35Å; G180-K183 PolarHBondContact O-N 3.22Å; G180-L184 WeakPolarHBondContact O-CB 3.34Å; G180-L184 PolarHBondContact O-N 2.94Å
181	T	96.5	Very high	94.7	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-66.6	-41	175.5	-56.2	0	0	0	0	111.9	V141 F146 L177 V178 Y179 N185 L193	V141-T181 HydrophobicContact CG1-CG2 4.06Å; F146-T181 HydrophobicContact CE1-CG2 4.17Å; F146-T181 WeakPolarHBondContact CE1-OG1 3.43Å; L177-T181 WeakPolarHBondContact O-CB 3.49Å; L177-T181 PolarHBondContact O-N 3.39Å; L177-T181 PolarHBondContact O-OG1 2.88Å; V178-T181 WeakPolarHBondContact O-CB 3.5Å; V178-T181 PolarHBondContact O-N 3.21Å; Y179-T181 VanDerWaalsContact C-N 3.3Å; Y179-T181 PolarHBondContact O-N 3.1Å; T181-N185 PolarHBondContact O-ND2 3.48Å; T181-L193 HydrophobicContact CG2-CD1 4.47Å; T181-L193 HydrophobicContact CG2-CD2 4.39Å
182	I	96	Very high	94.8	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.062	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-49.7	174.8	-66	169.6	0	0	0	110.3	V178 Y179 L184 N185 H194 C197 I198 I250	V178-I182 HydrophobicContact CG1-CD1 4.32Å; V178-I182 WeakPolarHBondContact O-CG1 3.45Å; V178-I182 PolarHBondContact O-N 3.44Å; Y179-I182 PolarHBondContact O-N 3.33Å; I182-L184 VanDerWaalsContact C-N 3.29Å; I182-L184 PolarHBondContact O-N 3.11Å; I182-N185 PolarHBondContact O-N 3Å; I182-H194 PolarHBondContact O-NE2 3Å; I182-C197 HydrophobicContact CD1-CB 3.68Å; I182-C197 HydrophobicContact CG1-CB 3.56Å; I182-I198 HydrophobicContact CD1-CG1 4.22Å; I182-I250 HydrophobicContact CD1-CD1 3.97Å; I182-I250 HydrophobicContact CG2-CD1 4.39Å; I182-I250 HydrophobicContact CG2-CG2 4.08Å
183	K	94.4	Very high	94.9	Very high	107 Å²	107	35.4 Å²	35.4	47%	0.465	17%	0.172	S	C	.	.	H	α-helix	trans	-64.1	-29.9	-177.6	-77.2	-175.5	178.1	-175.1	0	113.5	Y130 Y179 G180 K186	Y130-K183 VanDerWaalsContact OH-CB 3.27Å; Y130-K183 WeakPolarHBondContact OH-CB 3.16Å; Y179-K183 WeakPolarHBondContact O-CB 3.34Å; Y179-K183 WeakPolarHBondContact O-CG 3.49Å; Y179-K183 PolarHBondContact O-N 3.21Å; G180-K183 PolarHBondContact O-N 3.22Å; K183-K186 VanDerWaalsContact O-CE 3.24Å; K183-K186 WeakPolarHBondContact O-CE 3.36Å; K183-K186 WeakPolarHBondContact O-CG 3.3Å
184	L	94.3	Very high	95	Very high	29 Å²	29	33.7 Å²	33.7	15%	0.152	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-42.3	178.7	-175.4	68.1	0	0	0	110.9	L126 A129 Y130 I138 V141 G180 I182 K186	L126-L184 HydrophobicContact CD1-CD2 4.03Å; A129-L184 HydrophobicContact CB-CD1 4.47Å; A129-L184 HydrophobicContact CB-CD2 3.83Å; Y130-L184 HydrophobicContact CD1-CD1 4.14Å; Y130-L184 HydrophobicContact CD2-CD1 4.2Å; Y130-L184 HydrophobicContact CE1-CD1 4.03Å; Y130-L184 HydrophobicContact CE2-CB 4.05Å; Y130-L184 HydrophobicContact CE2-CD1 4.09Å; Y130-L184 HydrophobicContact CG-CD1 4.22Å; Y130-L184 PolarHBondContact OH-N 3.05Å; I138-L184 HydrophobicContact CG1-CD1 4.41Å; I138-L184 HydrophobicContact CG2-CD2 4.42Å; V141-L184 HydrophobicContact CB-CD2 3.94Å; V141-L184 HydrophobicContact CG1-CD2 3.9Å; V141-L184 HydrophobicContact CG2-CD2 4.06Å; G180-L184 WeakPolarHBondContact O-CB 3.34Å; G180-L184 PolarHBondContact O-N 2.94Å; I182-L184 VanDerWaalsContact C-N 3.29Å; I182-L184 PolarHBondContact O-N 3.11Å; L184-K186 PolarHBondContact O-N 3.01Å
185	N	91	Very high	95	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.016	16%	0.161	C	C	.	.	S	Bend	trans	-98.8	75.7	-171.4	-66.6	-64.7	0	0	0	111.5	T181 I182 W190 L193 H194	T181-N185 PolarHBondContact O-ND2 3.48Å; I182-N185 PolarHBondContact O-N 3Å; N185-W190 HydrophobicContact CB-CB 4.01Å; N185-W190 HydrophobicContact CB-CD2 3.81Å; N185-W190 HydrophobicContact CB-CE3 4.19Å; N185-W190 HydrophobicContact CB-CG 3.74Å; N185-W190 WeakPolarHBondContact O-CB 3.38Å; N185-L193 HydrophobicContact CB-CD2 3.97Å; N185-L193 WeakPolarHBondContact ND2-CD2 3.31Å; N185-H194 PolarHBondContact O-CE1 3.26Å; N185-H194 VanDerWaalsContact O-CE1 3.25Å; N185-H194 PolarHBondContact O-NE2 3.45Å
186	K	87.5	Confident	95	Very high	171 Å²	171	34 Å²	34	74%	0.743	16%	0.16	S	C	*	.			trans	-80.2	146	-175.6	-59.1	-175.7	-178.5	-178.3	0	113.1	K183 L184	K183-K186 VanDerWaalsContact O-CE 3.24Å; K183-K186 WeakPolarHBondContact O-CE 3.36Å; K183-K186 WeakPolarHBondContact O-CG 3.3Å; L184-K186 PolarHBondContact O-N 3.01Å
187	G	89.4	Confident	95	Very high	26 Å²	26	28.8 Å²	28.8	27%	0.268	14%	0.136	S	C	.	.	S	Bend	trans	108.2	163.3	168.6	0	0	0	0	0	115.3	R189 W190	G187-R189 PolarHBondContact O-N 3.48Å; G187-R189 VanDerWaalsContact O-N 3.1Å; G187-W190 PolarHBondContact O-N 3.38Å
188	Q	92.5	Very high	95.1	Very high	39 Å²	39	28.2 Å²	28.2	18%	0.182	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-55.7	-31.9	-173.9	178.8	177.2	7.9	0	0	113.7	W190 L191 V258 L285	Q188-W190 PolarHBondContact O-N 3.04Å; Q188-L191 HydrophobicContact CB-CD1 4.43Å; Q188-L191 HydrophobicContact CG-CD1 3.9Å; Q188-L191 WeakPolarHBondContact O-CD1 3.45Å; Q188-L191 VanDerWaalsContact O-CG 3.32Å; Q188-L191 WeakPolarHBondContact O-CG 3.35Å; Q188-L191 PolarHBondContact O-N 2.99Å; Q188-V258 HydrophobicContact CG-CG2 3.9Å; Q188-L285 HydrophobicContact CG-CD1 3.76Å
189	R	93.6	Very high	95	Very high	74 Å²	74	28.9 Å²	28.9	28%	0.279	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-62.3	-28.1	179.5	71	176.7	-68.2	-129.4	-6.2	113.2	G187 H279 F280 G451	G187-R189 PolarHBondContact O-N 3.48Å; G187-R189 VanDerWaalsContact O-N 3.1Å; R189-H279 PolarHBondContact NH2-ND1 2.74Å; R189-H279 CarbonylContact O-C 3.56Å; R189-H279 WeakPolarHBondContact O-CA 3.47Å; R189-H279 WeakPolarHBondContact O-CB 3.36Å; R189-F280 PolarHBondContact O-N 3.2Å; R189-G451 VanDerWaalsContact NH2-CA 3.31Å
190	W	95.1	Very high	95.1	Very high	30 Å²	30	26.5 Å²	26.5	11%	0.114	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-96.5	5.6	-175.2	-68.1	110.1	0	0	0	113.7	A142 N185 G187 Q188 P192 L193 H194 H279	A142-W190 HydrophobicContact CB-CH2 3.46Å; A142-W190 VanDerWaalsContact CB-CH2 3.46Å; A142-W190 HydrophobicContact CB-CZ2 4.42Å; A142-W190 HydrophobicContact CB-CZ3 3.6Å; N185-W190 HydrophobicContact CB-CB 4.01Å; N185-W190 HydrophobicContact CB-CD2 3.81Å; N185-W190 HydrophobicContact CB-CE3 4.19Å; N185-W190 HydrophobicContact CB-CG 3.74Å; N185-W190 WeakPolarHBondContact O-CB 3.38Å; G187-W190 PolarHBondContact O-N 3.38Å; Q188-W190 PolarHBondContact O-N 3.04Å; W190-P192 VanDerWaalsContact C-N 3.29Å; W190-L193 HydrophobicContact CE3-CB 4.29Å; W190-L193 HydrophobicContact CE3-CD2 3.83Å; W190-L193 HydrophobicContact CZ3-CD2 4.21Å; W190-L193 WeakPolarHBondContact O-CB 3.39Å; W190-L193 PolarHBondContact O-N 3.37Å; W190-L193 VanDerWaalsContact O-N 3.11Å; W190-H194 PolarHBondContact O-CD2 3.37Å; W190-H194 PolarHBondContact O-N 3.48Å; W190-H279 HydrophobicContact CD2-CB 4.15Å; W190-H279 HydrophobicContact CE3-CB 3.75Å; W190-H279 HydrophobicContact CH2-CB 4.41Å; W190-H279 HydrophobicContact CZ3-CB 3.89Å; W190-H279 AromaticContact CZ3-CD2 3.97Å
191	L	95.9	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-54.1	-36.4	176.6	-71.8	173	0	0	0	114.4	Q188 L193 H194 F195 V254 L257 V258 F280 I294	Q188-L191 HydrophobicContact CB-CD1 4.43Å; Q188-L191 HydrophobicContact CG-CD1 3.9Å; Q188-L191 WeakPolarHBondContact O-CD1 3.45Å; Q188-L191 VanDerWaalsContact O-CG 3.32Å; Q188-L191 WeakPolarHBondContact O-CG 3.35Å; Q188-L191 PolarHBondContact O-N 2.99Å; L191-L193 PolarHBondContact O-N 2.96Å; L191-H194 PolarHBondContact O-N 3.21Å; L191-F195 HydrophobicContact CB-CE2 4.39Å; L191-F195 HydrophobicContact CB-CZ 4.48Å; L191-F195 WeakPolarHBondContact O-CD2 3.27Å; L191-F195 VanDerWaalsContact O-CG 3.24Å; L191-F195 WeakPolarHBondContact O-CG 3.33Å; L191-F195 PolarHBondContact O-N 2.91Å; L191-V254 HydrophobicContact CD1-CG1 4.21Å; L191-V254 HydrophobicContact CD2-CG1 4.13Å; L191-V254 HydrophobicContact CD2-CG2 3.86Å; L191-L257 HydrophobicContact CD2-CD1 4.45Å; L191-V258 HydrophobicContact CD1-CG2 3.36Å; L191-F280 HydrophobicContact CB-CE2 4.36Å; L191-I294 HydrophobicContact CD1-CD1 3.97Å; L191-I294 HydrophobicContact CD1-CG1 4.28Å; L191-I294 HydrophobicContact CD1-CG2 4.08Å
192	P	96.6	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.1	-48.2	175.2	-24	35.6	0	0	0	111.7	W190 H194 F195 H196 L274 L277 F280	W190-P192 VanDerWaalsContact C-N 3.29Å; P192-H194 VanDerWaalsContact C-N 3.35Å; P192-H194 PolarHBondContact O-N 2.87Å; P192-F195 PolarHBondContact O-N 3.17Å; P192-H196 PolarHBondContact O-CD2 2.97Å; P192-H196 PolarHBondContact O-N 2.85Å; P192-L274 HydrophobicContact CB-CB 4.42Å; P192-L274 HydrophobicContact CG-CD2 4.31Å; P192-L277 HydrophobicContact CB-CB 4.11Å; P192-L277 VanDerWaalsContact CB-O 3.25Å; P192-L277 WeakPolarHBondContact CB-O 3.44Å; P192-L277 HydrophobicContact CG-CB 4.36Å; P192-F280 VanDerWaalsContact CD-CE2 3.49Å; P192-F280 HydrophobicContact CG-CD2 3.75Å; P192-F280 HydrophobicContact CG-CE1 4.26Å; P192-F280 HydrophobicContact CG-CE2 3.46Å; P192-F280 VanDerWaalsContact CG-CE2 3.46Å; P192-F280 HydrophobicContact CG-CG 4.28Å; P192-F280 HydrophobicContact CG-CZ 3.74Å
193	L	96.8	Very high	95	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58	-44.6	173.4	174.6	63	0	0	0	111.9	V147 T181 N185 W190 L191 F195 H196 C197 L278	V147-L193 HydrophobicContact CG1-CD1 4.43Å; V147-L193 HydrophobicContact CG2-CD1 3.45Å; V147-L193 VanDerWaalsContact CG2-CD1 3.45Å; T181-L193 HydrophobicContact CG2-CD1 4.47Å; T181-L193 HydrophobicContact CG2-CD2 4.39Å; N185-L193 HydrophobicContact CB-CD2 3.97Å; N185-L193 WeakPolarHBondContact ND2-CD2 3.31Å; W190-L193 HydrophobicContact CE3-CB 4.29Å; W190-L193 HydrophobicContact CE3-CD2 3.83Å; W190-L193 HydrophobicContact CZ3-CD2 4.21Å; W190-L193 WeakPolarHBondContact O-CB 3.39Å; W190-L193 PolarHBondContact O-N 3.37Å; W190-L193 VanDerWaalsContact O-N 3.11Å; L191-L193 PolarHBondContact O-N 2.96Å; L193-F195 VanDerWaalsContact C-N 3.3Å; L193-F195 PolarHBondContact O-N 3.48Å; L193-H196 WeakPolarHBondContact O-CB 3.48Å; L193-H196 PolarHBondContact O-N 3.16Å; L193-C197 WeakPolarHBondContact O-CB 3.45Å; L193-C197 PolarHBondContact O-N 3.06Å; L193-C197 PolarHBondContact O-SG 3.45Å; L193-C197 VanDerWaalsContact O-SG 3.35Å; L193-L278 VanDerWaalsContact CB-O 3.23Å; L193-L278 WeakPolarHBondContact CB-O 3.37Å; L193-L278 HydrophobicContact CD1-CD2 4.25Å; L193-L278 PolarHBondContact N-O 3.48Å
194	H	96.8	Very high	94.9	Very high	13 Å²	13	22 Å²	22	6%	0.06	11%	0.107	C	C	.	.	H	α-helix	trans	-58.8	-43.1	176.9	-64.1	175.7	0	0	0	111.7	I182 N185 W190 L191 P192 C197 I198	I182-H194 PolarHBondContact O-NE2 3Å; N185-H194 PolarHBondContact O-CE1 3.26Å; N185-H194 VanDerWaalsContact O-CE1 3.25Å; N185-H194 PolarHBondContact O-NE2 3.45Å; W190-H194 PolarHBondContact O-CD2 3.37Å; W190-H194 PolarHBondContact O-N 3.48Å; L191-H194 PolarHBondContact O-N 3.21Å; P192-H194 VanDerWaalsContact C-N 3.35Å; P192-H194 PolarHBondContact O-N 2.87Å; H194-C197 WeakPolarHBondContact O-CB 3.5Å; H194-C197 PolarHBondContact O-N 3.38Å; H194-I198 WeakPolarHBondContact O-CB 3.43Å; H194-I198 WeakPolarHBondContact O-CD1 3.47Å; H194-I198 WeakPolarHBondContact O-CG1 3.5Å; H194-I198 PolarHBondContact O-N 2.98Å
195	F	97.6	Very high	94.9	Very high	3 Å²	3	20.7 Å²	20.7	1%	0.013	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-40.3	177.2	-65.5	-21.6	0	0	0	112.5	L191 P192 L193 C197 I198 S199 V254 L274 I294 W297 L298 L301	L191-F195 HydrophobicContact CB-CE2 4.39Å; L191-F195 HydrophobicContact CB-CZ 4.48Å; L191-F195 WeakPolarHBondContact O-CD2 3.27Å; L191-F195 VanDerWaalsContact O-CG 3.24Å; L191-F195 WeakPolarHBondContact O-CG 3.33Å; L191-F195 PolarHBondContact O-N 2.91Å; P192-F195 PolarHBondContact O-N 3.17Å; L193-F195 VanDerWaalsContact C-N 3.3Å; L193-F195 PolarHBondContact O-N 3.48Å; F195-C197 VanDerWaalsContact C-N 3.34Å; F195-C197 PolarHBondContact O-N 3.29Å; F195-I198 HydrophobicContact CD1-CD1 4.45Å; F195-I198 PolarHBondContact O-N 3.31Å; F195-S199 WeakPolarHBondContact O-CB 3.39Å; F195-S199 PolarHBondContact O-N 3.08Å; F195-S199 PolarHBondContact O-OG 3.14Å; F195-V254 HydrophobicContact CE1-CG2 4.18Å; F195-V254 HydrophobicContact CZ-CG1 4.46Å; F195-L274 HydrophobicContact CD2-CD1 3.78Å; F195-L274 HydrophobicContact CE2-CD1 3.99Å; F195-I294 HydrophobicContact CE2-CG2 4.29Å; F195-I294 HydrophobicContact CZ-CG2 4.14Å; F195-W297 HydrophobicContact CD2-CB 3.57Å; F195-W297 HydrophobicContact CD2-CG 4.18Å; F195-W297 HydrophobicContact CE2-CB 3.65Å; F195-W297 HydrophobicContact CG-CB 4.31Å; F195-W297 HydrophobicContact CZ-CB 4.46Å; F195-L298 HydrophobicContact CZ-CB 4.25Å; F195-L301 HydrophobicContact CB-CD1 3.75Å; F195-L301 HydrophobicContact CD1-CD1 3.36Å; F195-L301 HydrophobicContact CE1-CD1 4.12Å; F195-L301 HydrophobicContact CG-CD1 3.71Å
196	H	97.2	Very high	94.9	Very high	19 Å²	19	20.8 Å²	20.8	9%	0.088	10%	0.101	C	C	.	.	H	α-helix	trans	-57.8	-48	171.2	-74.3	-71.4	0	0	0	111.6	W144 V147 P192 L193 S199 M200 L274 R275 L277	W144-H196 AromaticContact CH2-CE1 3.95Å; W144-H196 AromaticContact CH2-NE2 3.71Å; V147-H196 HydrophobicContact CG1-CB 4.45Å; P192-H196 PolarHBondContact O-CD2 2.97Å; P192-H196 PolarHBondContact O-N 2.85Å; L193-H196 WeakPolarHBondContact O-CB 3.48Å; L193-H196 PolarHBondContact O-N 3.16Å; H196-S199 PolarHBondContact O-N 3.13Å; H196-M200 HydrophobicContact CB-CE 4.29Å; H196-M200 WeakPolarHBondContact O-CG 3.49Å; H196-M200 PolarHBondContact O-N 3.38Å; H196-L274 PolarHBondContact NE2-O 3.41Å; H196-R275 PolarHBondContact CE1-O 3.49Å; H196-L277 PolarHBondContact NE2-O 3.28Å; H196-L277 VanDerWaalsContact NE2-O 3.13Å
197	C	97.4	Very high	95.1	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.007	7%	0.068	C	C	.	.	H	α-helix	trans	-61	-45.8	178	-73.1	0	0	0	0	112.1	V178 I182 L193 H194 F195 S199 M200 L201	V178-C197 HydrophobicContact CG1-CB 3.53Å; V178-C197 WeakPolarHBondContact CG1-O 3.43Å; I182-C197 HydrophobicContact CD1-CB 3.68Å; I182-C197 HydrophobicContact CG1-CB 3.56Å; L193-C197 WeakPolarHBondContact O-CB 3.45Å; L193-C197 PolarHBondContact O-N 3.06Å; L193-C197 PolarHBondContact O-SG 3.45Å; L193-C197 VanDerWaalsContact O-SG 3.35Å; H194-C197 WeakPolarHBondContact O-CB 3.5Å; H194-C197 PolarHBondContact O-N 3.38Å; F195-C197 VanDerWaalsContact C-N 3.34Å; F195-C197 PolarHBondContact O-N 3.29Å; C197-S199 PolarHBondContact O-N 2.88Å; C197-M200 WeakPolarHBondContact O-CB 3.38Å; C197-M200 PolarHBondContact O-N 2.87Å; C197-M200 VanDerWaalsContact O-N 3.12Å; C197-L201 PolarHBondContact O-N 3.37Å
198	I	97.5	Very high	95.1	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-65	-40.3	178.8	-66.2	162.7	0	0	0	110.9	I182 H194 F195 M200 L201 H202 T247 I250 L251 L301	I182-I198 HydrophobicContact CD1-CG1 4.22Å; H194-I198 WeakPolarHBondContact O-CB 3.43Å; H194-I198 WeakPolarHBondContact O-CD1 3.47Å; H194-I198 WeakPolarHBondContact O-CG1 3.5Å; H194-I198 PolarHBondContact O-N 2.98Å; F195-I198 HydrophobicContact CD1-CD1 4.45Å; F195-I198 PolarHBondContact O-N 3.31Å; I198-M200 VanDerWaalsContact C-N 3.29Å; I198-M200 PolarHBondContact O-N 3.13Å; I198-L201 WeakPolarHBondContact O-CB 3.47Å; I198-L201 PolarHBondContact O-N 3.12Å; I198-L201 VanDerWaalsContact O-N 3.17Å; I198-H202 VanDerWaalsContact CG2-CE1 3.47Å; I198-H202 WeakPolarHBondContact CG2-CE1 3.32Å; I198-H202 WeakPolarHBondContact CG2-NE2 3.43Å; I198-H202 PolarHBondContact O-N 2.85Å; I198-T247 HydrophobicContact CG2-CG2 4.26Å; I198-I250 HydrophobicContact CD1-CB 4.42Å; I198-I250 HydrophobicContact CD1-CG2 3.79Å; I198-I250 HydrophobicContact CG1-CG2 4.43Å; I198-L251 HydrophobicContact CD1-CD2 3.63Å; I198-L251 HydrophobicContact CD1-CG 4.05Å; I198-L251 HydrophobicContact CG2-CD1 4.25Å; I198-L251 HydrophobicContact CG2-CD2 4.17Å; I198-L251 HydrophobicContact CG2-CG 4.31Å; I198-L301 HydrophobicContact CB-CD1 4.29Å; I198-L301 HydrophobicContact CG2-CD1 4.2Å; I198-L301 HydrophobicContact CG2-CD2 4.21Å
199	S	97	Very high	94.8	Very high	14 Å²	14	13.6 Å²	13.6	10%	0.098	7%	0.069	C	C	.	.	H	α-helix	trans	-59.2	-38.4	171.9	-69.5	0	0	0	0	112.4	F195 H196 C197 H202 N203 L301	F195-S199 WeakPolarHBondContact O-CB 3.39Å; F195-S199 PolarHBondContact O-N 3.08Å; F195-S199 PolarHBondContact O-OG 3.14Å; H196-S199 PolarHBondContact O-N 3.13Å; C197-S199 PolarHBondContact O-N 2.88Å; S199-H202 PolarHBondContact O-N 3.39Å; S199-N203 WeakPolarHBondContact O-CB 3.24Å; S199-N203 VanDerWaalsContact O-CG 3.27Å; S199-N203 PolarHBondContact O-N 3.17Å; S199-L301 WeakPolarHBondContact OG-CD2 3.47Å
200	M	97	Very high	94.4	Very high	1 Å²	1	12 Å²	12	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-63.4	-43.5	174.6	-65.3	174	-154.8	0	0	111.6	V147 L150 R151 C154 H196 C197 I198 N203 M204	V147-M200 HydrophobicContact CG1-CE 3.63Å; V147-M200 WeakPolarHBondContact O-CE 3.19Å; L150-M200 HydrophobicContact CB-SD 4.4Å; L150-M200 HydrophobicContact CD2-SD 4.39Å; L150-M200 HydrophobicContact CG-SD 4.1Å; R151-M200 HydrophobicContact CB-CE 3.6Å; R151-M200 HydrophobicContact CB-CG 4.3Å; R151-M200 HydrophobicContact CB-SD 3.95Å; R151-M200 HydrophobicContact CG-CE 4Å; R151-M200 HydrophobicContact CG-CG 4.06Å; R151-M200 HydrophobicContact CG-SD 4.36Å; C154-M200 HydrophobicContact CB-CB 4.02Å; C154-M200 HydrophobicContact CB-CG 4.45Å; H196-M200 HydrophobicContact CB-CE 4.29Å; H196-M200 WeakPolarHBondContact O-CG 3.49Å; H196-M200 PolarHBondContact O-N 3.38Å; C197-M200 WeakPolarHBondContact O-CB 3.38Å; C197-M200 PolarHBondContact O-N 2.87Å; C197-M200 VanDerWaalsContact O-N 3.12Å; I198-M200 VanDerWaalsContact C-N 3.29Å; I198-M200 PolarHBondContact O-N 3.13Å; M200-N203 WeakPolarHBondContact O-CB 3.12Å; M200-N203 PolarHBondContact O-N 2.82Å; M200-M204 WeakPolarHBondContact O-CG 3.48Å; M200-M204 PolarHBondContact O-N 2.88Å
201	L	96.9	Very high	93.6	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.3	-45.3	175.7	-67.7	178.9	0	0	0	111.4	V178 Y179 C197 I198 N203 M204 A205 I245 T247	V178-L201 HydrophobicContact CB-CD2 3.79Å; V178-L201 HydrophobicContact CB-CG 4.23Å; V178-L201 HydrophobicContact CG1-CD1 3.93Å; V178-L201 HydrophobicContact CG1-CD2 3.81Å; V178-L201 HydrophobicContact CG1-CG 3.66Å; V178-L201 HydrophobicContact CG2-CD2 4.2Å; Y179-L201 HydrophobicContact CE1-CD1 4.4Å; Y179-L201 HydrophobicContact CE2-CD1 4.23Å; C197-L201 PolarHBondContact O-N 3.37Å; I198-L201 WeakPolarHBondContact O-CB 3.47Å; I198-L201 PolarHBondContact O-N 3.12Å; I198-L201 VanDerWaalsContact O-N 3.17Å; L201-N203 VanDerWaalsContact C-N 3.34Å; L201-N203 PolarHBondContact O-N 2.92Å; L201-M204 CarbonylContact O-C 3.48Å; L201-M204 PolarHBondContact O-N 3.07Å; L201-A205 WeakPolarHBondContact O-CB 3.25Å; L201-A205 PolarHBondContact O-N 3.02Å; L201-I245 HydrophobicContact CB-CG2 4Å; L201-I245 HydrophobicContact CD1-CG2 4.11Å; L201-I245 HydrophobicContact CD2-CD1 4.49Å; L201-I245 HydrophobicContact CD2-CG2 4Å; L201-I245 HydrophobicContact CG-CG2 4.23Å; L201-I245 WeakPolarHBondContact O-CD1 3.32Å; L201-T247 HydrophobicContact CB-CG2 3.77Å; L201-T247 HydrophobicContact CD1-CG2 3.78Å; L201-T247 HydrophobicContact CG-CG2 4.43Å
202	H	96.1	Very high	92.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-41.7	176.3	-69.5	177.6	0	0	0	112.1	I198 S199 M204 A205 G206 V207 T247 L301 E304 L308	I198-H202 VanDerWaalsContact CG2-CE1 3.47Å; I198-H202 WeakPolarHBondContact CG2-CE1 3.32Å; I198-H202 WeakPolarHBondContact CG2-NE2 3.43Å; I198-H202 PolarHBondContact O-N 2.85Å; S199-H202 PolarHBondContact O-N 3.39Å; H202-M204 PolarHBondContact O-N 2.89Å; H202-A205 CarbonylContact O-C 3.45Å; H202-A205 PolarHBondContact O-N 3.39Å; H202-G206 PolarHBondContact O-N 3.31Å; H202-V207 HydrophobicContact CB-CB 4.15Å; H202-V207 HydrophobicContact CB-CG1 4.33Å; H202-V207 WeakPolarHBondContact O-CB 3.43Å; H202-V207 PolarHBondContact O-N 3.24Å; H202-T247 PolarHBondContact CD2-OG1 3.04Å; H202-T247 WeakPolarHBondContact NE2-CB 3.48Å; H202-T247 PolarHBondContact NE2-OG1 3.26Å; H202-L301 PolarHBondContact CE1-O 2.86Å; H202-L301 VanDerWaalsContact CE1-O 3.22Å; H202-E304 IonicContact CE1-OE2 2.8Å; H202-E304 IonicContact CG-OE2 3.72Å; H202-E304 WeakPolarHBondContact ND1-CB 3.03Å; H202-E304 IonicContact ND1-OE2 3.02Å; H202-E304 PolarHBondContact ND1-OE2 3.17Å; H202-L308 HydrophobicContact CB-CD1 4.35Å
203	N	93.9	Very high	89.9	Confident	39 Å²	39	26.3 Å²	26.3	21%	0.209	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-45.8	173.1	-75.9	-5.4	0	0	0	111.2	D155 S158 S199 M200 L201 A205 G206	D155-N203 PolarHBondContact OD1-ND2 2.97Å; D155-N203 VanDerWaalsContact OD1-ND2 3.13Å; S158-N203 WeakPolarHBondContact CB-O 3.47Å; S158-N203 PolarHBondContact OG-O 3.23Å; S199-N203 WeakPolarHBondContact O-CB 3.24Å; S199-N203 VanDerWaalsContact O-CG 3.27Å; S199-N203 PolarHBondContact O-N 3.17Å; M200-N203 WeakPolarHBondContact O-CB 3.12Å; M200-N203 PolarHBondContact O-N 2.82Å; L201-N203 VanDerWaalsContact C-N 3.34Å; L201-N203 PolarHBondContact O-N 2.92Å; N203-A205 VanDerWaalsContact C-N 3.32Å; N203-A205 PolarHBondContact O-N 3.16Å; N203-G206 WeakPolarHBondContact O-CA 3.49Å; N203-G206 PolarHBondContact O-N 3.01Å
204	M	93.6	Very high	86.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-30.7	176.5	-74.3	176.5	57.7	0	0	113.6	C154 I171 L174 M200 L201 H202 G206 R235 I245	C154-M204 HydrophobicContact CB-CG 3.79Å; C154-M204 HydrophobicContact CB-SD 3.65Å; C154-M204 WeakPolarHBondContact O-CG 3.2Å; C154-M204 PolarHBondContact SG-SD 2.96Å; I171-M204 HydrophobicContact CB-CE 4.23Å; I171-M204 HydrophobicContact CG1-CE 4.44Å; I171-M204 HydrophobicContact CG2-CE 3.99Å; I171-M204 WeakPolarHBondContact O-CE 3.27Å; L174-M204 HydrophobicContact CB-CE 3.77Å; L174-M204 HydrophobicContact CB-SD 4.06Å; M200-M204 WeakPolarHBondContact O-CG 3.48Å; M200-M204 PolarHBondContact O-N 2.88Å; L201-M204 CarbonylContact O-C 3.48Å; L201-M204 PolarHBondContact O-N 3.07Å; H202-M204 PolarHBondContact O-N 2.89Å; M204-G206 PolarHBondContact O-N 2.88Å; M204-R235 PolarHBondContact O-NH2 3.43Å; M204-I245 HydrophobicContact CB-CD1 4.03Å
205	A	93.4	Very high	83.9	Confident	1 Å²	1	41 Å²	41	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-75.3	-10.2	171.8	0	0	0	0	0	112.7	L201 H202 N203 I245 L308	L201-A205 WeakPolarHBondContact O-CB 3.25Å; L201-A205 PolarHBondContact O-N 3.02Å; H202-A205 CarbonylContact O-C 3.45Å; H202-A205 PolarHBondContact O-N 3.39Å; N203-A205 VanDerWaalsContact C-N 3.32Å; N203-A205 PolarHBondContact O-N 3.16Å; A205-I245 HydrophobicContact CB-CB 4.47Å; A205-I245 HydrophobicContact CB-CD1 4.04Å; A205-I245 HydrophobicContact CB-CG1 4.15Å; A205-L308 HydrophobicContact CB-CD1 3.97Å; A205-L308 HydrophobicContact CB-CD2 3.56Å; A205-L308 HydrophobicContact CB-CG 4.42Å
206	G	91.3	Very high	80.7	Confident	5 Å²	5	45 Å²	45	5%	0.052	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	42.3	176.8	0	0	0	0	0	113.2	H202 N203 M204 G234 R235 A236	H202-G206 PolarHBondContact O-N 3.31Å; N203-G206 WeakPolarHBondContact O-CA 3.49Å; N203-G206 PolarHBondContact O-N 3.01Å; M204-G206 PolarHBondContact O-N 2.88Å; G206-G234 CarbonylContact O-C 3.59Å; G206-G234 WeakPolarHBondContact O-CA 3.48Å; G206-R235 PolarHBondContact O-N 2.6Å; G206-R235 VanDerWaalsContact O-N 3.12Å; G206-A236 VanDerWaalsContact O-CB 3.27Å; G206-A236 WeakPolarHBondContact O-CB 3.32Å; G206-A236 PolarHBondContact O-N 3.41Å
207	V	91.8	Very high	77.7	Confident	5 Å²	5	52 Å²	52	3%	0.03	29%	0.294	C	S	.	.			trans	-44.4	135.9	177.4	65.5	0	0	0	0	112.1	H202 V209 E304 L308	H202-V207 HydrophobicContact CB-CB 4.15Å; H202-V207 HydrophobicContact CB-CG1 4.33Å; H202-V207 WeakPolarHBondContact O-CB 3.43Å; H202-V207 PolarHBondContact O-N 3.24Å; V207-V209 HydrophobicContact CG1-CG2 4.25Å; V207-V209 PolarHBondContact O-N 2.86Å; V207-E304 HydrophobicContact CG2-CB 3.73Å; V207-E304 HydrophobicContact CG2-CG 3.7Å; V207-L308 VanDerWaalsContact CA-CD2 3.48Å; V207-L308 HydrophobicContact CB-CD2 3.98Å; V207-L308 HydrophobicContact CB-CG 4.42Å
208	P	88.9	Confident	74.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	34%	0.337	C	S	.	.			trans	-64.9	122.2	175.8	-21.1	33	0	0	0	111.6	L232 T233 L237 A307 W392 Y395	P208-L232 HydrophobicContact CB-CB 4.22Å; P208-L232 HydrophobicContact CB-CD1 4.12Å; P208-T233 CarbonylContact C-O 3.42Å; P208-T233 WeakPolarHBondContact CA-O 3.14Å; P208-L237 HydrophobicContact CB-CD1 4.43Å; P208-L237 HydrophobicContact CB-CD2 4.1Å; P208-L237 HydrophobicContact CB-CG 4.24Å; P208-L237 HydrophobicContact CG-CD2 3.84Å; P208-L237 HydrophobicContact CG-CG 4.12Å; P208-A307 HydrophobicContact CG-CB 4.23Å; P208-W392 HydrophobicContact CB-CH2 4.36Å; P208-W392 HydrophobicContact CB-CZ3 4.11Å; P208-W392 HydrophobicContact CG-CH2 3.84Å; P208-W392 HydrophobicContact CG-CZ3 4.03Å; P208-Y395 HydrophobicContact CB-CE1 4.09Å; P208-Y395 VanDerWaalsContact O-CE1 3.3Å; P208-Y395 WeakPolarHBondContact O-CE1 3.37Å; P208-Y395 PolarHBondContact O-OH 3.32Å
209	V	87.4	Confident	71.1	Confident	79 Å²	79	64.1 Å²	64.1	48%	0.479	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	154.2	177.2	-177.1	0	0	0	0	109.3	V207 L232 T233	V207-V209 HydrophobicContact CG1-CG2 4.25Å; V207-V209 PolarHBondContact O-N 2.86Å; V209-L232 CarbonylContact O-C 3.58Å; V209-L232 WeakPolarHBondContact O-CA 3.5Å; V209-L232 WeakPolarHBondContact O-CD2 3.49Å; V209-T233 PolarHBondContact N-O 2.95Å; V209-T233 PolarHBondContact O-N 3.2Å
210	L	85.1	Confident	67.9	Low	42 Å²	42	72.9 Å²	72.9	22%	0.22	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	135.7	175.9	-65.6	170.4	0	0	0	111.2	E212 L232 V396 K399 Q400	L210-E212 PolarHBondContact O-N 3.32Å; L210-L232 HydrophobicContact CD2-CD2 3.9Å; L210-L232 HydrophobicContact CG-CD2 4.47Å; L210-V396 HydrophobicContact CD2-CB 4.43Å; L210-V396 HydrophobicContact CD2-CG1 3.88Å; L210-K399 HydrophobicContact CD1-CB 3.81Å; L210-K399 HydrophobicContact CD2-CB 4.29Å; L210-K399 HydrophobicContact CG-CB 3.88Å; L210-Q400 HydrophobicContact CD1-CG 3.7Å; L210-Q400 HydrophobicContact CD2-CG 4.42Å
211	C	78.6	Confident	64.6	Low	56 Å²	56	78.2 Å²	78.2	38%	0.378	44%	0.443	S	S	.	.			trans	-62.6	126.4	169.3	-58.5	0	0	0	0	109.7	A213 P231 L232 T233	C211-A213 PolarHBondContact O-N 3.47Å; C211-P231 PolarHBondContact N-O 2.96Å; C211-L232 VanDerWaalsContact SG-C 3.56Å; C211-L232 PolarHBondContact SG-N 3.5Å; C211-L232 VanDerWaalsContact SG-N 3.42Å; C211-T233 VanDerWaalsContact SG-CG2 3.55Å
212	E	63.6	Low	61.5	Low	186 Å²	186	86.4 Å²	86.4	87%	0.869	49%	0.486	S	S	*	.			trans	-69.7	93.9	167.1	-64.5	-176.1	-178.4	0	0	108.4	L210 N214	L210-E212 PolarHBondContact O-N 3.32Å; E212-N214 PolarHBondContact O-N 2.52Å
213	A	49.6	Very low	58.7	Low	87 Å²	87	92.4 Å²	92.4	72%	0.719	52%	0.522	S	S	*	.			trans	-67.8	99.9	173.3	0	0	0	0	0	108.9	C211 L215	C211-A213 PolarHBondContact O-N 3.47Å; A213-L215 PolarHBondContact O-N 3.09Å
