A0A3Q0KC57_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession A0A3Q0KC57, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 587 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59.5	Low	68.9	Low	102 Å²	102	61.8 Å²	61.8	50%	0.502	31%	0.312	S	S	.	.				0	-75.7	0	-53.2	-33.6	177.1	0	0	113.1	F3 F4 S5 L24 L27	M1-F3 CarbonylContact O-C 3.59Å; M1-F3 PolarHBondContact O-N 3.35Å; M1-F4 WeakPolarHBondContact O-CA 3.17Å; M1-F4 WeakPolarHBondContact O-CB 3.36Å; M1-F4 PolarHBondContact O-N 3.2Å; M1-S5 PolarHBondContact O-N 3.2Å; M1-L24 HydrophobicContact SD-CD2 4.31Å; M1-L27 HydrophobicContact CE-CB 3.9Å; M1-L27 HydrophobicContact CE-CD1 3.9Å; M1-L27 HydrophobicContact CE-CD2 3.76Å; M1-L27 HydrophobicContact CE-CG 4.06Å; M1-L27 HydrophobicContact SD-CB 4.26Å; M1-L27 HydrophobicContact SD-CD1 4.06Å
2	N	67.7	Low	69.2	Low	128 Å²	128	60.3 Å²	60.3	68%	0.684	31%	0.306	S	S	*	.	H	α-helix	trans	-46.3	-33.3	-170.5	-59.9	11.2	0	0	0	117	Q6	N2-Q6 WeakPolarHBondContact O-CG 3.41Å; N2-Q6 PolarHBondContact O-N 2.84Å; N2-Q6 VanDerWaalsContact O-N 3.12Å
3	F	65.3	Low	69.6	Low	46 Å²	46	63.5 Å²	63.5	20%	0.202	34%	0.337	C	S	.	.	H	α-helix	trans	-69	-38.4	174.5	-179.9	-101.1	0	0	0	113.4	M1 F7 C73 K76	M1-F3 CarbonylContact O-C 3.59Å; M1-F3 PolarHBondContact O-N 3.35Å; F3-F7 WeakPolarHBondContact O-CB 3.45Å; F3-F7 PolarHBondContact O-N 2.82Å; F3-C73 HydrophobicContact CE1-CB 4.21Å; F3-C73 HydrophobicContact CZ-CB 4.48Å; F3-C73 VanDerWaalsContact CZ-SG 3.53Å; F3-K76 HydrophobicContact CD1-CD 3.79Å; F3-K76 HydrophobicContact CD2-CD 4.17Å; F3-K76 HydrophobicContact CE1-CB 4.31Å; F3-K76 HydrophobicContact CE1-CD 3.55Å; F3-K76 HydrophobicContact CE2-CD 3.94Å; F3-K76 HydrophobicContact CG-CD 4.09Å; F3-K76 HydrophobicContact CZ-CD 3.62Å
4	F	68.5	Low	69.4	Low	4 Å²	4	71.5 Å²	71.5	2%	0.018	36%	0.36	C	S	.	.	H	α-helix	trans	-69.3	-39	173.4	-66.4	-67.1	0	0	0	112	M1 F7 L8 L24 L42 Y45 L77 I80	M1-F4 WeakPolarHBondContact O-CA 3.17Å; M1-F4 WeakPolarHBondContact O-CB 3.36Å; M1-F4 PolarHBondContact O-N 3.2Å; F4-F7 PolarHBondContact O-N 3.5Å; F4-L8 WeakPolarHBondContact O-CB 3.4Å; F4-L8 WeakPolarHBondContact O-CG 3.49Å; F4-L8 PolarHBondContact O-N 3.47Å; F4-L24 HydrophobicContact CB-CD1 4.21Å; F4-L24 HydrophobicContact CB-CD2 4.28Å; F4-L42 HydrophobicContact CE2-CD1 4.21Å; F4-Y45 HydrophobicContact CD1-CE1 4.14Å; F4-L77 HydrophobicContact CE1-CD1 4.07Å; F4-L77 HydrophobicContact CE1-CD2 3.45Å; F4-L77 VanDerWaalsContact CE1-CD2 3.45Å; F4-L77 HydrophobicContact CE1-CG 3.61Å; F4-L77 HydrophobicContact CE2-CD2 4.35Å; F4-L77 HydrophobicContact CZ-CD2 3.26Å; F4-L77 HydrophobicContact CZ-CG 3.63Å; F4-I80 HydrophobicContact CE2-CD1 3.82Å; F4-I80 HydrophobicContact CZ-CD1 4.11Å
5	S	69.1	Low	69.3	Low	48 Å²	48	69.4 Å²	69.4	34%	0.336	35%	0.348	S	S	.	.	H	α-helix	trans	-58.1	-49.4	173.6	-46.3	0	0	0	0	110.9	M1 F7 L8 E9	M1-S5 PolarHBondContact O-N 3.2Å; S5-F7 VanDerWaalsContact C-N 3.34Å; S5-F7 PolarHBondContact O-N 3.07Å; S5-L8 PolarHBondContact O-N 3.23Å; S5-E9 WeakPolarHBondContact O-CG 3.41Å; S5-E9 PolarHBondContact O-N 3.41Å
6	Q	70.9	Confident	69.1	Low	88 Å²	88	70.8 Å²	70.8	41%	0.411	36%	0.363	S	S	.	.	H	α-helix	trans	-62.5	-36.9	174.9	-74.8	172	42.7	0	0	113.1	N2 L10	N2-Q6 WeakPolarHBondContact O-CG 3.41Å; N2-Q6 PolarHBondContact O-N 2.84Å; N2-Q6 VanDerWaalsContact O-N 3.12Å; Q6-L10 WeakPolarHBondContact O-CB 3.36Å; Q6-L10 WeakPolarHBondContact O-CD1 3.35Å; Q6-L10 VanDerWaalsContact O-CG 3.25Å; Q6-L10 WeakPolarHBondContact O-CG 3.42Å; Q6-L10 PolarHBondContact O-N 3.34Å