214	N	31.9	Very low	55.8	Low	136 Å²	136	99.1 Å²	99.1	73%	0.727	55%	0.553	S	S	*	*			trans	2.6	85.5	168	-61.8	-21.1	0	0	0	115.1	E212 S216	E212-N214 PolarHBondContact O-N 2.52Å; N214-S216 PolarHBondContact O-N 3.31Å
215	L	36.2	Very low	53	Low	186 Å²	186	105.9 Å²	105.9	97%	0.974	59%	0.589	S	S	*	*	S	Bend	trans	-76	10.6	168.5	-92.3	147.9	0	0	0	112.9	A213	A213-L215 PolarHBondContact O-N 3.09Å
216	S	31.7	Very low	50.6	Low	88 Å²	88	113 Å²	113	62%	0.615	63%	0.627	S	S	*	*	S	Bend	trans	-145.9	131.5	171	-168.7	0	0	0	0	109.6	N214	N214-S216 PolarHBondContact O-N 3.31Å
217	E	33.1	Very low	48.6	Very low	165 Å²	165	116.7 Å²	116.7	77%	0.771	65%	0.645	S	S	*	*			trans	82	103.9	172.3	-51.9	-168.2	175	0	0	117.4	K219	E217-K219 PolarHBondContact O-N 3.11Å
218	G	26.8	Very low	47.2	Very low	88 Å²	88	120.4 Å²	120.4	91%	0.907	66%	0.664	S	S	*	*			trans	-58.9	97.9	158.8	0	0	0	0	0	110.6
219	K	29.9	Very low	46.1	Very low	169 Å²	169	127.9 Å²	127.9	74%	0.735	69%	0.693	S	S	*	*			trans	-146.6	105.8	148.1	-101.3	173.1	-176.2	176.7	0	107.4	E217 T221	E217-K219 PolarHBondContact O-N 3.11Å; K219-T221 VanDerWaalsContact C-N 3.27Å; K219-T221 PolarHBondContact O-N 3.24Å
220	Q	28.6	Very low	45.4	Very low	197 Å²	197	124.6 Å²	124.6	92%	0.921	67%	0.673	S	S	*	*			trans	-56.4	95.5	156.7	-78.9	169	-14.7	0	0	107.8
221	T	27.7	Very low	45.1	Very low	113 Å²	113	125.2 Å²	125.2	69%	0.693	68%	0.679	S	S	*	*			trans	-146.5	65.4	165.1	42.1	0	0	0	0	109.2	K219	K219-T221 VanDerWaalsContact C-N 3.27Å; K219-T221 PolarHBondContact O-N 3.24Å
222	L	33.4	Very low	45.1	Very low	172 Å²	172	123 Å²	123	90%	0.901	66%	0.663	S	S	*	*			trans	-153.9	62.9	153.8	-82.9	-178.9	0	0	0	107.6
223	V	36.5	Very low	45.9	Very low	126 Å²	126	118.1 Å²	118.1	76%	0.764	65%	0.646	S	S	*	*			trans	-137.2	61.2	161.8	-170.3	0	0	0	0	107
224	E	32.6	Very low	47.4	Very low	181 Å²	181	115.4 Å²	115.4	85%	0.846	63%	0.627	S	S	*	*	S	Bend	trans	-126	104.3	156.6	-74.4	-173.8	172.8	0	0	104.5
225	N	34.7	Very low	49.8	Very low	142 Å²	142	110.6 Å²	110.6	76%	0.759	60%	0.599	S	S	*	*	S	Bend	trans	106.9	110.5	-173.9	-53.9	-29.3	0	0	0	113.7	D227	N225-D227 PolarHBondContact O-N 3.38Å
226	N	42.4	Very low	52	Low	151 Å²	151	101.8 Å²	101.8	81%	0.807	55%	0.553	S	S	*	*			trans	-61.9	22.6	-179.8	-86.4	-22.2	0	0	0	115.6	L228	N226-L228 PolarHBondContact O-N 3.28Å; N226-L228 VanDerWaalsContact O-N 3.12Å
227	D	51.2	Low	54.2	Low	82 Å²	82	98.9 Å²	98.9	44%	0.439	53%	0.531	S	S	.	.			trans	-85.2	90.2	-178.3	-70.3	-9	0	0	0	109.8	N225 R229 F381	N225-D227 PolarHBondContact O-N 3.38Å; D227-R229 VanDerWaalsContact C-N 3.3Å; D227-R229 HydrophobicContact CB-CG 4.46Å; D227-R229 PolarHBondContact O-N 3.01Å; D227-R229 IonicContact OD2-CZ 3.61Å; D227-R229 IonicContact OD2-NH2 3.5Å; D227-R229 PolarHBondContact OD2-NH2 3.47Å; D227-F381 HydrophobicContact CB-CE1 4.35Å
228	L	61.9	Low	56.4	Low	82 Å²	82	93.7 Å²	93.7	43%	0.429	51%	0.512	S	S	.	.			trans	-65.9	89.3	168.4	-86.7	88.6	0	0	0	109.7	N226 I382 N386	N226-L228 PolarHBondContact O-N 3.28Å; N226-L228 VanDerWaalsContact O-N 3.12Å; L228-I382 HydrophobicContact CB-CB 3.84Å; L228-I382 HydrophobicContact CB-CD1 3.88Å; L228-I382 HydrophobicContact CB-CG1 4.17Å; L228-I382 HydrophobicContact CD2-CB 4.4Å; L228-I382 HydrophobicContact CD2-CD1 4.12Å; L228-I382 HydrophobicContact CD2-CG2 4.27Å; L228-I382 HydrophobicContact CG-CD1 4.47Å; L228-I382 WeakPolarHBondContact O-CB 3.39Å; L228-I382 WeakPolarHBondContact O-CG1 3.3Å; L228-I382 PolarHBondContact O-N 2.96Å; L228-N386 WeakPolarHBondContact CD2-OD1 3.33Å
229	R	65.3	Low	58.9	Low	157 Å²	157	90.5 Å²	90.5	59%	0.592	48%	0.476	S	S	*	.	B	Isolated β-bridge	trans	-82.9	157	174.9	-69	-171.7	172	101	12	111.8	D227 F381 I382	D227-R229 VanDerWaalsContact C-N 3.3Å; D227-R229 HydrophobicContact CB-CG 4.46Å; D227-R229 PolarHBondContact O-N 3.01Å; D227-R229 IonicContact OD2-CZ 3.61Å; D227-R229 IonicContact OD2-NH2 3.5Å; D227-R229 PolarHBondContact OD2-NH2 3.47Å; R229-F381 HydrophobicContact CG-CE1 4.44Å; R229-I382 WeakPolarHBondContact O-CD1 3.4Å
230	L	72.6	Confident	61.1	Low	11 Å²	11	87.5 Å²	87.5	6%	0.058	47%	0.468	C	S	.	.			trans	-45.3	140.7	168.7	-79.2	164.8	0	0	0	111.3	L232 L237 T380 L388 W392	L230-L232 HydrophobicContact CB-CB 4.25Å; L230-L232 HydrophobicContact CD2-CD1 4.37Å; L230-L232 PolarHBondContact O-N 3.02Å; L230-L237 HydrophobicContact CD1-CD2 3.93Å; L230-T380 HydrophobicContact CD1-CG2 4.39Å; L230-T380 WeakPolarHBondContact CG-O 3.34Å; L230-T380 PolarHBondContact N-O 3Å; L230-L388 HydrophobicContact CD2-CD2 3.38Å; L230-L388 HydrophobicContact CG-CD2 4.36Å; L230-W392 HydrophobicContact CD1-CD2 4.04Å; L230-W392 HydrophobicContact CD1-CE3 4.47Å; L230-W392 HydrophobicContact CD1-CG 4.34Å; L230-W392 HydrophobicContact CD1-CZ2 4.34Å; L230-W392 HydrophobicContact CD2-CB 3.74Å; L230-W392 HydrophobicContact CD2-CD2 4.04Å; L230-W392 HydrophobicContact CD2-CE3 4.46Å; L230-W392 HydrophobicContact CD2-CG 3.72Å
231	P	78.3	Confident	63.4	Low	55 Å²	55	80.9 Å²	80.9	36%	0.357	44%	0.439	S	S	.	.	S	Bend	trans	-76	42.2	171.9	35.6	-37.2	0	0	0	111.3	C211 V396	C211-P231 PolarHBondContact N-O 2.96Å; P231-V396 HydrophobicContact CG-CG1 4.22Å; P231-V396 HydrophobicContact CG-CG2 3.97Å
232	L	80.1	Confident	66.1	Low	9 Å²	9	78.2 Å²	78.2	5%	0.047	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144.9	-177.1	-63.3	170.4	0	0	0	109.8	P208 V209 L210 C211 L230 L237 W392 Y395 V396	P208-L232 HydrophobicContact CB-CB 4.22Å; P208-L232 HydrophobicContact CB-CD1 4.12Å; V209-L232 CarbonylContact O-C 3.58Å; V209-L232 WeakPolarHBondContact O-CA 3.5Å; V209-L232 WeakPolarHBondContact O-CD2 3.49Å; L210-L232 HydrophobicContact CD2-CD2 3.9Å; L210-L232 HydrophobicContact CG-CD2 4.47Å; C211-L232 VanDerWaalsContact SG-C 3.56Å; C211-L232 PolarHBondContact SG-N 3.5Å; C211-L232 VanDerWaalsContact SG-N 3.42Å; L230-L232 HydrophobicContact CB-CB 4.25Å; L230-L232 HydrophobicContact CD2-CD1 4.37Å; L230-L232 PolarHBondContact O-N 3.02Å; L232-L237 HydrophobicContact CB-CD1 3.89Å; L232-L237 WeakPolarHBondContact O-CD1 3.46Å; L232-W392 HydrophobicContact CD1-CD2 4.42Å; L232-W392 HydrophobicContact CD1-CE3 3.38Å; L232-W392 HydrophobicContact CD1-CZ3 3.47Å; L232-W392 VanDerWaalsContact CD1-CZ3 3.47Å; L232-Y395 HydrophobicContact CD1-CD1 3.91Å; L232-Y395 HydrophobicContact CD1-CE1 4.21Å; L232-Y395 HydrophobicContact CD2-CD1 4.31Å; L232-Y395 HydrophobicContact CD2-CE1 4.17Å; L232-V396 HydrophobicContact CD1-CG2 3.96Å; L232-V396 HydrophobicContact CD2-CG2 4.03Å; L232-V396 HydrophobicContact CG-CG2 3.96Å
233	T	79.7	Confident	68.8	Low	83 Å²	83	72.4 Å²	72.4	51%	0.509	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	142.9	170.6	49.4	0	0	0	0	109.2	P208 V209 C211	P208-T233 CarbonylContact C-O 3.42Å; P208-T233 WeakPolarHBondContact CA-O 3.14Å; V209-T233 PolarHBondContact N-O 2.95Å; V209-T233 PolarHBondContact O-N 3.2Å; C211-T233 VanDerWaalsContact SG-CG2 3.55Å
234	G	80.5	Confident	71.3	Confident	31 Å²	31	71.3 Å²	71.3	32%	0.32	38%	0.375	S	S	.	.			trans	163	144.3	179.4	0	0	0	0	0	110.8	G206 A236 L237	G206-G234 CarbonylContact O-C 3.59Å; G206-G234 WeakPolarHBondContact O-CA 3.48Å; G234-A236 PolarHBondContact O-N 3.32Å; G234-L237 WeakPolarHBondContact O-CB 3.32Å; G234-L237 PolarHBondContact O-N 3.46Å; G234-L237 VanDerWaalsContact O-N 3.11Å
235	R	81.8	Confident	74.1	Confident	34 Å²	34	63 Å²	63	13%	0.128	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-64.7	-29.9	-176.6	-63	-175.4	-76.1	145.3	6.9	112.3	S158 D162 M204 G206 L237 S238	S158-R235 VanDerWaalsContact O-CZ 3.31Å; S158-R235 PolarHBondContact O-NE 3.03Å; S158-R235 VanDerWaalsContact O-NE 3.11Å; S158-R235 PolarHBondContact O-NH2 3.17Å; D162-R235 WeakPolarHBondContact OD1-CD 3.33Å; D162-R235 IonicContact OD1-NH1 4Å; D162-R235 PolarHBondContact OD1-NH1 3.09Å; D162-R235 WeakPolarHBondContact OD2-CD 3.21Å; D162-R235 WeakPolarHBondContact OD2-CG 3.2Å; M204-R235 PolarHBondContact O-NH2 3.43Å; G206-R235 PolarHBondContact O-N 2.6Å; G206-R235 VanDerWaalsContact O-N 3.12Å; R235-L237 PolarHBondContact O-N 3.32Å; R235-L237 VanDerWaalsContact O-N 3.14Å; R235-S238 PolarHBondContact O-N 3.37Å
236	A	82.8	Confident	76.9	Confident	2 Å²	2	59.6 Å²	59.6	2%	0.017	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.2	-19.3	175.9	0	0	0	0	0	114	G206 G234 S238 L308	G206-A236 VanDerWaalsContact O-CB 3.27Å; G206-A236 WeakPolarHBondContact O-CB 3.32Å; G206-A236 PolarHBondContact O-N 3.41Å; G234-A236 PolarHBondContact O-N 3.32Å; A236-S238 VanDerWaalsContact C-N 3.31Å; A236-L308 HydrophobicContact CB-CD2 3.84Å
237	L	78.2	Confident	79.4	Confident	27 Å²	27	52.4 Å²	52.4	14%	0.141	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-72.1	-27.8	174.7	-62.2	176	0	0	0	112.3	P208 L230 L232 G234 R235 N311 T380 W392	P208-L237 HydrophobicContact CB-CD1 4.43Å; P208-L237 HydrophobicContact CB-CD2 4.1Å; P208-L237 HydrophobicContact CB-CG 4.24Å; P208-L237 HydrophobicContact CG-CD2 3.84Å; P208-L237 HydrophobicContact CG-CG 4.12Å; L230-L237 HydrophobicContact CD1-CD2 3.93Å; L232-L237 HydrophobicContact CB-CD1 3.89Å; L232-L237 WeakPolarHBondContact O-CD1 3.46Å; G234-L237 WeakPolarHBondContact O-CB 3.32Å; G234-L237 PolarHBondContact O-N 3.46Å; G234-L237 VanDerWaalsContact O-N 3.11Å; R235-L237 PolarHBondContact O-N 3.32Å; R235-L237 VanDerWaalsContact O-N 3.14Å; L237-N311 WeakPolarHBondContact CA-ND2 3.5Å; L237-N311 WeakPolarHBondContact CD2-ND2 3.3Å; L237-N311 PolarHBondContact O-ND2 3.28Å; L237-T380 HydrophobicContact CB-CG2 4.44Å; L237-T380 WeakPolarHBondContact O-CG2 3.28Å; L237-W392 HydrophobicContact CD2-CH2 3.62Å; L237-W392 HydrophobicContact CD2-CZ2 3.93Å; L237-W392 HydrophobicContact CD2-CZ3 4.28Å
238	S	80	Confident	81.6	Confident	55 Å²	55	49 Å²	49	39%	0.385	27%	0.265	S	S	.	.	S	Bend	trans	-87.1	132.7	174.9	-175.4	0	0	0	0	110.5	R235 A236 D240	R235-S238 PolarHBondContact O-N 3.37Å; A236-S238 VanDerWaalsContact C-N 3.31Å; S238-D240 VanDerWaalsContact C-N 3.32Å; S238-D240 PolarHBondContact O-N 3.12Å
239	S	78	Confident	83.1	Confident	22 Å²	22	48.6 Å²	48.6	15%	0.154	27%	0.268	C	S	.	.	S	Bend	trans	-67.7	-31.3	176.4	-64.7	0	0	0	0	113.2	N241 E376	S239-N241 PolarHBondContact O-N 2.96Å; S239-E376 WeakPolarHBondContact CB-OE2 3.27Å; S239-E376 VanDerWaalsContact OG-CB 3.27Å; S239-E376 WeakPolarHBondContact OG-CB 3.41Å; S239-E376 PolarHBondContact OG-OE2 3Å
240	D	77.3	Confident	84.5	Confident	106 Å²	106	42.5 Å²	42.5	57%	0.567	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-29.4	-171.3	-68.6	-34.3	0	0	0	113.6	S238 R369	S238-D240 VanDerWaalsContact C-N 3.32Å; S238-D240 PolarHBondContact O-N 3.12Å; D240-R369 IonicContact OD1-NH2 2.61Å
241	N	76.2	Confident	85.7	Confident	58 Å²	58	42 Å²	42	31%	0.31	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	20.6	-176.9	-70.2	-18.3	0	0	0	112.6	D162 S239 L243	D162-N241 PolarHBondContact OD2-ND2 3.5Å; S239-N241 PolarHBondContact O-N 2.96Å; N241-L243 PolarHBondContact O-N 3Å
242	R	83.9	Confident	86.6	Confident	57 Å²	57	40 Å²	40	22%	0.215	23%	0.23	C	C	.	.			trans	-66.1	121.9	179.2	-171.7	-178.5	-61.2	141.9	9.1	110.2	S312 E376	R242-S312 PolarHBondContact NH1-OG 3.33Å; R242-E376 IonicContact CZ-OE1 2.69Å; R242-E376 IonicContact CZ-OE2 2.68Å; R242-E376 IonicContact NH1-OE1 3.97Å; R242-E376 PolarHBondContact NH1-OE1 3.39Å; R242-E376 IonicContact NH1-OE2 2.75Å; R242-E376 PolarHBondContact NH1-OE2 3.25Å; R242-E376 VanDerWaalsContact NH2-CD 3.26Å; R242-E376 IonicContact NH2-OE1 2.69Å; R242-E376 PolarHBondContact NH2-OE1 2.85Å; R242-E376 IonicContact NH2-OE2 3.34Å; R242-E376 PolarHBondContact NH2-OE2 3.49Å
243	L	89.9	Confident	87.2	Confident	50 Å²	50	43.3 Å²	43.3	26%	0.262	25%	0.248	S	C	.	.			trans	-108.1	126.2	174.6	-178.4	71	0	0	0	109.5	I171 N241 I245	I171-L243 HydrophobicContact CD1-CD2 4.22Å; I171-L243 HydrophobicContact CG2-CD1 4.26Å; I171-L243 HydrophobicContact CG2-CD2 3.48Å; I171-L243 VanDerWaalsContact CG2-CD2 3.48Å; N241-L243 PolarHBondContact O-N 3Å; L243-I245 HydrophobicContact CD2-CD1 3.7Å; L243-I245 HydrophobicContact CD2-CG1 3.79Å; L243-I245 HydrophobicContact CG-CD1 4.42Å; L243-I245 HydrophobicContact CG-CG1 3.96Å
244	L	90.4	Very high	88	Confident	102 Å²	102	39.5 Å²	39.5	53%	0.534	22%	0.224	S	C	.	.			trans	-88.4	116.1	170.2	173.9	63	0	0	0	109.2	P246 H309 Y318	L244-P246 HydrophobicContact CG-CG 4.38Å; L244-H309 VanDerWaalsContact CD1-CE1 3.42Å; L244-H309 WeakPolarHBondContact CD1-CE1 3.47Å; L244-H309 VanDerWaalsContact CD1-NE2 3.27Å; L244-H309 WeakPolarHBondContact CD1-NE2 3.41Å; L244-Y318 HydrophobicContact CD1-CE2 4.11Å
245	I	91.6	Very high	88.6	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.036	22%	0.215	C	C	.	.			trans	-117.1	109.4	166.2	-56.9	-175.3	0	0	0	107.2	Y179 L201 M204 A205 L243 T247	Y179-I245 HydrophobicContact CE2-CG2 4.07Å; Y179-I245 WeakPolarHBondContact OH-CG2 3.43Å; L201-I245 HydrophobicContact CB-CG2 4Å; L201-I245 HydrophobicContact CD1-CG2 4.11Å; L201-I245 HydrophobicContact CD2-CD1 4.49Å; L201-I245 HydrophobicContact CD2-CG2 4Å; L201-I245 HydrophobicContact CG-CG2 4.23Å; L201-I245 WeakPolarHBondContact O-CD1 3.32Å; M204-I245 HydrophobicContact CB-CD1 4.03Å; A205-I245 HydrophobicContact CB-CB 4.47Å; A205-I245 HydrophobicContact CB-CD1 4.04Å; A205-I245 HydrophobicContact CB-CG1 4.15Å; L243-I245 HydrophobicContact CD2-CD1 3.7Å; L243-I245 HydrophobicContact CD2-CG1 3.79Å; L243-I245 HydrophobicContact CG-CD1 4.42Å; L243-I245 HydrophobicContact CG-CG1 3.96Å; I245-T247 VanDerWaalsContact C-N 3.34Å; I245-T247 HydrophobicContact CG2-CG2 4.11Å; I245-T247 PolarHBondContact O-N 3.33Å
246	P	92.8	Very high	89.1	Confident	71 Å²	71	44.7 Å²	44.7	46%	0.461	24%	0.242	S	C	.	.			trans	-66.9	80.4	-176.2	-22.1	34.1	0	0	0	113.9	Y179 L244	Y179-P246 PolarHBondContact OH-O 3.31Å; L244-P246 HydrophobicContact CG-CG 4.38Å
247	T	95.1	Very high	89.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.			trans	-91.6	-19	176.6	57.9	0	0	0	0	113.2	I198 L201 H202 I245 I250 L251 C305	I198-T247 HydrophobicContact CG2-CG2 4.26Å; L201-T247 HydrophobicContact CB-CG2 3.77Å; L201-T247 HydrophobicContact CD1-CG2 3.78Å; L201-T247 HydrophobicContact CG-CG2 4.43Å; H202-T247 PolarHBondContact CD2-OG1 3.04Å; H202-T247 WeakPolarHBondContact NE2-CB 3.48Å; H202-T247 PolarHBondContact NE2-OG1 3.26Å; I245-T247 VanDerWaalsContact C-N 3.34Å; I245-T247 HydrophobicContact CG2-CG2 4.11Å; I245-T247 PolarHBondContact O-N 3.33Å; T247-I250 PolarHBondContact O-N 3.05Å; T247-L251 PolarHBondContact O-N 3.06Å; T247-C305 PolarHBondContact OG1-SG 3.01Å; T247-C305 VanDerWaalsContact OG1-SG 3.42Å
248	L	96.3	Very high	90.2	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-55.9	-48.9	-175.8	-178.1	60.5	0	0	0	113.1	I250 L251 L252 L302 M306 P321 F322	L248-I250 VanDerWaalsContact C-N 3.32Å; L248-I250 PolarHBondContact O-N 3.19Å; L248-L251 PolarHBondContact O-N 3.2Å; L248-L251 VanDerWaalsContact O-N 3.12Å; L248-L252 HydrophobicContact CD1-CD1 3.92Å; L248-L252 HydrophobicContact CD1-CD2 4.09Å; L248-L252 HydrophobicContact CD1-CG 3.82Å; L248-L252 HydrophobicContact CD2-CD1 4.34Å; L248-L252 HydrophobicContact CG-CD1 3.78Å; L248-L252 HydrophobicContact CG-CG 4.11Å; L248-L252 WeakPolarHBondContact O-CG 3.31Å; L248-L252 PolarHBondContact O-N 2.82Å; L248-L302 HydrophobicContact CD1-CD2 3.93Å; L248-M306 HydrophobicContact CD1-CE 3.91Å; L248-M306 HydrophobicContact CD2-CE 4.07Å; L248-P321 HydrophobicContact CD2-CB 4.45Å; L248-F322 HydrophobicContact CD1-CB 4.11Å; L248-F322 HydrophobicContact CD2-CB 4.28Å
249	P	95.2	Very high	90.7	Very high	74 Å²	74	49 Å²	49	48%	0.481	26%	0.26	S	S	.	.	H	α-helix	trans	-57.6	-44	-179.5	-25.1	35.8	0	0	0	112.7	L251 L252 D253	P249-L251 VanDerWaalsContact C-N 3.28Å; P249-L251 PolarHBondContact O-N 3.19Å; P249-L252 PolarHBondContact O-N 3.09Å; P249-L252 VanDerWaalsContact O-N 3.11Å; P249-D253 VanDerWaalsContact O-CG 3.25Å; P249-D253 PolarHBondContact O-N 3.13Å
250	I	95	Very high	91.4	Very high	29 Å²	29	48.3 Å²	48.3	15%	0.149	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-38.7	179.3	-57	178	0	0	0	111.2	Y179 I182 I198 T247 L248	Y179-I250 HydrophobicContact CD1-CD1 3.64Å; Y179-I250 HydrophobicContact CE1-CD1 3.4Å; I182-I250 HydrophobicContact CD1-CD1 3.97Å; I182-I250 HydrophobicContact CG2-CD1 4.39Å; I182-I250 HydrophobicContact CG2-CG2 4.08Å; I198-I250 HydrophobicContact CD1-CB 4.42Å; I198-I250 HydrophobicContact CD1-CG2 3.79Å; I198-I250 HydrophobicContact CG1-CG2 4.43Å; T247-I250 PolarHBondContact O-N 3.05Å; L248-I250 VanDerWaalsContact C-N 3.32Å; L248-I250 PolarHBondContact O-N 3.19Å
251	L	96.8	Very high	92	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-69.8	-38.9	176.5	-70.5	169.2	0	0	0	111.9	I198 T247 L248 P249 V254 L298 L301 L302 C305	I198-L251 HydrophobicContact CD1-CD2 3.63Å; I198-L251 HydrophobicContact CD1-CG 4.05Å; I198-L251 HydrophobicContact CG2-CD1 4.25Å; I198-L251 HydrophobicContact CG2-CD2 4.17Å; I198-L251 HydrophobicContact CG2-CG 4.31Å; T247-L251 PolarHBondContact O-N 3.06Å; L248-L251 PolarHBondContact O-N 3.2Å; L248-L251 VanDerWaalsContact O-N 3.12Å; P249-L251 VanDerWaalsContact C-N 3.28Å; P249-L251 PolarHBondContact O-N 3.19Å; L251-V254 WeakPolarHBondContact O-CB 3.46Å; L251-V254 WeakPolarHBondContact O-CG2 3.48Å; L251-V254 PolarHBondContact O-N 3.31Å; L251-L298 HydrophobicContact CB-CD1 4.14Å; L251-L298 HydrophobicContact CD2-CD1 3.96Å; L251-L298 WeakPolarHBondContact O-CD1 3.45Å; L251-L301 HydrophobicContact CD1-CB 4.05Å; L251-L301 HydrophobicContact CD2-CB 3.6Å; L251-L301 HydrophobicContact CD2-CD1 3.89Å; L251-L301 HydrophobicContact CD2-CG 4.41Å; L251-L302 HydrophobicContact CB-CD2 3.66Å; L251-L302 HydrophobicContact CB-CG 4.27Å; L251-L302 HydrophobicContact CD1-CD2 4.03Å; L251-L302 HydrophobicContact CD1-CG 4.39Å; L251-L302 HydrophobicContact CG-CD2 4.44Å; L251-C305 HydrophobicContact CD1-CB 3.96Å
252	L	96.3	Very high	92.4	Very high	13 Å²	13	48.8 Å²	48.8	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-35.3	178.7	-64.7	179.5	0	0	0	111.8	L248 P249 V254 F255 L302 P321 F322 E325	L248-L252 HydrophobicContact CD1-CD1 3.92Å; L248-L252 HydrophobicContact CD1-CD2 4.09Å; L248-L252 HydrophobicContact CD1-CG 3.82Å; L248-L252 HydrophobicContact CD2-CD1 4.34Å; L248-L252 HydrophobicContact CG-CD1 3.78Å; L248-L252 HydrophobicContact CG-CG 4.11Å; L248-L252 WeakPolarHBondContact O-CG 3.31Å; L248-L252 PolarHBondContact O-N 2.82Å; P249-L252 PolarHBondContact O-N 3.09Å; P249-L252 VanDerWaalsContact O-N 3.11Å; L252-V254 PolarHBondContact O-N 3.3Å; L252-V254 VanDerWaalsContact O-N 3.08Å; L252-F255 HydrophobicContact CD2-CD2 4.19Å; L252-F255 HydrophobicContact CD2-CE2 3.9Å; L252-F255 WeakPolarHBondContact O-CB 3.16Å; L252-F255 WeakPolarHBondContact O-CD2 3.35Å; L252-F255 PolarHBondContact O-N 3.43Å; L252-L302 HydrophobicContact CD2-CD2 4.24Å; L252-P321 HydrophobicContact CD1-CB 4.18Å; L252-F322 HydrophobicContact CD2-CD2 4.32Å; L252-E325 HydrophobicContact CB-CG 4.37Å; L252-E325 HydrophobicContact CD1-CB 4.35Å; L252-E325 HydrophobicContact CD1-CG 3.95Å; L252-E325 HydrophobicContact CD2-CB 3.91Å; L252-E325 HydrophobicContact CD2-CG 4.34Å; L252-E325 HydrophobicContact CG-CG 4.43Å
253	D	94.5	Very high	92	Very high	78 Å²	78	57.4 Å²	57.4	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-56.5	-26.8	174.9	-69.5	-14	0	0	0	112.5	P249 F255 Q256 L257	P249-D253 VanDerWaalsContact O-CG 3.25Å; P249-D253 PolarHBondContact O-N 3.13Å; D253-F255 PolarHBondContact O-N 3.31Å; D253-Q256 WeakPolarHBondContact O-CA 3.45Å; D253-Q256 WeakPolarHBondContact O-CB 3.47Å; D253-Q256 PolarHBondContact O-N 3.04Å; D253-L257 WeakPolarHBondContact O-CG 3.29Å; D253-L257 PolarHBondContact O-N 3.16Å
254	V	95.3	Very high	91.2	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.018	28%	0.283	C	S	.	.	H	α-helix	trans	-59.7	-32.8	176.9	-175	0	0	0	0	111.9	L191 F195 L251 L252 Q256 L257 V258 I294 L298	L191-V254 HydrophobicContact CD1-CG1 4.21Å; L191-V254 HydrophobicContact CD2-CG1 4.13Å; L191-V254 HydrophobicContact CD2-CG2 3.86Å; F195-V254 HydrophobicContact CE1-CG2 4.18Å; F195-V254 HydrophobicContact CZ-CG1 4.46Å; L251-V254 WeakPolarHBondContact O-CB 3.46Å; L251-V254 WeakPolarHBondContact O-CG2 3.48Å; L251-V254 PolarHBondContact O-N 3.31Å; L252-V254 PolarHBondContact O-N 3.3Å; L252-V254 VanDerWaalsContact O-N 3.08Å; V254-Q256 PolarHBondContact O-N 2.91Å; V254-L257 PolarHBondContact O-N 3.39Å; V254-V258 HydrophobicContact CG1-CG2 4Å; V254-V258 PolarHBondContact O-N 2.87Å; V254-I294 HydrophobicContact CG1-CG2 4.08Å; V254-L298 HydrophobicContact CB-CD1 4.11Å; V254-L298 HydrophobicContact CB-CD2 4.08Å; V254-L298 HydrophobicContact CG1-CD1 4.47Å; V254-L298 HydrophobicContact CG1-CD2 3.92Å; V254-L298 HydrophobicContact CG2-CD1 4.22Å
255	F	94.1	Very high	90.3	Very high	26 Å²	26	55.3 Å²	55.3	11%	0.114	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-26.7	175.5	-67.1	-56	0	0	0	112.8	L252 D253 F260 L298 L302 V326 F329 M342	L252-F255 HydrophobicContact CD2-CD2 4.19Å; L252-F255 HydrophobicContact CD2-CE2 3.9Å; L252-F255 WeakPolarHBondContact O-CB 3.16Å; L252-F255 WeakPolarHBondContact O-CD2 3.35Å; L252-F255 PolarHBondContact O-N 3.43Å; D253-F255 PolarHBondContact O-N 3.31Å; F255-F260 HydrophobicContact CD1-CE2 4.25Å; F255-L298 HydrophobicContact CD1-CD2 4.07Å; F255-L298 HydrophobicContact CE1-CD2 3.65Å; F255-L298 HydrophobicContact CZ-CD2 3.93Å; F255-L302 HydrophobicContact CE2-CD1 4.22Å; F255-L302 HydrophobicContact CZ-CD1 3.98Å; F255-V326 HydrophobicContact CE2-CG2 4.17Å; F255-V326 HydrophobicContact CZ-CG2 4.19Å; F255-F329 HydrophobicContact CD1-CB 4.12Å; F255-F329 HydrophobicContact CD1-CD1 4.39Å; F255-F329 AromaticContact CD1-CD2 3.4Å; F255-F329 HydrophobicContact CD1-CD2 3.4Å; F255-F329 AromaticContact CD1-CE2 3.84Å; F255-F329 HydrophobicContact CD1-CE2 3.84Å; F255-F329 AromaticContact CD1-CG 3.71Å; F255-F329 HydrophobicContact CD1-CG 3.71Å; F255-F329 HydrophobicContact CD1-CZ 4.48Å; F255-F329 HydrophobicContact CE1-CB 4.25Å; F255-F329 AromaticContact CE1-CD1 3.94Å; F255-F329 HydrophobicContact CE1-CD1 3.94Å; F255-F329 AromaticContact CE1-CD2 3.78Å; F255-F329 HydrophobicContact CE1-CD2 3.78Å; F255-F329 HydrophobicContact CE1-CE1 4.21Å; F255-F329 HydrophobicContact CE1-CE2 4.05Å; F255-F329 AromaticContact CE1-CG 3.71Å; F255-F329 HydrophobicContact CE1-CG 3.71Å; F255-F329 HydrophobicContact CE1-CZ 4.25Å; F255-F329 HydrophobicContact CG-CB 4.43Å; F255-F329 HydrophobicContact CG-CD2 4.27Å; F255-F329 HydrophobicContact CG-CG 4.47Å; F255-F329 HydrophobicContact CZ-CG 4.48Å; F255-M342 HydrophobicContact CE1-CE 4.06Å; F255-M342 HydrophobicContact CZ-CE 3.91Å; F255-M342 HydrophobicContact CZ-CG 4.34Å; F255-M342 HydrophobicContact CZ-SD 4.15Å
256	Q	91.6	Very high	89.6	Confident	149 Å²	149	61.7 Å²	61.7	70%	0.696	32%	0.32	S	S	*	.	H	α-helix	trans	-89.5	-33.1	176.7	-56.9	-178.1	5.9	0	0	111.7	D253 V254	D253-Q256 WeakPolarHBondContact O-CA 3.45Å; D253-Q256 WeakPolarHBondContact O-CB 3.47Å; D253-Q256 PolarHBondContact O-N 3.04Å; V254-Q256 PolarHBondContact O-N 2.91Å
257	L	92.2	Very high	88.9	Confident	77 Å²	77	63.9 Å²	63.9	40%	0.403	33%	0.331	S	S	.	.	H	α-helix	trans	-74.4	-27	-179.6	-68.4	171.9	0	0	0	113.8	L191 D253 V254	L191-L257 HydrophobicContact CD2-CD1 4.45Å; D253-L257 WeakPolarHBondContact O-CG 3.29Å; D253-L257 PolarHBondContact O-N 3.16Å; V254-L257 PolarHBondContact O-N 3.39Å
258	V	92.3	Very high	88	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.03	34%	0.341	C	S	.	.			trans	-118.4	120	-172.7	-177.7	0	0	0	0	111.5	Q188 L191 V254 F260 I294	Q188-V258 HydrophobicContact CG-CG2 3.9Å; L191-V258 HydrophobicContact CD1-CG2 3.36Å; V254-V258 HydrophobicContact CG1-CG2 4Å; V254-V258 PolarHBondContact O-N 2.87Å; V258-F260 HydrophobicContact CB-CD2 4.19Å; V258-F260 HydrophobicContact CB-CE1 4.43Å; V258-F260 HydrophobicContact CB-CE2 3.74Å; V258-F260 HydrophobicContact CB-CZ 3.88Å; V258-F260 HydrophobicContact CG1-CD1 4Å; V258-F260 HydrophobicContact CG1-CD2 4.06Å; V258-F260 HydrophobicContact CG1-CE1 3.79Å; V258-F260 HydrophobicContact CG1-CE2 3.89Å; V258-F260 HydrophobicContact CG1-CG 4.14Å; V258-F260 HydrophobicContact CG1-CZ 3.75Å; V258-F260 VanDerWaalsContact O-CD2 3.3Å; V258-F260 WeakPolarHBondContact O-CD2 3.4Å; V258-F260 PolarHBondContact O-N 3.49Å; V258-F260 VanDerWaalsContact O-N 3.09Å; V258-I294 HydrophobicContact CG2-CD1 4.49Å; V258-I294 HydrophobicContact CG2-CG2 4.3Å
259	N	91	Very high	86.8	Confident	91 Å²	91	72.7 Å²	72.7	49%	0.487	38%	0.381	S	S	.	.			trans	-81.2	88.7	170.5	-172.2	-7	0	0	0	111.1	N261 Q262	N259-N261 PolarHBondContact O-N 2.94Å; N259-N261 VanDerWaalsContact O-N 3.13Å; N259-N261 WeakPolarHBondContact OD1-CB 3.45Å; N259-N261 PolarHBondContact OD1-N 3.14Å; N259-N261 VanDerWaalsContact OD1-N 3.08Å; N259-Q262 HydrophobicContact CB-CB 4.28Å; N259-Q262 VanDerWaalsContact O-CB 3.25Å; N259-Q262 WeakPolarHBondContact O-CB 3.37Å; N259-Q262 PolarHBondContact O-N 3.47Å; N259-Q262 PolarHBondContact OD1-N 3.3Å
260	F	91.7	Very high	86.2	Confident	8 Å²	8	70.6 Å²	70.6	4%	0.035	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.9	177.7	-67.5	-78.7	0	0	0	114.6	F255 V258 I294 I295 L298 F329 V335 F338	F255-F260 HydrophobicContact CD1-CE2 4.25Å; V258-F260 HydrophobicContact CB-CD2 4.19Å; V258-F260 HydrophobicContact CB-CE1 4.43Å; V258-F260 HydrophobicContact CB-CE2 3.74Å; V258-F260 HydrophobicContact CB-CZ 3.88Å; V258-F260 HydrophobicContact CG1-CD1 4Å; V258-F260 HydrophobicContact CG1-CD2 4.06Å; V258-F260 HydrophobicContact CG1-CE1 3.79Å; V258-F260 HydrophobicContact CG1-CE2 3.89Å; V258-F260 HydrophobicContact CG1-CG 4.14Å; V258-F260 HydrophobicContact CG1-CZ 3.75Å; V258-F260 VanDerWaalsContact O-CD2 3.3Å; V258-F260 WeakPolarHBondContact O-CD2 3.4Å; V258-F260 PolarHBondContact O-N 3.49Å; V258-F260 VanDerWaalsContact O-N 3.09Å; F260-I294 HydrophobicContact CE1-CB 4.49Å; F260-I294 HydrophobicContact CE1-CG2 4.04Å; F260-I294 HydrophobicContact CZ-CG2 3.94Å; F260-I295 HydrophobicContact CD1-CB 4.39Å; F260-I295 HydrophobicContact CD1-CD1 4.41Å; F260-I295 HydrophobicContact CE1-CB 3.82Å; F260-I295 HydrophobicContact CE1-CD1 3.93Å; F260-I295 HydrophobicContact CE1-CG1 4.38Å; F260-I295 HydrophobicContact CZ-CD1 3.99Å; F260-L298 HydrophobicContact CZ-CD2 4.36Å; F260-F329 HydrophobicContact CB-CE2 4.27Å; F260-F329 AromaticContact CD2-CE2 3.59Å; F260-F329 HydrophobicContact CD2-CE2 3.59Å; F260-F329 HydrophobicContact CD2-CZ 4.29Å; F260-F329 HydrophobicContact CE2-CE2 4.18Å; F260-F329 HydrophobicContact CG-CE2 4.09Å; F260-F329 HydrophobicContact CG-CZ 4.47Å; F260-V335 WeakPolarHBondContact O-CG2 3.44Å; F260-F338 HydrophobicContact CB-CD2 4.08Å; F260-F338 HydrophobicContact CB-CE2 4.32Å; F260-F338 HydrophobicContact CD1-CD2 4.05Å; F260-F338 HydrophobicContact CD1-CE2 4.05Å; F260-F338 HydrophobicContact CG-CD2 4.42Å
261	N	90.3	Very high	85.8	Confident	56 Å²	56	72.7 Å²	72.7	30%	0.299	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-12.4	173.9	-70.1	-47.9	0	0	0	112.9	N259 R263 V332 R334	N259-N261 PolarHBondContact O-N 2.94Å; N259-N261 VanDerWaalsContact O-N 3.13Å; N259-N261 WeakPolarHBondContact OD1-CB 3.45Å; N259-N261 PolarHBondContact OD1-N 3.14Å; N259-N261 VanDerWaalsContact OD1-N 3.08Å; N261-R263 PolarHBondContact O-N 2.87Å; N261-V332 PolarHBondContact ND2-O 2.92Å; N261-R334 PolarHBondContact OD1-N 3.44Å
262	Q	85.1	Confident	85.5	Confident	118 Å²	118	74.1 Å²	74.1	55%	0.551	39%	0.393	S	S	*	.	S	Bend	trans	-65.5	119.5	179.8	-172.8	172.6	4.4	0	0	109.6	N259 S264	N259-Q262 HydrophobicContact CB-CB 4.28Å; N259-Q262 VanDerWaalsContact O-CB 3.25Å; N259-Q262 WeakPolarHBondContact O-CB 3.37Å; N259-Q262 PolarHBondContact O-N 3.47Å; N259-Q262 PolarHBondContact OD1-N 3.3Å; Q262-S264 PolarHBondContact O-N 3.48Å
263	R	74.1	Confident	85.3	Confident	238 Å²	238	73.9 Å²	73.9	90%	0.898	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-69.5	116.1	170.7	-69.2	-173.7	-179.1	-168	0.8	108.1	N261 G265	N261-R263 PolarHBondContact O-N 2.87Å; R263-G265 PolarHBondContact O-N 3.13Å
264	S	74.5	Confident	85.2	Confident	30 Å²	30	70.3 Å²	70.3	21%	0.21	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-57.4	132	173.1	-61.3	0	0	0	0	110.2	Q262 R266 R286 E287 T288	Q262-S264 PolarHBondContact O-N 3.48Å; S264-R266 PolarHBondContact O-N 3.09Å; S264-R286 CarbonylContact C-O 3.46Å; S264-R286 WeakPolarHBondContact CA-O 3.41Å; S264-R286 VanDerWaalsContact CB-O 3.25Å; S264-R286 WeakPolarHBondContact CB-O 3.38Å; S264-E287 PolarHBondContact OG-O 3.27Å; S264-E287 VanDerWaalsContact OG-O 3.04Å; S264-T288 VanDerWaalsContact CB-CA 3.45Å; S264-T288 VanDerWaalsContact OG-CA 3.27Å; S264-T288 WeakPolarHBondContact OG-CA 3.16Å; S264-T288 PolarHBondContact OG-N 3.36Å
265	G	70.7	Confident	85.2	Confident	79 Å²	79	72.4 Å²	72.4	81%	0.814	38%	0.38	S	S	*	.	S	Bend	trans	-74.5	-14.2	-176.7	0	0	0	0	0	113.5	R263 R286	R263-G265 PolarHBondContact O-N 3.13Å; G265-R286 PolarHBondContact N-O 3.04Å
266	R	76.3	Confident	85.1	Confident	140 Å²	140	72.7 Å²	72.7	53%	0.528	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-128.9	131.9	-178.8	-164	177.7	-173.7	174.5	1.9	110.5	S264 S268 S283 R286 E287 T288	S264-R266 PolarHBondContact O-N 3.09Å; R266-S268 PolarHBondContact O-N 3.14Å; R266-S283 PolarHBondContact NH1-OG 3.41Å; R266-R286 PolarHBondContact N-O 2.92Å; R266-R286 VanDerWaalsContact N-O 3.14Å; R266-E287 HydrophobicContact CB-CG 4.21Å; R266-E287 HydrophobicContact CG-CG 4.45Å; R266-E287 WeakPolarHBondContact O-CA 3.23Å; R266-T288 PolarHBondContact O-N 3.23Å; R266-T288 VanDerWaalsContact O-N 3.09Å
267	V	78.6	Confident	85.2	Confident	117 Å²	117	67 Å²	67	71%	0.709	36%	0.357	S	S	*	.			trans	-71	127.7	169.7	-177.3	0	0	0	0	107.9
268	S	76.2	Confident	85.3	Confident	28 Å²	28	63.9 Å²	63.9	20%	0.196	34%	0.341	C	S	.	.			trans	-76.3	133.9	175.3	53.9	0	0	0	0	111	R266 T288 A289	R266-S268 PolarHBondContact O-N 3.14Å; S268-T288 PolarHBondContact N-OG1 3.41Å; S268-T288 PolarHBondContact OG-OG1 2.86Å; S268-A289 WeakPolarHBondContact OG-CB 3.33Å; S268-A289 PolarHBondContact OG-N 3.06Å
269	N	71.8	Confident	85.4	Confident	167 Å²	167	65.8 Å²	65.8	89%	0.893	35%	0.349	S	S	*	.	S	Bend	trans	-76.4	-30.9	174.1	-67	-21.6	0	0	0	112.3
270	A	81.7	Confident	85.5	Confident	30 Å²	30	61.5 Å²	61.5	25%	0.248	33%	0.326	C	S	.	.	S	Bend	trans	-140	152.3	-175.2	0	0	0	0	0	111.3
271	P	86.6	Confident	85.5	Confident	74 Å²	74	62.9 Å²	62.9	48%	0.481	34%	0.335	S	S	.	.			trans	-69.2	139.2	173.5	29.7	-34.8	0	0	0	111.1	L409	P271-L409 HydrophobicContact CB-CD2 3.67Å; P271-L409 HydrophobicContact CG-CD2 3.48Å; P271-L409 VanDerWaalsContact CG-CD2 3.48Å
272	L	89.9	Confident	85.5	Confident	29 Å²	29	63.4 Å²	63.4	15%	0.152	34%	0.342	C	S	.	.			trans	-82	130.8	178.7	-66.6	173.4	0	0	0	111.1	F280 Q284 A289 A293	L272-F280 HydrophobicContact CD1-CE1 4.12Å; L272-Q284 HydrophobicContact CD1-CB 4.48Å; L272-A289 HydrophobicContact CB-CB 4.48Å; L272-A289 HydrophobicContact CD1-CB 4.12Å; L272-A289 HydrophobicContact CG-CB 3.86Å; L272-A293 HydrophobicContact CB-CB 4.19Å
273	D	92.2	Very high	85.6	Confident	9 Å²	9	59.5 Å²	59.5	5%	0.048	33%	0.327	C	S	.	.			trans	-98.6	100.6	173.5	-174.1	3.3	0	0	0	110.7	R275 L276 N413	D273-R275 PolarHBondContact O-N 3.35Å; D273-R275 VanDerWaalsContact O-N 3.08Å; D273-R275 VanDerWaalsContact OD1-CB 3.26Å; D273-R275 WeakPolarHBondContact OD1-CB 3.43Å; D273-R275 VanDerWaalsContact OD1-CG 3.32Å; D273-R275 WeakPolarHBondContact OD1-CG 3.12Å; D273-R275 IonicContact OD1-CZ 3.73Å; D273-R275 PolarHBondContact OD1-N 3.19Å; D273-R275 VanDerWaalsContact OD1-N 3.08Å; D273-R275 IonicContact OD1-NE 3.67Å; D273-R275 PolarHBondContact OD1-NE 2.83Å; D273-R275 IonicContact OD1-NH2 2.92Å; D273-R275 IonicContact OD2-CZ 3.67Å; D273-R275 IonicContact OD2-NE 2.82Å; D273-R275 PolarHBondContact OD2-NE 3.43Å; D273-R275 IonicContact OD2-NH2 2.6Å; D273-R275 PolarHBondContact OD2-NH2 3.5Å; D273-L276 HydrophobicContact CB-CD1 4.31Å; D273-L276 HydrophobicContact CB-CG 4.46Å; D273-L276 PolarHBondContact O-N 3.15Å; D273-N413 VanDerWaalsContact CB-ND2 3.25Å; D273-N413 WeakPolarHBondContact CB-ND2 3.35Å; D273-N413 PolarHBondContact OD2-ND2 3.38Å
274	L	94	Very high	86.4	Confident	3 Å²	3	50 Å²	50	2%	0.016	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-63.9	-14.8	-179.5	-51.5	-168.1	0	0	0	112.9	P192 F195 H196 L276 L277 F280 A293 W297	P192-L274 HydrophobicContact CB-CB 4.42Å; P192-L274 HydrophobicContact CG-CD2 4.31Å; F195-L274 HydrophobicContact CD2-CD1 3.78Å; F195-L274 HydrophobicContact CE2-CD1 3.99Å; H196-L274 PolarHBondContact NE2-O 3.41Å; L274-L276 PolarHBondContact O-N 3.39Å; L274-L277 HydrophobicContact CD2-CD1 4.04Å; L274-L277 PolarHBondContact O-N 2.86Å; L274-L277 VanDerWaalsContact O-O 3.07Å; L274-F280 HydrophobicContact CD1-CZ 4.33Å; L274-F280 HydrophobicContact CD2-CE1 3.61Å; L274-F280 HydrophobicContact CD2-CZ 3.51Å; L274-A293 HydrophobicContact CD1-CB 4.21Å; L274-A293 HydrophobicContact CD2-CB 3.86Å; L274-A293 HydrophobicContact CG-CB 3.97Å; L274-W297 HydrophobicContact CB-CG 4.42Å; L274-W297 HydrophobicContact CD1-CB 4.12Å; L274-W297 HydrophobicContact CD1-CG 3.77Å; L274-W297 HydrophobicContact CG-CG 4.31Å
275	R	93.5	Very high	87.1	Confident	47 Å²	47	51.2 Å²	51.2	18%	0.177	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-64.6	-21.3	174	-59.6	174.5	-63.3	164.4	6.9	112.7	I90 W144 H196 D273 W297 L406 T410	I90-R275 HydrophobicContact CD1-CB 4.31Å; W144-R275 VanDerWaalsContact CH2-O 3.29Å; W144-R275 WeakPolarHBondContact CH2-O 3.37Å; H196-R275 PolarHBondContact CE1-O 3.49Å; D273-R275 PolarHBondContact O-N 3.35Å; D273-R275 VanDerWaalsContact O-N 3.08Å; D273-R275 VanDerWaalsContact OD1-CB 3.26Å; D273-R275 WeakPolarHBondContact OD1-CB 3.43Å; D273-R275 VanDerWaalsContact OD1-CG 3.32Å; D273-R275 WeakPolarHBondContact OD1-CG 3.12Å; D273-R275 IonicContact OD1-CZ 3.73Å; D273-R275 PolarHBondContact OD1-N 3.19Å; D273-R275 VanDerWaalsContact OD1-N 3.08Å; D273-R275 IonicContact OD1-NE 3.67Å; D273-R275 PolarHBondContact OD1-NE 2.83Å; D273-R275 IonicContact OD1-NH2 2.92Å; D273-R275 IonicContact OD2-CZ 3.67Å; D273-R275 IonicContact OD2-NE 2.82Å; D273-R275 PolarHBondContact OD2-NE 3.43Å; D273-R275 IonicContact OD2-NH2 2.6Å; D273-R275 PolarHBondContact OD2-NH2 3.5Å; R275-W297 HydrophobicContact CG-CH2 3.76Å; R275-W297 HydrophobicContact CG-CZ2 3.49Å; R275-W297 VanDerWaalsContact CG-CZ2 3.49Å; R275-L406 PolarHBondContact NH2-O 3.28Å; R275-T410 PolarHBondContact NH1-OG1 3.48Å; R275-T410 PolarHBondContact NH2-OG1 2.68Å
276	L	93.5	Very high	87.8	Confident	32 Å²	32	54.4 Å²	54.4	17%	0.168	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-106.7	6.9	-177.4	-56	177.6	0	0	0	112.3	V85 A87 I90 D273 L274	V85-L276 HydrophobicContact CG1-CD2 4.08Å; A87-L276 HydrophobicContact CB-CD1 3.8Å; I90-L276 HydrophobicContact CB-CD2 4.21Å; I90-L276 HydrophobicContact CD1-CD2 3.66Å; I90-L276 HydrophobicContact CG1-CD2 4.49Å; I90-L276 HydrophobicContact CG2-CD2 4.47Å; D273-L276 HydrophobicContact CB-CD1 4.31Å; D273-L276 HydrophobicContact CB-CG 4.46Å; D273-L276 PolarHBondContact O-N 3.15Å; L274-L276 PolarHBondContact O-N 3.39Å
277	L	93.5	Very high	88.4	Confident	30 Å²	30	49.2 Å²	49.2	16%	0.157	27%	0.266	C	S	.	.			trans	-124.7	137.5	-178.8	-64.2	168.5	0	0	0	110.6	P192 H196 L274 F280	P192-L277 HydrophobicContact CB-CB 4.11Å; P192-L277 VanDerWaalsContact CB-O 3.25Å; P192-L277 WeakPolarHBondContact CB-O 3.44Å; P192-L277 HydrophobicContact CG-CB 4.36Å; H196-L277 PolarHBondContact NE2-O 3.28Å; H196-L277 VanDerWaalsContact NE2-O 3.13Å; L274-L277 HydrophobicContact CD2-CD1 4.04Å; L274-L277 PolarHBondContact O-N 2.86Å; L274-L277 VanDerWaalsContact O-O 3.07Å; L277-F280 HydrophobicContact CD1-CE1 4.42Å
278	L	94.2	Very high	88.8	Confident	11 Å²	11	45.9 Å²	45.9	6%	0.058	25%	0.246	C	C	.	.	S	Bend	trans	-96.3	-34.7	165.4	-65	-178.3	0	0	0	111.5	N143 W144 V147 L193	N143-L278 VanDerWaalsContact C-CD1 3.47Å; W144-L278 HydrophobicContact CB-CD1 4.44Å; W144-L278 HydrophobicContact CD2-CD1 3.83Å; W144-L278 HydrophobicContact CD2-CD2 3.86Å; W144-L278 HydrophobicContact CD2-CG 3.77Å; W144-L278 VanDerWaalsContact CE2-CG 3.5Å; W144-L278 HydrophobicContact CE3-CD1 4.43Å; W144-L278 HydrophobicContact CE3-CD2 3.75Å; W144-L278 HydrophobicContact CE3-CG 4.21Å; W144-L278 HydrophobicContact CG-CD1 3.81Å; W144-L278 HydrophobicContact CG-CG 4.25Å; W144-L278 HydrophobicContact CH2-CD2 3.69Å; W144-L278 HydrophobicContact CH2-CG 4.15Å; W144-L278 HydrophobicContact CZ2-CD2 3.79Å; W144-L278 HydrophobicContact CZ2-CG 3.7Å; W144-L278 HydrophobicContact CZ3-CD2 3.67Å; W144-L278 HydrophobicContact CZ3-CG 4.39Å; V147-L278 HydrophobicContact CB-CD2 4.32Å; V147-L278 HydrophobicContact CG1-CD2 4.16Å; V147-L278 HydrophobicContact CG2-CD1 4.47Å; V147-L278 HydrophobicContact CG2-CD2 4Å; L193-L278 VanDerWaalsContact CB-O 3.23Å; L193-L278 WeakPolarHBondContact CB-O 3.37Å; L193-L278 HydrophobicContact CD1-CD2 4.25Å; L193-L278 PolarHBondContact N-O 3.48Å
279	H	94	Very high	89.4	Confident	44 Å²	44	44.7 Å²	44.7	20%	0.204	24%	0.238	C	C	.	.	S	Bend	trans	-141.2	156.2	174.4	64.4	81.7	0	0	0	110.8	R189 W190	R189-H279 PolarHBondContact NH2-ND1 2.74Å; R189-H279 CarbonylContact O-C 3.56Å; R189-H279 WeakPolarHBondContact O-CA 3.47Å; R189-H279 WeakPolarHBondContact O-CB 3.36Å; W190-H279 HydrophobicContact CD2-CB 4.15Å; W190-H279 HydrophobicContact CE3-CB 3.75Å; W190-H279 HydrophobicContact CH2-CB 4.41Å; W190-H279 HydrophobicContact CZ3-CB 3.89Å; W190-H279 AromaticContact CZ3-CD2 3.97Å
280	F	93	Very high	90.4	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.009	20%	0.196	C	C	.	.			trans	-76.1	139.8	166.1	-65.1	-71.3	0	0	0	110.2	R189 L191 P192 L272 L274 L277 Q284 L285 I294	R189-F280 PolarHBondContact O-N 3.2Å; L191-F280 HydrophobicContact CB-CE2 4.36Å; P192-F280 VanDerWaalsContact CD-CE2 3.49Å; P192-F280 HydrophobicContact CG-CD2 3.75Å; P192-F280 HydrophobicContact CG-CE1 4.26Å; P192-F280 HydrophobicContact CG-CE2 3.46Å; P192-F280 VanDerWaalsContact CG-CE2 3.46Å; P192-F280 HydrophobicContact CG-CG 4.28Å; P192-F280 HydrophobicContact CG-CZ 3.74Å; L272-F280 HydrophobicContact CD1-CE1 4.12Å; L274-F280 HydrophobicContact CD1-CZ 4.33Å; L274-F280 HydrophobicContact CD2-CE1 3.61Å; L274-F280 HydrophobicContact CD2-CZ 3.51Å; L277-F280 HydrophobicContact CD1-CE1 4.42Å; F280-Q284 HydrophobicContact CB-CB 4.44Å; F280-Q284 HydrophobicContact CD1-CB 4.16Å; F280-L285 HydrophobicContact CB-CB 4.48Å; F280-L285 HydrophobicContact CB-CD1 4.07Å; F280-L285 HydrophobicContact CD2-CD1 4.01Å; F280-L285 HydrophobicContact CG-CD1 4.11Å; F280-I294 HydrophobicContact CE2-CD1 3.76Å; F280-I294 HydrophobicContact CE2-CG1 3.83Å; F280-I294 HydrophobicContact CZ-CD1 3.98Å; F280-I294 HydrophobicContact CZ-CG1 3.75Å
281	T	92.3	Very high	90.9	Very high	36 Å²	36	35.9 Å²	35.9	22%	0.221	19%	0.187	C	C	.	.			trans	-75.2	157	162.4	72.8	0	0	0	0	109.7	S283 Q284 L285 D449	T281-S283 PolarHBondContact O-N 3.2Å; T281-S283 VanDerWaalsContact O-N 3.13Å; T281-Q284 PolarHBondContact O-N 3.46Å; T281-Q284 VanDerWaalsContact O-N 3.09Å; T281-Q284 VanDerWaalsContact OG1-CG 3.3Å; T281-Q284 WeakPolarHBondContact OG1-CG 3.29Å; T281-Q284 PolarHBondContact OG1-N 3.21Å; T281-L285 PolarHBondContact O-N 3.25Å; T281-D449 VanDerWaalsContact CG2-OD2 3.24Å; T281-D449 WeakPolarHBondContact CG2-OD2 3.41Å
282	P	89.6	Confident	91.2	Very high	67 Å²	67	36.2 Å²	36.2	44%	0.435	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.1	176.1	-26	35	0	0	0	113.6	R286	P282-R286 PolarHBondContact O-NH1 3.5Å; P282-R286 VanDerWaalsContact O-NH1 3.08Å
283	S	88.2	Confident	91.4	Very high	36 Å²	36	35.3 Å²	35.3	25%	0.252	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-49.3	173.8	-175.7	0	0	0	0	111.5	R266 T281 L285 R286	R266-S283 PolarHBondContact NH1-OG 3.41Å; T281-S283 PolarHBondContact O-N 3.2Å; T281-S283 VanDerWaalsContact O-N 3.13Å; S283-L285 VanDerWaalsContact C-N 3.25Å; S283-L285 PolarHBondContact O-N 2.99Å; S283-R286 PolarHBondContact O-N 2.89Å
284	Q	90.9	Very high	91.5	Very high	39 Å²	39	34.9 Å²	34.9	18%	0.182	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-59.2	-38.2	-179.7	-72.9	167.5	-16.8	0	0	111.6	L272 F280 T281 R286 E287 S290	L272-Q284 HydrophobicContact CD1-CB 4.48Å; F280-Q284 HydrophobicContact CB-CB 4.44Å; F280-Q284 HydrophobicContact CD1-CB 4.16Å; T281-Q284 PolarHBondContact O-N 3.46Å; T281-Q284 VanDerWaalsContact O-N 3.09Å; T281-Q284 VanDerWaalsContact OG1-CG 3.3Å; T281-Q284 WeakPolarHBondContact OG1-CG 3.29Å; T281-Q284 PolarHBondContact OG1-N 3.21Å; Q284-R286 PolarHBondContact O-N 3.47Å; Q284-E287 WeakPolarHBondContact O-CB 3.25Å; Q284-E287 PolarHBondContact O-N 3.4Å; Q284-S290 WeakPolarHBondContact O-CB 3.38Å
285	L	88.4	Confident	91.6	Very high	56 Å²	56	34.9 Å²	34.9	29%	0.293	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-64.5	-21.6	179.5	-157.1	73.3	0	0	0	113.6	Q188 F280 T281 S283 S290	Q188-L285 HydrophobicContact CG-CD1 3.76Å; F280-L285 HydrophobicContact CB-CB 4.48Å; F280-L285 HydrophobicContact CB-CD1 4.07Å; F280-L285 HydrophobicContact CD2-CD1 4.01Å; F280-L285 HydrophobicContact CG-CD1 4.11Å; T281-L285 PolarHBondContact O-N 3.25Å; S283-L285 VanDerWaalsContact C-N 3.25Å; S283-L285 PolarHBondContact O-N 2.99Å; L285-S290 PolarHBondContact O-OG 3.46Å
286	R	86	Confident	91.6	Very high	145 Å²	145	33.5 Å²	33.5	55%	0.547	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-89.2	-4.8	176.1	-65.8	-171.5	-62	-96.1	3.5	113.4	S264 G265 R266 P282 S283 Q284	S264-R286 CarbonylContact C-O 3.46Å; S264-R286 WeakPolarHBondContact CA-O 3.41Å; S264-R286 VanDerWaalsContact CB-O 3.25Å; S264-R286 WeakPolarHBondContact CB-O 3.38Å; G265-R286 PolarHBondContact N-O 3.04Å; R266-R286 PolarHBondContact N-O 2.92Å; R266-R286 VanDerWaalsContact N-O 3.14Å; P282-R286 PolarHBondContact O-NH1 3.5Å; P282-R286 VanDerWaalsContact O-NH1 3.08Å; S283-R286 PolarHBondContact O-N 2.89Å; Q284-R286 PolarHBondContact O-N 3.47Å
287	E	87.7	Confident	91.8	Very high	31 Å²	31	33.1 Å²	33.1	15%	0.145	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-85.7	148.4	-179.4	-68.2	175	-167.7	0	0	111.6	S264 R266 Q284 A289 S290	S264-E287 PolarHBondContact OG-O 3.27Å; S264-E287 VanDerWaalsContact OG-O 3.04Å; R266-E287 HydrophobicContact CB-CG 4.21Å; R266-E287 HydrophobicContact CG-CG 4.45Å; R266-E287 WeakPolarHBondContact O-CA 3.23Å; Q284-E287 WeakPolarHBondContact O-CB 3.25Å; Q284-E287 PolarHBondContact O-N 3.4Å; E287-A289 VanDerWaalsContact C-N 3.25Å; E287-A289 PolarHBondContact O-N 3.08Å; E287-S290 PolarHBondContact O-N 3.08Å; E287-S290 PolarHBondContact O-OG 3.46Å
288	T	87	Confident	92	Very high	47 Å²	47	31.7 Å²	31.7	29%	0.288	17%	0.166	S	C	.	.	H	α-helix	trans	-57.1	-39.6	175.7	43.2	0	0	0	0	112.1	S264 R266 S268 S290 N291 D292	S264-T288 VanDerWaalsContact CB-CA 3.45Å; S264-T288 VanDerWaalsContact OG-CA 3.27Å; S264-T288 WeakPolarHBondContact OG-CA 3.16Å; S264-T288 PolarHBondContact OG-N 3.36Å; R266-T288 PolarHBondContact O-N 3.23Å; R266-T288 VanDerWaalsContact O-N 3.09Å; S268-T288 PolarHBondContact N-OG1 3.41Å; S268-T288 PolarHBondContact OG-OG1 2.86Å; T288-S290 PolarHBondContact O-N 3.21Å; T288-S290 VanDerWaalsContact O-N 3.14Å; T288-N291 PolarHBondContact O-N 3.39Å; T288-D292 PolarHBondContact O-N 2.85Å
289	A	90.1	Very high	92.1	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-62.6	-20.6	-178.7	0	0	0	0	0	114.6	S268 L272 E287 A293	S268-A289 WeakPolarHBondContact OG-CB 3.33Å; S268-A289 PolarHBondContact OG-N 3.06Å; L272-A289 HydrophobicContact CB-CB 4.48Å; L272-A289 HydrophobicContact CD1-CB 4.12Å; L272-A289 HydrophobicContact CG-CB 3.86Å; E287-A289 VanDerWaalsContact C-N 3.25Å; E287-A289 PolarHBondContact O-N 3.08Å; A289-A293 WeakPolarHBondContact O-CB 3.49Å; A289-A293 PolarHBondContact O-N 3.08Å
290	S	92.1	Very high	92.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.6	-52.9	179.9	62.9	0	0	0	0	111.8	Q284 L285 E287 T288 D292 A293 I294	Q284-S290 WeakPolarHBondContact O-CB 3.38Å; L285-S290 PolarHBondContact O-OG 3.46Å; E287-S290 PolarHBondContact O-N 3.08Å; E287-S290 PolarHBondContact O-OG 3.46Å; T288-S290 PolarHBondContact O-N 3.21Å; T288-S290 VanDerWaalsContact O-N 3.14Å; S290-D292 VanDerWaalsContact C-N 3.33Å; S290-D292 PolarHBondContact O-N 3.27Å; S290-A293 PolarHBondContact O-N 3.48Å; S290-I294 WeakPolarHBondContact O-CB 3.46Å; S290-I294 WeakPolarHBondContact O-CD1 2.98Å; S290-I294 WeakPolarHBondContact O-CG1 3.26Å; S290-I294 PolarHBondContact O-N 2.87Å
291	N	92.3	Very high	92.4	Very high	11 Å²	11	30.2 Å²	30.2	6%	0.059	16%	0.159	C	C	.	.	H	α-helix	trans	-63.5	-39.5	177.5	-74.7	-17.4	0	0	0	111.5	T288 I294 I295 F338	T288-N291 PolarHBondContact O-N 3.39Å; N291-I294 PolarHBondContact O-N 3.22Å; N291-I295 VanDerWaalsContact O-CG2 3.3Å; N291-I295 WeakPolarHBondContact O-CG2 3.47Å; N291-I295 PolarHBondContact O-N 3.09Å; N291-F338 HydrophobicContact CB-CE2 4.41Å; N291-F338 HydrophobicContact CB-CZ 4.32Å
292	D	92.7	Very high	92.7	Very high	82 Å²	82	28.5 Å²	28.5	44%	0.439	15%	0.148	S	C	.	.	H	α-helix	trans	-62.2	-42.1	175.7	-68.6	-30.7	0	0	0	112	T288 S290 I295 S296 F338	T288-D292 PolarHBondContact O-N 2.85Å; S290-D292 VanDerWaalsContact C-N 3.33Å; S290-D292 PolarHBondContact O-N 3.27Å; D292-I295 WeakPolarHBondContact O-CG2 3.33Å; D292-S296 WeakPolarHBondContact O-CB 3.36Å; D292-S296 PolarHBondContact O-N 3.46Å; D292-F338 WeakPolarHBondContact OD1-CE1 3.3Å; D292-F338 VanDerWaalsContact OD1-CZ 3.25Å; D292-F338 WeakPolarHBondContact OD1-CZ 3.44Å
293	A	93.9	Very high	93	Very high	10 Å²	10	25.3 Å²	25.3	8%	0.083	13%	0.127	C	C	.	.	H	α-helix	trans	-68.7	-44.8	176	0	0	0	0	0	111.3	L272 L274 A289 S290 I295 S296 W297	L272-A293 HydrophobicContact CB-CB 4.19Å; L274-A293 HydrophobicContact CD1-CB 4.21Å; L274-A293 HydrophobicContact CD2-CB 3.86Å; L274-A293 HydrophobicContact CG-CB 3.97Å; A289-A293 WeakPolarHBondContact O-CB 3.49Å; A289-A293 PolarHBondContact O-N 3.08Å; S290-A293 PolarHBondContact O-N 3.48Å; A293-I295 PolarHBondContact O-N 3.07Å; A293-S296 PolarHBondContact O-N 3.29Å; A293-W297 VanDerWaalsContact O-CD1 3.26Å; A293-W297 PolarHBondContact O-N 3.5Å
294	I	95.4	Very high	93.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.6	-50.1	179.9	-69.3	163.4	0	0	0	110.7	L191 F195 V254 V258 F260 F280 S290 N291 S296 W297 L298	L191-I294 HydrophobicContact CD1-CD1 3.97Å; L191-I294 HydrophobicContact CD1-CG1 4.28Å; L191-I294 HydrophobicContact CD1-CG2 4.08Å; F195-I294 HydrophobicContact CE2-CG2 4.29Å; F195-I294 HydrophobicContact CZ-CG2 4.14Å; V254-I294 HydrophobicContact CG1-CG2 4.08Å; V258-I294 HydrophobicContact CG2-CD1 4.49Å; V258-I294 HydrophobicContact CG2-CG2 4.3Å; F260-I294 HydrophobicContact CE1-CB 4.49Å; F260-I294 HydrophobicContact CE1-CG2 4.04Å; F260-I294 HydrophobicContact CZ-CG2 3.94Å; F280-I294 HydrophobicContact CE2-CD1 3.76Å; F280-I294 HydrophobicContact CE2-CG1 3.83Å; F280-I294 HydrophobicContact CZ-CD1 3.98Å; F280-I294 HydrophobicContact CZ-CG1 3.75Å; S290-I294 WeakPolarHBondContact O-CB 3.46Å; S290-I294 WeakPolarHBondContact O-CD1 2.98Å; S290-I294 WeakPolarHBondContact O-CG1 3.26Å; S290-I294 PolarHBondContact O-N 2.87Å; N291-I294 PolarHBondContact O-N 3.22Å; I294-S296 VanDerWaalsContact C-N 3.34Å; I294-S296 PolarHBondContact O-N 2.99Å; I294-W297 PolarHBondContact O-N 3.42Å; I294-L298 VanDerWaalsContact O-CB 3.22Å; I294-L298 WeakPolarHBondContact O-CB 3.45Å; I294-L298 PolarHBondContact O-N 3.44Å
295	I	95	Very high	93.6	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	11%	0.111	C	C	.	.	H	α-helix	trans	-67.3	-36.7	-177.7	-165.8	65.9	0	0	0	111.9	F260 N291 D292 A293 L298 F299 F329 F338 M342	F260-I295 HydrophobicContact CD1-CB 4.39Å; F260-I295 HydrophobicContact CD1-CD1 4.41Å; F260-I295 HydrophobicContact CE1-CB 3.82Å; F260-I295 HydrophobicContact CE1-CD1 3.93Å; F260-I295 HydrophobicContact CE1-CG1 4.38Å; F260-I295 HydrophobicContact CZ-CD1 3.99Å; N291-I295 VanDerWaalsContact O-CG2 3.3Å; N291-I295 WeakPolarHBondContact O-CG2 3.47Å; N291-I295 PolarHBondContact O-N 3.09Å; D292-I295 WeakPolarHBondContact O-CG2 3.33Å; A293-I295 PolarHBondContact O-N 3.07Å; I295-L298 HydrophobicContact CD1-CD2 4.33Å; I295-L298 PolarHBondContact O-N 2.92Å; I295-F299 WeakPolarHBondContact O-CB 3.26Å; I295-F299 PolarHBondContact O-N 3.25Å; I295-F329 HydrophobicContact CD1-CZ 4.16Å; I295-F338 HydrophobicContact CB-CD1 4.3Å; I295-F338 HydrophobicContact CB-CG 4.44Å; I295-F338 HydrophobicContact CD1-CB 4.47Å; I295-F338 HydrophobicContact CG1-CB 4.01Å; I295-F338 HydrophobicContact CG1-CD1 4.16Å; I295-F338 HydrophobicContact CG1-CG 4.04Å; I295-F338 HydrophobicContact CG2-CD1 3.55Å; I295-F338 HydrophobicContact CG2-CE1 3.6Å; I295-F338 HydrophobicContact CG2-CG 4.17Å; I295-F338 HydrophobicContact CG2-CZ 4.22Å; I295-M342 HydrophobicContact CD1-CE 3.71Å
296	S	94.8	Very high	93.9	Very high	19 Å²	19	20 Å²	20	13%	0.133	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-44.7	177.1	177.8	0	0	0	0	111.1	D292 A293 I294 D300 R402 E405	D292-S296 WeakPolarHBondContact O-CB 3.36Å; D292-S296 PolarHBondContact O-N 3.46Å; A293-S296 PolarHBondContact O-N 3.29Å; I294-S296 VanDerWaalsContact C-N 3.34Å; I294-S296 PolarHBondContact O-N 2.99Å; S296-D300 PolarHBondContact O-N 2.75Å; S296-R402 PolarHBondContact OG-NH1 3.03Å; S296-E405 PolarHBondContact OG-OE1 3.08Å; S296-E405 VanDerWaalsContact OG-OE1 3.12Å
297	W	96.3	Very high	94.3	Very high	24 Å²	24	13.2 Å²	13.2	9%	0.091	7%	0.072	C	C	.	.	H	α-helix	trans	-69.1	-43.4	174.7	-84.4	90.8	0	0	0	113.1	F195 L274 R275 A293 I294 F299 D300 L301 R402 L406	F195-W297 HydrophobicContact CD2-CB 3.57Å; F195-W297 HydrophobicContact CD2-CG 4.18Å; F195-W297 HydrophobicContact CE2-CB 3.65Å; F195-W297 HydrophobicContact CG-CB 4.31Å; F195-W297 HydrophobicContact CZ-CB 4.46Å; L274-W297 HydrophobicContact CB-CG 4.42Å; L274-W297 HydrophobicContact CD1-CB 4.12Å; L274-W297 HydrophobicContact CD1-CG 3.77Å; L274-W297 HydrophobicContact CG-CG 4.31Å; R275-W297 HydrophobicContact CG-CH2 3.76Å; R275-W297 HydrophobicContact CG-CZ2 3.49Å; R275-W297 VanDerWaalsContact CG-CZ2 3.49Å; A293-W297 VanDerWaalsContact O-CD1 3.26Å; A293-W297 PolarHBondContact O-N 3.5Å; I294-W297 PolarHBondContact O-N 3.42Å; W297-F299 VanDerWaalsContact C-N 3.29Å; W297-F299 PolarHBondContact O-N 3.42Å; W297-D300 PolarHBondContact O-N 2.98Å; W297-L301 WeakPolarHBondContact O-CG 3.49Å; W297-L301 PolarHBondContact O-N 2.67Å; W297-R402 VanDerWaalsContact CG-NH2 3.33Å; W297-L406 HydrophobicContact CZ2-CD2 3.99Å
298	L	97.2	Very high	94.5	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.2	-44.1	176.3	177	59.4	0	0	0	111.1	F195 L251 V254 F255 F260 I294 I295 L301 L302	F195-L298 HydrophobicContact CZ-CB 4.25Å; L251-L298 HydrophobicContact CB-CD1 4.14Å; L251-L298 HydrophobicContact CD2-CD1 3.96Å; L251-L298 WeakPolarHBondContact O-CD1 3.45Å; V254-L298 HydrophobicContact CB-CD1 4.11Å; V254-L298 HydrophobicContact CB-CD2 4.08Å; V254-L298 HydrophobicContact CG1-CD1 4.47Å; V254-L298 HydrophobicContact CG1-CD2 3.92Å; V254-L298 HydrophobicContact CG2-CD1 4.22Å; F255-L298 HydrophobicContact CD1-CD2 4.07Å; F255-L298 HydrophobicContact CE1-CD2 3.65Å; F255-L298 HydrophobicContact CZ-CD2 3.93Å; F260-L298 HydrophobicContact CZ-CD2 4.36Å; I294-L298 VanDerWaalsContact O-CB 3.22Å; I294-L298 WeakPolarHBondContact O-CB 3.45Å; I294-L298 PolarHBondContact O-N 3.44Å; I295-L298 HydrophobicContact CD1-CD2 4.33Å; I295-L298 PolarHBondContact O-N 2.92Å; L298-L301 PolarHBondContact O-N 3.05Å; L298-L302 HydrophobicContact CD1-CD1 3.72Å; L298-L302 HydrophobicContact CD1-CG 3.96Å; L298-L302 HydrophobicContact CD2-CD1 4.47Å; L298-L302 HydrophobicContact CG-CD1 3.72Å; L298-L302 HydrophobicContact CG-CG 4.38Å; L298-L302 VanDerWaalsContact O-CB 3.31Å; L298-L302 WeakPolarHBondContact O-CB 3.41Å; L298-L302 VanDerWaalsContact O-CG 3.22Å; L298-L302 WeakPolarHBondContact O-CG 3.27Å; L298-L302 PolarHBondContact O-N 3.36Å
299	F	97.1	Very high	94.7	Very high	19 Å²	19	10 Å²	10	8%	0.083	5%	0.054	C	C	.	.	H	α-helix	trans	-60.6	-46.1	176.9	176	-93	0	0	0	112.6	I295 W297 L302 A303 Q341 M342 L345 F394 H398	I295-F299 WeakPolarHBondContact O-CB 3.26Å; I295-F299 PolarHBondContact O-N 3.25Å; W297-F299 VanDerWaalsContact C-N 3.29Å; W297-F299 PolarHBondContact O-N 3.42Å; F299-L302 PolarHBondContact O-N 2.68Å; F299-A303 WeakPolarHBondContact O-CB 3.31Å; F299-A303 PolarHBondContact O-N 2.97Å; F299-Q341 HydrophobicContact CD2-CB 4.19Å; F299-Q341 HydrophobicContact CE2-CB 4.17Å; F299-Q341 VanDerWaalsContact CE2-O 3.28Å; F299-Q341 WeakPolarHBondContact CE2-O 3.18Å; F299-M342 HydrophobicContact CB-CE 4.36Å; F299-M342 HydrophobicContact CD2-CE 4.46Å; F299-M342 HydrophobicContact CD2-SD 4.32Å; F299-L345 HydrophobicContact CD2-CB 4.29Å; F299-L345 HydrophobicContact CD2-CD2 4.18Å; F299-L345 HydrophobicContact CE2-CB 3.57Å; F299-L345 HydrophobicContact CE2-CD2 4.17Å; F299-L345 HydrophobicContact CE2-CG 4.45Å; F299-L345 HydrophobicContact CZ-CB 4.27Å; F299-F394 HydrophobicContact CE2-CZ 4.37Å; F299-F394 HydrophobicContact CZ-CE1 4.19Å; F299-F394 AromaticContact CZ-CZ 3.72Å; F299-F394 HydrophobicContact CZ-CZ 3.72Å; F299-H398 AromaticContact CD1-CE1 3.48Å; F299-H398 VanDerWaalsContact CD1-CE1 3.48Å; F299-H398 WeakPolarHBondContact CD1-CE1 3.09Å; F299-H398 AromaticContact CD1-NE2 3.69Å; F299-H398 AromaticContact CE1-CD2 3.98Å; F299-H398 AromaticContact CE1-CE1 3.3Å; F299-H398 WeakPolarHBondContact CE1-CE1 3.32Å; F299-H398 AromaticContact CE1-CG 3.89Å; F299-H398 AromaticContact CE1-ND1 3.48Å; F299-H398 WeakPolarHBondContact CE1-ND1 3.35Å; F299-H398 AromaticContact CE1-NE2 3.61Å