7	F	72.5	Confident	69	Low	5 Å²	5	69.1 Å²	69.1	2%	0.022	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-45.9	174.6	170	-87	0	0	0	111.4	F3 F4 S5 L10 W11 L49 I53 Y69 C73	F3-F7 WeakPolarHBondContact O-CB 3.45Å; F3-F7 PolarHBondContact O-N 2.82Å; F4-F7 PolarHBondContact O-N 3.5Å; S5-F7 VanDerWaalsContact C-N 3.34Å; S5-F7 PolarHBondContact O-N 3.07Å; F7-L10 PolarHBondContact O-N 3.35Å; F7-W11 HydrophobicContact CE1-CB 4.21Å; F7-W11 HydrophobicContact CE1-CE3 4.26Å; F7-W11 HydrophobicContact CE2-CE3 4.1Å; F7-W11 HydrophobicContact CZ-CB 4.39Å; F7-W11 HydrophobicContact CZ-CD2 4.15Å; F7-W11 AromaticContact CZ-CE3 3.49Å; F7-W11 HydrophobicContact CZ-CE3 3.49Å; F7-W11 VanDerWaalsContact CZ-CE3 3.49Å; F7-W11 HydrophobicContact CZ-CZ3 4.13Å; F7-W11 WeakPolarHBondContact O-CB 3.48Å; F7-W11 PolarHBondContact O-N 3.49Å; F7-L49 HydrophobicContact CD1-CD2 4.23Å; F7-L49 HydrophobicContact CE1-CD1 3.54Å; F7-L49 HydrophobicContact CE1-CD2 3.8Å; F7-L49 HydrophobicContact CE1-CG 4.28Å; F7-L49 HydrophobicContact CZ-CD1 3.93Å; F7-L49 HydrophobicContact CZ-CD2 4.32Å; F7-I53 HydrophobicContact CZ-CD1 4.48Å; F7-Y69 HydrophobicContact CD2-CD1 4.41Å; F7-Y69 AromaticContact CD2-CE1 3.78Å; F7-Y69 HydrophobicContact CD2-CE1 3.78Å; F7-Y69 HydrophobicContact CE2-CE1 4.49Å; F7-C73 HydrophobicContact CD2-CB 4.44Å; F7-C73 WeakPolarHBondContact CD2-SG 3.49Å
8	L	70.5	Confident	68.6	Low	15 Å²	15	74.4 Å²	74.4	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-65.6	-40.6	179.4	-77.9	178.8	0	0	0	112.2	F4 S5 W11 N12 A21 P22 L24 Y45	F4-L8 WeakPolarHBondContact O-CB 3.4Å; F4-L8 WeakPolarHBondContact O-CG 3.49Å; F4-L8 PolarHBondContact O-N 3.47Å; S5-L8 PolarHBondContact O-N 3.23Å; L8-W11 PolarHBondContact O-N 3.01Å; L8-N12 WeakPolarHBondContact O-CB 3.39Å; L8-N12 VanDerWaalsContact O-CG 3.23Å; L8-N12 PolarHBondContact O-N 3.12Å; L8-N12 PolarHBondContact O-ND2 3.43Å; L8-A21 HydrophobicContact CD2-CB 3.34Å; L8-P22 WeakPolarHBondContact CD2-O 3.43Å; L8-L24 HydrophobicContact CD1-CB 3.7Å; L8-L24 HydrophobicContact CD1-CD1 4.36Å; L8-Y45 VanDerWaalsContact CD2-OH 3.32Å; L8-Y45 WeakPolarHBondContact CD2-OH 3.07Å; L8-Y45 WeakPolarHBondContact CG-OH 3.35Å
9	E	72.8	Confident	68.2	Low	131 Å²	131	73 Å²	73	61%	0.612	39%	0.389	S	S	*	.	H	α-helix	trans	-58.6	-49	172.1	-75.1	169.3	179	0	0	111.1	S5 S13	S5-E9 WeakPolarHBondContact O-CG 3.41Å; S5-E9 PolarHBondContact O-N 3.41Å; E9-S13 WeakPolarHBondContact O-CB 3.48Å; E9-S13 PolarHBondContact O-N 3.45Å
10	L	69.8	Low	68.1	Low	97 Å²	97	75.7 Å²	75.7	51%	0.508	40%	0.397	S	S	.	.	H	α-helix	trans	-65.6	-40.6	178.6	-73	169.2	0	0	0	112.8	Q6 F7 R14 Y69	Q6-L10 WeakPolarHBondContact O-CB 3.36Å; Q6-L10 WeakPolarHBondContact O-CD1 3.35Å; Q6-L10 VanDerWaalsContact O-CG 3.25Å; Q6-L10 WeakPolarHBondContact O-CG 3.42Å; Q6-L10 PolarHBondContact O-N 3.34Å; F7-L10 PolarHBondContact O-N 3.35Å; L10-R14 WeakPolarHBondContact O-CB 3.49Å; L10-R14 PolarHBondContact O-N 3.15Å; L10-Y69 HydrophobicContact CD1-CE1 4.19Å
11	W	71.3	Confident	67.9	Low	16 Å²	16	72.1 Å²	72.1	6%	0.061	38%	0.378	C	S	.	.	H	α-helix	trans	-66	-52.6	177.9	-175	-75.6	0	0	0	111	F7 L8 S13 R14 F15 N19 A21 I53 H56 I60 L70	F7-W11 HydrophobicContact CE1-CB 4.21Å; F7-W11 HydrophobicContact CE1-CE3 4.26Å; F7-W11 HydrophobicContact CE2-CE3 4.1Å; F7-W11 HydrophobicContact CZ-CB 4.39Å; F7-W11 HydrophobicContact CZ-CD2 4.15Å; F7-W11 AromaticContact CZ-CE3 3.49Å; F7-W11 HydrophobicContact CZ-CE3 3.49Å; F7-W11 VanDerWaalsContact CZ-CE3 3.49Å; F7-W11 HydrophobicContact CZ-CZ3 4.13Å; F7-W11 WeakPolarHBondContact O-CB 3.48Å; F7-W11 PolarHBondContact O-N 3.49Å; L8-W11 PolarHBondContact