300	D	96.8	Very high	94.7	Very high	7 Å²	7	9.9 Å²	9.9	4%	0.037	5%	0.052	C	C	.	.	H	α-helix	trans	-62.8	-46.1	178.7	-173.5	29.9	0	0	0	111.5	S296 W297 A303 E304 H398 K399 R402	S296-D300 PolarHBondContact O-N 2.75Å; W297-D300 PolarHBondContact O-N 2.98Å; D300-A303 WeakPolarHBondContact O-CB 3.32Å; D300-A303 PolarHBondContact O-N 3.23Å; D300-E304 WeakPolarHBondContact O-CG 3.21Å; D300-E304 PolarHBondContact O-N 3.44Å; D300-H398 WeakPolarHBondContact CA-NE2 3.26Å; D300-H398 IonicContact OD1-NE2 3.3Å; D300-H398 PolarHBondContact OD1-NE2 3.46Å; D300-K399 IonicContact OD1-NZ 2.81Å; D300-K399 PolarHBondContact OD1-NZ 2.9Å; D300-R402 WeakPolarHBondContact OD2-CG 3.27Å; D300-R402 IonicContact OD2-CZ 3.3Å; D300-R402 IonicContact OD2-NE 2.72Å; D300-R402 PolarHBondContact OD2-NE 3.48Å; D300-R402 IonicContact OD2-NH2 3.62Å
301	L	97.5	Very high	94.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-67.7	-38.3	178	-65	175.2	0	0	0	112.6	F195 I198 S199 H202 L251 W297 L298 A303 E304 C305	F195-L301 HydrophobicContact CB-CD1 3.75Å; F195-L301 HydrophobicContact CD1-CD1 3.36Å; F195-L301 HydrophobicContact CE1-CD1 4.12Å; F195-L301 HydrophobicContact CG-CD1 3.71Å; I198-L301 HydrophobicContact CB-CD1 4.29Å; I198-L301 HydrophobicContact CG2-CD1 4.2Å; I198-L301 HydrophobicContact CG2-CD2 4.21Å; S199-L301 WeakPolarHBondContact OG-CD2 3.47Å; H202-L301 PolarHBondContact CE1-O 2.86Å; H202-L301 VanDerWaalsContact CE1-O 3.22Å; L251-L301 HydrophobicContact CD1-CB 4.05Å; L251-L301 HydrophobicContact CD2-CB 3.6Å; L251-L301 HydrophobicContact CD2-CD1 3.89Å; L251-L301 HydrophobicContact CD2-CG 4.41Å; W297-L301 WeakPolarHBondContact O-CG 3.49Å; W297-L301 PolarHBondContact O-N 2.67Å; L298-L301 PolarHBondContact O-N 3.05Å; L301-A303 VanDerWaalsContact C-N 3.33Å; L301-E304 PolarHBondContact O-N 3.47Å; L301-C305 VanDerWaalsContact O-CB 3.27Å; L301-C305 WeakPolarHBondContact O-CB 3.34Å; L301-C305 PolarHBondContact O-N 3.4Å
302	L	97.5	Very high	94.5	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-64.6	-39.4	173.7	-75.3	168.4	0	0	0	111.3	L248 L251 L252 F255 L298 F299 C305 M306 F322 M342 L345	L248-L302 HydrophobicContact CD1-CD2 3.93Å; L251-L302 HydrophobicContact CB-CD2 3.66Å; L251-L302 HydrophobicContact CB-CG 4.27Å; L251-L302 HydrophobicContact CD1-CD2 4.03Å; L251-L302 HydrophobicContact CD1-CG 4.39Å; L251-L302 HydrophobicContact CG-CD2 4.44Å; L252-L302 HydrophobicContact CD2-CD2 4.24Å; F255-L302 HydrophobicContact CE2-CD1 4.22Å; F255-L302 HydrophobicContact CZ-CD1 3.98Å; L298-L302 HydrophobicContact CD1-CD1 3.72Å; L298-L302 HydrophobicContact CD1-CG 3.96Å; L298-L302 HydrophobicContact CD2-CD1 4.47Å; L298-L302 HydrophobicContact CG-CD1 3.72Å; L298-L302 HydrophobicContact CG-CG 4.38Å; L298-L302 VanDerWaalsContact O-CB 3.31Å; L298-L302 WeakPolarHBondContact O-CB 3.41Å; L298-L302 VanDerWaalsContact O-CG 3.22Å; L298-L302 WeakPolarHBondContact O-CG 3.27Å; L298-L302 PolarHBondContact O-N 3.36Å; F299-L302 PolarHBondContact O-N 2.68Å; L302-C305 PolarHBondContact O-N 3.34Å; L302-M306 WeakPolarHBondContact O-CG 3.06Å; L302-M306 PolarHBondContact O-N 3.48Å; L302-F322 HydrophobicContact CB-CE2 4.15Å; L302-F322 HydrophobicContact CD1-CE2 4.09Å; L302-F322 HydrophobicContact CD2-CD2 3.96Å; L302-F322 HydrophobicContact CD2-CE2 4.14Å; L302-F322 HydrophobicContact CG-CE2 4.36Å; L302-M342 HydrophobicContact CD1-CE 4.18Å; L302-M342 HydrophobicContact CD1-SD 4Å; L302-L345 HydrophobicContact CB-CD2 4.06Å
303	A	96.7	Very high	94.4	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-63.2	-42.5	175	0	0	0	0	0	111.8	F299 D300 L301 M306 A307 L345 Y395	F299-A303 WeakPolarHBondContact O-CB 3.31Å; F299-A303 PolarHBondContact O-N 2.97Å; D300-A303 WeakPolarHBondContact O-CB 3.32Å; D300-A303 PolarHBondContact O-N 3.23Å; L301-A303 VanDerWaalsContact C-N 3.33Å; A303-M306 PolarHBondContact O-N 3.07Å; A303-A307 WeakPolarHBondContact O-CB 3.35Å; A303-A307 PolarHBondContact O-N 3.24Å; A303-L345 HydrophobicContact CB-CD1 4.13Å; A303-L345 HydrophobicContact CB-CD2 4.35Å; A303-Y395 HydrophobicContact CB-CD2 4.3Å; A303-Y395 HydrophobicContact CB-CE2 4.4Å
304	E	95.5	Very high	94.2	Very high	20 Å²	20	10.3 Å²	10.3	9%	0.093	6%	0.056	C	C	.	.	H	α-helix	trans	-61.5	-45.3	172.3	-73.2	-176.5	167.8	0	0	112.5	H202 V207 D300 L301 M306 A307 L308 K399	H202-E304 IonicContact CE1-OE2 2.8Å; H202-E304 IonicContact CG-OE2 3.72Å; H202-E304 WeakPolarHBondContact ND1-CB 3.03Å; H202-E304 IonicContact ND1-OE2 3.02Å; H202-E304 PolarHBondContact ND1-OE2 3.17Å; V207-E304 HydrophobicContact CG2-CB 3.73Å; V207-E304 HydrophobicContact CG2-CG 3.7Å; D300-E304 WeakPolarHBondContact O-CG 3.21Å; D300-E304 PolarHBondContact O-N 3.44Å; L301-E304 PolarHBondContact O-N 3.47Å; E304-M306 VanDerWaalsContact C-N 3.28Å; E304-M306 PolarHBondContact O-N 2.91Å; E304-A307 WeakPolarHBondContact O-CB 3.5Å; E304-A307 PolarHBondContact O-N 3.17Å; E304-L308 WeakPolarHBondContact O-CG 3.38Å; E304-L308 PolarHBondContact O-N 2.98Å; E304-K399 VanDerWaalsContact CD-NZ 3.31Å; E304-K399 IonicContact OE1-NZ 3.45Å; E304-K399 PolarHBondContact OE1-NZ 3.49Å
305	C	95.3	Very high	94.2	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-59	-40.4	179.3	-171.4	0	0	0	0	111.6	T247 L251 L301 L302 Y318	T247-C305 PolarHBondContact OG1-SG 3.01Å; T247-C305 VanDerWaalsContact OG1-SG 3.42Å; L251-C305 HydrophobicContact CD1-CB 3.96Å; L301-C305 VanDerWaalsContact O-CB 3.27Å; L301-C305 WeakPolarHBondContact O-CB 3.34Å; L301-C305 PolarHBondContact O-N 3.4Å; L302-C305 PolarHBondContact O-N 3.34Å; C305-Y318 PolarHBondContact SG-OH 3.36Å
306	M	95	Very high	94.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-69.8	-39.3	173	-65.3	-61.3	103.5	0	0	111.9	L248 L302 A303 E304 L308 H309 A310 F315 Y318 F322 V349 F391	L248-M306 HydrophobicContact CD1-CE 3.91Å; L248-M306 HydrophobicContact CD2-CE 4.07Å; L302-M306 WeakPolarHBondContact O-CG 3.06Å; L302-M306 PolarHBondContact O-N 3.48Å; A303-M306 PolarHBondContact O-N 3.07Å; E304-M306 VanDerWaalsContact C-N 3.28Å; E304-M306 PolarHBondContact O-N 2.91Å; M306-L308 VanDerWaalsContact C-N 3.34Å; M306-L308 PolarHBondContact O-N 3.18Å; M306-H309 PolarHBondContact O-N 3.32Å; M306-A310 WeakPolarHBondContact O-CB 3.31Å; M306-A310 PolarHBondContact O-N 2.88Å; M306-F315 HydrophobicContact CB-CE2 4.33Å; M306-F315 WeakPolarHBondContact O-CE2 3.24Å; M306-F315 HydrophobicContact SD-CE2 4.26Å; M306-F315 HydrophobicContact SD-CZ 4.39Å; M306-Y318 HydrophobicContact CE-CD1 4.17Å; M306-Y318 HydrophobicContact CE-CE1 3.64Å; M306-F322 HydrophobicContact CE-CB 4.1Å; M306-F322 HydrophobicContact CE-CG 4.29Å; M306-F322 HydrophobicContact SD-CB 4.31Å; M306-F322 HydrophobicContact SD-CD1 4.06Å; M306-F322 HydrophobicContact SD-CG 4.16Å; M306-V349 HydrophobicContact CB-CG2 4.2Å; M306-V349 HydrophobicContact CG-CG2 3.79Å; M306-V349 HydrophobicContact SD-CG1 4.05Å; M306-V349 HydrophobicContact SD-CG2 4.36Å; M306-F391 HydrophobicContact CB-CE2 3.94Å; M306-F391 HydrophobicContact CB-CZ 3.83Å
307	A	93.6	Very high	94.2	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.008	8%	0.075	C	C	.	.	H	α-helix	trans	-65.8	-33.5	179.9	0	0	0	0	0	113.3	P208 A303 E304 H309 A310 F391 W392 Y395	P208-A307 HydrophobicContact CG-CB 4.23Å; A303-A307 WeakPolarHBondContact O-CB 3.35Å; A303-A307 PolarHBondContact O-N 3.24Å; E304-A307 WeakPolarHBondContact O-CB 3.5Å; E304-A307 PolarHBondContact O-N 3.17Å; A307-H309 PolarHBondContact O-N 2.69Å; A307-A310 PolarHBondContact O-N 3.4Å; A307-F391 HydrophobicContact CB-CE1 4.13Å; A307-F391 HydrophobicContact CB-CZ 4.05Å; A307-W392 HydrophobicContact CB-CH2 4.29Å; A307-W392 HydrophobicContact CB-CZ3 4.12Å; A307-Y395 HydrophobicContact CB-CD1 4.38Å; A307-Y395 HydrophobicContact CB-CD2 3.81Å; A307-Y395 HydrophobicContact CB-CE1 4.06Å; A307-Y395 HydrophobicContact CB-CE2 3.45Å; A307-Y395 VanDerWaalsContact CB-CE2 3.45Å; A307-Y395 HydrophobicContact CB-CG 4.25Å
308	L	92.4	Very high	94.1	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-56.2	-36.2	175.7	-78.4	170	0	0	0	113.1	H202 A205 V207 A236 E304 M306	H202-L308 HydrophobicContact CB-CD1 4.35Å; A205-L308 HydrophobicContact CB-CD1 3.97Å; A205-L308 HydrophobicContact CB-CD2 3.56Å; A205-L308 HydrophobicContact CB-CG 4.42Å; V207-L308 VanDerWaalsContact CA-CD2 3.48Å; V207-L308 HydrophobicContact CB-CD2 3.98Å; V207-L308 HydrophobicContact CB-CG 4.42Å; A236-L308 HydrophobicContact CB-CD2 3.84Å; E304-L308 WeakPolarHBondContact O-CG 3.38Å; E304-L308 PolarHBondContact O-N 2.98Å; M306-L308 VanDerWaalsContact C-N 3.34Å; M306-L308 PolarHBondContact O-N 3.18Å
309	H	90.8	Very high	94.1	Very high	10 Å²	10	15.5 Å²	15.5	5%	0.046	8%	0.079	C	C	.	.	H	α-helix	trans	-113	6.8	-177.5	-64.6	-69.2	0	0	0	113.4	L244 M306 A307 N311 S312 F315 Y318	L244-H309 VanDerWaalsContact CD1-CE1 3.42Å; L244-H309 WeakPolarHBondContact CD1-CE1 3.47Å; L244-H309 VanDerWaalsContact CD1-NE2 3.27Å; L244-H309 WeakPolarHBondContact CD1-NE2 3.41Å; M306-H309 PolarHBondContact O-N 3.32Å; A307-H309 PolarHBondContact O-N 2.69Å; H309-N311 PolarHBondContact O-N 2.82Å; H309-S312 WeakPolarHBondContact O-CB 3.3Å; H309-S312 PolarHBondContact O-N 2.96Å; H309-F315 WeakPolarHBondContact O-CD2 3.24Å; H309-Y318 HydrophobicContact CB-CD1 3.74Å; H309-Y318 HydrophobicContact CB-CE1 3.89Å; H309-Y318 HydrophobicContact CB-CG 4.2Å; H309-Y318 AromaticContact CD2-CE1 3.57Å; H309-Y318 AromaticContact CD2-CE2 3.75Å; H309-Y318 AromaticContact CD2-CZ 3.33Å; H309-Y318 PolarHBondContact CD2-OH 3.23Å; H309-Y318 AromaticContact CG-CE1 3.99Å
310	A	92	Very high	94	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.6	-176.3	0	0	0	0	0	113.3	M306 A307 S312 F315 H352 I356 F391 W392	M306-A310 WeakPolarHBondContact O-CB 3.31Å; M306-A310 PolarHBondContact O-N 2.88Å; A307-A310 PolarHBondContact O-N 3.4Å; A310-S312 VanDerWaalsContact C-N 3.3Å; A310-F315 HydrophobicContact CB-CE2 4.38Å; A310-H352 PolarHBondContact O-NE2 2.69Å; A310-I356 WeakPolarHBondContact O-CD1 3.34Å; A310-F391 HydrophobicContact CB-CD1 3.92Å; A310-F391 HydrophobicContact CB-CE1 3.58Å; A310-W392 HydrophobicContact CB-CH2 3.98Å; A310-W392 HydrophobicContact CB-CZ2 3.55Å
311	N	89	Confident	94	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.016	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-8.7	176.1	-63.1	-24.5	0	0	0	113.1	L237 H309 E376 C379 T380 W392	L237-N311 WeakPolarHBondContact CA-ND2 3.5Å; L237-N311 WeakPolarHBondContact CD2-ND2 3.3Å; L237-N311 PolarHBondContact O-ND2 3.28Å; H309-N311 PolarHBondContact O-N 2.82Å; N311-E376 WeakPolarHBondContact O-CA 3.31Å; N311-E376 VanDerWaalsContact O-CB 3.22Å; N311-E376 WeakPolarHBondContact O-CB 3.49Å; N311-E376 WeakPolarHBondContact O-CG 3.46Å; N311-C379 HydrophobicContact CB-CB 4.11Å; N311-C379 WeakPolarHBondContact OD1-CB 3.41Å; N311-T380 WeakPolarHBondContact ND2-CG2 3.23Å; N311-W392 WeakPolarHBondContact OD1-CZ2 3.24Å; N311-W392 PolarHBondContact OD1-NE1 3.17Å
312	S	89.8	Confident	94	Very high	13 Å²	13	22.2 Å²	22.2	9%	0.091	12%	0.119	C	C	.	.			trans	-68.8	135.6	-177.3	-173.3	0	0	0	0	110.9	R242 H309 A310 V314 F315 E376	R242-S312 PolarHBondContact NH1-OG 3.33Å; H309-S312 WeakPolarHBondContact O-CB 3.3Å; H309-S312 PolarHBondContact O-N 2.96Å; A310-S312 VanDerWaalsContact C-N 3.3Å; S312-V314 PolarHBondContact O-N 3.08Å; S312-V314 VanDerWaalsContact O-N 3.16Å; S312-V314 PolarHBondContact OG-N 3.3Å; S312-F315 VanDerWaalsContact O-CB 3.3Å; S312-F315 WeakPolarHBondContact O-CB 3.49Å; S312-F315 PolarHBondContact O-N 3.18Å; S312-F315 VanDerWaalsContact O-N 3.09Å; S312-E376 WeakPolarHBondContact CA-OE1 3.04Å
313	I	90.2	Very high	94	Very high	19 Å²	19	22.8 Å²	22.8	10%	0.097	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-36.4	169.4	-165.7	168	0	0	0	109.7	F315 I356 R360 V363 I372 E376	I313-F315 VanDerWaalsContact C-N 3.27Å; I313-F315 PolarHBondContact O-N 2.79Å; I313-I356 VanDerWaalsContact O-CG2 3.26Å; I313-I356 WeakPolarHBondContact O-CG2 3.47Å; I313-R360 HydrophobicContact CD1-CG 4.05Å; I313-R360 HydrophobicContact CG1-CG 3.65Å; I313-R360 PolarHBondContact O-NE 3.07Å; I313-R360 PolarHBondContact O-NH2 2.9Å; I313-V363 HydrophobicContact CD1-CG2 4.33Å; I313-I372 HydrophobicContact CB-CG2 4.26Å; I313-I372 HydrophobicContact CD1-CG1 4.16Å; I313-I372 HydrophobicContact CD1-CG2 4.44Å; I313-I372 HydrophobicContact CG2-CG2 3.97Å; I313-E376 PolarHBondContact N-OE1 3.39Å
314	V	91.4	Very high	94	Very high	77 Å²	77	26.3 Å²	26.3	47%	0.467	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	2.5	-177.7	-168.7	0	0	0	0	114.3	S312 E317 Y318 R360	S312-V314 PolarHBondContact O-N 3.08Å; S312-V314 VanDerWaalsContact O-N 3.16Å; S312-V314 PolarHBondContact OG-N 3.3Å; V314-E317 HydrophobicContact CG1-CB 4.24Å; V314-E317 PolarHBondContact O-N 2.86Å; V314-E317 VanDerWaalsContact O-N 3.12Å; V314-Y318 PolarHBondContact O-N 3.47Å; V314-Y318 VanDerWaalsContact O-N 3.11Å; V314-R360 VanDerWaalsContact C-NH2 3.34Å
315	F	94.1	Very high	94	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-54.1	-40.4	-175.1	179.3	-95.6	0	0	0	115.3	M306 H309 A310 S312 I313 E317 Y318 S319 V349 H352 I356	M306-F315 HydrophobicContact CB-CE2 4.33Å; M306-F315 WeakPolarHBondContact O-CE2 3.24Å; M306-F315 HydrophobicContact SD-CE2 4.26Å; M306-F315 HydrophobicContact SD-CZ 4.39Å; H309-F315 WeakPolarHBondContact O-CD2 3.24Å; A310-F315 HydrophobicContact CB-CE2 4.38Å; S312-F315 VanDerWaalsContact O-CB 3.3Å; S312-F315 WeakPolarHBondContact O-CB 3.49Å; S312-F315 PolarHBondContact O-N 3.18Å; S312-F315 VanDerWaalsContact O-N 3.09Å; I313-F315 VanDerWaalsContact C-N 3.27Å; I313-F315 PolarHBondContact O-N 2.79Å; F315-E317 PolarHBondContact O-N 3.42Å; F315-Y318 PolarHBondContact O-N 2.98Å; F315-S319 WeakPolarHBondContact O-CB 3.37Å; F315-S319 PolarHBondContact O-N 3.48Å; F315-S319 PolarHBondContact O-OG 3.48Å; F315-V349 HydrophobicContact CE1-CG1 4.21Å; F315-V349 HydrophobicContact CZ-CG1 3.91Å; F315-H352 AromaticContact CD1-CD2 3.61Å; F315-H352 HydrophobicContact CE1-CB 4.07Å; F315-H352 AromaticContact CE1-CD2 3.38Å; F315-H352 WeakPolarHBondContact CE1-CD2 3.29Å; F315-H352 AromaticContact CZ-CD2 3.7Å; F315-I356 HydrophobicContact CB-CD1 3.46Å; F315-I356 VanDerWaalsContact CB-CD1 3.46Å; F315-I356 HydrophobicContact CD1-CD1 3.79Å; F315-I356 HydrophobicContact CG-CD1 3.84Å
316	P	95.2	Very high	94.1	Very high	11 Å²	11	28.2 Å²	28.2	7%	0.071	15%	0.152	C	C	.	.	H	α-helix	trans	-49.9	-47.6	171.3	-33.4	30.2	0	0	0	116.2	S319 L320 S353 I356 I357 R360	P316-S319 PolarHBondContact O-OG 3.2Å; P316-L320 PolarHBondContact O-N 2.8Å; P316-S353 WeakPolarHBondContact CA-OG 3.41Å; P316-I356 HydrophobicContact CG-CB 4.02Å; P316-I356 HydrophobicContact CG-CG2 3.79Å; P316-I357 HydrophobicContact CB-CD1 4.21Å; P316-I357 HydrophobicContact CB-CG1 4.03Å; P316-I357 HydrophobicContact CG-CD1 4.3Å; P316-I357 HydrophobicContact CG-CG1 3.69Å; P316-R360 VanDerWaalsContact CG-NH2 3.3Å
317	E	95.6	Very high	94.2	Very high	101 Å²	101	32.2 Å²	32.2	47%	0.472	17%	0.17	S	C	.	.	H	α-helix	trans	-72.2	-38.8	177.5	-64.4	72.8	-151.8	0	0	110.7	V314 F315 S319 L320 R360	V314-E317 HydrophobicContact CG1-CB 4.24Å; V314-E317 PolarHBondContact O-N 2.86Å; V314-E317 VanDerWaalsContact O-N 3.12Å; F315-E317 PolarHBondContact O-N 3.42Å; E317-S319 PolarHBondContact O-N 2.66Å; E317-L320 PolarHBondContact O-N 3.15Å; E317-R360 VanDerWaalsContact CD-NH1 3.33Å; E317-R360 IonicContact OE1-CZ 3.59Å; E317-R360 IonicContact OE1-NH1 2.69Å; E317-R360 PolarHBondContact OE1-NH1 3.43Å; E317-R360 IonicContact OE1-NH2 3.97Å; E317-R360 IonicContact OE2-CZ 3.33Å; E317-R360 IonicContact OE2-NH1 3.17Å; E317-R360 PolarHBondContact OE2-NH1 3.26Å; E317-R360 VanDerWaalsContact OE2-NH1 3.17Å; E317-R360 IonicContact OE2-NH2 3.56Å; E317-R360 PolarHBondContact OE2-NH2 3.33Å
318	Y	94.5	Very high	94.3	Very high	42 Å²	42	37.3 Å²	37.3	17%	0.165	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-40.1	178.5	-178.4	-99.9	0	0	0	113.4	L244 C305 M306 H309 V314 F315 L320 P321	L244-Y318 HydrophobicContact CD1-CE2 4.11Å; C305-Y318 PolarHBondContact SG-OH 3.36Å; M306-Y318 HydrophobicContact CE-CD1 4.17Å; M306-Y318 HydrophobicContact CE-CE1 3.64Å; H309-Y318 HydrophobicContact CB-CD1 3.74Å; H309-Y318 HydrophobicContact CB-CE1 3.89Å; H309-Y318 HydrophobicContact CB-CG 4.2Å; H309-Y318 AromaticContact CD2-CE1 3.57Å; H309-Y318 AromaticContact CD2-CE2 3.75Å; H309-Y318 AromaticContact CD2-CZ 3.33Å; H309-Y318 PolarHBondContact CD2-OH 3.23Å; H309-Y318 AromaticContact CG-CE1 3.99Å; V314-Y318 PolarHBondContact O-N 3.47Å; V314-Y318 VanDerWaalsContact O-N 3.11Å; F315-Y318 PolarHBondContact O-N 2.98Å; Y318-L320 VanDerWaalsContact C-N 3.33Å; Y318-P321 WeakPolarHBondContact O-CD 3.11Å
319	S	95.7	Very high	94.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-81.7	-10.1	-177.5	58.5	0	0	0	0	113.7	F315 P316 E317 F322 I323	F315-S319 WeakPolarHBondContact O-CB 3.37Å; F315-S319 PolarHBondContact O-N 3.48Å; F315-S319 PolarHBondContact O-OG 3.48Å; P316-S319 PolarHBondContact O-OG 3.2Å; E317-S319 PolarHBondContact O-N 2.66Å; S319-F322 WeakPolarHBondContact O-CB 3.12Å; S319-F322 PolarHBondContact O-N 3.05Å; S319-I323 WeakPolarHBondContact O-CG1 3.13Å; S319-I323 PolarHBondContact O-N 3.25Å
320	L	96.6	Very high	94.7	Very high	102 Å²	102	39.5 Å²	39.5	53%	0.534	20%	0.204	S	C	.	.	H	α-helix	trans	-62.3	-48.9	-175.6	179.6	64.7	0	0	0	113.3	P316 E317 Y318 F322 I323 T324	P316-L320 PolarHBondContact O-N 2.8Å; E317-L320 PolarHBondContact O-N 3.15Å; Y318-L320 VanDerWaalsContact C-N 3.33Å; L320-F322 VanDerWaalsContact C-N 3.27Å; L320-F322 PolarHBondContact O-N 3.45Å; L320-I323 PolarHBondContact O-N 3.35Å; L320-I323 VanDerWaalsContact O-N 3.12Å; L320-T324 PolarHBondContact O-N 3.5Å; L320-T324 PolarHBondContact O-OG1 2.92Å
321	P	96.5	Very high	94.8	Very high	65 Å²	65	47 Å²	47	42%	0.422	24%	0.239	S	C	.	.	H	α-helix	trans	-57.9	-41	177.2	-24.3	34.9	0	0	0	112.3	L248 L252 Y318 I323 T324 E325	L248-P321 HydrophobicContact CD2-CB 4.45Å; L252-P321 HydrophobicContact CD1-CB 4.18Å; Y318-P321 WeakPolarHBondContact O-CD 3.11Å; P321-I323 PolarHBondContact O-N 2.73Å; P321-T324 PolarHBondContact O-N 3.14Å; P321-E325 WeakPolarHBondContact O-CG 3.13Å; P321-E325 PolarHBondContact O-N 2.68Å
322	F	97.2	Very high	95	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-46.9	175.3	167.3	-99.9	0	0	0	112.3	L248 L252 L302 M306 S319 L320 T324 V326 L345 M346 V349	L248-F322 HydrophobicContact CD1-CB 4.11Å; L248-F322 HydrophobicContact CD2-CB 4.28Å; L252-F322 HydrophobicContact CD2-CD2 4.32Å; L302-F322 HydrophobicContact CB-CE2 4.15Å; L302-F322 HydrophobicContact CD1-CE2 4.09Å; L302-F322 HydrophobicContact CD2-CD2 3.96Å; L302-F322 HydrophobicContact CD2-CE2 4.14Å; L302-F322 HydrophobicContact CG-CE2 4.36Å; M306-F322 HydrophobicContact CE-CB 4.1Å; M306-F322 HydrophobicContact CE-CG 4.29Å; M306-F322 HydrophobicContact SD-CB 4.31Å; M306-F322 HydrophobicContact SD-CD1 4.06Å; M306-F322 HydrophobicContact SD-CG 4.16Å; S319-F322 WeakPolarHBondContact O-CB 3.12Å; S319-F322 PolarHBondContact O-N 3.05Å; L320-F322 VanDerWaalsContact C-N 3.27Å; L320-F322 PolarHBondContact O-N 3.45Å; F322-T324 VanDerWaalsContact C-N 3.31Å; F322-T324 PolarHBondContact O-N 2.94Å; F322-V326 HydrophobicContact CD2-CG2 3.83Å; F322-V326 HydrophobicContact CE1-CG2 4.45Å; F322-V326 HydrophobicContact CE2-CG2 3.46Å; F322-V326 VanDerWaalsContact CE2-CG2 3.46Å; F322-V326 HydrophobicContact CG-CG2 4.47Å; F322-V326 HydrophobicContact CZ-CG2 3.79Å; F322-V326 WeakPolarHBondContact O-CB 3.49Å; F322-V326 VanDerWaalsContact O-CG2 3.29Å; F322-V326 WeakPolarHBondContact O-CG2 3.32Å; F322-V326 PolarHBondContact O-N 3.47Å; F322-L345 HydrophobicContact CE1-CG 4.45Å; F322-L345 HydrophobicContact CE2-CD2 4.15Å; F322-L345 HydrophobicContact CZ-CD2 3.73Å; F322-L345 HydrophobicContact CZ-CG 3.79Å; F322-M346 HydrophobicContact CE1-CB 4.4Å; F322-V349 HydrophobicContact CD1-CB 4.38Å; F322-V349 HydrophobicContact CD1-CG1 3.89Å; F322-V349 HydrophobicContact CD1-CG2 4.43Å; F322-V349 HydrophobicContact CE1-CB 3.96Å; F322-V349 HydrophobicContact CE1-CG1 3.98Å; F322-V349 HydrophobicContact CE1-CG2 3.83Å
323	I	97.3	Very high	95.2	Very high	13 Å²	13	50.5 Å²	50.5	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-40.1	-179.7	-67.6	166.5	0	0	0	110.8	S319 L320 P321 K327 M346 V349 R350	S319-I323 WeakPolarHBondContact O-CG1 3.13Å; S319-I323 PolarHBondContact O-N 3.25Å; L320-I323 PolarHBondContact O-N 3.35Å; L320-I323 VanDerWaalsContact O-N 3.12Å; P321-I323 PolarHBondContact O-N 2.73Å; I323-K327 HydrophobicContact CG2-CD 4.42Å; I323-K327 VanDerWaalsContact O-CG 3.27Å; I323-K327 WeakPolarHBondContact O-CG 3.29Å; I323-K327 PolarHBondContact O-N 2.93Å; I323-K327 VanDerWaalsContact O-N 3.11Å; I323-M346 HydrophobicContact CG2-CG 4.48Å; I323-V349 HydrophobicContact CD1-CG1 4.32Å; I323-V349 HydrophobicContact CG1-CG1 4.26Å; I323-R350 HydrophobicContact CD1-CB 4.49Å
324	T	96.6	Very high	95.3	Very high	73 Å²	73	60.2 Å²	60.2	45%	0.448	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-51.6	179.8	-60.7	0	0	0	0	111.5	L320 P321 F322 V326 K327 Q328	L320-T324 PolarHBondContact O-N 3.5Å; L320-T324 PolarHBondContact O-OG1 2.92Å; P321-T324 PolarHBondContact O-N 3.14Å; F322-T324 VanDerWaalsContact C-N 3.31Å; F322-T324 PolarHBondContact O-N 2.94Å; T324-V326 PolarHBondContact O-N 2.91Å; T324-K327 WeakPolarHBondContact O-CB 3.36Å; T324-K327 PolarHBondContact O-N 3.41Å; T324-Q328 PolarHBondContact O-N 3.2Å; T324-Q328 VanDerWaalsContact O-N 3.07Å
325	E	96.2	Very high	95.4	Very high	60 Å²	60	59 Å²	59	28%	0.28	29%	0.288	S	S	.	.	H	α-helix	trans	-63.5	-40.7	180	-72.8	-54.3	124.7	0	0	112.2	L252 P321 K327 Q328 F329	L252-E325 HydrophobicContact CB-CG 4.37Å; L252-E325 HydrophobicContact CD1-CB 4.35Å; L252-E325 HydrophobicContact CD1-CG 3.95Å; L252-E325 HydrophobicContact CD2-CB 3.91Å; L252-E325 HydrophobicContact CD2-CG 4.34Å; L252-E325 HydrophobicContact CG-CG 4.43Å; P321-E325 WeakPolarHBondContact O-CG 3.13Å; P321-E325 PolarHBondContact O-N 2.68Å; E325-K327 PolarHBondContact O-N 3.33Å; E325-Q328 WeakPolarHBondContact O-CB 3.33Å; E325-Q328 PolarHBondContact O-N 3.32Å; E325-F329 WeakPolarHBondContact O-CB 3.2Å; E325-F329 PolarHBondContact O-N 3.18Å
326	V	96.5	Very high	95.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-37.2	176.9	171.6	0	0	0	0	111.8	F255 F322 T324 Q328 F329 L330 M342 M346	F255-V326 HydrophobicContact CE2-CG2 4.17Å; F255-V326 HydrophobicContact CZ-CG2 4.19Å; F322-V326 HydrophobicContact CD2-CG2 3.83Å; F322-V326 HydrophobicContact CE1-CG2 4.45Å; F322-V326 HydrophobicContact CE2-CG2 3.46Å; F322-V326 VanDerWaalsContact CE2-CG2 3.46Å; F322-V326 HydrophobicContact CG-CG2 4.47Å; F322-V326 HydrophobicContact CZ-CG2 3.79Å; F322-V326 WeakPolarHBondContact O-CB 3.49Å; F322-V326 VanDerWaalsContact O-CG2 3.29Å; F322-V326 WeakPolarHBondContact O-CG2 3.32Å; F322-V326 PolarHBondContact O-N 3.47Å; T324-V326 PolarHBondContact O-N 2.91Å; V326-Q328 VanDerWaalsContact C-N 3.31Å; V326-Q328 PolarHBondContact O-N 2.97Å; V326-F329 PolarHBondContact O-N 3.5Å; V326-L330 HydrophobicContact CG1-CD1 4.01Å; V326-L330 HydrophobicContact CG1-CG 4.21Å; V326-L330 WeakPolarHBondContact O-CB 3.47Å; V326-L330 WeakPolarHBondContact O-CG 3.34Å; V326-L330 PolarHBondContact O-N 3.32Å; V326-M342 HydrophobicContact CB-CG 4.36Å; V326-M342 HydrophobicContact CG1-CB 4.34Å; V326-M342 HydrophobicContact CG1-CG 3.53Å; V326-M342 HydrophobicContact CG2-CG 3.9Å; V326-M342 HydrophobicContact CG2-SD 4.27Å; V326-M346 HydrophobicContact CB-SD 4.22Å; V326-M346 HydrophobicContact CG1-CB 3.83Å; V326-M346 HydrophobicContact CG1-CG 4.16Å; V326-M346 HydrophobicContact CG1-SD 3.82Å
327	K	96.8	Very high	95.3	Very high	85 Å²	85	64.2 Å²	64.2	37%	0.37	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-47.1	172.2	-78	171.5	-179.2	174.6	0	110.7	I323 T324 E325 F329 L330 H331 M346	I323-K327 HydrophobicContact CG2-CD 4.42Å; I323-K327 VanDerWaalsContact O-CG 3.27Å; I323-K327 WeakPolarHBondContact O-CG 3.29Å; I323-K327 PolarHBondContact O-N 2.93Å; I323-K327 VanDerWaalsContact O-N 3.11Å; T324-K327 WeakPolarHBondContact O-CB 3.36Å; T324-K327 PolarHBondContact O-N 3.41Å; E325-K327 PolarHBondContact O-N 3.33Å; K327-F329 PolarHBondContact O-N 3.36Å; K327-L330 PolarHBondContact O-N 3.2Å; K327-L330 VanDerWaalsContact O-N 3.17Å; K327-H331 PolarHBondContact O-CD2 3.18Å; K327-H331 PolarHBondContact O-N 2.98Å; K327-H331 VanDerWaalsContact O-N 3.11Å; K327-M346 HydrophobicContact CG-SD 3.75Å
328	Q	95.9	Very high	95.2	Very high	108 Å²	108	60.2 Å²	60.2	51%	0.505	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-46	178.8	-175.1	60.3	15.3	0	0	111.3	T324 E325 V326 L330 H331 V332	T324-Q328 PolarHBondContact O-N 3.2Å; T324-Q328 VanDerWaalsContact O-N 3.07Å; E325-Q328 WeakPolarHBondContact O-CB 3.33Å; E325-Q328 PolarHBondContact O-N 3.32Å; V326-Q328 VanDerWaalsContact C-N 3.31Å; V326-Q328 PolarHBondContact O-N 2.97Å; Q328-L330 VanDerWaalsContact C-N 3.3Å; Q328-L330 PolarHBondContact O-N 3.47Å; Q328-H331 WeakPolarHBondContact O-CB 3.47Å; Q328-H331 PolarHBondContact O-N 3.28Å; Q328-V332 WeakPolarHBondContact O-CG2 3.34Å; Q328-V332 PolarHBondContact O-N 2.96Å; Q328-V332 VanDerWaalsContact O-N 3.08Å
329	F	95.5	Very high	95.3	Very high	16 Å²	16	59.2 Å²	59.2	7%	0.07	32%	0.316	C	S	.	.	H	α-helix	trans	-56.4	-42.6	173.7	172.6	-104	0	0	0	112.5	F255 F260 I295 E325 V326 K327 H331 V332 C333 F338 M342	F255-F329 HydrophobicContact CD1-CB 4.12Å; F255-F329 HydrophobicContact CD1-CD1 4.39Å; F255-F329 AromaticContact CD1-CD2 3.4Å; F255-F329 HydrophobicContact CD1-CD2 3.4Å; F255-F329 AromaticContact CD1-CE2 3.84Å; F255-F329 HydrophobicContact CD1-CE2 3.84Å; F255-F329 AromaticContact CD1-CG 3.71Å; F255-F329 HydrophobicContact CD1-CG 3.71Å; F255-F329 HydrophobicContact CD1-CZ 4.48Å; F255-F329 HydrophobicContact CE1-CB 4.25Å; F255-F329 AromaticContact CE1-CD1 3.94Å; F255-F329 HydrophobicContact CE1-CD1 3.94Å; F255-F329 AromaticContact CE1-CD2 3.78Å; F255-F329 HydrophobicContact CE1-CD2 3.78Å; F255-F329 HydrophobicContact CE1-CE1 4.21Å; F255-F329 HydrophobicContact CE1-CE2 4.05Å; F255-F329 AromaticContact CE1-CG 3.71Å; F255-F329 HydrophobicContact CE1-CG 3.71Å; F255-F329 HydrophobicContact CE1-CZ 4.25Å; F255-F329 HydrophobicContact CG-CB 4.43Å; F255-F329 HydrophobicContact CG-CD2 4.27Å; F255-F329 HydrophobicContact CG-CG 4.47Å; F255-F329 HydrophobicContact CZ-CG 4.48Å; F260-F329 HydrophobicContact CB-CE2 4.27Å; F260-F329 AromaticContact CD2-CE2 3.59Å; F260-F329 HydrophobicContact CD2-CE2 3.59Å; F260-F329 HydrophobicContact CD2-CZ 4.29Å; F260-F329 HydrophobicContact CE2-CE2 4.18Å; F260-F329 HydrophobicContact CG-CE2 4.09Å; F260-F329 HydrophobicContact CG-CZ 4.47Å; I295-F329 HydrophobicContact CD1-CZ 4.16Å; E325-F329 WeakPolarHBondContact O-CB 3.2Å; E325-F329 PolarHBondContact O-N 3.18Å; V326-F329 PolarHBondContact O-N 3.5Å; K327-F329 PolarHBondContact O-N 3.36Å; F329-H331 VanDerWaalsContact C-N 3.26Å; F329-H331 PolarHBondContact O-N 2.88Å; F329-V332 PolarHBondContact O-N 3.25Å; F329-C333 HydrophobicContact CD1-CB 4.49Å; F329-C333 HydrophobicContact CD2-CB 4.01Å; F329-C333 HydrophobicContact CE1-CB 4.13Å; F329-C333 HydrophobicContact CE2-CB 3.6Å; F329-C333 HydrophobicContact CG-CB 4.45Å; F329-C333 HydrophobicContact CZ-CB 3.67Å; F329-C333 WeakPolarHBondContact O-CB 3.48Å; F329-C333 PolarHBondContact O-N 2.95Å; F329-F338 HydrophobicContact CZ-CB 4.34Å; F329-M342 HydrophobicContact CD1-CB 4.34Å; F329-M342 HydrophobicContact CD1-CG 4.2Å; F329-M342 HydrophobicContact CE1-CB 4.16Å; F329-M342 HydrophobicContact CE1-CG 4.35Å
330	L	95.5	Very high	95.3	Very high	41 Å²	41	69 Å²	69	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-67.5	-23.6	178.1	-68.9	172.3	0	0	0	113.5	V326 K327 Q328 C339 K343 M346	V326-L330 HydrophobicContact CG1-CD1 4.01Å; V326-L330 HydrophobicContact CG1-CG 4.21Å; V326-L330 WeakPolarHBondContact O-CB 3.47Å; V326-L330 WeakPolarHBondContact O-CG 3.34Å; V326-L330 PolarHBondContact O-N 3.32Å; K327-L330 PolarHBondContact O-N 3.2Å; K327-L330 VanDerWaalsContact O-N 3.17Å; Q328-L330 VanDerWaalsContact C-N 3.3Å; Q328-L330 PolarHBondContact O-N 3.47Å; L330-C339 HydrophobicContact CD2-CB 3.68Å; L330-C339 VanDerWaalsContact CD2-O 3.3Å; L330-C339 WeakPolarHBondContact CD2-O 3.37Å; L330-K343 HydrophobicContact CD1-CB 3.91Å; L330-K343 HydrophobicContact CD1-CG 4.18Å; L330-K343 HydrophobicContact CD2-CB 4.07Å; L330-M346 HydrophobicContact CD1-CE 3.58Å; L330-M346 HydrophobicContact CD1-SD 4.24Å
331	H	95	Very high	95.1	Very high	158 Å²	158	68.2 Å²	68.2	73%	0.731	35%	0.347	S	S	*	.	H	α-helix	trans	-79.4	-34.5	172.2	-74.1	-67.5	0	0	0	112.4	K327 Q328 F329	K327-H331 PolarHBondContact O-CD2 3.18Å; K327-H331 PolarHBondContact O-N 2.98Å; K327-H331 VanDerWaalsContact O-N 3.11Å; Q328-H331 WeakPolarHBondContact O-CB 3.47Å; Q328-H331 PolarHBondContact O-N 3.28Å; F329-H331 VanDerWaalsContact C-N 3.26Å; F329-H331 PolarHBondContact O-N 2.88Å
332	V	94	Very high	95.1	Very high	80 Å²	80	65.1 Å²	65.1	49%	0.485	33%	0.327	S	S	.	.	H	α-helix	trans	-87.1	-40.4	-176.2	176.3	0	0	0	0	112.6	N261 Q328 F329	N261-V332 PolarHBondContact ND2-O 2.92Å; Q328-V332 WeakPolarHBondContact O-CG2 3.34Å; Q328-V332 PolarHBondContact O-N 2.96Å; Q328-V332 VanDerWaalsContact O-N 3.08Å; F329-V332 PolarHBondContact O-N 3.25Å
333	C	93.8	Very high	95.1	Very high	9 Å²	9	71.1 Å²	71.1	6%	0.061	35%	0.353	C	S	.	.			trans	-80.1	126.6	-175	-173.7	0	0	0	0	111.8	F329 C339	F329-C333 HydrophobicContact CD1-CB 4.49Å; F329-C333 HydrophobicContact CD2-CB 4.01Å; F329-C333 HydrophobicContact CE1-CB 4.13Å; F329-C333 HydrophobicContact CE2-CB 3.6Å; F329-C333 HydrophobicContact CG-CB 4.45Å; F329-C333 HydrophobicContact CZ-CB 3.67Å; F329-C333 WeakPolarHBondContact O-CB 3.48Å; F329-C333 PolarHBondContact O-N 2.95Å; C333-C339 PolarHBondContact O-SG 3.46Å; C333-C339 VanDerWaalsContact SG-SG 3.69Å
334	R	92.5	Very high	95	Very high	223 Å²	223	72.4 Å²	72.4	84%	0.842	37%	0.365	S	S	*	.			trans	-97.9	-7.5	-179	-59.8	-178.7	-179.2	174.9	0.2	112.9	N261 A336	N261-R334 PolarHBondContact OD1-N 3.44Å; R334-A336 PolarHBondContact O-N 3.2Å
335	V	93.1	Very high	95	Very high	52 Å²	52	68.9 Å²	68.9	32%	0.315	34%	0.344	S	S	.	.			trans	-81.1	104.5	-177.8	-175.6	0	0	0	0	110	F260 G337 F338 C339	F260-V335 WeakPolarHBondContact O-CG2 3.44Å; V335-G337 VanDerWaalsContact C-N 3.27Å; V335-G337 PolarHBondContact O-N 3.5Å; V335-G337 VanDerWaalsContact O-N 3.17Å; V335-F338 HydrophobicContact CB-CB 4.4Å; V335-F338 HydrophobicContact CB-CD2 3.56Å; V335-F338 HydrophobicContact CB-CE2 3.97Å; V335-F338 HydrophobicContact CB-CG 4.03Å; V335-F338 HydrophobicContact CG1-CB 4.47Å; V335-F338 HydrophobicContact CG1-CD1 4.1Å; V335-F338 HydrophobicContact CG1-CD2 3.58Å; V335-F338 HydrophobicContact CG1-CE1 4.19Å; V335-F338 HydrophobicContact CG1-CE2 3.71Å; V335-F338 HydrophobicContact CG1-CG 3.79Å; V335-F338 HydrophobicContact CG1-CZ 4.02Å; V335-F338 HydrophobicContact CG2-CD2 4.08Å; V335-F338 HydrophobicContact CG2-CE2 4.12Å; V335-F338 PolarHBondContact O-N 3.43Å; V335-F338 VanDerWaalsContact O-N 3.14Å; V335-C339 PolarHBondContact O-N 2.82Å; V335-C339 VanDerWaalsContact O-N 3.08Å; V335-C339 PolarHBondContact O-SG 3.36Å; V335-C339 VanDerWaalsContact O-SG 3.41Å
336	A	93.4	Very high	95.1	Very high	78 Å²	78	66.8 Å²	66.8	65%	0.645	33%	0.334	S	S	*	.	H	α-helix	trans	-56.5	-35.8	-173.1	0	0	0	0	0	114.2	R334 R340	R334-A336 PolarHBondContact O-N 3.2Å; A336-R340 VanDerWaalsContact O-CB 3.23Å; A336-R340 WeakPolarHBondContact O-CB 3.25Å; A336-R340 PolarHBondContact O-N 2.89Å
337	G	92.2	Very high	95.1	Very high	42 Å²	42	69.5 Å²	69.5	43%	0.433	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-47.8	178	0	0	0	0	0	112.4	V335 R340 Q341	V335-G337 VanDerWaalsContact C-N 3.27Å; V335-G337 PolarHBondContact O-N 3.5Å; V335-G337 VanDerWaalsContact O-N 3.17Å; G337-R340 PolarHBondContact O-N 3.49Å; G337-Q341 PolarHBondContact O-N 3.42Å
338	F	94.6	Very high	95.1	Very high	17 Å²	17	68.2 Å²	68.2	8%	0.075	35%	0.345	C	S	.	.	H	α-helix	trans	-68	-46.9	-179.5	-55.4	-14.8	0	0	0	110.7	F260 N291 D292 I295 F329 V335 R340 Q341 M342	F260-F338 HydrophobicContact CB-CD2 4.08Å; F260-F338 HydrophobicContact CB-CE2 4.32Å; F260-F338 HydrophobicContact CD1-CD2 4.05Å; F260-F338 HydrophobicContact CD1-CE2 4.05Å; F260-F338 HydrophobicContact CG-CD2 4.42Å; N291-F338 HydrophobicContact CB-CE2 4.41Å; N291-F338 HydrophobicContact CB-CZ 4.32Å; D292-F338 WeakPolarHBondContact OD1-CE1 3.3Å; D292-F338 VanDerWaalsContact OD1-CZ 3.25Å; D292-F338 WeakPolarHBondContact OD1-CZ 3.44Å; I295-F338 HydrophobicContact CB-CD1 4.3Å; I295-F338 HydrophobicContact CB-CG 4.44Å; I295-F338 HydrophobicContact CD1-CB 4.47Å; I295-F338 HydrophobicContact CG1-CB 4.01Å; I295-F338 HydrophobicContact CG1-CD1 4.16Å; I295-F338 HydrophobicContact CG1-CG 4.04Å; I295-F338 HydrophobicContact CG2-CD1 3.55Å; I295-F338 HydrophobicContact CG2-CE1 3.6Å; I295-F338 HydrophobicContact CG2-CG 4.17Å; I295-F338 HydrophobicContact CG2-CZ 4.22Å; F329-F338 HydrophobicContact CZ-CB 4.34Å; V335-F338 HydrophobicContact CB-CB 4.4Å; V335-F338 HydrophobicContact CB-CD2 3.56Å; V335-F338 HydrophobicContact CB-CE2 3.97Å; V335-F338 HydrophobicContact CB-CG 4.03Å; V335-F338 HydrophobicContact CG1-CB 4.47Å; V335-F338 HydrophobicContact CG1-CD1 4.1Å; V335-F338 HydrophobicContact CG1-CD2 3.58Å; V335-F338 HydrophobicContact CG1-CE1 4.19Å; V335-F338 HydrophobicContact CG1-CE2 3.71Å; V335-F338 HydrophobicContact CG1-CG 3.79Å; V335-F338 HydrophobicContact CG1-CZ 4.02Å; V335-F338 HydrophobicContact CG2-CD2 4.08Å; V335-F338 HydrophobicContact CG2-CE2 4.12Å; V335-F338 PolarHBondContact O-N 3.43Å; V335-F338 VanDerWaalsContact O-N 3.14Å; F338-R340 VanDerWaalsContact C-N 3.32Å; F338-R340 PolarHBondContact O-N 2.92Å; F338-Q341 PolarHBondContact O-N 3.21Å; F338-M342 PolarHBondContact O-N 3.48Å
339	C	96	Very high	95.1	Very high	21 Å²	21	63 Å²	63	14%	0.142	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-38.8	179.2	-63.7	0	0	0	0	112.1	L330 C333 V335 K343	L330-C339 HydrophobicContact CD2-CB 3.68Å; L330-C339 VanDerWaalsContact CD2-O 3.3Å; L330-C339 WeakPolarHBondContact CD2-O 3.37Å; C333-C339 PolarHBondContact O-SG 3.46Å; C333-C339 VanDerWaalsContact SG-SG 3.69Å; V335-C339 PolarHBondContact O-N 2.82Å; V335-C339 VanDerWaalsContact O-N 3.08Å; V335-C339 PolarHBondContact O-SG 3.36Å; V335-C339 VanDerWaalsContact O-SG 3.41Å; C339-K343 WeakPolarHBondContact O-CB 3.47Å; C339-K343 PolarHBondContact O-N 3.48Å
340	R	95.8	Very high	95.1	Very high	206 Å²	206	66.7 Å²	66.7	78%	0.777	33%	0.334	S	S	*	.	H	α-helix	trans	-63.1	-45.5	178.6	-179.5	178.1	174.1	171.2	-1.2	112	A336 G337 F338 A344	A336-R340 VanDerWaalsContact O-CB 3.23Å; A336-R340 WeakPolarHBondContact O-CB 3.25Å; A336-R340 PolarHBondContact O-N 2.89Å; G337-R340 PolarHBondContact O-N 3.49Å; F338-R340 VanDerWaalsContact C-N 3.32Å; F338-R340 PolarHBondContact O-N 2.92Å; R340-A344 WeakPolarHBondContact O-CB 3.37Å; R340-A344 PolarHBondContact O-N 3.01Å; R340-A344 VanDerWaalsContact O-N 3.17Å
341	Q	93.6	Very high	95.1	Very high	86 Å²	86	67.9 Å²	67.9	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-53.1	178.7	-69.8	176.8	-4.5	0	0	110.3	F299 G337 F338 K343 A344 L345	F299-Q341 HydrophobicContact CD2-CB 4.19Å; F299-Q341 HydrophobicContact CE2-CB 4.17Å; F299-Q341 VanDerWaalsContact CE2-O 3.28Å; F299-Q341 WeakPolarHBondContact CE2-O 3.18Å; G337-Q341 PolarHBondContact O-N 3.42Å; F338-Q341 PolarHBondContact O-N 3.21Å; Q341-K343 VanDerWaalsContact C-N 3.35Å; Q341-K343 PolarHBondContact O-N 2.97Å; Q341-A344 WeakPolarHBondContact O-CB 3.17Å; Q341-A344 PolarHBondContact O-N 2.97Å; Q341-L345 PolarHBondContact O-N 3.03Å
342	M	96.2	Very high	95.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-38.3	-176	-153.5	60.1	69.7	0	0	112.6	F255 I295 F299 L302 V326 F329 F338 A344 L345 M346	F255-M342 HydrophobicContact CE1-CE 4.06Å; F255-M342 HydrophobicContact CZ-CE 3.91Å; F255-M342 HydrophobicContact CZ-CG 4.34Å; F255-M342 HydrophobicContact CZ-SD 4.15Å; I295-M342 HydrophobicContact CD1-CE 3.71Å; F299-M342 HydrophobicContact CB-CE 4.36Å; F299-M342 HydrophobicContact CD2-CE 4.46Å; F299-M342 HydrophobicContact CD2-SD 4.32Å; L302-M342 HydrophobicContact CD1-CE 4.18Å; L302-M342 HydrophobicContact CD1-SD 4Å; V326-M342 HydrophobicContact CB-CG 4.36Å; V326-M342 HydrophobicContact CG1-CB 4.34Å; V326-M342 HydrophobicContact CG1-CG 3.53Å; V326-M342 HydrophobicContact CG2-CG 3.9Å; V326-M342 HydrophobicContact CG2-SD 4.27Å; F329-M342 HydrophobicContact CD1-CB 4.34Å; F329-M342 HydrophobicContact CD1-CG 4.2Å; F329-M342 HydrophobicContact CE1-CB 4.16Å; F329-M342 HydrophobicContact CE1-CG 4.35Å; F338-M342 PolarHBondContact O-N 3.48Å; M342-A344 VanDerWaalsContact C-N 3.32Å; M342-A344 PolarHBondContact O-N 2.75Å; M342-L345 PolarHBondContact O-N 2.98Å; M342-M346 WeakPolarHBondContact O-CB 3.43Å; M342-M346 PolarHBondContact O-N 2.91Å
343	K	96.9	Very high	95.1	Very high	125 Å²	125	57.2 Å²	57.2	54%	0.543	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-36.8	173.9	-173.8	172.5	-177.4	173.4	0	112.4	L330 C339 Q341 M346 T347	L330-K343 HydrophobicContact CD1-CB 3.91Å; L330-K343 HydrophobicContact CD1-CG 4.18Å; L330-K343 HydrophobicContact CD2-CB 4.07Å; C339-K343 WeakPolarHBondContact O-CB 3.47Å; C339-K343 PolarHBondContact O-N 3.48Å; Q341-K343 VanDerWaalsContact C-N 3.35Å; Q341-K343 PolarHBondContact O-N 2.97Å; K343-M346 HydrophobicContact CG-CE 4.43Å; K343-T347 WeakPolarHBondContact O-CB 3.31Å; K343-T347 PolarHBondContact O-N 3.15Å; K343-T347 PolarHBondContact O-OG1 3.21Å
344	A	95.9	Very high	95.2	Very high	40 Å²	40	61.3 Å²	61.3	33%	0.331	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-46.2	177.9	0	0	0	0	0	111.7	R340 Q341 M342 T347 K348 F394	R340-A344 WeakPolarHBondContact O-CB 3.37Å; R340-A344 PolarHBondContact O-N 3.01Å; R340-A344 VanDerWaalsContact O-N 3.17Å; Q341-A344 WeakPolarHBondContact O-CB 3.17Å; Q341-A344 PolarHBondContact O-N 2.97Å; M342-A344 VanDerWaalsContact C-N 3.32Å; M342-A344 PolarHBondContact O-N 2.75Å; A344-T347 PolarHBondContact O-N 3.05Å; A344-K348 WeakPolarHBondContact O-CG 3.39Å; A344-K348 PolarHBondContact O-N 2.84Å; A344-F394 HydrophobicContact CB-CE2 4.21Å
345	L	96.7	Very high	95.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-49.6	175.2	174.6	64	0	0	0	111.4	F299 L302 A303 F322 Q341 M342 T347 K348 V349 F391 F394	F299-L345 HydrophobicContact CD2-CB 4.29Å; F299-L345 HydrophobicContact CD2-CD2 4.18Å; F299-L345 HydrophobicContact CE2-CB 3.57Å; F299-L345 HydrophobicContact CE2-CD2 4.17Å; F299-L345 HydrophobicContact CE2-CG 4.45Å; F299-L345 HydrophobicContact CZ-CB 4.27Å; L302-L345 HydrophobicContact CB-CD2 4.06Å; A303-L345 HydrophobicContact CB-CD1 4.13Å; A303-L345 HydrophobicContact CB-CD2 4.35Å; F322-L345 HydrophobicContact CE1-CG 4.45Å; F322-L345 HydrophobicContact CE2-CD2 4.15Å; F322-L345 HydrophobicContact CZ-CD2 3.73Å; F322-L345 HydrophobicContact CZ-CG 3.79Å; Q341-L345 PolarHBondContact O-N 3.03Å; M342-L345 PolarHBondContact O-N 2.98Å; L345-T347 VanDerWaalsContact C-N 3.28Å; L345-T347 PolarHBondContact O-N 3.43Å; L345-K348 PolarHBondContact O-N 3.38Å; L345-K348 VanDerWaalsContact O-N 3.09Å; L345-V349 HydrophobicContact CD1-CG2 3.94Å; L345-V349 HydrophobicContact CG-CG2 4.28Å; L345-V349 WeakPolarHBondContact O-CG2 3.44Å; L345-V349 PolarHBondContact O-N 3.35Å; L345-F391 HydrophobicContact CD1-CE2 4.35Å; L345-F394 HydrophobicContact CB-CE1 4.19Å; L345-F394 HydrophobicContact CB-CZ 4.12Å; L345-F394 HydrophobicContact CD1-CD1 4.38Å; L345-F394 HydrophobicContact CD1-CE1 3.69Å; L345-F394 HydrophobicContact CD1-CZ 4.47Å
346	M	97.1	Very high	95.1	Very high	15 Å²	15	51.5 Å²	51.5	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-56.1	-41.2	178.5	-177.7	-170.2	61.6	0	0	112.7	F322 I323 V326 K327 L330 M342 K343 K348 V349 R350	F322-M346 HydrophobicContact CE1-CB 4.4Å; I323-M346 HydrophobicContact CG2-CG 4.48Å; V326-M346 HydrophobicContact CB-SD 4.22Å; V326-M346 HydrophobicContact CG1-CB 3.83Å; V326-M346 HydrophobicContact CG1-CG 4.16Å; V326-M346 HydrophobicContact CG1-SD 3.82Å; K327-M346 HydrophobicContact CG-SD 3.75Å; L330-M346 HydrophobicContact CD1-CE 3.58Å; L330-M346 HydrophobicContact CD1-SD 4.24Å; M342-M346 WeakPolarHBondContact O-CB 3.43Å; M342-M346 PolarHBondContact O-N 2.91Å; K343-M346 HydrophobicContact CG-CE 4.43Å; M346-K348 VanDerWaalsContact C-N 3.34Å; M346-K348 PolarHBondContact O-N 2.68Å; M346-V349 PolarHBondContact O-N 3.4Å; M346-R350 WeakPolarHBondContact O-CB 3.46Å; M346-R350 PolarHBondContact O-N 2.86Å
347	T	97	Very high	95.1	Very high	58 Å²	58	50.8 Å²	50.8	36%	0.356	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-44	178.7	-55.8	0	0	0	0	110.7	K343 A344 L345 R350 E351	K343-T347 WeakPolarHBondContact O-CB 3.31Å; K343-T347 PolarHBondContact O-N 3.15Å; K343-T347 PolarHBondContact O-OG1 3.21Å; A344-T347 PolarHBondContact O-N 3.05Å; L345-T347 VanDerWaalsContact C-N 3.28Å; L345-T347 PolarHBondContact O-N 3.43Å; T347-R350 PolarHBondContact O-N 3.19Å; T347-E351 WeakPolarHBondContact O-CG 3.38Å; T347-E351 PolarHBondContact O-N 3.36Å
348	K	95.8	Very high	95	Very high	57 Å²	57	54.7 Å²	54.7	25%	0.248	25%	0.251	C	S	.	.	H	α-helix	trans	-70.6	-38.2	-179.9	-65.7	-70.1	159.9	-137.9	0	113.1	A344 L345 M346 R350 E351 H352 P390 F394	A344-K348 WeakPolarHBondContact O-CG 3.39Å; A344-K348 PolarHBondContact O-N 2.84Å; L345-K348 PolarHBondContact O-N 3.38Å; L345-K348 VanDerWaalsContact O-N 3.09Å; M346-K348 VanDerWaalsContact C-N 3.34Å; M346-K348 PolarHBondContact O-N 2.68Å; K348-R350 VanDerWaalsContact C-N 3.35Å; K348-E351 IonicContact NZ-OE1 2.62Å; K348-E351 PolarHBondContact NZ-OE1 3.11Å; K348-E351 IonicContact NZ-OE2 2.52Å; K348-E351 PolarHBondContact NZ-OE2 2.84Å; K348-E351 PolarHBondContact O-N 2.79Å; K348-H352 WeakPolarHBondContact O-CB 3.24Å; K348-H352 PolarHBondContact O-N 3.3Å; K348-P390 HydrophobicContact CD-CB 4.12Å; K348-F394 HydrophobicContact CB-CB 4.39Å; K348-F394 HydrophobicContact CB-CG 4.32Å; K348-F394 HydrophobicContact CD-CB 4.26Å; K348-F394 HydrophobicContact CG-CB 3.98Å; K348-F394 HydrophobicContact CG-CD2 3.89Å; K348-F394 HydrophobicContact CG-CE2 4.46Å; K348-F394 HydrophobicContact CG-CG 3.89Å
349	V	96.4	Very high	94.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-42.9	172.9	168.9	0	0	0	0	110.8	M306 F315 F322 I323 L345 M346 H352 S353 F391	M306-V349 HydrophobicContact CB-CG2 4.2Å; M306-V349 HydrophobicContact CG-CG2 3.79Å; M306-V349 HydrophobicContact SD-CG1 4.05Å; M306-V349 HydrophobicContact SD-CG2 4.36Å; F315-V349 HydrophobicContact CE1-CG1 4.21Å; F315-V349 HydrophobicContact CZ-CG1 3.91Å; F322-V349 HydrophobicContact CD1-CB 4.38Å; F322-V349 HydrophobicContact CD1-CG1 3.89Å; F322-V349 HydrophobicContact CD1-CG2 4.43Å; F322-V349 HydrophobicContact CE1-CB 3.96Å; F322-V349 HydrophobicContact CE1-CG1 3.98Å; F322-V349 HydrophobicContact CE1-CG2 3.83Å; I323-V349 HydrophobicContact CD1-CG1 4.32Å; I323-V349 HydrophobicContact CG1-CG1 4.26Å; L345-V349 HydrophobicContact CD1-CG2 3.94Å; L345-V349 HydrophobicContact CG-CG2 4.28Å; L345-V349 WeakPolarHBondContact O-CG2 3.44Å; L345-V349 PolarHBondContact O-N 3.35Å; M346-V349 PolarHBondContact O-N 3.4Å; V349-H352 PolarHBondContact O-N 3.02Å; V349-S353 WeakPolarHBondContact O-CB 3.07Å; V349-S353 PolarHBondContact O-N 3.09Å; V349-F391 HydrophobicContact CG2-CD2 4.13Å; V349-F391 HydrophobicContact CG2-CE2 4.03Å
350	R	96.4	Very high	94.4	Very high	92 Å²	92	56.1 Å²	56.1	35%	0.347	26%	0.255	S	S	.	.	H	α-helix	trans	-63.7	-47.6	175.8	-172.4	-174.4	-62.7	-161.9	8.5	112.4	I323 M346 T347 K348 H352 S353 E354	I323-R350 HydrophobicContact CD1-CB 4.49Å; M346-R350 WeakPolarHBondContact O-CB 3.46Å; M346-R350 PolarHBondContact O-N 2.86Å; T347-R350 PolarHBondContact O-N 3.19Å; K348-R350 VanDerWaalsContact C-N 3.35Å; R350-H352 PolarHBondContact O-N 2.83Å; R350-S353 WeakPolarHBondContact O-CB 3.16Å; R350-S353 PolarHBondContact O-N 3.12Å; R350-E354 HydrophobicContact CG-CG 4.5Å; R350-E354 WeakPolarHBondContact O-CG 3.47Å; R350-E354 PolarHBondContact O-N 2.52Å
351	E	94.8	Very high	94.1	Very high	67 Å²	67	55.9 Å²	55.9	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-55	-41.1	176	-75.2	171.5	-155.9	0	0	111.4	T347 K348 W355 P390	T347-E351 WeakPolarHBondContact O-CG 3.38Å; T347-E351 PolarHBondContact O-N 3.36Å; K348-E351 IonicContact NZ-OE1 2.62Å; K348-E351 PolarHBondContact NZ-OE1 3.11Å; K348-E351 IonicContact NZ-OE2 2.52Å; K348-E351 PolarHBondContact NZ-OE2 2.84Å; K348-E351 PolarHBondContact O-N 2.79Å; E351-W355 WeakPolarHBondContact O-CB 3.46Å; E351-W355 PolarHBondContact O-N 3.37Å; E351-P390 WeakPolarHBondContact OE2-CB 3.37Å
352	H	94.3	Very high	93.6	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-68.7	-43.4	177.5	-167.8	55.2	0	0	0	112.8	A310 F315 K348 V349 R350 E354 W355 I356 L389 F391	A310-H352 PolarHBondContact O-NE2 2.69Å; F315-H352 AromaticContact CD1-CD2 3.61Å; F315-H352 HydrophobicContact CE1-CB 4.07Å; F315-H352 AromaticContact CE1-CD2 3.38Å; F315-H352 WeakPolarHBondContact CE1-CD2 3.29Å; F315-H352 AromaticContact CZ-CD2 3.7Å; K348-H352 WeakPolarHBondContact O-CB 3.24Å; K348-H352 PolarHBondContact O-N 3.3Å; V349-H352 PolarHBondContact O-N 3.02Å; R350-H352 PolarHBondContact O-N 2.83Å; H352-E354 PolarHBondContact O-N 3.37Å; H352-W355 WeakPolarHBondContact O-CB 3.5Å; H352-W355 PolarHBondContact O-N 3.3Å; H352-I356 WeakPolarHBondContact NE2-CD1 3.5Å; H352-I356 WeakPolarHBondContact O-CG1 3.39Å; H352-I356 PolarHBondContact O-N 3.01Å; H352-L389 VanDerWaalsContact CE1-CD2 3.5Å; H352-L389 WeakPolarHBondContact CE1-CD2 3.41Å; H352-F391 HydrophobicContact CB-CB 3.69Å; H352-F391 HydrophobicContact CB-CG 4.38Å
353	S	95.3	Very high	93.1	Very high	13 Å²	13	62.1 Å²	62.1	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-47.5	174.2	-179.2	0	0	0	0	111.7	P316 V349 R350 W355 I356 I357	P316-S353 WeakPolarHBondContact CA-OG 3.41Å; V349-S353 WeakPolarHBondContact O-CB 3.07Å; V349-S353 PolarHBondContact O-N 3.09Å; R350-S353 WeakPolarHBondContact O-CB 3.16Å; R350-S353 PolarHBondContact O-N 3.12Å; S353-W355 VanDerWaalsContact C-N 3.32Å; S353-W355 PolarHBondContact O-N 3.04Å; S353-I356 PolarHBondContact O-N 2.89Å; S353-I357 WeakPolarHBondContact O-CG1 3.47Å; S353-I357 PolarHBondContact O-N 3.44Å
354	E	94.4	Very high	92.3	Very high	94 Å²	94	67.5 Å²	67.5	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-37.4	175.4	-71.4	174.2	-167.3	0	0	112.9	R350 H352 K358	R350-E354 HydrophobicContact CG-CG 4.5Å; R350-E354 WeakPolarHBondContact O-CG 3.47Å; R350-E354 PolarHBondContact O-N 2.52Å; H352-E354 PolarHBondContact O-N 3.37Å; E354-K358 WeakPolarHBondContact O-CG 3.42Å; E354-K358 PolarHBondContact O-N 2.62Å; E354-K358 VanDerWaalsContact O-N 3.11Å
355	W	92.5	Very high	91.6	Very high	69 Å²	69	69.7 Å²	69.7	26%	0.261	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-44.9	174.4	-177.5	96.3	0	0	0	111.3	E351 H352 S353 I357 K358 C359 T378 C379 L389	E351-W355 WeakPolarHBondContact O-CB 3.46Å; E351-W355 PolarHBondContact O-N 3.37Å; H352-W355 WeakPolarHBondContact O-CB 3.5Å; H352-W355 PolarHBondContact O-N 3.3Å; S353-W355 VanDerWaalsContact C-N 3.32Å; S353-W355 PolarHBondContact O-N 3.04Å; W355-I357 PolarHBondContact O-N 2.99Å; W355-K358 WeakPolarHBondContact O-CB 3.33Å; W355-K358 PolarHBondContact O-N 3.02Å; W355-K358 VanDerWaalsContact O-N 3.12Å; W355-C359 WeakPolarHBondContact CH2-SG 3.4Å; W355-C359 VanDerWaalsContact CZ2-SG 3.51Å; W355-C359 HydrophobicContact CZ3-CB 4.39Å; W355-C359 PolarHBondContact O-N 3.35Å; W355-C359 PolarHBondContact O-SG 2.85Å; W355-T378 HydrophobicContact CH2-CG2 4.22Å; W355-T378 HydrophobicContact CZ2-CG2 4.41Å; W355-C379 WeakPolarHBondContact CZ3-SG 3.34Å; W355-L389 HydrophobicContact CD2-CD2 3.68Å; W355-L389 HydrophobicContact CD2-CG 4.39Å; W355-L389 HydrophobicContact CE3-CD2 3.63Å; W355-L389 HydrophobicContact CG-CD2 4.37Å; W355-L389 HydrophobicContact CH2-CD2 3.92Å; W355-L389 HydrophobicContact CZ2-CD1 4.26Å; W355-L389 HydrophobicContact CZ2-CD2 3.94Å; W355-L389 HydrophobicContact CZ2-CG 4.44Å; W355-L389 HydrophobicContact CZ3-CD2 3.78Å
356	I	91.7	Very high	90.8	Very high	1 Å²	1	75.8 Å²	75.8	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-42.8	177.8	-69.7	179	0	0	0	110.7	A310 I313 F315 P316 H352 S353 K358 C359 R360	A310-I356 WeakPolarHBondContact O-CD1 3.34Å; I313-I356 VanDerWaalsContact O-CG2 3.26Å; I313-I356 WeakPolarHBondContact O-CG2 3.47Å; F315-I356 HydrophobicContact CB-CD1 3.46Å; F315-I356 VanDerWaalsContact CB-CD1 3.46Å; F315-I356 HydrophobicContact CD1-CD1 3.79Å; F315-I356 HydrophobicContact CG-CD1 3.84Å; P316-I356 HydrophobicContact CG-CB 4.02Å; P316-I356 HydrophobicContact CG-CG2 3.79Å; H352-I356 WeakPolarHBondContact NE2-CD1 3.5Å; H352-I356 WeakPolarHBondContact O-CG1 3.39Å; H352-I356 PolarHBondContact O-N 3.01Å; S353-I356 PolarHBondContact O-N 2.89Å; I356-K358 VanDerWaalsContact C-N 3.27Å; I356-K358 PolarHBondContact O-N 3.43Å; I356-C359 WeakPolarHBondContact O-CB 3.41Å; I356-C359 PolarHBondContact O-N 3.12Å; I356-R360 HydrophobicContact CG2-CG 4.26Å; I356-R360 WeakPolarHBondContact O-CG 3.46Å; I356-R360 PolarHBondContact O-N 3.3Å
357	I	92.9	Very high	90.1	Very high	63 Å²	63	79.3 Å²	79.3	32%	0.323	36%	0.362	S	S	.	.	H	α-helix	trans	-56.6	-42	174.3	-67.9	165.7	0	0	0	110.9	P316 S353 W355 C359 R360 R361	P316-I357 HydrophobicContact CB-CD1 4.21Å; P316-I357 HydrophobicContact CB-CG1 4.03Å; P316-I357 HydrophobicContact CG-CD1 4.3Å; P316-I357 HydrophobicContact CG-CG1 3.69Å; S353-I357 WeakPolarHBondContact O-CG1 3.47Å; S353-I357 PolarHBondContact O-N 3.44Å; W355-I357 PolarHBondContact O-N 2.99Å; I357-C359 VanDerWaalsContact C-N 3.34Å; I357-C359 PolarHBondContact O-N 3.43Å; I357-R360 PolarHBondContact O-N 3.42Å; I357-R361 WeakPolarHBondContact O-CG 3.33Å; I357-R361 PolarHBondContact O-N 3.05Å
358	K	91.3	Very high	89.5	Confident	123 Å²	123	78 Å²	78	54%	0.535	36%	0.356	S	S	.	.	H	α-helix	trans	-64.3	-37.4	176.2	-70.8	167.8	-174.8	168.9	0	112.4	E354 W355 I356	E354-K358 WeakPolarHBondContact O-CG 3.42Å; E354-K358 PolarHBondContact O-N 2.62Å; E354-K358 VanDerWaalsContact O-N 3.11Å; W355-K358 WeakPolarHBondContact O-CB 3.33Å; W355-K358 PolarHBondContact O-N 3.02Å; W355-K358 VanDerWaalsContact O-N 3.12Å; I356-K358 VanDerWaalsContact C-N 3.27Å; I356-K358 PolarHBondContact O-N 3.43Å
359	C	87.7	Confident	89	Confident	13 Å²	13	83 Å²	83	9%	0.088	37%	0.373	C	S	.	.	H	α-helix	trans	-69	-42.3	175.1	-68.6	0	0	0	0	111.9	W355 I356 I357 R361 R362 I375	W355-C359 WeakPolarHBondContact CH2-SG 3.4Å; W355-C359 VanDerWaalsContact CZ2-SG 3.51Å; W355-C359 HydrophobicContact CZ3-CB 4.39Å; W355-C359 PolarHBondContact O-N 3.35Å; W355-C359 PolarHBondContact O-SG 2.85Å; I356-C359 WeakPolarHBondContact O-CB 3.41Å; I356-C359 PolarHBondContact O-N 3.12Å; I357-C359 VanDerWaalsContact C-N 3.34Å; I357-C359 PolarHBondContact O-N 3.43Å; C359-R361 VanDerWaalsContact C-N 3.28Å; C359-R361 PolarHBondContact O-N 2.89Å; C359-R362 WeakPolarHBondContact O-CB 3.32Å; C359-R362 PolarHBondContact O-N 3.36Å; C359-I375 HydrophobicContact CB-CD1 4.46Å; C359-I375 HydrophobicContact CB-CG2 4.01Å
360	R	89.9	Confident	88.5	Confident	55 Å²	55	88.4 Å²	88.4	21%	0.208	40%	0.402	C	S	.	.	H	α-helix	trans	-57.5	-38.1	176.4	-72.5	-173.5	-169.3	177.3	6.9	113.2	I313 V314 P316 E317 I356 I357 R362 V363	I313-R360 HydrophobicContact CD1-CG 4.05Å; I313-R360 HydrophobicContact CG1-CG 3.65Å; I313-R360 PolarHBondContact O-NE 3.07Å; I313-R360 PolarHBondContact O-NH2 2.9Å; V314-R360 VanDerWaalsContact C-NH2 3.34Å; P316-R360 VanDerWaalsContact CG-NH2 3.3Å; E317-R360 VanDerWaalsContact CD-NH1 3.33Å; E317-R360 IonicContact OE1-CZ 3.59Å; E317-R360 IonicContact OE1-NH1 2.69Å; E317-R360 PolarHBondContact OE1-NH1 3.43Å; E317-R360 IonicContact OE1-NH2 3.97Å; E317-R360 IonicContact OE2-CZ 3.33Å; E317-R360 IonicContact OE2-NH1 3.17Å; E317-R360 PolarHBondContact OE2-NH1 3.26Å; E317-R360 VanDerWaalsContact OE2-NH1 3.17Å; E317-R360 IonicContact OE2-NH2 3.56Å; E317-R360 PolarHBondContact OE2-NH2 3.33Å; I356-R360 HydrophobicContact CG2-CG 4.26Å; I356-R360 WeakPolarHBondContact O-CG 3.46Å; I356-R360 PolarHBondContact O-N 3.3Å; I357-R360 PolarHBondContact O-N 3.42Å; R360-R362 PolarHBondContact O-N 3.46Å; R360-V363 WeakPolarHBondContact O-CB 3.36Å; R360-V363 PolarHBondContact O-N 3.41Å
361	R	88.6	Confident	87.9	Confident	201 Å²	201	86.9 Å²	86.9	76%	0.758	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-15.3	176.1	-70.2	174.9	-174	-175.8	0.6	113.8	I357 C359	I357-R361 WeakPolarHBondContact O-CG 3.33Å; I357-R361 PolarHBondContact O-N 3.05Å; C359-R361 VanDerWaalsContact C-N 3.28Å; C359-R361 PolarHBondContact O-N 2.89Å
362	R	84.7	Confident	87.5	Confident	196 Å²	196	85.5 Å²	85.5	74%	0.74	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-13.7	177.1	-55.7	176.7	-177.7	172	-1	112.9	C359 R360 R364	C359-R362 WeakPolarHBondContact O-CB 3.32Å; C359-R362 PolarHBondContact O-N 3.36Å; R360-R362 PolarHBondContact O-N 3.46Å; R362-R364 PolarHBondContact O-N 3.4Å
363	V	84.2	Confident	87	Confident	21 Å²	21	87.1 Å²	87.1	13%	0.127	40%	0.402	C	S	.	.			trans	-71.4	122.4	174.9	-177.4	0	0	0	0	107.7	I313 R360 N365 L366 E371 I375	I313-V363 HydrophobicContact CD1-CG2 4.33Å; R360-V363 WeakPolarHBondContact O-CB 3.36Å; R360-V363 PolarHBondContact O-N 3.41Å; V363-N365 WeakPolarHBondContact CG1-O 3.44Å; V363-L366 HydrophobicContact CG1-CD2 4.13Å; V363-E371 HydrophobicContact CG1-CB 4.29Å; V363-E371 WeakPolarHBondContact CG1-OE2 3.44Å; V363-I375 HydrophobicContact CG2-CD1 3.08Å; V363-I375 HydrophobicContact CG2-CG1 4.46Å