O-N 3.01Å; W11-S13 PolarHBondContact O-N 3.14Å; W11-R14 PolarHBondContact O-N 3Å; W11-F15 AromaticContact CD2-CD2 3.79Å; W11-F15 HydrophobicContact CD2-CD2 3.79Å; W11-F15 HydrophobicContact CD2-CE2 4.25Å; W11-F15 AromaticContact CE2-CD2 3.72Å; W11-F15 HydrophobicContact CE3-CD2 4.23Å; W11-F15 HydrophobicContact CE3-CE2 4.22Å; W11-F15 HydrophobicContact CG-CD2 4.09Å; W11-F15 HydrophobicContact CH2-CE2 4.48Å; W11-F15 HydrophobicContact CZ2-CD2 4.13Å; W11-F15 HydrophobicContact CZ2-CE2 4.48Å; W11-F15 HydrophobicContact CZ3-CE2 4.34Å; W11-F15 AromaticContact NE1-CD2 3.92Å; W11-F15 PolarHBondContact O-N 2.91Å; W11-N19 PolarHBondContact NE1-O 2.87Å; W11-A21 HydrophobicContact CB-CB 4.33Å; W11-A21 VanDerWaalsContact CD1-CB 3.42Å; W11-A21 HydrophobicContact CD2-CB 4.34Å; W11-A21 HydrophobicContact CG-CB 3.77Å; W11-I53 HydrophobicContact CH2-CG1 3.96Å; W11-I53 HydrophobicContact CZ3-CG1 4.01Å; W11-H56 HydrophobicContact CZ2-CB 4.42Å; W11-H56 AromaticContact CZ2-CD2 3.95Å; W11-I60 HydrophobicContact CH2-CD1 3.58Å; W11-I60 HydrophobicContact CZ2-CD1 4.19Å; W11-I60 HydrophobicContact CZ3-CD1 4.25Å; W11-L70 HydrophobicContact CZ3-CD1 4.2Å
12	N	72.6	Confident	68.2	Low	44 Å²	44	69 Å²	69	24%	0.235	37%	0.366	C	S	.	.	H	α-helix	trans	-68.3	-23.7	-179.2	-66.1	-24.8	0	0	0	112.5	L8 K20 A21	L8-N12 WeakPolarHBondContact O-CB 3.39Å; L8-N12 VanDerWaalsContact O-CG 3.23Å; L8-N12 PolarHBondContact O-N 3.12Å; L8-N12 PolarHBondContact O-ND2 3.43Å; N12-K20 WeakPolarHBondContact OD1-CA 3.16Å; N12-A21 PolarHBondContact OD1-N 3.27Å
13	S	74.3	Confident	68	Low	101 Å²	101	69 Å²	69	71%	0.706	36%	0.362	S	S	*	.	H	α-helix	trans	-73.3	-34.8	169.9	-179.9	0	0	0	0	112.9	E9 W11	E9-S13 WeakPolarHBondContact O-CB 3.48Å; E9-S13 PolarHBondContact O-N 3.45Å; W11-S13 PolarHBondContact O-N 3.14Å
14	R	67.4	Low	67.8	Low	176 Å²	176	68.3 Å²	68.3	66%	0.664	36%	0.36	S	S	*	.	H	α-helix	trans	-88.7	-29.9	-178.2	-165.8	63.3	171.9	-169.8	0.2	113.4	L10 W11 P16	L10-R14 WeakPolarHBondContact O-CB 3.49Å; L10-R14 PolarHBondContact O-N 3.15Å; W11-R14 PolarHBondContact O-N 3Å; R14-P16 VanDerWaalsContact C-CD 3.44Å; R14-P16 WeakPolarHBondContact O-CD 3.43Å
15	F	67	Low	67.3	Low	40 Å²	40	71.9 Å²	71.9	18%	0.175	38%	0.379	C	S	.	.	S	Bend	trans	-123.3	72.7	-177.1	-56.7	-64.4	0	0	0	110.9	W11 N19 I60	W11-F15 AromaticContact CD2-CD2 3.79Å; W11-F15 HydrophobicContact CD2-CD2 3.79Å; W11-F15 HydrophobicContact CD2-CE2 4.25Å; W11-F15 AromaticContact CE2-CD2 3.72Å; W11-F15 HydrophobicContact CE3-CD2 4.23Å; W11-F15 HydrophobicContact CE3-CE2 4.22Å; W11-F15 HydrophobicContact CG-CD2 4.09Å; W11-F15 HydrophobicContact CH2-CE2 4.48Å; W11-F15 HydrophobicContact CZ2-CD2 4.13Å; W11-F15 HydrophobicContact CZ2-CE2 4.48Å; W11-F15 HydrophobicContact CZ3-CE2 4.34Å; W11-F15 AromaticContact NE1-CD2 3.92Å; W11-F15 PolarHBondContact O-N 2.91Å; F15-N19 HydrophobicContact CB-CB 3.96Å; F15-I60 HydrophobicContact CE1-CB 4.48Å; F15-I60 HydrophobicContact CE1-CD1 4.44Å; F15-I60 HydrophobicContact CE1-CG1 3.74Å; F15-I60 HydrophobicContact CE1-CG2 4.34Å; F15-I60 HydrophobicContact CE2-CD1 4.15Å; F15-I60 HydrophobicContact CE2-CG1 4.32Å; F15-I60 HydrophobicContact CZ-CB 4.31Å; F15-I60 HydrophobicContact CZ-CD1 3.93Å; F15-I60 HydrophobicContact CZ-CG1 3.62Å; F15-I60 HydrophobicContact CZ-CG2 3.83Å
16	P	66	Low	66.5	Low	91 Å²	91	72.6 Å²	72.6	59%	0.591	38%	0.384	S	S	*	.			trans	-66.5	159.7	169.7	30.4	-35.3	0	0	0	111.3	R14	R14-P16 VanDerWaalsContact C-CD 3.44Å; R14-P16 WeakPolarHBondContact O-CD 3.43Å