364	R	80.8	Confident	86.5	Confident	239 Å²	239	91.5 Å²	91.5	90%	0.902	42%	0.424	S	S	*	.	S	Bend	trans	-83.8	-37.6	178.1	-67.1	-179.5	-178.2	171	-0.2	110.7	R362 E371	R362-R364 PolarHBondContact O-N 3.4Å; R364-E371 PolarHBondContact N-OE2 3.32Å
365	N	81.4	Confident	86	Confident	85 Å²	85	88.2 Å²	88.2	46%	0.455	41%	0.409	S	S	.	.			trans	-132.2	112.7	-176.7	-172.9	-4.3	0	0	0	111	V363 A367 S368 E371	V363-N365 WeakPolarHBondContact CG1-O 3.44Å; N365-A367 PolarHBondContact O-N 3.15Å; N365-A367 VanDerWaalsContact OD1-CB 3.27Å; N365-A367 WeakPolarHBondContact OD1-CB 3.5Å; N365-A367 PolarHBondContact OD1-N 3.06Å; N365-S368 WeakPolarHBondContact O-CB 3.28Å; N365-S368 PolarHBondContact O-N 2.99Å; N365-S368 VanDerWaalsContact O-N 3.1Å; N365-E371 PolarHBondContact N-OE2 3.03Å
366	L	78.9	Confident	85.7	Confident	129 Å²	129	85.5 Å²	85.5	68%	0.675	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.7	176.2	-67	171.5	0	0	0	113.2	V363 S368 I372	V363-L366 HydrophobicContact CG1-CD2 4.13Å; L366-S368 VanDerWaalsContact C-N 3.32Å; L366-I372 WeakPolarHBondContact O-CD1 3.47Å
367	A	82.6	Confident	85.2	Confident	88 Å²	88	87.6 Å²	87.6	73%	0.727	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-14.8	173.5	0	0	0	0	0	113	N365 R369	N365-A367 PolarHBondContact O-N 3.15Å; N365-A367 VanDerWaalsContact OD1-CB 3.27Å; N365-A367 WeakPolarHBondContact OD1-CB 3.5Å; N365-A367 PolarHBondContact OD1-N 3.06Å; A367-R369 PolarHBondContact O-N 2.76Å; A367-R369 VanDerWaalsContact O-N 3.12Å
368	S	85	Confident	84.7	Confident	32 Å²	32	88 Å²	88	22%	0.224	42%	0.42	C	S	.	.			trans	-78.8	99.3	-179.3	-176.5	0	0	0	0	110.7	N365 L366 N370 E371 I372	N365-S368 WeakPolarHBondContact O-CB 3.28Å; N365-S368 PolarHBondContact O-N 2.99Å; N365-S368 VanDerWaalsContact O-N 3.1Å; L366-S368 VanDerWaalsContact C-N 3.32Å; S368-N370 PolarHBondContact O-N 3.43Å; S368-N370 VanDerWaalsContact O-N 3.17Å; S368-E371 PolarHBondContact O-N 3.33Å; S368-E371 VanDerWaalsContact O-N 3.11Å; S368-E371 PolarHBondContact OG-N 3.43Å; S368-I372 PolarHBondContact O-N 3.07Å
369	R	85.7	Confident	84.1	Confident	162 Å²	162	82.3 Å²	82.3	61%	0.611	40%	0.395	S	S	*	.	H	α-helix	trans	-53.1	-36.9	175	-172.6	176.8	-178.9	110.7	0.5	111.9	D240 A367 I372 L373	D240-R369 IonicContact OD1-NH2 2.61Å; A367-R369 PolarHBondContact O-N 2.76Å; A367-R369 VanDerWaalsContact O-N 3.12Å; R369-I372 PolarHBondContact O-N 3.04Å; R369-L373 HydrophobicContact CG-CD1 3.86Å; R369-L373 HydrophobicContact CG-CG 4.1Å; R369-L373 WeakPolarHBondContact O-CB 3.43Å; R369-L373 VanDerWaalsContact O-CG 3.22Å; R369-L373 WeakPolarHBondContact O-CG 3.44Å; R369-L373 PolarHBondContact O-N 2.85Å
370	N	85.2	Confident	83.4	Confident	113 Å²	113	82.7 Å²	82.7	60%	0.604	40%	0.397	S	S	*	.	H	α-helix	trans	-66	-41.1	180	-67.2	-35.5	0	0	0	112.6	S368 I372 L373 N374	S368-N370 PolarHBondContact O-N 3.43Å; S368-N370 VanDerWaalsContact O-N 3.17Å; N370-I372 VanDerWaalsContact C-N 3.33Å; N370-L373 PolarHBondContact O-N 2.78Å; N370-N374 WeakPolarHBondContact O-CB 3.45Å; N370-N374 PolarHBondContact O-N 3.34Å; N370-N374 PolarHBondContact O-ND2 3.4Å
371	E	84	Confident	82.4	Confident	59 Å²	59	83.6 Å²	83.6	28%	0.276	40%	0.403	S	S	.	.	H	α-helix	trans	-64.3	-41	176.4	-73.9	-177	-149.3	0	0	111.3	V363 R364 N365 S368 N374 I375	V363-E371 HydrophobicContact CG1-CB 4.29Å; V363-E371 WeakPolarHBondContact CG1-OE2 3.44Å; R364-E371 PolarHBondContact N-OE2 3.32Å; N365-E371 PolarHBondContact N-OE2 3.03Å; S368-E371 PolarHBondContact O-N 3.33Å; S368-E371 VanDerWaalsContact O-N 3.11Å; S368-E371 PolarHBondContact OG-N 3.43Å; E371-N374 PolarHBondContact O-N 2.95Å; E371-I375 PolarHBondContact O-N 2.99Å
372	I	85.9	Confident	81.5	Confident	39 Å²	39	75.8 Å²	75.8	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-62.6	-54.5	176.1	-63.9	171.1	0	0	0	109.9	I313 L366 S368 R369 N370 N374 I375 E376	I313-I372 HydrophobicContact CB-CG2 4.26Å; I313-I372 HydrophobicContact CD1-CG1 4.16Å; I313-I372 HydrophobicContact CD1-CG2 4.44Å; I313-I372 HydrophobicContact CG2-CG2 3.97Å; L366-I372 WeakPolarHBondContact O-CD1 3.47Å; S368-I372 PolarHBondContact O-N 3.07Å; R369-I372 PolarHBondContact O-N 3.04Å; N370-I372 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 2.95Å; I372-I375 PolarHBondContact O-N 2.96Å; I372-E376 HydrophobicContact CG2-CG 4.1Å; I372-E376 WeakPolarHBondContact O-CG 3.3Å; I372-E376 PolarHBondContact O-N 3.2Å
373	L	85	Confident	80.4	Confident	35 Å²	35	70.6 Å²	70.6	18%	0.183	36%	0.363	C	S	.	.	H	α-helix	trans	-56.9	-37.1	-179.8	-72.1	176.4	0	0	0	112.2	R369 N370 E376 S377	R369-L373 HydrophobicContact CG-CD1 3.86Å; R369-L373 HydrophobicContact CG-CG 4.1Å; R369-L373 WeakPolarHBondContact O-CB 3.43Å; R369-L373 VanDerWaalsContact O-CG 3.22Å; R369-L373 WeakPolarHBondContact O-CG 3.44Å; R369-L373 PolarHBondContact O-N 2.85Å; N370-L373 PolarHBondContact O-N 2.78Å; L373-E376 PolarHBondContact O-N 3.14Å; L373-S377 WeakPolarHBondContact O-CB 3.34Å; L373-S377 PolarHBondContact O-N 3.14Å; L373-S377 PolarHBondContact O-OG 3.32Å
374	N	83.9	Confident	79.2	Confident	105 Å²	105	77.6 Å²	77.6	56%	0.561	40%	0.399	S	S	*	.	H	α-helix	trans	-62.5	-42.6	175.8	-74.2	-19	0	0	0	112	N370 E371 I372 T378	N370-N374 WeakPolarHBondContact O-CB 3.45Å; N370-N374 PolarHBondContact O-N 3.34Å; N370-N374 PolarHBondContact O-ND2 3.4Å; E371-N374 PolarHBondContact O-N 2.95Å; I372-N374 PolarHBondContact O-N 2.95Å; N374-T378 WeakPolarHBondContact O-CB 3.38Å; N374-T378 PolarHBondContact O-N 2.9Å; N374-T378 PolarHBondContact O-OG1 3.21Å
375	I	83.7	Confident	78.2	Confident	24 Å²	24	69.1 Å²	69.1	12%	0.123	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-47.9	176.8	-69.3	176.7	0	0	0	110.9	C359 V363 E371 I372 S377 T378 C379	C359-I375 HydrophobicContact CB-CD1 4.46Å; C359-I375 HydrophobicContact CB-CG2 4.01Å; V363-I375 HydrophobicContact CG2-CD1 3.08Å; V363-I375 HydrophobicContact CG2-CG1 4.46Å; E371-I375 PolarHBondContact O-N 2.99Å; I372-I375 PolarHBondContact O-N 2.96Å; I375-S377 VanDerWaalsContact C-N 3.27Å; I375-S377 PolarHBondContact O-N 3.16Å; I375-T378 VanDerWaalsContact O-CB 3.31Å; I375-T378 WeakPolarHBondContact O-CB 3.45Å; I375-T378 PolarHBondContact O-N 2.92Å; I375-C379 PolarHBondContact O-N 3.01Å
376	E	86.3	Confident	77.1	Confident	13 Å²	13	70.6 Å²	70.6	6%	0.061	38%	0.384	C	S	.	.	H	α-helix	trans	-62.4	-38.2	-179.3	-60.4	-161.8	150.2	0	0	111.5	S239 R242 N311 S312 I313 I372 L373 C379	S239-E376 WeakPolarHBondContact CB-OE2 3.27Å; S239-E376 VanDerWaalsContact OG-CB 3.27Å; S239-E376 WeakPolarHBondContact OG-CB 3.41Å; S239-E376 PolarHBondContact OG-OE2 3Å; R242-E376 IonicContact CZ-OE1 2.69Å; R242-E376 IonicContact CZ-OE2 2.68Å; R242-E376 IonicContact NH1-OE1 3.97Å; R242-E376 PolarHBondContact NH1-OE1 3.39Å; R242-E376 IonicContact NH1-OE2 2.75Å; R242-E376 PolarHBondContact NH1-OE2 3.25Å; R242-E376 VanDerWaalsContact NH2-CD 3.26Å; R242-E376 IonicContact NH2-OE1 2.69Å; R242-E376 PolarHBondContact NH2-OE1 2.85Å; R242-E376 IonicContact NH2-OE2 3.34Å; R242-E376 PolarHBondContact NH2-OE2 3.49Å; N311-E376 WeakPolarHBondContact O-CA 3.31Å; N311-E376 VanDerWaalsContact O-CB 3.22Å; N311-E376 WeakPolarHBondContact O-CB 3.49Å; N311-E376 WeakPolarHBondContact O-CG 3.46Å; S312-E376 WeakPolarHBondContact CA-OE1 3.04Å; I313-E376 PolarHBondContact N-OE1 3.39Å; I372-E376 HydrophobicContact CG2-CG 4.1Å; I372-E376 WeakPolarHBondContact O-CG 3.3Å; I372-E376 PolarHBondContact O-N 3.2Å; L373-E376 PolarHBondContact O-N 3.14Å; E376-C379 WeakPolarHBondContact O-CB 3.44Å; E376-C379 PolarHBondContact O-N 3.36Å
377	S	82.4	Confident	76.7	Confident	45 Å²	45	71.1 Å²	71.1	32%	0.315	38%	0.381	S	S	.	.	H	α-helix	trans	-66.6	-37.5	173.5	-59	0	0	0	0	111.6	L373 I375 C379 T380 F381	L373-S377 WeakPolarHBondContact O-CB 3.34Å; L373-S377 PolarHBondContact O-N 3.14Å; L373-S377 PolarHBondContact O-OG 3.32Å; I375-S377 VanDerWaalsContact C-N 3.27Å; I375-S377 PolarHBondContact O-N 3.16Å; S377-C379 PolarHBondContact O-N 3.02Å; S377-T380 WeakPolarHBondContact O-CA 3.02Å; S377-T380 WeakPolarHBondContact O-CB 3.28Å; S377-T380 PolarHBondContact O-N 3.4Å; S377-T380 PolarHBondContact O-OG1 2.94Å; S377-F381 WeakPolarHBondContact O-CD2 3.38Å
378	T	81.2	Confident	76.5	Confident	72 Å²	72	68.6 Å²	68.6	44%	0.442	36%	0.355	S	S	.	.	H	α-helix	trans	-58.3	-33.8	177.1	-58.4	0	0	0	0	111.9	W355 N374 I375 T380 F381	W355-T378 HydrophobicContact CH2-CG2 4.22Å; W355-T378 HydrophobicContact CZ2-CG2 4.41Å; N374-T378 WeakPolarHBondContact O-CB 3.38Å; N374-T378 PolarHBondContact O-N 2.9Å; N374-T378 PolarHBondContact O-OG1 3.21Å; I375-T378 VanDerWaalsContact O-CB 3.31Å; I375-T378 WeakPolarHBondContact O-CB 3.45Å; I375-T378 PolarHBondContact O-N 2.92Å; T378-T380 PolarHBondContact O-N 3.41Å; T378-F381 PolarHBondContact O-N 3.33Å
379	C	78.4	Confident	76.4	Confident	2 Å²	2	68 Å²	68	1%	0.014	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.3	174.9	-60.7	0	0	0	0	113.5	N311 W355 I375 E376 S377 W392	N311-C379 HydrophobicContact CB-CB 4.11Å; N311-C379 WeakPolarHBondContact OD1-CB 3.41Å; W355-C379 WeakPolarHBondContact CZ3-SG 3.34Å; I375-C379 PolarHBondContact O-N 3.01Å; E376-C379 WeakPolarHBondContact O-CB 3.44Å; E376-C379 PolarHBondContact O-N 3.36Å; S377-C379 PolarHBondContact O-N 3.02Å; C379-W392 PolarHBondContact O-NE1 3.3Å; C379-W392 VanDerWaalsContact O-NE1 3.08Å
380	T	73.9	Confident	76.3	Confident	21 Å²	21	62.6 Å²	62.6	13%	0.129	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-10.4	-177.3	69	0	0	0	0	115.1	L230 L237 N311 S377 T378	L230-T380 HydrophobicContact CD1-CG2 4.39Å; L230-T380 WeakPolarHBondContact CG-O 3.34Å; L230-T380 PolarHBondContact N-O 3Å; L237-T380 HydrophobicContact CB-CG2 4.44Å; L237-T380 WeakPolarHBondContact O-CG2 3.28Å; N311-T380 WeakPolarHBondContact ND2-CG2 3.23Å; S377-T380 WeakPolarHBondContact O-CA 3.02Å; S377-T380 WeakPolarHBondContact O-CB 3.28Å; S377-T380 PolarHBondContact O-N 3.4Å; S377-T380 PolarHBondContact O-OG1 2.94Å; T378-T380 PolarHBondContact O-N 3.41Å
381	F	70.1	Confident	76.5	Confident	75 Å²	75	57.2 Å²	57.2	33%	0.329	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-92.2	145.6	178.4	-69.2	-73.7	0	0	0	110.9	D227 R229 S377 T378	D227-F381 HydrophobicContact CB-CE1 4.35Å; R229-F381 HydrophobicContact CG-CE1 4.44Å; S377-F381 WeakPolarHBondContact O-CD2 3.38Å; T378-F381 PolarHBondContact O-N 3.33Å
382	I	67.9	Low	76.9	Confident	37 Å²	37	54.4 Å²	54.4	19%	0.19	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-72	128.7	166.1	-59.1	175.6	0	0	0	106.4	L228 R229 N386 L388	L228-I382 HydrophobicContact CB-CB 3.84Å; L228-I382 HydrophobicContact CB-CD1 3.88Å; L228-I382 HydrophobicContact CB-CG1 4.17Å; L228-I382 HydrophobicContact CD2-CB 4.4Å; L228-I382 HydrophobicContact CD2-CD1 4.12Å; L228-I382 HydrophobicContact CD2-CG2 4.27Å; L228-I382 HydrophobicContact CG-CD1 4.47Å; L228-I382 WeakPolarHBondContact O-CB 3.39Å; L228-I382 WeakPolarHBondContact O-CG1 3.3Å; L228-I382 PolarHBondContact O-N 2.96Å; R229-I382 WeakPolarHBondContact O-CD1 3.4Å; I382-N386 VanDerWaalsContact CG2-C 3.41Å; I382-N386 VanDerWaalsContact CG2-CA 3.5Å; I382-L388 HydrophobicContact CG1-CD2 3.72Å
383	D	62.1	Low	77	Confident	87 Å²	87	57.2 Å²	57.2	47%	0.465	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-57.4	157.1	177.7	179.2	35.3	0	0	0	110.7	S385 N386 K387	D383-S385 PolarHBondContact O-N 2.95Å; D383-S385 PolarHBondContact OD2-OG 3.38Å; D383-N386 WeakPolarHBondContact O-CA 3.14Å; D383-N386 PolarHBondContact O-N 3.49Å; D383-K387 WeakPolarHBondContact CB-O 3.4Å; D383-K387 PolarHBondContact N-O 3.08Å; D383-K387 VanDerWaalsContact N-O 3.09Å
384	N	58.6	Low	77.4	Confident	168 Å²	168	57.2 Å²	57.2	90%	0.898	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-19.2	177.8	-69.1	-33.5	0	0	0	113	N386	N384-N386 VanDerWaalsContact C-N 3.27Å; N384-N386 PolarHBondContact O-N 3.48Å
385	S	59.7	Low	77.9	Confident	60 Å²	60	52.2 Å²	52.2	42%	0.42	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	8.1	173.4	66.1	0	0	0	0	114.9	D383 K387	D383-S385 PolarHBondContact O-N 2.95Å; D383-S385 PolarHBondContact OD2-OG 3.38Å; S385-K387 PolarHBondContact O-N 2.92Å
386	N	59	Low	78.2	Confident	117 Å²	117	51.7 Å²	51.7	63%	0.626	28%	0.275	S	S	*	.	S	Bend	trans	55.5	26.4	-170	-71.5	-19.3	0	0	0	113.6	L228 I382 D383 N384	L228-N386 WeakPolarHBondContact CD2-OD1 3.33Å; I382-N386 VanDerWaalsContact CG2-C 3.41Å; I382-N386 VanDerWaalsContact CG2-CA 3.5Å; D383-N386 WeakPolarHBondContact O-CA 3.14Å; D383-N386 PolarHBondContact O-N 3.49Å; N384-N386 VanDerWaalsContact C-N 3.27Å; N384-N386 PolarHBondContact O-N 3.48Å
387	K	70.1	Confident	78.5	Confident	140 Å²	140	55.7 Å²	55.7	61%	0.609	29%	0.294	S	S	*	.			trans	-111	137.5	179.4	-67.9	178.8	-176.7	176.5	0	110.7	D383 S385	D383-K387 WeakPolarHBondContact CB-O 3.4Å; D383-K387 PolarHBondContact N-O 3.08Å; D383-K387 VanDerWaalsContact N-O 3.09Å; S385-K387 PolarHBondContact O-N 2.92Å
388	L	78.1	Confident	79.1	Confident	35 Å²	35	54.4 Å²	54.4	18%	0.183	28%	0.283	C	S	.	.			trans	-77.3	154.4	170.2	-68.9	173.9	0	0	0	110.1	L230 I382 W392 Q393 V396	L230-L388 HydrophobicContact CD2-CD2 3.38Å; L230-L388 HydrophobicContact CG-CD2 4.36Å; I382-L388 HydrophobicContact CG1-CD2 3.72Å; L388-W392 HydrophobicContact CB-CB 4.33Å; L388-Q393 HydrophobicContact CB-CB 4.06Å; L388-V396 HydrophobicContact CD1-CG2 4.42Å
389	L	83.7	Confident	79.7	Confident	18 Å²	18	52.1 Å²	52.1	9%	0.094	27%	0.267	C	S	.	.			trans	-55.4	146.1	167	-89.1	65.3	0	0	0	109.5	H352 W355 F391 W392 Q393	H352-L389 VanDerWaalsContact CE1-CD2 3.5Å; H352-L389 WeakPolarHBondContact CE1-CD2 3.41Å; W355-L389 HydrophobicContact CD2-CD2 3.68Å; W355-L389 HydrophobicContact CD2-CG 4.39Å; W355-L389 HydrophobicContact CE3-CD2 3.63Å; W355-L389 HydrophobicContact CG-CD2 4.37Å; W355-L389 HydrophobicContact CH2-CD2 3.92Å; W355-L389 HydrophobicContact CZ2-CD1 4.26Å; W355-L389 HydrophobicContact CZ2-CD2 3.94Å; W355-L389 HydrophobicContact CZ2-CG 4.44Å; W355-L389 HydrophobicContact CZ3-CD2 3.78Å; L389-F391 PolarHBondContact O-N 3.33Å; L389-F391 VanDerWaalsContact O-N 3.1Å; L389-W392 PolarHBondContact O-N 3.23Å; L389-Q393 PolarHBondContact O-N 3.06Å
390	P	82.8	Confident	80.3	Confident	50 Å²	50	56.6 Å²	56.6	33%	0.325	29%	0.288	S	S	.	.	H	α-helix	trans	-53.1	-38.6	-173.2	-28.5	34.6	0	0	0	114.1	K348 E351 F394	K348-P390 HydrophobicContact CD-CB 4.12Å; E351-P390 WeakPolarHBondContact OE2-CB 3.37Å; P390-F394 WeakPolarHBondContact O-CB 3.38Å; P390-F394 PolarHBondContact O-N 2.8Å; P390-F394 VanDerWaalsContact O-N 3.1Å
391	F	91	Very high	81.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.6	-48	175.7	173.1	-98.4	0	0	0	112.6	M306 A307 A310 L345 V349 H352 L389 Q393 F394 Y395	M306-F391 HydrophobicContact CB-CE2 3.94Å; M306-F391 HydrophobicContact CB-CZ 3.83Å; A307-F391 HydrophobicContact CB-CE1 4.13Å; A307-F391 HydrophobicContact CB-CZ 4.05Å; A310-F391 HydrophobicContact CB-CD1 3.92Å; A310-F391 HydrophobicContact CB-CE1 3.58Å; L345-F391 HydrophobicContact CD1-CE2 4.35Å; V349-F391 HydrophobicContact CG2-CD2 4.13Å; V349-F391 HydrophobicContact CG2-CE2 4.03Å; H352-F391 HydrophobicContact CB-CB 3.69Å; H352-F391 HydrophobicContact CB-CG 4.38Å; L389-F391 PolarHBondContact O-N 3.33Å; L389-F391 VanDerWaalsContact O-N 3.1Å; F391-Q393 VanDerWaalsContact C-N 3.34Å; F391-Q393 PolarHBondContact O-N 2.89Å; F391-F394 WeakPolarHBondContact O-CB 3.44Å; F391-F394 PolarHBondContact O-N 3.23Å; F391-F394 VanDerWaalsContact O-N 3.17Å; F391-Y395 HydrophobicContact CZ-CD2 4.38Å; F391-Y395 WeakPolarHBondContact O-CB 3.32Å; F391-Y395 PolarHBondContact O-N 3.1Å
392	W	90.6	Very high	82.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-39	178.5	-74	126.9	0	0	0	112.6	P208 L230 L232 L237 A307 A310 N311 C379 L388 L389 F394 Y395 V396	P208-W392 HydrophobicContact CB-CH2 4.36Å; P208-W392 HydrophobicContact CB-CZ3 4.11Å; P208-W392 HydrophobicContact CG-CH2 3.84Å; P208-W392 HydrophobicContact CG-CZ3 4.03Å; L230-W392 HydrophobicContact CD1-CD2 4.04Å; L230-W392 HydrophobicContact CD1-CE3 4.47Å; L230-W392 HydrophobicContact CD1-CG 4.34Å; L230-W392 HydrophobicContact CD1-CZ2 4.34Å; L230-W392 HydrophobicContact CD2-CB 3.74Å; L230-W392 HydrophobicContact CD2-CD2 4.04Å; L230-W392 HydrophobicContact CD2-CE3 4.46Å; L230-W392 HydrophobicContact CD2-CG 3.72Å; L232-W392 HydrophobicContact CD1-CD2 4.42Å; L232-W392 HydrophobicContact CD1-CE3 3.38Å; L232-W392 HydrophobicContact CD1-CZ3 3.47Å; L232-W392 VanDerWaalsContact CD1-CZ3 3.47Å; L237-W392 HydrophobicContact CD2-CH2 3.62Å; L237-W392 HydrophobicContact CD2-CZ2 3.93Å; L237-W392 HydrophobicContact CD2-CZ3 4.28Å; A307-W392 HydrophobicContact CB-CH2 4.29Å; A307-W392 HydrophobicContact CB-CZ3 4.12Å; A310-W392 HydrophobicContact CB-CH2 3.98Å; A310-W392 HydrophobicContact CB-CZ2 3.55Å; N311-W392 WeakPolarHBondContact OD1-CZ2 3.24Å; N311-W392 PolarHBondContact OD1-NE1 3.17Å; C379-W392 PolarHBondContact O-NE1 3.3Å; C379-W392 VanDerWaalsContact O-NE1 3.08Å; L388-W392 HydrophobicContact CB-CB 4.33Å; L389-W392 PolarHBondContact O-N 3.23Å; W392-F394 VanDerWaalsContact C-N 3.32Å; W392-F394 PolarHBondContact O-N 2.96Å; W392-Y395 HydrophobicContact CE3-CD1 4.11Å; W392-Y395 AromaticContact CZ3-CD1 3.99Å; W392-Y395 HydrophobicContact CZ3-CD1 3.99Å; W392-Y395 HydrophobicContact CZ3-CE1 4.38Å; W392-Y395 PolarHBondContact O-N 2.83Å; W392-V396 WeakPolarHBondContact O-CB 3.35Å; W392-V396 VanDerWaalsContact O-CG2 3.28Å; W392-V396 WeakPolarHBondContact O-CG2 3.35Å; W392-V396 PolarHBondContact O-N 3.02Å
393	Q	89.4	Confident	83.4	Confident	98 Å²	98	61.9 Å²	61.9	46%	0.458	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-46.8	173.2	-173.4	178	3.7	0	0	111.1	L388 L389 F391 Q397	L388-Q393 HydrophobicContact CB-CB 4.06Å; L389-Q393 PolarHBondContact O-N 3.06Å; F391-Q393 VanDerWaalsContact C-N 3.34Å; F391-Q393 PolarHBondContact O-N 2.89Å; Q393-Q397 VanDerWaalsContact O-CG 3.29Å; Q393-Q397 WeakPolarHBondContact O-CG 3.21Å; Q393-Q397 PolarHBondContact O-N 3.29Å
394	F	92.8	Very high	84.9	Confident	35 Å²	35	61.9 Å²	61.9	15%	0.154	31%	0.312	C	S	.	.	H	α-helix	trans	-62.9	-45.4	177	175.3	-90.9	0	0	0	111.9	F299 A344 L345 K348 P390 F391 W392 Q397 H398	F299-F394 HydrophobicContact CE2-CZ 4.37Å; F299-F394 HydrophobicContact CZ-CE1 4.19Å; F299-F394 AromaticContact CZ-CZ 3.72Å; F299-F394 HydrophobicContact CZ-CZ 3.72Å; A344-F394 HydrophobicContact CB-CE2 4.21Å; L345-F394 HydrophobicContact CB-CE1 4.19Å; L345-F394 HydrophobicContact CB-CZ 4.12Å; L345-F394 HydrophobicContact CD1-CD1 4.38Å; L345-F394 HydrophobicContact CD1-CE1 3.69Å; L345-F394 HydrophobicContact CD1-CZ 4.47Å; K348-F394 HydrophobicContact CB-CB 4.39Å; K348-F394 HydrophobicContact CB-CG 4.32Å; K348-F394 HydrophobicContact CD-CB 4.26Å; K348-F394 HydrophobicContact CG-CB 3.98Å; K348-F394 HydrophobicContact CG-CD2 3.89Å; K348-F394 HydrophobicContact CG-CE2 4.46Å; K348-F394 HydrophobicContact CG-CG 3.89Å; P390-F394 WeakPolarHBondContact O-CB 3.38Å; P390-F394 PolarHBondContact O-N 2.8Å; P390-F394 VanDerWaalsContact O-N 3.1Å; F391-F394 WeakPolarHBondContact O-CB 3.44Å; F391-F394 PolarHBondContact O-N 3.23Å; F391-F394 VanDerWaalsContact O-N 3.17Å; W392-F394 VanDerWaalsContact C-N 3.32Å; W392-F394 PolarHBondContact O-N 2.96Å; F394-Q397 PolarHBondContact O-N 2.88Å; F394-H398 VanDerWaalsContact O-CB 3.31Å; F394-H398 WeakPolarHBondContact O-CB 3.49Å; F394-H398 PolarHBondContact O-N 2.93Å
395	Y	93.8	Very high	86.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-45.3	-178.3	-176.8	-99.5	0	0	0	112	P208 L232 A303 A307 F391 W392 Q397 H398 K399	P208-Y395 HydrophobicContact CB-CE1 4.09Å; P208-Y395 VanDerWaalsContact O-CE1 3.3Å; P208-Y395 WeakPolarHBondContact O-CE1 3.37Å; P208-Y395 PolarHBondContact O-OH 3.32Å; L232-Y395 HydrophobicContact CD1-CD1 3.91Å; L232-Y395 HydrophobicContact CD1-CE1 4.21Å; L232-Y395 HydrophobicContact CD2-CD1 4.31Å; L232-Y395 HydrophobicContact CD2-CE1 4.17Å; A303-Y395 HydrophobicContact CB-CD2 4.3Å; A303-Y395 HydrophobicContact CB-CE2 4.4Å; A307-Y395 HydrophobicContact CB-CD1 4.38Å; A307-Y395 HydrophobicContact CB-CD2 3.81Å; A307-Y395 HydrophobicContact CB-CE1 4.06Å; A307-Y395 HydrophobicContact CB-CE2 3.45Å; A307-Y395 VanDerWaalsContact CB-CE2 3.45Å; A307-Y395 HydrophobicContact CB-CG 4.25Å; F391-Y395 HydrophobicContact CZ-CD2 4.38Å; F391-Y395 WeakPolarHBondContact O-CB 3.32Å; F391-Y395 PolarHBondContact O-N 3.1Å; W392-Y395 HydrophobicContact CE3-CD1 4.11Å; W392-Y395 AromaticContact CZ3-CD1 3.99Å; W392-Y395 HydrophobicContact CZ3-CD1 3.99Å; W392-Y395 HydrophobicContact CZ3-CE1 4.38Å; W392-Y395 PolarHBondContact O-N 2.83Å; Y395-Q397 PolarHBondContact O-N 2.9Å; Y395-H398 PolarHBondContact O-N 2.91Å; Y395-K399 HydrophobicContact CD1-CG 4.3Å; Y395-K399 HydrophobicContact CE1-CG 3.87Å; Y395-K399 HydrophobicContact CE2-CG 4.3Å; Y395-K399 VanDerWaalsContact CZ-CE 3.47Å; Y395-K399 WeakPolarHBondContact O-CG 3.4Å; Y395-K399 PolarHBondContact O-N 3.25Å; Y395-K399 WeakPolarHBondContact OH-CE 3.46Å
396	V	91.4	Very high	87.9	Confident	12 Å²	12	55.7 Å²	55.7	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-47.3	175.4	170	0	0	0	0	111	L210 P231 L232 L388 W392 H398 K399 Q400	L210-V396 HydrophobicContact CD2-CB 4.43Å; L210-V396 HydrophobicContact CD2-CG1 3.88Å; P231-V396 HydrophobicContact CG-CG1 4.22Å; P231-V396 HydrophobicContact CG-CG2 3.97Å; L232-V396 HydrophobicContact CD1-CG2 3.96Å; L232-V396 HydrophobicContact CD2-CG2 4.03Å; L232-V396 HydrophobicContact CG-CG2 3.96Å; L388-V396 HydrophobicContact CD1-CG2 4.42Å; W392-V396 WeakPolarHBondContact O-CB 3.35Å; W392-V396 VanDerWaalsContact O-CG2 3.28Å; W392-V396 WeakPolarHBondContact O-CG2 3.35Å; W392-V396 PolarHBondContact O-N 3.02Å; V396-H398 VanDerWaalsContact C-N 3.33Å; V396-H398 PolarHBondContact O-N 3.13Å; V396-K399 PolarHBondContact O-N 3.25Å; V396-Q400 WeakPolarHBondContact O-CG 3.38Å; V396-Q400 PolarHBondContact O-N 2.72Å; V396-Q400 VanDerWaalsContact O-N 3.09Å
397	Q	92	Very high	89.4	Confident	98 Å²	98	53 Å²	53	46%	0.458	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-43.2	176.8	-73.3	176.7	-5.3	0	0	111.6	Q393 F394 Y395 Q400 I401	Q393-Q397 VanDerWaalsContact O-CG 3.29Å; Q393-Q397 WeakPolarHBondContact O-CG 3.21Å; Q393-Q397 PolarHBondContact O-N 3.29Å; F394-Q397 PolarHBondContact O-N 2.88Å; Y395-Q397 PolarHBondContact O-N 2.9Å; Q397-Q400 PolarHBondContact O-N 3.42Å; Q397-I401 VanDerWaalsContact O-CG1 3.3Å; Q397-I401 WeakPolarHBondContact O-CG1 3.3Å; Q397-I401 PolarHBondContact O-N 2.84Å
398	H	94	Very high	90.4	Very high	17 Å²	17	55.1 Å²	55.1	8%	0.079	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-47.6	177.9	173.8	41.5	0	0	0	111.5	F299 D300 F394 Y395 V396 Q400 I401 R402	F299-H398 AromaticContact CD1-CE1 3.48Å; F299-H398 VanDerWaalsContact CD1-CE1 3.48Å; F299-H398 WeakPolarHBondContact CD1-CE1 3.09Å; F299-H398 AromaticContact CD1-NE2 3.69Å; F299-H398 AromaticContact CE1-CD2 3.98Å; F299-H398 AromaticContact CE1-CE1 3.3Å; F299-H398 WeakPolarHBondContact CE1-CE1 3.32Å; F299-H398 AromaticContact CE1-CG 3.89Å; F299-H398 AromaticContact CE1-ND1 3.48Å; F299-H398 WeakPolarHBondContact CE1-ND1 3.35Å; F299-H398 AromaticContact CE1-NE2 3.61Å; D300-H398 WeakPolarHBondContact CA-NE2 3.26Å; D300-H398 IonicContact OD1-NE2 3.3Å; D300-H398 PolarHBondContact OD1-NE2 3.46Å; F394-H398 VanDerWaalsContact O-CB 3.31Å; F394-H398 WeakPolarHBondContact O-CB 3.49Å; F394-H398 PolarHBondContact O-N 2.93Å; Y395-H398 PolarHBondContact O-N 2.91Å; V396-H398 VanDerWaalsContact C-N 3.33Å; V396-H398 PolarHBondContact O-N 3.13Å; H398-Q400 VanDerWaalsContact C-N 3.29Å; H398-Q400 PolarHBondContact O-N 2.83Å; H398-I401 PolarHBondContact O-N 2.85Å; H398-I401 VanDerWaalsContact O-N 3.15Å; H398-R402 VanDerWaalsContact O-CB 3.31Å; H398-R402 WeakPolarHBondContact O-CB 3.08Å; H398-R402 PolarHBondContact O-N 3.33Å
399	K	93.5	Very high	90.9	Very high	24 Å²	24	54.4 Å²	54.4	10%	0.104	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-36.9	177.4	-72.7	-54.9	-170.9	-172.9	0	112.9	L210 D300 E304 Y395 V396 R402 F403	L210-K399 HydrophobicContact CD1-CB 3.81Å; L210-K399 HydrophobicContact CD2-CB 4.29Å; L210-K399 HydrophobicContact CG-CB 3.88Å; D300-K399 IonicContact OD1-NZ 2.81Å; D300-K399 PolarHBondContact OD1-NZ 2.9Å; E304-K399 VanDerWaalsContact CD-NZ 3.31Å; E304-K399 IonicContact OE1-NZ 3.45Å; E304-K399 PolarHBondContact OE1-NZ 3.49Å; Y395-K399 HydrophobicContact CD1-CG 4.3Å; Y395-K399 HydrophobicContact CE1-CG 3.87Å; Y395-K399 HydrophobicContact CE2-CG 4.3Å; Y395-K399 VanDerWaalsContact CZ-CE 3.47Å; Y395-K399 WeakPolarHBondContact O-CG 3.4Å; Y395-K399 PolarHBondContact O-N 3.25Å; Y395-K399 WeakPolarHBondContact OH-CE 3.46Å; V396-K399 PolarHBondContact O-N 3.25Å; K399-R402 PolarHBondContact O-N 3.28Å; K399-F403 WeakPolarHBondContact O-CB 3.42Å; K399-F403 PolarHBondContact O-N 3.44Å
400	Q	92.4	Very high	91.1	Very high	97 Å²	97	55 Å²	55	45%	0.453	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-44.6	173.9	-70.4	171.5	-2.6	0	0	112.2	L210 V396 Q397 H398 R402 N404	L210-Q400 HydrophobicContact CD1-CG 3.7Å; L210-Q400 HydrophobicContact CD2-CG 4.42Å; V396-Q400 WeakPolarHBondContact O-CG 3.38Å; V396-Q400 PolarHBondContact O-N 2.72Å; V396-Q400 VanDerWaalsContact O-N 3.09Å; Q397-Q400 PolarHBondContact O-N 3.42Å; H398-Q400 VanDerWaalsContact C-N 3.29Å; H398-Q400 PolarHBondContact O-N 2.83Å; Q400-R402 VanDerWaalsContact C-N 3.33Å; Q400-N404 PolarHBondContact O-N 3.45Å; Q400-N404 PolarHBondContact O-ND2 2.69Å; Q400-N404 VanDerWaalsContact O-ND2 3.07Å
401	I	93.1	Very high	91.2	Very high	111 Å²	111	58 Å²	58	57%	0.569	27%	0.272	S	S	*	.	H	α-helix	trans	-61.6	-46.1	176.6	-68.7	165.1	0	0	0	109.9	Q397 H398 N404 E405	Q397-I401 VanDerWaalsContact O-CG1 3.3Å; Q397-I401 WeakPolarHBondContact O-CG1 3.3Å; Q397-I401 PolarHBondContact O-N 2.84Å; H398-I401 PolarHBondContact O-N 2.85Å; H398-I401 VanDerWaalsContact O-N 3.15Å; I401-N404 PolarHBondContact O-N 3.29Å; I401-E405 WeakPolarHBondContact O-CB 3.22Å; I401-E405 PolarHBondContact O-N 2.91Å