17	G	67.9	Low	65.8	Low	43 Å²	43	69.3 Å²	69.3	44%	0.443	37%	0.369	S	S	.	.	S	Bend	trans	89.9	-146.1	-179	0	0	0	0	0	113.5	N19 K20	G17-N19 PolarHBondContact O-N 3.06Å; G17-K20 WeakPolarHBondContact O-CG 3.46Å; G17-K20 PolarHBondContact O-N 3.45Å
18	D	61.4	Low	65.1	Low	165 Å²	165	74.3 Å²	74.3	88%	0.882	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-14.7	-174.5	-51.3	-40.8	0	0	0	113.4	K20	D18-K20 PolarHBondContact O-N 2.87Å
19	N	61.9	Low	64.3	Low	47 Å²	47	77 Å²	77	25%	0.251	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	13.5	179.5	-50.3	-52.9	0	0	0	113.2	W11 F15 G17 H56	W11-N19 PolarHBondContact NE1-O 2.87Å; F15-N19 HydrophobicContact CB-CB 3.96Å; G17-N19 PolarHBondContact O-N 3.06Å; N19-H56 PolarHBondContact OD1-CE1 3.25Å; N19-H56 PolarHBondContact OD1-ND1 3.09Å
20	K	65.5	Low	63.6	Low	126 Å²	126	78.4 Å²	78.4	55%	0.548	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-63.8	136.1	179.4	-83.4	169	-178.9	173.5	0	110.9	N12 G17 D18	N12-K20 WeakPolarHBondContact OD1-CA 3.16Å; G17-K20 WeakPolarHBondContact O-CG 3.46Å; G17-K20 PolarHBondContact O-N 3.45Å; D18-K20 PolarHBondContact O-N 2.87Å
21	A	64.9	Low	63.1	Low	2 Å²	2	80 Å²	80	2%	0.017	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-68.9	146.5	173.2	0	0	0	0	0	110.1	L8 W11 N12 Q23 L49	L8-A21 HydrophobicContact CD2-CB 3.34Å; W11-A21 HydrophobicContact CB-CB 4.33Å; W11-A21 VanDerWaalsContact CD1-CB 3.42Å; W11-A21 HydrophobicContact CD2-CB 4.34Å; W11-A21 HydrophobicContact CG-CB 3.77Å; N12-A21 PolarHBondContact OD1-N 3.27Å; A21-Q23 PolarHBondContact O-N 2.93Å; A21-L49 HydrophobicContact CB-CD1 4.36Å
22	P	64.5	Low	62.6	Low	37 Å²	37	81.5 Å²	81.5	24%	0.24	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-55.3	134.3	-179.9	22.3	-33.4	0	0	0	110.3	L8 Y45 K48	L8-P22 WeakPolarHBondContact CD2-O 3.43Å; P22-Y45 HydrophobicContact CB-CE2 4.5Å; P22-Y45 HydrophobicContact CG-CE2 4.12Å; P22-Y45 WeakPolarHBondContact O-CE2 3.28Å; P22-K48 HydrophobicContact CG-CB 4.32Å
23	Q	63.3	Low	62.2	Low	128 Å²	128	85 Å²	85	60%	0.598	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-69.7	143.5	-179	-65.8	-159.3	4.7	0	0	111.1	A21 D25	A21-Q23 PolarHBondContact O-N 2.93Å; Q23-D25 PolarHBondContact O-N 2.87Å; Q23-D25 PolarHBondContact OE1-OD2 2.42Å
24	L	61	Low	62.1	Low	31 Å²	31	82.4 Å²	82.4	16%	0.162	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-76.6	23.3	-179.9	-149.8	82.6	0	0	0	113	M1 F4 L8 C26 L27 Y45	M1-L24 HydrophobicContact SD-CD2 4.31Å; F4-L24 HydrophobicContact CB-CD1 4.21Å; F4-L24 HydrophobicContact CB-CD2 4.28Å; L8-L24 HydrophobicContact CD1-CB 3.7Å; L8-L24 HydrophobicContact CD1-CD1 4.36Å; L24-C26 PolarHBondContact O-N 3.46Å; L24-C26 VanDerWaalsContact O-N 3.12Å; L24-L27 HydrophobicContact CD1-CD1 3.91Å; L24-L27 HydrophobicContact CD2-CB 4.21Å; L24-L27 HydrophobicContact CD2-CD1 4.3Å; L24-L27 HydrophobicContact CG-CB 4.09Å; L24-L27 HydrophobicContact CG-CD1 3.97Å; L24-L27 PolarHBondContact O-N 2.6Å; L24-Y45 HydrophobicContact CD1-CD1 3.79Å; L24-Y45 HydrophobicContact CD1-CD2 3.81Å; L24-Y45 HydrophobicContact CD1-CE1 3.5Å; L24-Y45 VanDerWaalsContact CD1-CE1 3.5Å; L24-Y45 HydrophobicContact CD1-CE2 3.5Å; L24-Y45 HydrophobicContact CD1-CG 3.95Å
25	D	57.7	Low	62.3	Low	78 Å²	78	77.7 Å²	77.7	42%	0.417	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-58.1	-28.8	-175.5	-84.7	-55.6	0	0	0	112.8	Q23 L27 K28	Q23-D25 PolarHBondContact O-N 2.87Å; Q23-D25 PolarHBondContact OE1-OD2 2.42Å; D25-L27 PolarHBondContact O-N 3.09Å; D25-K28 IonicContact OD1-NZ 2.6Å; D25-K28 PolarHBondContact OD1-NZ 3.17Å; D25-K28 VanDerWaalsContact OD1-NZ 3.13Å