402	R	92.9	Very high	90.9	Very high	7 Å²	7	60 Å²	60	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-44.9	-179.5	-174.2	58.4	168.4	174	-3.2	112.1	S296 W297 D300 H398 K399 Q400 N404 E405 L406	S296-R402 PolarHBondContact OG-NH1 3.03Å; W297-R402 VanDerWaalsContact CG-NH2 3.33Å; D300-R402 WeakPolarHBondContact OD2-CG 3.27Å; D300-R402 IonicContact OD2-CZ 3.3Å; D300-R402 IonicContact OD2-NE 2.72Å; D300-R402 PolarHBondContact OD2-NE 3.48Å; D300-R402 IonicContact OD2-NH2 3.62Å; H398-R402 VanDerWaalsContact O-CB 3.31Å; H398-R402 WeakPolarHBondContact O-CB 3.08Å; H398-R402 PolarHBondContact O-N 3.33Å; K399-R402 PolarHBondContact O-N 3.28Å; Q400-R402 VanDerWaalsContact C-N 3.33Å; R402-N404 VanDerWaalsContact C-N 3.31Å; R402-N404 PolarHBondContact O-N 2.95Å; R402-E405 WeakPolarHBondContact CD-OE2 3.37Å; R402-E405 IonicContact CZ-OE2 2.81Å; R402-E405 VanDerWaalsContact NH1-CD 3.29Å; R402-E405 IonicContact NH1-OE1 3.25Å; R402-E405 PolarHBondContact NH1-OE1 3.46Å; R402-E405 IonicContact NH1-OE2 3.9Å; R402-E405 PolarHBondContact NH1-OE2 2.88Å; R402-E405 WeakPolarHBondContact O-CB 3.19Å; R402-E405 PolarHBondContact O-N 2.99Å; R402-L406 HydrophobicContact CG-CD1 4.23Å; R402-L406 HydrophobicContact CG-CG 4.46Å; R402-L406 VanDerWaalsContact O-CG 3.32Å; R402-L406 WeakPolarHBondContact O-CG 3.46Å; R402-L406 PolarHBondContact O-N 3.26Å
403	F	90.7	Very high	90.5	Very high	125 Å²	125	61.5 Å²	61.5	55%	0.548	29%	0.294	S	S	.	.	H	α-helix	trans	-56.1	-46.3	174.5	178.6	-100.2	0	0	0	111.8	K399 L406 N407	K399-F403 WeakPolarHBondContact O-CB 3.42Å; K399-F403 PolarHBondContact O-N 3.44Å; F403-L406 PolarHBondContact O-N 3.36Å; F403-N407 WeakPolarHBondContact CD1-ND2 3.39Å; F403-N407 WeakPolarHBondContact CE1-ND2 3.48Å; F403-N407 VanDerWaalsContact CZ-ND2 3.27Å; F403-N407 WeakPolarHBondContact CZ-ND2 3.37Å; F403-N407 WeakPolarHBondContact O-CB 3.46Å; F403-N407 VanDerWaalsContact O-CG 3.24Å; F403-N407 PolarHBondContact O-N 3.05Å; F403-N407 PolarHBondContact O-ND2 2.69Å
404	N	92.5	Very high	89.9	Confident	88 Å²	88	63.5 Å²	63.5	47%	0.471	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-39.1	178	-68.6	-35.6	0	0	0	112.8	Q400 I401 R402 N407 R408	Q400-N404 PolarHBondContact O-N 3.45Å; Q400-N404 PolarHBondContact O-ND2 2.69Å; Q400-N404 VanDerWaalsContact O-ND2 3.07Å; I401-N404 PolarHBondContact O-N 3.29Å; R402-N404 VanDerWaalsContact C-N 3.31Å; R402-N404 PolarHBondContact O-N 2.95Å; N404-N407 PolarHBondContact O-N 3.46Å; N404-R408 WeakPolarHBondContact O-CG 3.23Å; N404-R408 PolarHBondContact O-N 2.94Å; N404-R408 VanDerWaalsContact O-N 3.07Å
405	E	91.5	Very high	88.4	Confident	69 Å²	69	69.4 Å²	69.4	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-50.3	174.9	-176.6	-171	-174.6	0	0	111.1	S296 I401 R402 N407 R408 L409	S296-E405 PolarHBondContact OG-OE1 3.08Å; S296-E405 VanDerWaalsContact OG-OE1 3.12Å; I401-E405 WeakPolarHBondContact O-CB 3.22Å; I401-E405 PolarHBondContact O-N 2.91Å; R402-E405 WeakPolarHBondContact CD-OE2 3.37Å; R402-E405 IonicContact CZ-OE2 2.81Å; R402-E405 VanDerWaalsContact NH1-CD 3.29Å; R402-E405 IonicContact NH1-OE1 3.25Å; R402-E405 PolarHBondContact NH1-OE1 3.46Å; R402-E405 IonicContact NH1-OE2 3.9Å; R402-E405 PolarHBondContact NH1-OE2 2.88Å; R402-E405 WeakPolarHBondContact O-CB 3.19Å; R402-E405 PolarHBondContact O-N 2.99Å; E405-N407 VanDerWaalsContact C-N 3.32Å; E405-N407 PolarHBondContact O-N 3.47Å; E405-R408 WeakPolarHBondContact O-CB 3.39Å; E405-R408 PolarHBondContact O-N 3.29Å; E405-R408 VanDerWaalsContact O-N 3.17Å; E405-L409 WeakPolarHBondContact O-CG 3.33Å; E405-L409 PolarHBondContact O-N 2.86Å
406	L	91.4	Very high	86.2	Confident	29 Å²	29	75.4 Å²	75.4	15%	0.152	36%	0.355	C	S	.	.	H	α-helix	trans	-64.2	-36	179.3	-67	179.3	0	0	0	112.3	R275 W297 R402 F403 L409 T410	R275-L406 PolarHBondContact NH2-O 3.28Å; W297-L406 HydrophobicContact CZ2-CD2 3.99Å; R402-L406 HydrophobicContact CG-CD1 4.23Å; R402-L406 HydrophobicContact CG-CG 4.46Å; R402-L406 VanDerWaalsContact O-CG 3.32Å; R402-L406 WeakPolarHBondContact O-CG 3.46Å; R402-L406 PolarHBondContact O-N 3.26Å; F403-L406 PolarHBondContact O-N 3.36Å; L406-L409 HydrophobicContact CD2-CD1 4.31Å; L406-L409 PolarHBondContact O-N 3.15Å; L406-T410 PolarHBondContact O-N 3.4Å; L406-T410 PolarHBondContact O-OG1 2.86Å
407	N	89.4	Confident	83.6	Confident	61 Å²	61	80.4 Å²	80.4	33%	0.326	39%	0.387	S	S	.	.	H	α-helix	trans	-64.2	-43.2	173.8	-72.4	-18.4	0	0	0	111.5	F403 N404 E405 L409 T410 E411	F403-N407 WeakPolarHBondContact CD1-ND2 3.39Å; F403-N407 WeakPolarHBondContact CE1-ND2 3.48Å; F403-N407 VanDerWaalsContact CZ-ND2 3.27Å; F403-N407 WeakPolarHBondContact CZ-ND2 3.37Å; F403-N407 WeakPolarHBondContact O-CB 3.46Å; F403-N407 VanDerWaalsContact O-CG 3.24Å; F403-N407 PolarHBondContact O-N 3.05Å; F403-N407 PolarHBondContact O-ND2 2.69Å; N404-N407 PolarHBondContact O-N 3.46Å; E405-N407 VanDerWaalsContact C-N 3.32Å; E405-N407 PolarHBondContact O-N 3.47Å; N407-L409 PolarHBondContact O-N 3.15Å; N407-T410 WeakPolarHBondContact O-CB 3.49Å; N407-T410 PolarHBondContact O-N 2.92Å; N407-E411 WeakPolarHBondContact O-CG 2.98Å; N407-E411 PolarHBondContact O-N 2.84Å
408	R	90.7	Very high	80.9	Confident	183 Å²	183	82.5 Å²	82.5	69%	0.691	40%	0.399	S	S	*	.	H	α-helix	trans	-62.3	-41.7	175.5	-72.2	174.4	-178.6	-175.6	1	112.6	N404 E405 T410 E411 S412	N404-R408 WeakPolarHBondContact O-CG 3.23Å; N404-R408 PolarHBondContact O-N 2.94Å; N404-R408 VanDerWaalsContact O-N 3.07Å; E405-R408 WeakPolarHBondContact O-CB 3.39Å; E405-R408 PolarHBondContact O-N 3.29Å; E405-R408 VanDerWaalsContact O-N 3.17Å; R408-T410 VanDerWaalsContact C-N 3.31Å; R408-T410 PolarHBondContact O-N 2.6Å; R408-E411 PolarHBondContact O-N 3.12Å; R408-S412 PolarHBondContact O-N 3.17Å; R408-S412 PolarHBondContact O-OG 2.96Å
409	L	89.2	Confident	77.9	Confident	20 Å²	20	87.1 Å²	87.1	11%	0.105	43%	0.43	C	S	.	.	H	α-helix	trans	-62.5	-40.2	174.7	-70.2	173.7	0	0	0	111.8	P271 E405 L406 N407 E411 S412 N413	P271-L409 HydrophobicContact CB-CD2 3.67Å; P271-L409 HydrophobicContact CG-CD2 3.48Å; P271-L409 VanDerWaalsContact CG-CD2 3.48Å; E405-L409 WeakPolarHBondContact O-CG 3.33Å; E405-L409 PolarHBondContact O-N 2.86Å; L406-L409 HydrophobicContact CD2-CD1 4.31Å; L406-L409 PolarHBondContact O-N 3.15Å; N407-L409 PolarHBondContact O-N 3.15Å; L409-E411 VanDerWaalsContact C-N 3.29Å; L409-E411 PolarHBondContact O-N 2.81Å; L409-S412 WeakPolarHBondContact CA-OG 3.31Å; L409-S412 PolarHBondContact O-N 3.19Å; L409-S412 PolarHBondContact O-OG 3.06Å; L409-N413 WeakPolarHBondContact O-CB 3.41Å; L409-N413 VanDerWaalsContact O-CG 3.23Å; L409-N413 PolarHBondContact O-N 3.19Å; L409-N413 PolarHBondContact O-ND2 3.24Å
410	T	86.8	Confident	75	Confident	31 Å²	31	92 Å²	92	19%	0.19	46%	0.457	C	S	.	.	H	α-helix	trans	-62	-39.8	175.2	-48.6	0	0	0	0	111.1	R275 L406 N407 R408 K414	R275-T410 PolarHBondContact NH1-OG1 3.48Å; R275-T410 PolarHBondContact NH2-OG1 2.68Å; L406-T410 PolarHBondContact O-N 3.4Å; L406-T410 PolarHBondContact O-OG1 2.86Å; N407-T410 WeakPolarHBondContact O-CB 3.49Å; N407-T410 PolarHBondContact O-N 2.92Å; R408-T410 VanDerWaalsContact C-N 3.31Å; R408-T410 PolarHBondContact O-N 2.6Å; T410-K414 WeakPolarHBondContact O-CG 3.02Å; T410-K414 PolarHBondContact O-N 3.38Å
411	E	85.3	Confident	72.2	Confident	113 Å²	113	92.4 Å²	92.4	53%	0.528	47%	0.467	S	S	.	.	H	α-helix	trans	-71.7	-36.4	177.2	-71.4	177.1	-176.9	0	0	113.3	N407 R408 L409 K414 K415	N407-E411 WeakPolarHBondContact O-CG 2.98Å; N407-E411 PolarHBondContact O-N 2.84Å; R408-E411 PolarHBondContact O-N 3.12Å; L409-E411 VanDerWaalsContact C-N 3.29Å; L409-E411 PolarHBondContact O-N 2.81Å; E411-K414 PolarHBondContact O-N 3.3Å; E411-K415 WeakPolarHBondContact O-CG 3.26Å
412	S	85.4	Confident	69.2	Low	42 Å²	42	93.1 Å²	93.1	29%	0.294	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-42.9	176.7	60.8	0	0	0	0	111.5	R408 L409 K414 K415	R408-S412 PolarHBondContact O-N 3.17Å; R408-S412 PolarHBondContact O-OG 2.96Å; L409-S412 WeakPolarHBondContact CA-OG 3.31Å; L409-S412 PolarHBondContact O-N 3.19Å; L409-S412 PolarHBondContact O-OG 3.06Å; S412-K414 PolarHBondContact O-N 2.91Å; S412-K415 PolarHBondContact O-N 3.36Å
413	N	83.1	Confident	66.6	Low	32 Å²	32	102.2 Å²	102.2	17%	0.171	51%	0.507	C	S	.	.	H	α-helix	trans	-69.3	-18.3	-179.5	-67	-22.7	0	0	0	113.4	A87 D273 L409	A87-N413 HydrophobicContact CB-CB 3.61Å; D273-N413 VanDerWaalsContact CB-ND2 3.25Å; D273-N413 WeakPolarHBondContact CB-ND2 3.35Å; D273-N413 PolarHBondContact OD2-ND2 3.38Å; L409-N413 WeakPolarHBondContact O-CB 3.41Å; L409-N413 VanDerWaalsContact O-CG 3.23Å; L409-N413 PolarHBondContact O-N 3.19Å; L409-N413 PolarHBondContact O-ND2 3.24Å
414	K	75.4	Confident	63.8	Low	139 Å²	139	103.5 Å²	103.5	60%	0.604	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-20.4	171.2	-75.4	175.2	-179.9	-177.1	0	113.3	T410 E411 S412	T410-K414 WeakPolarHBondContact O-CG 3.02Å; T410-K414 PolarHBondContact O-N 3.38Å; E411-K414 PolarHBondContact O-N 3.3Å; S412-K414 PolarHBondContact O-N 2.91Å
415	K	61.5	Low	61	Low	160 Å²	160	107.3 Å²	107.3	70%	0.696	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-16.2	-172.4	-72.3	175.2	-176.5	174.7	0	113.6	E411 S412 P417	E411-K415 WeakPolarHBondContact O-CG 3.26Å; S412-K415 PolarHBondContact O-N 3.36Å; K415-P417 WeakPolarHBondContact O-CD 3.47Å
416	E	48.9	Very low	58.3	Low	126 Å²	126	111 Å²	111	59%	0.589	56%	0.561	S	S	*	*	S	Bend	trans	-69.8	112.3	173.7	-70.3	-165.4	160.7	0	0	109.2	M418	E416-M418 PolarHBondContact O-N 3.13Å
417	P	35.4	Very low	55.6	Low	116 Å²	116	119.6 Å²	119.6	75%	0.753	60%	0.598	S	S	*	*			trans	-67.7	134.6	172.2	29.1	-29.9	0	0	0	107.9	K415	K415-P417 WeakPolarHBondContact O-CD 3.47Å
418	M	35.8	Very low	52.9	Low	142 Å²	142	122.3 Å²	122.3	70%	0.7	62%	0.618	S	S	*	*			trans	-46.4	140.9	165.5	-76.2	-72.1	-65.5	0	0	109	E416 N420	E416-M418 PolarHBondContact O-N 3.13Å; M418-N420 VanDerWaalsContact C-N 3.34Å; M418-N420 PolarHBondContact O-N 2.78Å
419	P	31.9	Very low	50	Low	115 Å²	115	123.5 Å²	123.5	75%	0.747	63%	0.629	S	S	*	*			trans	-59.8	102.9	169	-12.6	25.5	0	0	0	107.4	T421	P419-T421 PolarHBondContact O-N 3.49Å; P419-T421 VanDerWaalsContact O-N 3.12Å
420	N	32	Very low	47.6	Very low	125 Å²	125	128.4 Å²	128.4	67%	0.668	67%	0.665	S	S	*	*			trans	-62.8	113.9	164	-79.3	-5.6	0	0	0	105.8	M418 D422	M418-N420 VanDerWaalsContact C-N 3.34Å; M418-N420 PolarHBondContact O-N 2.78Å; N420-D422 PolarHBondContact O-N 3.38Å
421	T	32.7	Very low	45.1	Very low	106 Å²	106	135.8 Å²	135.8	65%	0.65	70%	0.697	S	S	*	*			trans	-66.5	68.8	157.8	33.8	0	0	0	0	108.8	P419 Y423	P419-T421 PolarHBondContact O-N 3.49Å; P419-T421 VanDerWaalsContact O-N 3.12Å; T421-Y423 VanDerWaalsContact C-N 3.26Å; T421-Y423 HydrophobicContact CG2-CE2 3.83Å; T421-Y423 PolarHBondContact O-N 3.03Å; T421-Y423 VanDerWaalsContact O-N 3.1Å
422	D	30.2	Very low	42.8	Very low	126 Å²	126	136 Å²	136	67%	0.674	71%	0.711	S	S	*	*			trans	-79.5	82.5	165.7	-75.1	-26.7	0	0	0	107	N420 N424	N420-D422 PolarHBondContact O-N 3.38Å; D422-N424 PolarHBondContact O-N 3Å; D422-N424 VanDerWaalsContact O-N 3.07Å
423	Y	38.2	Very low	40.3	Very low	198 Å²	198	141.6 Å²	141.6	78%	0.776	74%	0.738	S	S	*	*			trans	-66.3	106.7	164	-64.7	-78.6	0	0	0	107.7	T421 L425	T421-Y423 VanDerWaalsContact C-N 3.26Å; T421-Y423 HydrophobicContact CG2-CE2 3.83Å; T421-Y423 PolarHBondContact O-N 3.03Å; T421-Y423 VanDerWaalsContact O-N 3.1Å; Y423-L425 PolarHBondContact O-N 3.22Å
424	N	32.5	Very low	38.2	Very low	152 Å²	152	145.7 Å²	145.7	81%	0.813	77%	0.769	S	S	*	*			trans	-45.7	102.1	174.1	-91.2	-47.5	0	0	0	112.4	D422 N426	D422-N424 PolarHBondContact O-N 3Å; D422-N424 VanDerWaalsContact O-N 3.07Å; N424-N426 VanDerWaalsContact C-N 3.34Å; N424-N426 PolarHBondContact O-N 3.47Å; N424-N426 VanDerWaalsContact O-N 3.13Å
425	L	34.5	Very low	36.3	Very low	169 Å²	169	143.7 Å²	143.7	89%	0.885	77%	0.773	S	S	*	*			trans	-75.4	86.3	159.9	-79.3	159.9	0	0	0	108.5	Y423	Y423-L425 PolarHBondContact O-N 3.22Å
426	N	33.3	Very low	35.2	Very low	145 Å²	145	143.8 Å²	143.8	78%	0.775	78%	0.781	S	S	*	*			trans	-149.9	84.9	166.7	-91.6	-31.9	0	0	0	110.8	N424	N424-N426 VanDerWaalsContact C-N 3.34Å; N424-N426 PolarHBondContact O-N 3.47Å; N424-N426 VanDerWaalsContact O-N 3.13Å
427	K	35.7	Very low	34.5	Very low	210 Å²	210	142.4 Å²	142.4	91%	0.913	79%	0.785	S	S	*	*			trans	-156.5	141.4	148.8	-119.1	176.1	179.4	177.8	0	111.4
428	P	31.8	Very low	34.5	Very low	118 Å²	118	143.6 Å²	143.6	77%	0.766	79%	0.785	S	S	*	*			trans	-93.6	141.6	-157.4	35.2	-31.3	0	0	0	114.8
429	K	30.8	Very low	34.9	Very low	208 Å²	208	141.8 Å²	141.8	90%	0.904	79%	0.786	S	S	*	*			trans	23.6	118.2	147.4	-65.2	179.1	177.2	178.2	0	119.9
430	S	37.6	Very low	35	Very low	123 Å²	123	146 Å²	146	86%	0.86	80%	0.796	S	S	*	*			trans	-151.2	152.5	130.6	52.2	0	0	0	0	110.5
431	E	34.4	Very low	35.4	Very low	187 Å²	187	148.3 Å²	148.3	87%	0.874	80%	0.802	S	S	*	*			trans	-68.1	143.2	-156.2	-67.2	142.9	172.7	0	0	116.7
432	S	37.4	Very low	35.9	Very low	118 Å²	118	148.8 Å²	148.8	83%	0.825	81%	0.81	S	S	*	*				171.5	149.5	117.3	43.8	0	0	0	0	112.9
433	D	33	Very low	36.3	Very low	158 Å²	158	147.8 Å²	147.8	85%	0.845	81%	0.805	S	S	*	*			trans	-60.4	139.5	-165.3	-56.2	-59.1	0	0	0	117.3
434	S	40.1	Very low	36.4	Very low	118 Å²	118	141.1 Å²	141.1	83%	0.825	79%	0.787	S	S	*	*				159.4	147	108.8	63.6	0	0	0	0	113.1
435	S	34.7	Very low	37.1	Very low	98 Å²	98	136.8 Å²	136.8	69%	0.685	77%	0.769	S	S	*	*			trans	-47.9	133.5	-174.5	52.6	0	0	0	0	118
436	N	39.3	Very low	38	Very low	162 Å²	162	135.9 Å²	135.9	87%	0.866	76%	0.755	S	S	*	*				174.9	150.8	103.5	-96	-33	0	0	0	113.8
437	S	33.3	Very low	39.1	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	74%	0.741	S	S	*	*			trans	-72.1	156.5	-169	-140.9	0	0	0	0	116
438	D	34.9	Very low	39.9	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	72%	0.721	S	S	*	*			trans	85	97.6	145.6	-58.7	-13.5	0	0	0	120.1
439	S	45.3	Very low	41.2	Very low	104 Å²	104	124.3 Å²	124.3	73%	0.727	70%	0.695	S	S	*	*				150.9	109.8	109.3	57.1	0	0	0	0	111.7	H441	S439-H441 PolarHBondContact O-N 3.06Å
440	E	33.4	Very low	42.3	Very low	203 Å²	203	116 Å²	116	95%	0.949	66%	0.66	S	S	*	*			trans	-79.9	105.1	175.7	-66.5	-178.5	173.3	0	0	110.1
441	H	41.3	Very low	43	Very low	174 Å²	174	110.6 Å²	110.6	81%	0.806	63%	0.625	S	S	*	*			trans	-94.7	110	159.3	-82	-60.8	0	0	0	108.8	S439 D443	S439-H441 PolarHBondContact O-N 3.06Å; H441-D443 PolarHBondContact O-N 3.32Å
442	S	41.3	Very low	43.5	Very low	117 Å²	117	112.8 Å²	112.8	82%	0.818	63%	0.625	S	S	*	*			trans	-59	105	169.1	179.5	0	0	0	0	109.9	S444	S442-S444 PolarHBondContact O-N 3.4Å
443	D	39.5	Very low	43.9	Very low	104 Å²	104	111 Å²	111	56%	0.556	61%	0.609	S	S	*	*			trans	-78.8	88.6	175.8	-170.4	18.7	0	0	0	109.2	H441 S445	H441-D443 PolarHBondContact O-N 3.32Å; D443-S445 PolarHBondContact O-N 3.35Å
444	S	39.4	Very low	45	Very low	58 Å²	58	107.1 Å²	107.1	41%	0.406	59%	0.591	S	S	.	*			trans	-84.9	101	169.4	46.2	0	0	0	0	109.3	S442 Y446	S442-S444 PolarHBondContact O-N 3.4Å; S444-Y446 WeakPolarHBondContact O-CD2 3.43Å
445	S	49.2	Very low	45.7	Very low	61 Å²	61	104.6 Å²	104.6	43%	0.427	57%	0.571	S	S	.	*			trans	-70.2	139.3	164	59.2	0	0	0	0	109.7	D443	D443-S445 PolarHBondContact O-N 3.35Å
446	Y	52	Low	46.2	Very low	151 Å²	151	106 Å²	106	59%	0.592	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-123.5	153.6	172.1	-69	-86.9	0	0	0	110.8	S444 V457	S444-Y446 WeakPolarHBondContact O-CD2 3.43Å; Y446-V457 PolarHBondContact O-N 2.98Å; Y446-V457 VanDerWaalsContact O-N 3.15Å
447	D	57.7	Low	46.5	Very low	91 Å²	91	102 Å²	102	49%	0.487	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.9	-176.1	-71.5	19.1	0	0	0	108.5	V454 H456	D447-V454 HydrophobicContact CB-CG1 3.56Å; D447-H456 IonicContact OD1-CE1 3.67Å; D447-H456 PolarHBondContact OD1-CE1 3.02Å; D447-H456 IonicContact OD1-CG 3.93Å; D447-H456 IonicContact OD1-ND1 3.14Å; D447-H456 PolarHBondContact OD1-ND1 3.01Å; D447-H456 IonicContact OD2-CE1 3.22Å; D447-H456 PolarHBondContact OD2-CE1 3.06Å; D447-H456 IonicContact OD2-ND1 3.71Å; D447-H456 IonicContact OD2-NE2 3.81Å
448	I	52.6	Low	46.6	Very low	95 Å²	95	100.4 Å²	100.4	49%	0.487	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	104.5	171.7	-61.8	-178.9	0	0	0	106.9	D450 T455 V457	I448-D450 PolarHBondContact O-N 2.87Å; I448-T455 PolarHBondContact N-O 2.96Å; I448-T455 PolarHBondContact O-N 3.18Å; I448-T455 PolarHBondContact O-OG1 3.19Å; I448-V457 HydrophobicContact CD1-CB 4.35Å; I448-V457 HydrophobicContact CD1-CG2 3.67Å; I448-V457 HydrophobicContact CG1-CG2 4.27Å
449	D	58.2	Low	46.7	Very low	43 Å²	43	102.5 Å²	102.5	23%	0.23	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	107	170.6	-176	-2.5	0	0	0	108.8	T281 G451 V454	T281-D449 VanDerWaalsContact CG2-OD2 3.24Å; T281-D449 WeakPolarHBondContact CG2-OD2 3.41Å; D449-G451 PolarHBondContact O-N 3.17Å; D449-G451 PolarHBondContact OD1-N 2.75Å; D449-V454 HydrophobicContact CB-CG2 4.29Å
450	D	54.7	Low	46.6	Very low	33 Å²	33	102 Å²	102	18%	0.176	54%	0.535	C	S	.	.			trans	-84.5	10.3	-178.4	78.2	-2.7	0	0	0	113.3	K135 I448 R452 T453	K135-D450 VanDerWaalsContact CE-O 3.31Å; K135-D450 WeakPolarHBondContact CE-O 3.33Å; K135-D450 IonicContact NZ-OD1 2.88Å; K135-D450 IonicContact NZ-OD2 3.89Å; K135-D450 PolarHBondContact NZ-OD2 2.83Å; I448-D450 PolarHBondContact O-N 2.87Å; D450-R452 VanDerWaalsContact C-N 3.32Å; D450-R452 PolarHBondContact OD1-N 3.07Å; D450-T453 VanDerWaalsContact CG-O 3.24Å; D450-T453 VanDerWaalsContact CG-OG1 3.25Å; D450-T453 PolarHBondContact N-O 2.71Å; D450-T453 WeakPolarHBondContact OD1-CA 3.33Å; D450-T453 PolarHBondContact OD1-N 2.98Å; D450-T453 PolarHBondContact OD1-OG1 3.22Å; D450-T453 PolarHBondContact OD2-OG1 3.11Å
451	G	52	Low	46.9	Very low	11 Å²	11	101.7 Å²	101.7	11%	0.113	53%	0.531	C	S	.	.	S	Bend	trans	82.7	-0.7	-179.4	0	0	0	0	0	115.2	R189 D449	R189-G451 VanDerWaalsContact NH2-CA 3.31Å; D449-G451 PolarHBondContact O-N 3.17Å; D449-G451 PolarHBondContact OD1-N 2.75Å
452	R	44.8	Very low	46.7	Very low	232 Å²	232	100.5 Å²	100.5	88%	0.875	54%	0.535	S	S	*	.	S	Bend	trans	-135	-26.8	168.1	-78.2	-174.8	176.6	167.5	-0.3	113.1	D450	D450-R452 VanDerWaalsContact C-N 3.32Å; D450-R452 PolarHBondContact OD1-N 3.07Å
453	T	44.5	Very low	46.4	Very low	80 Å²	80	98.1 Å²	98.1	49%	0.491	53%	0.529	S	S	.	.			trans	-147	140.6	-174.3	38.5	0	0	0	0	110.5	D450	D450-T453 VanDerWaalsContact CG-O 3.24Å; D450-T453 VanDerWaalsContact CG-OG1 3.25Å; D450-T453 PolarHBondContact N-O 2.71Å; D450-T453 WeakPolarHBondContact OD1-CA 3.33Å; D450-T453 PolarHBondContact OD1-N 2.98Å; D450-T453 PolarHBondContact OD1-OG1 3.22Å; D450-T453 PolarHBondContact OD2-OG1 3.11Å
454	V	56.9	Low	46.2	Very low	77 Å²	77	102.3 Å²	102.3	47%	0.467	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.3	172.7	-179.4	0	0	0	0	108	D447 D449	D447-V454 HydrophobicContact CB-CG1 3.56Å; D449-V454 HydrophobicContact CB-CG2 4.29Å
455	T	54	Low	45.7	Very low	66 Å²	66	108 Å²	108	41%	0.405	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	120.3	174.8	49.7	0	0	0	0	110.4	I448	I448-T455 PolarHBondContact N-O 2.96Å; I448-T455 PolarHBondContact O-N 3.18Å; I448-T455 PolarHBondContact O-OG1 3.19Å
456	H	45.8	Very low	44.8	Very low	127 Å²	127	113.1 Å²	113.1	59%	0.588	59%	0.586	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.4	121.8	172.3	-67.4	-82.3	0	0	0	109.3	D447	D447-H456 IonicContact OD1-CE1 3.67Å; D447-H456 PolarHBondContact OD1-CE1 3.02Å; D447-H456 IonicContact OD1-CG 3.93Å; D447-H456 IonicContact OD1-ND1 3.14Å; D447-H456 PolarHBondContact OD1-ND1 3.01Å; D447-H456 IonicContact OD2-CE1 3.22Å; D447-H456 PolarHBondContact OD2-CE1 3.06Å; D447-H456 IonicContact OD2-ND1 3.71Å; D447-H456 IonicContact OD2-NE2 3.81Å
457	V	44.7	Very low	43.8	Very low	77 Å²	77	115.7 Å²	115.7	47%	0.467	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111	113.1	174.9	-176.7	0	0	0	0	109.9	Y446 I448	Y446-V457 PolarHBondContact O-N 2.98Å; Y446-V457 VanDerWaalsContact O-N 3.15Å; I448-V457 HydrophobicContact CD1-CB 4.35Å; I448-V457 HydrophobicContact CD1-CG2 3.67Å; I448-V457 HydrophobicContact CG1-CG2 4.27Å
458	S	35.9	Very low	42.4	Very low	65 Å²	65	121 Å²	121	46%	0.455	62%	0.619	S	S	.	*			trans	-84.5	133.6	170	-47.3	0	0	0	0	110	S460	S458-S460 PolarHBondContact O-N 2.97Å
459	K	38.1	Very low	41.4	Very low	183 Å²	183	125.8 Å²	125.8	80%	0.796	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	10.4	-176.1	-100.2	-179.4	176.2	171.3	0	115.4
460	S	43.5	Very low	40	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	4.7	-167.5	53.4	0	0	0	0	116.4	S458	S458-S460 PolarHBondContact O-N 2.97Å
461	K	37.9	Very low	38.9	Very low	197 Å²	197	138 Å²	138	86%	0.857	70%	0.7	S	S	*	*	S	Bend	trans	-104.9	-1.9	-179.6	-90.3	-177.1	176.8	179.3	0	117.4	G463	K461-G463 PolarHBondContact O-N 2.86Å
462	V	38.4	Very low	38	Very low	149 Å²	149	146.8 Å²	146.8	90%	0.903	74%	0.735	S	S	*	*	S	Bend	trans	-101.7	72.7	176.6	-172.7	0	0	0	0	109.6
463	G	34.2	Very low	37.3	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	73%	0.733	S	S	*	*	S	Bend	trans	-174.2	12.7	-174.9	0	0	0	0	0	118.5	K461	K461-G463 PolarHBondContact O-N 2.86Å
464	Q	34.7	Very low	36.8	Very low	192 Å²	192	148.2 Å²	148.2	90%	0.897	74%	0.743	S	S	*	*			trans	-147.3	51.7	176.7	-71.3	-169.6	-6.1	0	0	113.3
465	K	30.4	Very low	35.6	Very low	177 Å²	177	153.7 Å²	153.7	77%	0.77	76%	0.755	S	S	*	*			trans	-142.8	80.9	164.7	-79.6	-177.1	-178.9	169.1	0	108.6
466	N	30	Very low	34.4	Very low	170 Å²	170	156.5 Å²	156.5	91%	0.909	76%	0.764	S	S	*	*			trans	-179.9	64.7	161.3	-90.3	-23.2	0	0	0	110.8
467	K	30.6	Very low	33.8	Very low	204 Å²	204	157.8 Å²	157.8	89%	0.887	77%	0.767	S	S	*	*			trans	-166.5	75.8	166.6	-123.4	177.6	-174.7	176.3	0	111.4
468	K	29.3	Very low	33.2	Very low	204 Å²	204	160.2 Å²	160.2	89%	0.887	78%	0.778	S	S	*	*			trans	177.2	104.3	156.4	-102.3	162	-175.3	-177.7	0	107.7
469	E	29.7	Very low	33	Very low	194 Å²	194	166.5 Å²	166.5	91%	0.907	79%	0.793	S	S	*	*			trans	168.1	93.9	138.9	-94.2	175.6	179.5	0	0	110.7
470	K	29.7	Very low	32.9	Very low	197 Å²	197	163.1 Å²	163.1	86%	0.857	79%	0.788	S	S	*	*			trans	-144.7	96.5	151.4	-87.9	-172.2	179.2	176.6	0	105.9
471	T	31.9	Very low	32.2	Very low	135 Å²	135	165.4 Å²	165.4	83%	0.828	79%	0.793	S	S	*	*			trans	173	134.5	134.1	25.6	0	0	0	0	113
472	K	33.8	Very low	32	Very low	196 Å²	196	161.3 Å²	161.3	85%	0.852	79%	0.788	S	S	*	*			trans	90.8	98.1	151.5	-70.4	172.3	178.8	-179	0	120
473	K	29.7	Very low	31.7	Very low	192 Å²	192	163.6 Å²	163.6	84%	0.835	79%	0.786	S	S	*	*			trans	-13.5	135.9	134.7	-63	174.4	173.1	179.1	0	112.8
474	H	33.4	Very low	31.7	Very low	150 Å²	150	169 Å²	169	69%	0.694	79%	0.791	S	S	*	*				171.8	141.2	72.8	-130.2	-67.5	0	0	0	109.6
475	R	30.9	Very low	31.6	Very low	193 Å²	193	167.8 Å²	167.8	73%	0.728	79%	0.785	S	S	*	*			trans	62.6	115.2	144.9	-90.3	178.5	150.9	156.5	-1.8	121.1
476	E	30.8	Very low	31.8	Very low	124 Å²	124	167.8 Å²	167.8	58%	0.579	79%	0.788	S	S	*	*				71.1	132.9	101.2	-74.5	-174.2	130	0	0	112.7
477	K	31.9	Very low	32	Very low	154 Å²	154	164.1 Å²	164.1	67%	0.67	77%	0.773	S	S	*	*			cis	-179.9	158.1	14.1	-116.5	168.1	177.9	159.6	0	107.4
478	N	33.1	Very low	32	Very low	128 Å²	128	161.9 Å²	161.9	68%	0.684	77%	0.771	S	S	*	*			trans	75	147.2	149.1	-59.2	-10.6	0	0	0	118.6
479	Y	31.9	Very low	32.2	Very low	198 Å²	198	161.7 Å²	161.7	78%	0.776	77%	0.77	S	S	*	*			cis	-170.2	145.8	4.8	-129.8	-125.9	0	0	0	108.7
480	V	35	Very low	32.2	Very low	112 Å²	112	158.6 Å²	158.6	68%	0.679	77%	0.77	S	S	*	*			trans	55.3	113.7	133.6	177.7	0	0	0	0	120.2
481	N	29.2	Very low	32.1	Very low	141 Å²	141	157.2 Å²	157.2	75%	0.754	77%	0.769	S	S	*	*				96.7	143	69.5	-149.3	11.1	0	0	0	113.8
482	S	34.4	Very low	32	Very low	110 Å²	110	158.9 Å²	158.9	77%	0.769	77%	0.771	S	S	*	*			trans	128.6	92.3	162.7	-54.9	0	0	0	0	113.1
483	K	31.1	Very low	31.8	Very low	197 Å²	197	155.2 Å²	155.2	86%	0.857	76%	0.761	S	S	*	*				65.1	111.4	86.2	-83.4	-168.1	175.8	-177	0	117.4
484	K	34.1	Very low	31.6	Very low	180 Å²	180	152.5 Å²	152.5	78%	0.783	76%	0.761	S	S	*	*				162.5	113.2	125.6	-90.4	-179.4	176	-171.7	0	110.6
485	E	33.4	Very low	31.6	Very low	167 Å²	167	152 Å²	152	78%	0.78	76%	0.763	S	S	*	*				70.2	128.8	103.2	-74.3	170.8	-171.6	0	0	112.7
486	E	34.4	Very low	31.4	Very low	177 Å²	177	150.5 Å²	150.5	83%	0.827	77%	0.765	S	S	*	*			cis	-172.5	-168.1	1.6	-149.6	-174	-144.5	0	0	107
487	P	34.9	Very low	31.6	Very low	93 Å²	93	148.6 Å²	148.6	60%	0.604	77%	0.765	S	S	*	*				-101	163.5	-109.2	39	-24.2	0	0	0	116.1
488	N	30.3	Very low	31.6	Very low	158 Å²	158	149.4 Å²	149.4	85%	0.845	78%	0.777	S	S	*	*			trans	154.7	95.8	144.5	-80.7	-32.3	0	0	0	113.2
489	K	33.5	Very low	31.7	Very low	200 Å²	200	149.1 Å²	149.1	87%	0.87	77%	0.771	S	S	*	*			trans	163.2	117.1	137	-104	177.3	173.3	173.8	0	108.8	M491	K489-M491 VanDerWaalsContact C-N 3.32Å; K489-M491 PolarHBondContact O-N 3.46Å
490	S	28	Very low	31.8	Very low	129 Å²	129	143.4 Å²	143.4	90%	0.902	76%	0.76	S	S	*	*			trans	-60.4	91.6	166.2	51.4	0	0	0	0	110.2
491	M	27.8	Very low	32.3	Very low	168 Å²	168	144.2 Å²	144.2	83%	0.828	76%	0.761	S	S	*	*			trans	-95.3	98.9	153.9	-109.5	166.1	67.8	0	0	105	K489	K489-M491 VanDerWaalsContact C-N 3.32Å; K489-M491 PolarHBondContact O-N 3.46Å
492	L	29.9	Very low	33.2	Very low	169 Å²	169	140.2 Å²	140.2	89%	0.885	74%	0.737	S	S	*	*			trans	-88.7	123.9	168.8	-162.3	78.6	0	0	0	107.6
493	N	29.4	Very low	34.5	Very low	119 Å²	119	139 Å²	139	64%	0.636	72%	0.721	S	S	*	*			trans	-57.6	137.3	-172.3	-62.7	-49.5	0	0	0	112.9	D495	N493-D495 VanDerWaalsContact C-N 3.33Å; N493-D495 PolarHBondContact O-N 2.82Å; N493-D495 VanDerWaalsContact O-N 3.1Å
494	T	26.7	Very low	35.9	Very low	135 Å²	135	130 Å²	130	83%	0.828	68%	0.683	S	S	*	*			trans	-68.7	88.6	161	-47.9	0	0	0	0	108
495	D	32	Very low	37.1	Very low	139 Å²	139	123.6 Å²	123.6	74%	0.743	66%	0.656	S	S	*	*			trans	-89.5	108	168.3	-78	-29.1	0	0	0	109.1	N493 S497	N493-D495 VanDerWaalsContact C-N 3.33Å; N493-D495 PolarHBondContact O-N 2.82Å; N493-D495 VanDerWaalsContact O-N 3.1Å; D495-S497 PolarHBondContact O-N 3.45Å
496	E	28.6	Very low	38.3	Very low	162 Å²	162	117.3 Å²	117.3	76%	0.757	63%	0.632	S	S	*	*			trans	-57.1	109.3	165.3	-59.8	-170.9	152.3	0	0	108.7
497	S	33.6	Very low	39.5	Very low	84 Å²	84	109.9 Å²	109.9	59%	0.587	60%	0.601	S	S	*	*			trans	-114.3	106.7	163.3	49.2	0	0	0	0	108.4	D495 E499	D495-S497 PolarHBondContact O-N 3.45Å; S497-E499 PolarHBondContact O-N 3.14Å
498	D	32.6	Very low	40.6	Very low	171 Å²	171	106.2 Å²	106.2	91%	0.914	58%	0.576	S	S	*	*			trans	-63	86.1	163.7	-78	-38.2	0	0	0	107.8
499	E	34.1	Very low	41.8	Very low	123 Å²	123	102.5 Å²	102.5	58%	0.575	56%	0.555	S	S	*	*			trans	-90.8	141.9	-178.4	-72.9	-67.5	-177.4	0	0	112.7	E136 S497	E136-E499 WeakPolarHBondContact OE1-CB 3.42Å; E136-E499 VanDerWaalsContact OE1-CG 3.31Å; E136-E499 WeakPolarHBondContact OE1-CG 3.44Å; E136-E499 VanDerWaalsContact OE2-OE2 3.12Å; S497-E499 PolarHBondContact O-N 3.14Å
500	S	35.3	Very low	42.7	Very low	78 Å²	78	99 Å²	99	55%	0.545	55%	0.546	S	S	.	.			trans	-86.3	121	-153.1	60.5	0	0	0	0	114.5	E136 F502	E136-S500 PolarHBondContact OE2-N 3.2Å; E136-S500 PolarHBondContact OE2-OG 3.4Å; S500-F502 PolarHBondContact O-N 3.03Å; S500-F502 VanDerWaalsContact O-N 3.15Å
501	D	46.2	Very low	43.6	Very low	128 Å²	128	97.1 Å²	97.1	68%	0.684	52%	0.523	S	S	*	.			trans	-69.8	105.1	165.2	-145.5	15.8	0	0	0	106.1	K83 D503	K83-D501 IonicContact NZ-OD2 3.22Å; K83-D501 PolarHBondContact NZ-OD2 3.32Å; D501-D503 PolarHBondContact O-N 3.2Å