26	C	54.1	Low	62.7	Low	64 Å²	64	78 Å²	78	43%	0.432	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-61.3	-19.2	176.1	-48.3	0	0	0	0	113.7	L24 F32	L24-C26 PolarHBondContact O-N 3.46Å; L24-C26 VanDerWaalsContact O-N 3.12Å; C26-F32 WeakPolarHBondContact O-CE2 3.49Å; C26-F32 WeakPolarHBondContact O-CZ 3.5Å
27	L	55.4	Low	63.1	Low	19 Å²	19	75.1 Å²	75.1	10%	0.099	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-108.3	30.4	-170.2	-73.4	168	0	0	0	114.8	M1 L24 D25 A29 F32 A41 L42	M1-L27 HydrophobicContact CE-CB 3.9Å; M1-L27 HydrophobicContact CE-CD1 3.9Å; M1-L27 HydrophobicContact CE-CD2 3.76Å; M1-L27 HydrophobicContact CE-CG 4.06Å; M1-L27 HydrophobicContact SD-CB 4.26Å; M1-L27 HydrophobicContact SD-CD1 4.06Å; L24-L27 HydrophobicContact CD1-CD1 3.91Å; L24-L27 HydrophobicContact CD2-CB 4.21Å; L24-L27 HydrophobicContact CD2-CD1 4.3Å; L24-L27 HydrophobicContact CG-CB 4.09Å; L24-L27 HydrophobicContact CG-CD1 3.97Å; L24-L27 PolarHBondContact O-N 2.6Å; D25-L27 PolarHBondContact O-N 3.09Å; L27-A29 PolarHBondContact O-N 3.2Å; L27-F32 HydrophobicContact CD2-CE2 3.86Å; L27-F32 HydrophobicContact CD2-CZ 4.05Å; L27-A41 HydrophobicContact CD2-CB 4.09Å; L27-L42 HydrophobicContact CD1-CD1 3.73Å
28	K	57.9	Low	63.1	Low	109 Å²	109	76 Å²	76	47%	0.474	42%	0.421	S	S	.	.			trans	-68.1	122.4	164.6	-67	173.7	-170.6	163.8	0	108.2	D25 D30 Q31	D25-K28 IonicContact OD1-NZ 2.6Å; D25-K28 PolarHBondContact OD1-NZ 3.17Å; D25-K28 VanDerWaalsContact OD1-NZ 3.13Å; K28-D30 PolarHBondContact O-N 2.89Å; K28-Q31 HydrophobicContact CB-CG 4.41Å; K28-Q31 PolarHBondContact O-N 3.23Å; K28-Q31 VanDerWaalsContact O-N 3.11Å
29	A	54.6	Low	63.7	Low	71 Å²	71	69.4 Å²	69.4	59%	0.587	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-56.9	-28.5	-169.9	0	0	0	0	0	113.4	L27 Q31	L27-A29 PolarHBondContact O-N 3.2Å; A29-Q31 PolarHBondContact O-N 3.12Å
30	D	56.4	Low	64.4	Low	161 Å²	161	74.8 Å²	74.8	86%	0.861	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-75.1	-4.8	-176.1	-42.5	-37	0	0	0	113.9	K28	K28-D30 PolarHBondContact O-N 2.89Å
31	Q	59.6	Low	64.8	Low	130 Å²	130	69.5 Å²	69.5	61%	0.607	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-98.5	-1.4	-177	-65.5	-168.5	-6.4	0	0	115	K28 A29	K28-Q31 HydrophobicContact CB-CG 4.41Å; K28-Q31 PolarHBondContact O-N 3.23Å; K28-Q31 VanDerWaalsContact O-N 3.11Å; A29-Q31 PolarHBondContact O-N 3.12Å
32	F	60.6	Low	65.2	Low	48 Å²	48	70 Å²	70	21%	0.211	38%	0.384	C	S	.	.			trans	-117.4	118.9	-173.9	-65.1	-73.6	0	0	0	113.8	C26 L27 S34 D37 Q38 A41	C26-F32 WeakPolarHBondContact O-CE2 3.49Å; C26-F32 WeakPolarHBondContact O-CZ 3.5Å; L27-F32 HydrophobicContact CD2-CE2 3.86Å; L27-F32 HydrophobicContact CD2-CZ 4.05Å; F32-S34 VanDerWaalsContact C-N 3.33Å; F32-S34 PolarHBondContact O-N 2.8Å; F32-D37 HydrophobicContact CB-CB 4.41Å; F32-D37 HydrophobicContact CD1-CB 3.57Å; F32-D37 HydrophobicContact CE1-CB 4.35Å; F32-D37 HydrophobicContact CG-CB 4.43Å; F32-Q38 HydrophobicContact CB-CG 3.49Å; F32-Q38 VanDerWaalsContact CB-CG 3.49Å; F32-Q38 HydrophobicContact CD1-CG 4.26Å; F32-Q38 HydrophobicContact CD2-CG 3.72Å; F32-Q38 HydrophobicContact CG-CB 4.49Å; F32-Q38 HydrophobicContact CG-CG 3.54Å; F32-A41 HydrophobicContact CE1-CB 3.54Å; F32-A41 HydrophobicContact CZ-CB 3.4Å; F32-A41 VanDerWaalsContact CZ-CB 3.4Å
33	S	64.3	Low	65.6	Low	118 Å²	118	72 Å²	72	83%	0.825	39%	0.39	S	S	*	.	S	Bend	trans	-65.1	-29.6	173	34.7	0	0	0	0	114.1	D37	S33-D37 PolarHBondContact OG-OD2 3.13Å