502	F	48.1	Very low	44.4	Very low	58 Å²	58	92.8 Å²	92.8	25%	0.254	50%	0.503	S	S	.	.			trans	-59.2	101.9	175.4	174.7	-101.2	0	0	0	108.8	T125 S500 L504 A507	T125-F502 HydrophobicContact CG2-CD1 4.43Å; T125-F502 HydrophobicContact CG2-CE1 3.92Å; T125-F502 HydrophobicContact CG2-CZ 4.42Å; S500-F502 PolarHBondContact O-N 3.03Å; S500-F502 VanDerWaalsContact O-N 3.15Å; F502-L504 HydrophobicContact CE1-CB 4.5Å; F502-L504 HydrophobicContact CE1-CD1 4.34Å; F502-L504 PolarHBondContact O-N 3.02Å; F502-A507 HydrophobicContact CE2-CB 4.42Å; F502-A507 HydrophobicContact CZ-CB 3.94Å
503	D	60.9	Low	44.8	Very low	83 Å²	83	92.4 Å²	92.4	44%	0.444	50%	0.502	S	S	.	.			trans	-79.6	95.2	-177.9	-165.2	5.1	0	0	0	108.6	D501 E505 A506 A507	D501-D503 PolarHBondContact O-N 3.2Å; D503-E505 PolarHBondContact O-N 3.43Å; D503-E505 VanDerWaalsContact O-N 3.09Å; D503-E505 WeakPolarHBondContact OD1-CB 3.45Å; D503-E505 PolarHBondContact OD1-N 3.21Å; D503-E505 VanDerWaalsContact OD1-N 3.12Å; D503-A506 HydrophobicContact CB-CB 3.85Å; D503-A506 WeakPolarHBondContact O-CA 3.29Å; D503-A506 WeakPolarHBondContact O-CB 3.45Å; D503-A506 PolarHBondContact O-N 3.44Å; D503-A507 PolarHBondContact O-N 3.1Å
504	L	60.3	Low	45	Very low	10 Å²	10	95 Å²	95	5%	0.052	51%	0.507	C	S	.	.	H	α-helix	trans	-50.7	-32.7	171	-177.2	60.2	0	0	0	109.5	V79 Q121 Q145 F502 A507 L508	V79-L504 HydrophobicContact CG1-CD2 3.77Å; V79-L504 HydrophobicContact CG1-CG 4.35Å; Q121-L504 HydrophobicContact CG-CD1 4.37Å; Q145-L504 HydrophobicContact CB-CD2 4.46Å; F502-L504 HydrophobicContact CE1-CB 4.5Å; F502-L504 HydrophobicContact CE1-CD1 4.34Å; F502-L504 PolarHBondContact O-N 3.02Å; L504-A507 PolarHBondContact O-N 2.81Å; L504-L508 HydrophobicContact CD1-CD2 4.27Å; L504-L508 HydrophobicContact CD1-CG 4.29Å; L504-L508 HydrophobicContact CG-CD1 4.36Å; L504-L508 HydrophobicContact CG-CG 4.24Å; L504-L508 WeakPolarHBondContact O-CB 3.43Å; L504-L508 WeakPolarHBondContact O-CG 3.46Å; L504-L508 PolarHBondContact O-N 2.94Å
505	E	58.8	Low	45.2	Very low	45 Å²	45	93.3 Å²	93.3	21%	0.21	50%	0.501	C	S	.	.	H	α-helix	trans	-58.3	-51.3	171.8	-173.4	69.9	-180	0	0	112.1	V76 D503 A507 L508 M509	V76-E505 WeakPolarHBondContact CG1-OE1 3.29Å; V76-E505 VanDerWaalsContact CG1-OE2 3.27Å; V76-E505 WeakPolarHBondContact CG1-OE2 3.41Å; D503-E505 PolarHBondContact O-N 3.43Å; D503-E505 VanDerWaalsContact O-N 3.09Å; D503-E505 WeakPolarHBondContact OD1-CB 3.45Å; D503-E505 PolarHBondContact OD1-N 3.21Å; D503-E505 VanDerWaalsContact OD1-N 3.12Å; E505-A507 VanDerWaalsContact C-N 3.28Å; E505-A507 PolarHBondContact O-N 2.87Å; E505-L508 CarbonylContact O-C 3.51Å; E505-L508 WeakPolarHBondContact O-CA 3.25Å; E505-L508 PolarHBondContact O-N 3.18Å; E505-M509 HydrophobicContact CG-CG 4.04Å; E505-M509 VanDerWaalsContact O-CB 3.29Å; E505-M509 WeakPolarHBondContact O-CB 3.37Å; E505-M509 WeakPolarHBondContact O-CG 3.34Å; E505-M509 PolarHBondContact O-N 2.92Å
506	A	59.6	Low	45.3	Very low	35 Å²	35	93.1 Å²	93.1	29%	0.289	51%	0.505	S	S	.	.	H	α-helix	trans	-58.2	-44.2	177.5	0	0	0	0	0	110.5	D503 L508 M509 D510	D503-A506 HydrophobicContact CB-CB 3.85Å; D503-A506 WeakPolarHBondContact O-CA 3.29Å; D503-A506 WeakPolarHBondContact O-CB 3.45Å; D503-A506 PolarHBondContact O-N 3.44Å; A506-L508 VanDerWaalsContact C-N 3.28Å; A506-L508 PolarHBondContact O-N 3.22Å; A506-M509 PolarHBondContact O-N 3.5Å; A506-M509 VanDerWaalsContact O-N 3.11Å; A506-D510 VanDerWaalsContact O-CB 3.24Å; A506-D510 WeakPolarHBondContact O-CB 3.44Å; A506-D510 PolarHBondContact O-N 3.05Å
507	A	58.8	Low	45.4	Very low	21 Å²	21	92.5 Å²	92.5	17%	0.174	51%	0.506	C	S	.	.	H	α-helix	trans	-62.8	-32.6	175.5	0	0	0	0	0	113.4	F502 D503 L504 E505	F502-A507 HydrophobicContact CE2-CB 4.42Å; F502-A507 HydrophobicContact CZ-CB 3.94Å; D503-A507 PolarHBondContact O-N 3.1Å; L504-A507 PolarHBondContact O-N 2.81Å; E505-A507 VanDerWaalsContact C-N 3.28Å; E505-A507 PolarHBondContact O-N 2.87Å
508	L	58.5	Low	45.2	Very low	15 Å²	15	94.5 Å²	94.5	8%	0.079	51%	0.511	C	S	.	.	H	α-helix	trans	-80.6	-19.5	176.1	-66.6	-170.3	0	0	0	113.5	F75 V76 Y118 Q121 L504 E505 A506	F75-L508 HydrophobicContact CD1-CD1 3.98Å; F75-L508 HydrophobicContact CE1-CD1 3.54Å; V76-L508 HydrophobicContact CG2-CD1 4.27Å; Y118-L508 HydrophobicContact CD1-CD1 4.31Å; Y118-L508 HydrophobicContact CD1-CD2 3.45Å; Y118-L508 VanDerWaalsContact CD1-CD2 3.45Å; Y118-L508 HydrophobicContact CD1-CG 4.42Å; Y118-L508 HydrophobicContact CE1-CD1 3.99Å; Y118-L508 HydrophobicContact CE1-CD2 3.52Å; Y118-L508 HydrophobicContact CE1-CG 4.15Å; Q121-L508 HydrophobicContact CG-CD2 4.13Å; L504-L508 HydrophobicContact CD1-CD2 4.27Å; L504-L508 HydrophobicContact CD1-CG 4.29Å; L504-L508 HydrophobicContact CG-CD1 4.36Å; L504-L508 HydrophobicContact CG-CG 4.24Å; L504-L508 WeakPolarHBondContact O-CB 3.43Å; L504-L508 WeakPolarHBondContact O-CG 3.46Å; L504-L508 PolarHBondContact O-N 2.94Å; E505-L508 CarbonylContact O-C 3.51Å; E505-L508 WeakPolarHBondContact O-CA 3.25Å; E505-L508 PolarHBondContact O-N 3.18Å; A506-L508 VanDerWaalsContact C-N 3.28Å; A506-L508 PolarHBondContact O-N 3.22Å
509	M	54.5	Low	45	Very low	80 Å²	80	92.4 Å²	92.4	39%	0.394	51%	0.508	S	S	.	.	H	α-helix	trans	-103.9	-25.7	-175.4	-62.5	-69.2	-88.8	0	0	112.5	V76 E505 A506 E511 D512	V76-M509 HydrophobicContact CG2-SD 4.36Å; E505-M509 HydrophobicContact CG-CG 4.04Å; E505-M509 VanDerWaalsContact O-CB 3.29Å; E505-M509 WeakPolarHBondContact O-CB 3.37Å; E505-M509 WeakPolarHBondContact O-CG 3.34Å; E505-M509 PolarHBondContact O-N 2.92Å; A506-M509 PolarHBondContact O-N 3.5Å; A506-M509 VanDerWaalsContact O-N 3.11Å; M509-E511 VanDerWaalsContact C-N 3.28Å; M509-E511 PolarHBondContact O-N 2.95Å; M509-D512 VanDerWaalsContact O-CB 3.3Å; M509-D512 WeakPolarHBondContact O-CB 3.48Å; M509-D512 PolarHBondContact O-N 3.44Å
510	D	53.1	Low	45	Very low	128 Å²	128	92.6 Å²	92.6	68%	0.684	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-71.9	-16.4	-179.4	-73.9	-21.9	0	0	0	113.4	A506 D512	A506-D510 VanDerWaalsContact O-CB 3.24Å; A506-D510 WeakPolarHBondContact O-CB 3.44Å; A506-D510 PolarHBondContact O-N 3.05Å; D510-D512 PolarHBondContact O-N 3.07Å
511	E	46.3	Very low	44.9	Very low	89 Å²	89	96.8 Å²	96.8	42%	0.416	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-75.8	-7	171.5	-68.1	-150.7	162.7	0	0	113.4	R120 M509 D513 K514	R120-E511 IonicContact NH2-OE1 3.27Å; R120-E511 IonicContact NH2-OE2 3.87Å; M509-E511 VanDerWaalsContact C-N 3.28Å; M509-E511 PolarHBondContact O-N 2.95Å; E511-D513 VanDerWaalsContact C-N 3.35Å; E511-D513 PolarHBondContact O-N 3.07Å; E511-K514 PolarHBondContact O-N 3.41Å
512	D	45	Very low	44.5	Very low	76 Å²	76	98.1 Å²	98.1	41%	0.406	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-75.3	-17.1	-172.9	-75	-18.5	0	0	0	116	K72 M509 D510	K72-D512 IonicContact NZ-OD1 2.68Å; K72-D512 PolarHBondContact NZ-OD1 3.06Å; K72-D512 IonicContact NZ-OD2 3.65Å; K72-D512 PolarHBondContact NZ-OD2 3.47Å; M509-D512 VanDerWaalsContact O-CB 3.3Å; M509-D512 WeakPolarHBondContact O-CB 3.48Å; M509-D512 PolarHBondContact O-N 3.44Å; D510-D512 PolarHBondContact O-N 3.07Å
513	D	37.7	Very low	43.9	Very low	162 Å²	162	104.4 Å²	104.4	87%	0.866	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-95.7	-1.9	178.5	-75.5	-25.6	0	0	0	112.9	E511	E511-D513 VanDerWaalsContact C-N 3.35Å; E511-D513 PolarHBondContact O-N 3.07Å
514	K	34.7	Very low	43	Very low	173 Å²	173	107.7 Å²	107.7	75%	0.752	58%	0.583	S	S	*	*	S	Bend	trans	-140.5	105	178.5	-64.2	-176.6	-175.1	174.1	0	110.9	E511	E511-K514 PolarHBondContact O-N 3.41Å
515	S	31.3	Very low	41.7	Very low	99 Å²	99	112.8 Å²	112.8	69%	0.692	62%	0.616	S	S	*	*			trans	90.2	76.4	165.3	79.7	0	0	0	0	118.2
516	V	33.8	Very low	40.5	Very low	136 Å²	136	118.4 Å²	118.4	82%	0.824	65%	0.648	S	S	*	*	S	Bend	trans	-99.3	78.8	141.4	-175.4	0	0	0	0	106
517	N	30.4	Very low	39	Very low	148 Å²	148	124.9 Å²	124.9	79%	0.791	67%	0.669	S	S	*	*	S	Bend	trans	173.2	0.3	156.4	-93.8	-13.7	0	0	0	118.5
518	N	29.2	Very low	37.7	Very low	126 Å²	126	130.9 Å²	130.9	67%	0.674	69%	0.694	S	S	*	*			trans	-111.3	93.2	176.3	-77.4	9.9	0	0	0	111.6	D520	N518-D520 PolarHBondContact O-N 3.45Å
519	C	29.3	Very low	36.5	Very low	127 Å²	127	136.8 Å²	136.8	86%	0.858	73%	0.725	S	S	*	*			trans	-84.7	56.7	160.8	-70.2	0	0	0	0	109.9
520	D	32.6	Very low	35.4	Very low	127 Å²	127	141.1 Å²	141.1	68%	0.679	74%	0.744	S	S	*	*			trans	-93.4	124.2	168.5	-72.6	-35.5	0	0	0	108.6	N518 D522	N518-D520 PolarHBondContact O-N 3.45Å; D520-D522 PolarHBondContact O-N 3.37Å
521	L	34.7	Very low	34.3	Very low	167 Å²	167	138.2 Å²	138.2	87%	0.874	75%	0.745	S	S	*	*			trans	-62.4	108	178.3	-75.7	114	0	0	0	110
522	D	36.3	Very low	33.6	Very low	156 Å²	156	140 Å²	140	83%	0.834	76%	0.762	S	S	*	*			trans	-85.7	109.1	161.3	-78.8	-27.9	0	0	0	108.8	D520 L524	D520-D522 PolarHBondContact O-N 3.37Å; D522-L524 PolarHBondContact O-N 3.33Å
523	E	36	Very low	33	Very low	189 Å²	189	141.2 Å²	141.2	88%	0.883	78%	0.776	S	S	*	*			trans	-60.5	113.3	168.8	-72.1	177.4	158.9	0	0	109.7
524	L	41.2	Very low	32.7	Very low	153 Å²	153	139.4 Å²	139.4	80%	0.801	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-85	127.5	166.5	-78.4	167.4	0	0	0	108.7	D522	D522-L524 PolarHBondContact O-N 3.33Å
525	P	34.7	Very low	32.5	Very low	117 Å²	117	138.1 Å²	138.1	76%	0.76	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67	134.6	170.8	27.5	-32.5	0	0	0	109.9	F527	P525-F527 PolarHBondContact O-N 3.25Å
526	D	32.4	Very low	32.7	Very low	162 Å²	162	142 Å²	142	87%	0.866	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-53.5	118.1	177.1	-74.1	-39.1	0	0	0	110.7
527	F	28.8	Very low	33	Very low	171 Å²	171	147.1 Å²	147.1	75%	0.75	79%	0.786	S	S	*	*			trans	-96	96.2	164.5	-174.9	-95.8	0	0	0	107.5	P525 L529	P525-F527 PolarHBondContact O-N 3.25Å; F527-L529 HydrophobicContact CE1-CD1 4.46Å; F527-L529 PolarHBondContact O-N 3.38Å
528	E	30.8	Very low	33	Very low	148 Å²	148	144.6 Å²	144.6	69%	0.692	78%	0.78	S	S	*	*			trans	-65.7	128.8	166.8	-74.3	-172.7	153.6	0	0	109.3	E530	E528-E530 PolarHBondContact O-N 3.34Å
529	L	33.8	Very low	33.3	Very low	138 Å²	138	144.6 Å²	144.6	72%	0.723	78%	0.779	S	S	*	*			trans	-76.9	78.9	172.3	-150.3	107.5	0	0	0	107.8	F527	F527-L529 HydrophobicContact CE1-CD1 4.46Å; F527-L529 PolarHBondContact O-N 3.38Å
530	E	31.9	Very low	33.5	Very low	171 Å²	171	148 Å²	148	80%	0.799	78%	0.775	S	S	*	*			trans	-62.8	135.1	176.7	-73.4	-175.2	166.6	0	0	111.6	E528	E528-E530 PolarHBondContact O-N 3.34Å
531	G	30	Very low	33.8	Very low	68 Å²	68	149.5 Å²	149.5	70%	0.701	78%	0.777	S	S	*	*			trans	85.8	82.8	148.6	0	0	0	0	0	118
532	V	30.2	Very low	33.9	Very low	127 Å²	127	148.2 Å²	148.2	77%	0.77	77%	0.771	S	S	*	*			trans	-101	84.4	136.4	-178.3	0	0	0	0	106.2	T534	V532-T534 PolarHBondContact O-N 3.15Å
533	S	32.9	Very low	33.9	Very low	101 Å²	101	149 Å²	149	71%	0.706	77%	0.77	S	S	*	*			trans	-62.9	116.5	163.1	50.9	0	0	0	0	107.8
534	T	30.7	Very low	34.1	Very low	124 Å²	124	148.1 Å²	148.1	76%	0.761	77%	0.77	S	S	*	*			trans	-104.2	75.9	169.5	-47.6	0	0	0	0	106.6	V532	V532-T534 PolarHBondContact O-N 3.15Å
535	D	31.1	Very low	33.7	Very low	146 Å²	146	144.9 Å²	144.9	78%	0.781	76%	0.76	S	S	*	*			trans	-131.2	103.4	172.9	-70.6	-41	0	0	0	107.8
536	E	36.2	Very low	33.8	Very low	181 Å²	181	146.3 Å²	146.3	85%	0.846	76%	0.762	S	S	*	*			trans	-176.9	87	154.5	-105.8	177.7	-151.9	0	0	107.8
537	Y	40.1	Very low	34	Very low	243 Å²	243	145.4 Å²	145.4	95%	0.953	76%	0.757	S	S	*	*			trans	-153.5	105.8	142.9	-88.8	-70.2	0	0	0	108.1
538	S	30.3	Very low	34.6	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	76%	0.763	S	S	*	*			trans	-73.5	166.8	166.9	53.7	0	0	0	0	111.4
539	D	36.1	Very low	34.9	Very low	125 Å²	125	144 Å²	144	67%	0.668	77%	0.767	S	S	*	*			trans	90.1	134.8	166.6	-55	-39.8	0	0	0	116.5
540	R	33.7	Very low	35.2	Very low	200 Å²	200	144.8 Å²	144.8	76%	0.755	77%	0.772	S	S	*	*			cis	174.2	150.5	-18.2	-111.8	-177.4	-142.7	-153.1	-2.1	102.8
541	E	37.7	Very low	35.5	Very low	158 Å²	158	143.5 Å²	143.5	74%	0.738	77%	0.771	S	S	*	*			trans	72.3	140.9	163	-25.1	-159.4	150.5	0	0	114.8
542	D	37.1	Very low	36.1	Very low	140 Å²	140	144.7 Å²	144.7	75%	0.749	77%	0.768	S	S	*	*			cis	-161.7	163.9	15	-103	-31.1	0	0	0	110.2
543	E	36.7	Very low	36.7	Very low	172 Å²	172	146.7 Å²	146.7	80%	0.804	77%	0.769	S	S	*	*			trans	-50	152.4	178.1	-56	171.8	157.3	0	0	116.1
544	L	39.1	Very low	36.8	Very low	170 Å²	170	149.5 Å²	149.5	89%	0.89	78%	0.776	S	S	*	*				179.3	133.2	119.7	-91.7	162.6	0	0	0	112.1
545	S	32.7	Very low	37.2	Very low	85 Å²	85	149.5 Å²	149.5	59%	0.594	78%	0.781	S	S	*	*			trans	-67.5	158.9	-179.9	54.8	0	0	0	0	114.5
546	N	37.4	Very low	37.4	Very low	148 Å²	148	150.4 Å²	150.4	79%	0.791	79%	0.786	S	S	*	*				178.8	134.6	115.1	-83.1	-16.2	0	0	0	112.4
547	D	35.9	Very low	37.6	Very low	142 Å²	142	145.7 Å²	145.7	76%	0.759	79%	0.786	S	S	*	*			trans	-63.7	150.4	178.5	-50.6	-66.1	0	0	0	114.2
548	V	41.8	Very low	37.4	Very low	146 Å²	146	141 Å²	141	89%	0.885	78%	0.777	S	S	*	*			trans	-155.1	114	137.3	-174.1	0	0	0	0	109.4
549	D	37.5	Very low	37.7	Very low	144 Å²	144	141.9 Å²	141.9	77%	0.77	78%	0.784	S	S	*	*			trans	-70.8	145.8	164.9	-65.5	-56.7	0	0	0	111.8
550	N	40.7	Very low	37.7	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	79%	0.786	S	S	*	*			trans	-159.2	140.5	140.9	-133.6	-18.9	0	0	0	114.1
551	D	38.8	Very low	37.9	Very low	144 Å²	144	141.2 Å²	141.2	77%	0.77	79%	0.793	S	S	*	*			trans	-67.3	158.8	-168.8	-60.4	-61.7	0	0	0	116.5
552	S	41.9	Very low	37.8	Very low	93 Å²	93	141.9 Å²	141.9	65%	0.65	80%	0.796	S	S	*	*				135.6	121	112.6	-164	0	0	0	0	116.7
553	E	41.6	Very low	37.7	Very low	168 Å²	168	142.6 Å²	142.6	79%	0.785	80%	0.797	S	S	*	*			trans	80.4	100.3	138.6	-74.2	170	-174.9	0	0	123.1
554	N	35.8	Very low	37.6	Very low	160 Å²	160	139.6 Å²	139.6	86%	0.856	79%	0.791	S	S	*	*				41.7	122.8	116.7	-67.7	-18.3	0	0	0	121.6
555	S	38.7	Very low	37.2	Very low	124 Å²	124	138.8 Å²	138.8	87%	0.867	79%	0.787	S	S	*	*				-164.7	123	124.6	-176	0	0	0	0	111.4
556	D	35.9	Very low	37.1	Very low	166 Å²	166	142.7 Å²	142.7	89%	0.888	80%	0.801	S	S	*	*			trans	-64.9	156	172.1	-70.2	-50.1	0	0	0	113.6
557	G	40.2	Very low	36.7	Very low	81 Å²	81	140 Å²	140	84%	0.835	79%	0.793	S	S	*	*			trans	-175.5	79.5	173.8	0	0	0	0	0	112.9
558	N	35	Very low	36.7	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	80%	0.799	S	S	*	*			trans	-70.3	136.1	-178.7	-161.2	21.3	0	0	0	113.3
559	S	37.6	Very low	36	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	79%	0.793	S	S	*	*			trans	-172.8	114.5	140	50.1	0	0	0	0	111.7
560	D	35.3	Very low	35.8	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	80%	0.797	S	S	*	*			trans	-67.9	152.5	164.5	-59	-54.2	0	0	0	111.4
561	I	39.2	Very low	35.3	Very low	175 Å²	175	144 Å²	144	90%	0.897	80%	0.799	S	S	*	*			trans	-167.6	128.1	136.8	-90.2	143.3	0	0	0	108.7
562	E	35.2	Very low	35.1	Very low	172 Å²	172	144.5 Å²	144.5	80%	0.804	80%	0.8	S	S	*	*			trans	-80.1	161	-177.2	-65.8	178.1	121.4	0	0	115.1
563	M	35.3	Very low	34.7	Very low	156 Å²	156	145.1 Å²	145.1	77%	0.768	80%	0.804	S	S	*	*				84.6	132.6	128.8	-88.3	-82	-92.5	0	0	123.2
564	T	34.7	Very low	34.1	Very low	109 Å²	109	146.6 Å²	146.6	67%	0.669	81%	0.808	S	S	*	*			trans	88.2	109.4	148.9	56.9	0	0	0	0	121.5
565	D	30.3	Very low	34.1	Very low	153 Å²	153	147.6 Å²	147.6	82%	0.818	80%	0.804	S	S	*	*				21	135	126	-101	-28.5	0	0	0	119.3
566	L	30.6	Very low	33.8	Very low	167 Å²	167	149 Å²	149	87%	0.874	80%	0.797	S	S	*	*				-176.1	118.8	128.3	-96.6	163.5	0	0	0	112.1
567	S	29.6	Very low	33.8	Very low	92 Å²	92	149.6 Å²	149.6	64%	0.643	80%	0.795	S	S	*	*			trans	-66.4	156.9	161.8	59.5	0	0	0	0	113.8
568	K	34.2	Very low	33.3	Very low	200 Å²	200	155.7 Å²	155.7	87%	0.87	80%	0.798	S	S	*	*			trans	93.3	134.6	156.7	-68.1	175.2	177.9	169.2	0	119.7
569	S	28.4	Very low	33.2	Very low	110 Å²	110	154 Å²	154	77%	0.769	80%	0.804	S	S	*	*			trans	86	115.5	146.8	159	0	0	0	0	118
570	L	32.9	Very low	32.8	Very low	161 Å²	161	158.1 Å²	158.1	84%	0.843	81%	0.808	S	S	*	*			trans	-164.3	108.2	131.5	-101.4	145.1	0	0	0	112.6
571	K	29.8	Very low	32.8	Very low	200 Å²	200	158.1 Å²	158.1	87%	0.87	81%	0.813	S	S	*	*			trans	-112.2	130.5	149.9	-81	-179.4	177.2	175.1	0	106
572	I	35.4	Very low	32.5	Very low	154 Å²	154	155.8 Å²	155.8	79%	0.79	81%	0.807	S	S	*	*			trans	-176.6	111.2	156.4	-86.2	137.2	0	0	0	105.1
573	S	33.4	Very low	32.2	Very low	106 Å²	106	157.2 Å²	157.2	74%	0.741	81%	0.811	S	S	*	*				85.3	111.4	76.2	-152.8	0	0	0	0	116.5
574	K	29.5	Very low	32.2	Very low	199 Å²	199	159.4 Å²	159.4	87%	0.865	82%	0.819	S	S	*	*			trans	11	134.5	146.8	-61.7	175.7	177.6	175.3	0	121.6
575	K	34.4	Very low	31.9	Very low	180 Å²	180	164.2 Å²	164.2	78%	0.783	83%	0.831	S	S	*	*				-177.3	123	123.1	-104.6	172.9	178.4	179.3	0	110.9
576	Q	33.4	Very low	32.1	Very low	154 Å²	154	161.7 Å²	161.7	72%	0.72	83%	0.831	S	S	*	*				68.4	126.8	108.4	-73.4	-175.3	10.7	0	0	113.6
577	Q	36.1	Very low	32.3	Very low	179 Å²	179	161.2 Å²	161.2	84%	0.836	83%	0.829	S	S	*	*				-172.5	161	50.2	-112	156.9	35.8	0	0	110.9
578	K	28.1	Very low	32.4	Very low	208 Å²	208	161.4 Å²	161.4	90%	0.904	83%	0.831	S	S	*	*			trans	-85.6	147.7	177.2	-75.3	171.3	170.5	172.6	0	112.6
579	A	34.1	Very low	32.4	Very low	109 Å²	109	161.3 Å²	161.3	90%	0.901	83%	0.833	S	S	*	*			trans	-160.8	143.6	142.6	0	0	0	0	0	112.1
580	K	29.6	Very low	32.7	Very low	201 Å²	201	161.2 Å²	161.2	87%	0.874	83%	0.827	S	S	*	*			trans	-94.5	151.1	-178.7	-71.3	170.1	169.3	176.8	0	111.1
581	T	34.2	Very low	32.8	Very low	135 Å²	135	160.4 Å²	160.4	83%	0.828	83%	0.829	S	S	*	*			trans	-177.6	110.6	138.6	23.9	0	0	0	0	109.6
582	T	33.6	Very low	33	Very low	127 Å²	127	155.5 Å²	155.5	78%	0.779	82%	0.817	S	S	*	*				71.7	110	95.2	-16.8	0	0	0	0	117.5
583	K	29.7	Very low	32.9	Very low	202 Å²	202	157.7 Å²	157.7	88%	0.878	82%	0.821	S	S	*	*			trans	21.2	130.9	150.1	-67.4	178.8	176.1	176.1	0	121.7
584	E	33.4	Very low	33.1	Very low	201 Å²	201	161.9 Å²	161.9	94%	0.939	83%	0.829	S	S	*	*			trans	-152.2	142.8	138	-116.8	173.7	-172.9	0	0	112.1
585	K	28.5	Very low	33	Very low	211 Å²	211	159.5 Å²	159.5	92%	0.917	83%	0.825	S	S	*	*			trans	-119.1	130.6	175.6	-90	-176.2	173.2	-177.4	0	107.8
586	A	35.6	Very low	33.2	Very low	99 Å²	99	158.8 Å²	158.8	82%	0.818	83%	0.828	S	S	*	*			trans	-177.7	113.5	150.6	0	0	0	0	0	108
587	N	33.9	Very low	33	Very low	157 Å²	157	157 Å²	157	84%	0.84	82%	0.823	S	S	*	*				84.6	117.2	85.1	-111.7	11.7	0	0	0	116.2
588	S	32.2	Very low	32.7	Very low	97 Å²	97	157 Å²	157	68%	0.678	82%	0.82	S	S	*	*			trans	59.4	120.9	145.8	64.2	0	0	0	0	122.3
589	H	34.4	Very low	32.9	Very low	198 Å²	198	156.7 Å²	156.7	92%	0.917	82%	0.824	S	S	*	*			trans	-145.6	136.7	131	-130.4	-55.6	0	0	0	112.6
590	V	34.5	Very low	32.7	Very low	107 Å²	107	160.1 Å²	160.1	65%	0.648	82%	0.819	S	S	*	*			trans	-96.8	147.6	-170.5	167.8	0	0	0	0	111.4
591	V	34.7	Very low	32.9	Very low	144 Å²	144	159.5 Å²	159.5	87%	0.873	82%	0.816	S	S	*	*			trans	-160.5	131.9	136.2	-173	0	0	0	0	111.6
592	P	34	Very low	32.8	Very low	98 Å²	98	158 Å²	158	64%	0.636	81%	0.811	S	S	*	*			trans	-126.1	168.1	173.2	41.6	-28.3	0	0	0	116.7
593	K	33.2	Very low	32.8	Very low	199 Å²	199	158.4 Å²	158.4	87%	0.865	81%	0.813	S	S	*	*			trans	79.6	129.5	156.5	-70.4	178.4	-179.7	177.1	0	121.4
594	Q	37.3	Very low	32.8	Very low	194 Å²	194	156 Å²	156	91%	0.907	81%	0.81	S	S	*	*				-154.9	142.3	125.9	-105.4	178.1	29.9	0	0	112.2
595	L	28.8	Very low	32.9	Very low	149 Å²	149	151.5 Å²	151.5	78%	0.78	80%	0.801	S	S	*	*			trans	-126.7	135.2	-174	-118.7	162.1	0	0	0	106.2	L597	L595-L597 HydrophobicContact CD2-CD1 4.39Å
596	I	37	Very low	33	Very low	165 Å²	165	148.2 Å²	148.2	85%	0.846	80%	0.798	S	S	*	*			trans	-135.7	135.4	163.5	-64.4	-176.3	0	0	0	110.6
597	L	30.3	Very low	32.9	Very low	116 Å²	116	147.4 Å²	147.4	61%	0.607	80%	0.8	S	S	*	*			trans	-102.5	151.1	-168.4	-111.3	87.8	0	0	0	113.2	L595	L595-L597 HydrophobicContact CD2-CD1 4.39Å
598	K	29.3	Very low	32.9	Very low	180 Å²	180	149.8 Å²	149.8	78%	0.783	80%	0.803	S	S	*	*			trans	56.4	130.9	138.9	-67.8	-175.9	-171.2	158.4	0	122.1
599	M	32.6	Very low	33.2	Very low	201 Å²	201	150.3 Å²	150.3	99%	0.99	80%	0.804	S	S	*	*				-150.7	156.9	122.8	-87.6	-143.6	174.3	0	0	112
600	K	30.4	Very low	33.2	Very low	181 Å²	181	151.2 Å²	151.2	79%	0.787	81%	0.805	S	S	*	*			trans	-138.3	155.3	-152.5	-145.4	-175.3	-170.1	-177	0	110.1
601	K	32.5	Very low	33	Very low	188 Å²	188	155.8 Å²	155.8	82%	0.817	82%	0.817	S	S	*	*			trans	78.3	139.4	161.9	-58.3	-179.7	174.2	-177	0	115.9
602	S	32.7	Very low	32.9	Very low	103 Å²	103	155 Å²	155	72%	0.72	82%	0.817	S	S	*	*				178.5	125.6	56.7	-170.4	0	0	0	0	107.8
603	V	34.4	Very low	32.7	Very low	137 Å²	137	159.2 Å²	159.2	83%	0.83	83%	0.826	S	S	*	*				121.1	142.2	90.5	157.2	0	0	0	0	112.6
604	N	28.3	Very low	32.7	Very low	150 Å²	150	156.8 Å²	156.8	80%	0.802	83%	0.827	S	S	*	*			trans	-56.6	155	-176.7	-66.9	-33.3	0	0	0	117.3
605	S	35.3	Very low	32.4	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	82%	0.815	S	S	*	*				170.7	127.3	104	57.8	0	0	0	0	114.4
606	T	31.1	Very low	32.5	Very low	142 Å²	142	153.5 Å²	153.5	87%	0.871	82%	0.82	S	S	*	*			trans	31.6	124.9	139.5	56.4	0	0	0	0	122.6
607	G	33.5	Very low	32.1	Very low	83 Å²	83	152.2 Å²	152.2	86%	0.856	82%	0.82	S	S	*	*			trans	179.3	108.4	156.6	0	0	0	0	0	113
608	K	33.8	Very low	32.2	Very low	206 Å²	206	153 Å²	153	90%	0.896	83%	0.831	S	S	*	*			trans	-97.4	-176.2	-171.2	-134.5	-170.8	-171.8	175	0	110.7
609	P	38.3	Very low	32.1	Very low	108 Å²	108	149.6 Å²	149.6	70%	0.701	83%	0.829	S	S	*	*				-119.2	-179.7	-112.9	40.7	-23.8	0	0	0	114.2
610	K	34.8	Very low	32.1	Very low	217 Å²	217	147.8 Å²	147.8	94%	0.943	82%	0.822	S	S	*	*			trans	-159.6	144.1	149.7	-109.3	165.2	-169.3	-177.4	0	113.4
611	K	30.1	Very low	32.2	Very low	204 Å²	204	147.8 Å²	147.8	89%	0.887	82%	0.822	S	S	*	*			trans	-82.6	153	-167.1	-61.6	165.7	175.2	172.3	0	112.9
612	S	33.4	Very low	32	Very low	126 Å²	126	144 Å²	144	88%	0.881	82%	0.819	S	S	*	*			trans	-153.9	131.6	130.5	53.8	0	0	0	0	110.8
613	K	30.2	Very low	31.9	Very low	188 Å²	188	146.8 Å²	146.8	82%	0.817	83%	0.825	S	S	*	*			trans	-87.5	140.9	177.9	-71.3	172.4	171.1	179.4	0	108.8
614	V	33.5	Very low	31.7	Very low	148 Å²	148	149.1 Å²	149.1	90%	0.897	82%	0.824	S	S	*	*			trans	-141	128.1	135.5	-179.3	0	0	0	0	108.6
615	T	29.4	Very low	31.8	Very low	108 Å²	108	149.9 Å²	149.9	66%	0.663	83%	0.827	S	S	*	*			trans	-82.9	140.1	-176.6	41.3	0	0	0	0	112
616	N	31.8	Very low	31.7	Very low	165 Å²	165	150.5 Å²	150.5	88%	0.882	83%	0.827	S	S	*	*			trans	-166	97.6	134.3	-94.7	-17.2	0	0	0	109.7
617	T	29	Very low	31.6	Very low	138 Å²	138	154.7 Å²	154.7	85%	0.847	83%	0.826	S	S	*	*			trans	-95.1	116.6	171	39.4	0	0	0	0	109.2
618	T	31.3	Very low	31.6	Very low	134 Å²	134	158.1 Å²	158.1	82%	0.822	83%	0.825	S	S	*	*			trans	-112.4	102	158.9	-41.1	0	0	0	0	107.7
619	S	27.9	Very low	31.4	Very low	108 Å²	108	157.2 Å²	157.2	76%	0.755	82%	0.821	S	S	*	*			trans	-81.2	115.9	175.6	-170.9	0	0	0	0	108.6
620	I	33.8	Very low	31.1	Very low	162 Å²	162	160 Å²	160	83%	0.831	83%	0.825	S	S	*	*			trans	-107.6	115.8	163.4	-65.4	-177.3	0	0	0	108.2
621	K	31	Very low	31	Very low	181 Å²	181	157.7 Å²	157.7	79%	0.787	82%	0.823	S	S	*	*			trans	-57.5	132.5	-172.5	-69.8	168.5	175.5	173.8	0	112.4	L623	K621-L623 PolarHBondContact O-N 3.31Å
622	S	29.1	Very low	31	Very low	109 Å²	109	157.9 Å²	157.9	76%	0.762	82%	0.824	S	S	*	*			trans	-55.2	113	156.5	51.9	0	0	0	0	110.9	K624	S622-K624 PolarHBondContact O-N 2.75Å
623	L	30.4	Very low	30.9	Very low	162 Å²	162	161.4 Å²	161.4	85%	0.848	82%	0.824	S	S	*	*			trans	-81.3	99.4	164.7	-87.8	155.8	0	0	0	108.7	K621 L625	K621-L623 PolarHBondContact O-N 3.31Å; L623-L625 PolarHBondContact O-N 3.39Å
624	K	29	Very low	30.9	Very low	186 Å²	186	162.4 Å²	162.4	81%	0.809	83%	0.828	S	S	*	*			trans	-71	108	160.1	-73.1	177.8	177.3	176.4	0	107.3	S622 T626	S622-K624 PolarHBondContact O-N 2.75Å; K624-T626 PolarHBondContact O-N 3.2Å
625	L	30.7	Very low	30.9	Very low	166 Å²	166	165.6 Å²	165.6	87%	0.869	83%	0.83	S	S	*	*			trans	-82.3	107.5	164.7	-134.9	86.6	0	0	0	108.3	L623	L623-L625 PolarHBondContact O-N 3.39Å
626	T	33.4	Very low	31.1	Very low	120 Å²	120	170.6 Å²	170.6	74%	0.736	84%	0.842	S	S	*	*			trans	-62.8	130.4	173.9	41.3	0	0	0	0	110.9	K624 N628	K624-T626 PolarHBondContact O-N 3.2Å; T626-N628 PolarHBondContact O-N 3.34Å
627	R	30.2	Very low	31.1	Very low	229 Å²	229	166.9 Å²	166.9	86%	0.864	84%	0.835	S	S	*	*			trans	-55.7	110.5	167.8	-76.8	171.3	166.7	152.1	-4.2	110.2	K629	R627-K629 PolarHBondContact O-N 3.13Å
628	N	32.1	Very low	31.4	Very low	155 Å²	155	169.2 Å²	169.2	83%	0.829	84%	0.836	S	S	*	*			trans	-83.9	94.6	160.6	-105.1	-6.2	0	0	0	109	T626	T626-N628 PolarHBondContact O-N 3.34Å
629	K	30.5	Very low	31.9	Very low	187 Å²	187	169.5 Å²	169.5	81%	0.813	84%	0.838	S	S	*	*			trans	-94.4	73.9	162.8	-84.1	-174.3	171.4	-177	0	108.4	R627	R627-K629 PolarHBondContact O-N 3.13Å
630	Q	31.3	Very low	32.2	Very low	168 Å²	168	177.9 Å²	177.9	79%	0.785	86%	0.86	S	S	*	*			trans	-153	84.6	166.3	-76.4	-170	-23.4	0	0	107.7
631	D	32.9	Very low	32.1	Very low	168 Å²	168	178.7 Å²	178.7	90%	0.898	86%	0.862	S	S	*	*			trans	-172.7	56.7	153.9	-90.9	-28.1	0	0	0	109
632	F	30.1	Very low	32.2	Very low	207 Å²	207	178.5 Å²	178.5	91%	0.908	87%	0.866	S	S	*	*			trans	-132.7	93.3	165.8	-112.7	-88.6	0	0	0	105.2
633	K	31.4	Very low	32.4	Very low	201 Å²	201	182.4 Å²	182.4	87%	0.874	87%	0.871	S	S	*	*	S	Bend	trans	146.5	84.9	164.3	-85.3	168.6	-179.8	-174.1	0	109.5
634	K	30.8	Very low	32.5	Very low	209 Å²	209	183.6 Å²	183.6	91%	0.909	87%	0.873	S	S	*	*			trans	173.8	80.5	151.3	-100.4	168.9	-178.8	-173.9	0	109.2
635	K	33.7	Very low	32.7	Very low	214 Å²	214	183.4 Å²	183.4	93%	0.93	88%	0.877	S	S	*	*			trans	-173.7	63.1	158.6	-105.6	174.9	-176	-176.8	0	107.7
636	K	31.9	Very low	32.8	Very low	214 Å²	214	184.6 Å²	184.6	93%	0.93	88%	0.877	S	S	*	*	S	Bend	trans	-154.6	61.8	170.9	-144.2	-177.6	-171	-175	0	108.4
637	A	33.1	Very low	32.8	Very low	87 Å²	87	189.2 Å²	189.2	72%	0.719	89%	0.887	S	S	*	*	S	Bend	trans	179.9	144	165.4	0	0	0	0	0	106.2
638	E	35.7	Very low	33	Very low	186 Å²	186	186.2 Å²	186.2	87%	0.869	89%	0.889	S	S	*	*			trans	81.1	78.9	176.3	-56.3	172.9	178.1	0	0	115.7
639	T	41	Very low	33.1	Very low	141 Å²	141	188.8 Å²	188.8	87%	0.865	89%	0.894	S	S	*	*				-171.7	115.6	105.1	-48.2	0	0	0	0	106.7
640	K	34.3	Very low	33.3	Very low	283 Å²	283	188.9 Å²	188.9	100%	1.23	90%	0.902	S	S	*	*			trans	22.9	0	173.7	-78.6	-176.7	177	178.8	0	120.1

Retrieved 640 of 640 residues in 786.1 ms (Link to these results)

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