34	S	71.9	Confident	66.3	Low	46 Å²	46	71.1 Å²	71.1	32%	0.322	39%	0.385	S	S	.	.	S	Bend	trans	-145.2	160	-177.7	78.3	0	0	0	0	113.6	F32 A36 D37 Q38	F32-S34 VanDerWaalsContact C-N 3.33Å; F32-S34 PolarHBondContact O-N 2.8Å; S34-A36 PolarHBondContact O-N 3Å; S34-A36 PolarHBondContact OG-N 3.21Å; S34-D37 WeakPolarHBondContact CB-OD2 3.19Å; S34-D37 PolarHBondContact N-OD2 3.27Å; S34-D37 PolarHBondContact O-N 3.36Å; S34-D37 VanDerWaalsContact O-N 3.1Å; S34-D37 PolarHBondContact OG-N 3.36Å; S34-D37 VanDerWaalsContact OG-N 3.15Å; S34-D37 PolarHBondContact OG-OD1 3.13Å; S34-D37 PolarHBondContact OG-OD2 3.37Å; S34-Q38 PolarHBondContact O-N 3.14Å
35	V	72.8	Confident	67	Low	77 Å²	77	70.1 Å²	70.1	47%	0.467	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-29.7	171.5	-177.8	0	0	0	0	111.4	D37 Q38 K39 F84	V35-D37 VanDerWaalsContact C-N 3.35Å; V35-Q38 PolarHBondContact O-N 3.4Å; V35-K39 WeakPolarHBondContact O-CB 3.44Å; V35-K39 PolarHBondContact O-N 3.27Å; V35-F84 HydrophobicContact CG1-CD1 3.99Å; V35-F84 HydrophobicContact CG1-CE1 3.83Å
36	A	74.3	Confident	67.7	Low	48 Å²	48	68 Å²	68	40%	0.397	37%	0.371	S	S	.	.	H	α-helix	trans	-69.4	-31.9	175.5	0	0	0	0	0	112.4	S34 K39 R40	S34-A36 PolarHBondContact O-N 3Å; S34-A36 PolarHBondContact OG-N 3.21Å; A36-K39 PolarHBondContact O-N 3.38Å; A36-R40 WeakPolarHBondContact O-CG 3.44Å; A36-R40 PolarHBondContact O-N 3.09Å
37	D	74.5	Confident	68.7	Low	29 Å²	29	68.5 Å²	68.5	16%	0.155	37%	0.374	C	S	.	.	H	α-helix	trans	-72.6	-40.5	174.7	-51.3	-43.7	0	0	0	110.8	F32 S33 S34 V35 K39 R40 A41	F32-D37 HydrophobicContact CB-CB 4.41Å; F32-D37 HydrophobicContact CD1-CB 3.57Å; F32-D37 HydrophobicContact CE1-CB 4.35Å; F32-D37 HydrophobicContact CG-CB 4.43Å; S33-D37 PolarHBondContact OG-OD2 3.13Å; S34-D37 WeakPolarHBondContact CB-OD2 3.19Å; S34-D37 PolarHBondContact N-OD2 3.27Å; S34-D37 PolarHBondContact O-N 3.36Å; S34-D37 VanDerWaalsContact O-N 3.1Å; S34-D37 PolarHBondContact OG-N 3.36Å; S34-D37 VanDerWaalsContact OG-N 3.15Å; S34-D37 PolarHBondContact OG-OD1 3.13Å; S34-D37 PolarHBondContact OG-OD2 3.37Å; V35-D37 VanDerWaalsContact C-N 3.35Å; D37-K39 VanDerWaalsContact C-N 3.33Å; D37-K39 PolarHBondContact O-N 3.24Å; D37-R40 PolarHBondContact O-N 3.01Å; D37-R40 IonicContact OD1-CZ 2.67Å; D37-R40 IonicContact OD1-NE 2.72Å; D37-R40 IonicContact OD1-NH2 2.7Å; D37-R40 PolarHBondContact OD1-NH2 3.14Å; D37-A41 WeakPolarHBondContact O-CB 3.26Å; D37-A41 PolarHBondContact O-N 2.89Å
38	Q	69	Low	69.8	Low	62 Å²	62	72.1 Å²	72.1	29%	0.29	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-40.7	171.4	-65.5	-176.9	-5.8	0	0	112.1	F32 S34 V35 L42	F32-Q38 HydrophobicContact CB-CG 3.49Å; F32-Q38 VanDerWaalsContact CB-CG 3.49Å; F32-Q38 HydrophobicContact CD1-CG 4.26Å; F32-Q38 HydrophobicContact CD2-CG 3.72Å; F32-Q38 HydrophobicContact CG-CB 4.49Å; F32-Q38 HydrophobicContact CG-CG 3.54Å; S34-Q38 PolarHBondContact O-N 3.14Å; V35-Q38 PolarHBondContact O-N 3.4Å; Q38-L42 WeakPolarHBondContact O-CB 3.37Å; Q38-L42 PolarHBondContact O-N 2.98Å
39	K	72.8	Confident	70.6	Confident	26 Å²	26	67 Å²	67	11%	0.113	37%	0.367	C	S	.	.	H	α-helix	trans	-60.2	-53.5	174.2	-179.5	-173.1	171.7	-177.3	0	110.8	V35 A36 D37 A41 L42 E43 F84 E88	V35-K39 WeakPolarHBondContact O-CB 3.44Å; V35-K39 PolarHBondContact O-N 3.27Å; A36-K39 PolarHBondContact O-N 3.38Å; D37-K39 VanDerWaalsContact C-N 3.33Å; D37-K39 PolarHBondContact O-N 3.24Å; K39-A41 PolarHBondContact O-N 3.48Å; K39-L42 PolarHBondContact O-N 2.61Å; K39-L42 VanDerWaalsContact O-N 3.14Å; K39-E43 WeakPolarHBondContact CE-OE1 3.47Å; K39-E43 HydrophobicContact CG-CG 4.49Å; K39-E43 WeakPolarHBondContact O-CG 3.44Å; K39-E43 PolarHBondContact O-N 3.41Å; K39-F84 HydrophobicContact CB-CG 4.49Å; K39-F84 HydrophobicContact CD-CB 4.04Å; K39-F84 HydrophobicContact CG-CB 4.1Å; K39-F84 HydrophobicContact CG-CG 4.44Å; K39-E88 WeakPolarHBondContact CD-OE1 3.23Å; K39-E88 IonicContact NZ-OE1 3.88Å; K39-E88 PolarHBondContact NZ-OE1 3.18Å; K39-E88 IonicContact NZ-OE2 2.66Å; K39-E88 PolarHBondContact NZ-OE2 2.86Å
40	R	78.1	Confident	71.6	Confident	161 Å²	161	66.7 Å²	66.7	61%	0.608	36%	0.36	S	S	*	.	H	α-helix	trans	-57.5	-45.6	179.1	-76	-171.7	-73.1	172.2	-5.6	112.5	A36 D37 L42 E43 E44	A36-R40 WeakPolarHBondContact O-CG 3.44Å; A36-R40 PolarHBondContact O-N 3.09Å; D37-R40 PolarHBondContact O-N 3.01Å; D37-R40 IonicContact OD1-CZ 2.67Å; D37-R40 IonicContact OD1-NE 2.72Å; D37-R40 IonicContact OD1-NH2 2.7Å; D37-R40 PolarHBondContact OD1-NH2 3.14Å; R40-L42 VanDerWaalsContact C-N 3.33Å; R40-L42 PolarHBondContact O-N 2.79Å; R40-E43 PolarHBondContact O-N 3.1Å; R40-E44 WeakPolarHBondContact O-CB 3.48Å; R40-E44 PolarHBondContact O-N 2.83Å
41	A	73.7	Confident	72.5	Confident	14 Å²	14	64.1 Å²	64.1	12%	0.116	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-35.8	177.6	0	0	0	0	0	112.9	L27 F32 D37 K39 Y45	L27-A41 HydrophobicContact CD2-CB 4.09Å; F32-A41 HydrophobicContact CE1-CB 3.54Å; F32-A41 HydrophobicContact CZ-CB 3.4Å; F32-A41 VanDerWaalsContact CZ-CB 3.4Å; D37-A41 WeakPolarHBondContact O-CB 3.26Å; D37-A41 PolarHBondContact O-N 2.89Å; K39-A41 PolarHBondContact O-N 3.48Å; A41-Y45 VanDerWaalsContact O-CB 3.25Å; A41-Y45 WeakPolarHBondContact O-CB 3.49Å; A41-Y45 PolarHBondContact O-N 2.78Å
42	L	73.4	Confident	73.1	Confident	14 Å²	14	59.2 Å²	59.2	7%	0.073	32%	0.323	C	S	.	.	H	α-helix	trans	-70.9	-37.7	175.5	-169.3	73.6	0	0	0	112.2	F4 L27 Q38 K39 R40 S46 I80 F84	F4-L42 HydrophobicContact CE2-CD1 4.21Å; L27-L42 HydrophobicContact CD1-CD1 3.73Å; Q38-L42 WeakPolarHBondContact O-CB 3.37Å; Q38-L42 PolarHBondContact O-N 2.98Å; K39-L42 PolarHBondContact O-N 2.61Å; K39-L42 VanDerWaalsContact O-N 3.14Å; R40-L42 VanDerWaalsContact C-N 3.33Å; R40-L42 PolarHBondContact O-N 2.79Å; L42-S46 VanDerWaalsContact O-CB 3.26Å; L42-S46 WeakPolarHBondContact O-CB 3.38Å; L42-S46 PolarHBondContact O-N 2.98Å; L42-I80 HydrophobicContact CD2-CB 4.44Å; L42-I80 HydrophobicContact CD2-CG2 3.43Å; L42-I80 VanDerWaalsContact CD2-CG2 3.43Å; L42-F84 HydrophobicContact CD2-CD2 4.45Å; L42-F84 HydrophobicContact CD2-CE2 3.9Å
43	E	73.3	Confident	73.6	Confident	79 Å²	79	57.4 Å²	57.4	37%	0.369	32%	0.316	S	S	.	.	H	α-helix	trans	-67.1	-43.8	175	-73.4	174	167.8	0	0	111.5	K39 R40 S46 C47	K39-E43 WeakPolarHBondContact CE-OE1 3.47Å; K39-E43 HydrophobicContact CG-CG 4.49Å; K39-E43 WeakPolarHBondContact O-CG 3.44Å; K39-E43 PolarHBondContact O-N 3.41Å; R40-E43 PolarHBondContact O-N 3.1Å; E43-S46 WeakPolarHBondContact O-CB 3.45Å; E43-S46 PolarHBondContact O-N 3.13Å; E43-C47 WeakPolarHBondContact O-CB 3.49Å; E43-C47 PolarHBondContact O-N 3.41Å
44	E	78	Confident	74	Confident	108 Å²	108	56.9 Å²	56.9	51%	0.505	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-45	174.5	-168	-170.3	159.9	0	0	111.5	R40 S46 C47 K48	R40-E44 WeakPolarHBondContact O-CB 3.48Å; R40-E44 PolarHBondContact O-N 2.83Å; E44-S46 VanDerWaalsContact C-N 3.35Å; E44-S46 PolarHBondContact O-N 3.2Å; E44-C47 WeakPolarHBondContact O-CB 3.35Å; E44-C47 PolarHBondContact O-N 3.14Å; E44-K48 WeakPolarHBondContact O-CG 3.5Å; E44-K48 PolarHBondContact O-N 2.91Å; E44-K48 WeakPolarHBondContact OE1-CE 3.27Å; E44-K48 IonicContact OE1-NZ 3.68Å; E44-K48 PolarHBondContact OE1-NZ 2.78Å
45	Y	73.7	Confident	74.1	Confident	10 Å²	10	60.6 Å²	60.6	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-41.6	173.8	176	-93.4	0	0	0	112	F4 L8 P22 L24 A41 C47 K48 L49	F4-Y45 HydrophobicContact CD1-CE1 4.14Å; L8-Y45 VanDerWaalsContact CD2-OH 3.32Å; L8-Y45 WeakPolarHBondContact CD2-OH 3.07Å; L8-Y45 WeakPolarHBondContact CG-OH 3.35Å; P22-Y45 HydrophobicContact CB-CE2 4.5Å; P22-Y45 HydrophobicContact CG-CE2 4.12Å; P22-Y45 WeakPolarHBondContact O-CE2 3.28Å; L24-Y45 HydrophobicContact CD1-CD1 3.79Å; L24-Y45 HydrophobicContact CD1-CD2 3.81Å; L24-Y45 HydrophobicContact CD1-CE1 3.5Å; L24-Y45 VanDerWaalsContact CD1-CE1 3.5Å; L24-Y45 HydrophobicContact CD1-CE2 3.5Å; L24-Y45 HydrophobicContact CD1-CG 3.95Å; A41-Y45 VanDerWaalsContact O-CB 3.25Å; A41-Y45 WeakPolarHBondContact O-CB 3.49Å; A41-Y45 PolarHBondContact O-N 2.78Å; Y45-C47 VanDerWaalsContact C-N 3.29Å; Y45-C47 PolarHBondContact O-N 3.15Å; Y45-K48 PolarHBondContact O-N 2.84Å; Y45-L49 HydrophobicContact CE1-CB 4.4Å; Y45-L49 HydrophobicContact CE1-CD2 3.95Å; Y45-L49 VanDerWaalsContact O-CB 3.29Å; Y45-L49 WeakPolarHBondContact O-CB 3.43Å; Y45-L49 PolarHBondContact O-N 3.26Å
46	S	73.2	Confident	73.8	Confident	34 Å²	34	57.9 Å²	57.9	24%	0.238	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-40.7	174.8	-172.4	0	0	0	0	111.8	L42 E43 E44 S50	L42-S46 VanDerWaalsContact O-CB 3.26Å; L42-S46 WeakPolarHBondContact O-CB 3.38Å; L42-S46 PolarHBondContact O-N 2.98Å; E43-S46 WeakPolarHBondContact O-CB 3.45Å; E43-S46 PolarHBondContact O-N 3.13Å; E44-S46 VanDerWaalsContact C-N 3.35Å; E44-S46 PolarHBondContact O-N 3.2Å; S46-S50 WeakPolarHBondContact O-CB 3.46Å; S46-S50 PolarHBondContact O-N 3.07Å
47	C	76.2	Confident	73.6	Confident	75 Å²	75	59.8 Å²	59.8	51%	0.507	29%	0.294	S	S	.	.	H	α-helix	trans	-66.8	-51.1	178.3	-167	0	0	0	0	111.2	E43 E44 Y45 L49 S50 M51	E43-C47 WeakPolarHBondContact O-CB 3.49Å; E43-C47 PolarHBondContact O-N 3.41Å; E44-C47 WeakPolarHBondContact O-CB 3.35Å; E44-C47 PolarHBondContact O-N 3.14Å; Y45-C47 VanDerWaalsContact C-N 3.29Å; Y45-C47 PolarHBondContact O-N 3.15Å; C47-L49 VanDerWaalsContact C-N 3.3Å; C47-L49 PolarHBondContact O-N 2.88Å; C47-S50 WeakPolarHBondContact O-CB 3.38Å; C47-S50 PolarHBondContact O-N 2.73Å; C47-M51 PolarHBondContact O-N 2.83Å
48	K	78.6	Confident	73.2	Confident	95 Å²	95	67.5 Å²	67.5	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-56.7	-42.9	176.1	-70.8	174.6	-175.9	170.9	0	112.1	P22 E44 Y45 M51 T52	P22-K48 HydrophobicContact CG-CB 4.32Å; E44-K48 WeakPolarHBondContact O-CG 3.5Å; E44-K48 PolarHBondContact O-N 2.91Å; E44-K48 WeakPolarHBondContact OE1-CE 3.27Å; E44-K48 IonicContact OE1-NZ 3.68Å; E44-K48 PolarHBondContact OE1-NZ 2.78Å; Y45-K48 PolarHBondContact O-N 2.84Å; K48-M51 PolarHBondContact O-N 3.31Å; K48-T52 PolarHBondContact O-N 2.85Å; K48-T52 VanDerWaalsContact O-N 3.13Å; K48-T52 PolarHBondContact O-OG1 2.82Å
49	L	74.3	Confident	72.9	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-66.6	-39.4	176.3	-180	58.4	0	0	0	111.8	F7 A21 Y45 C47 M51 T52 I53	F7-L49 HydrophobicContact CD1-CD2 4.23Å; F7-L49 HydrophobicContact CE1-CD1 3.54Å; F7-L49 HydrophobicContact CE1-CD2 3.8Å; F7-L49 HydrophobicContact CE1-CG 4.28Å; F7-L49 HydrophobicContact CZ-CD1 3.93Å; F7-L49 HydrophobicContact CZ-CD2 4.32Å; A21-L49 HydrophobicContact CB-CD1 4.36Å; Y45-L49 HydrophobicContact CE1-CB 4.4Å; Y45-L49 HydrophobicContact CE1-CD2 3.95Å; Y45-L49 VanDerWaalsContact O-CB 3.29Å; Y45-L49 WeakPolarHBondContact O-CB 3.43Å; Y45-L49 PolarHBondContact O-N 3.26Å; C47-L49 VanDerWaalsContact C-N 3.3Å; C47-L49 PolarHBondContact O-N 2.88Å; L49-M51 VanDerWaalsContact C-N 3.32Å; L49-M51 PolarHBondContact O-N 3.06Å; L49-T52 PolarHBondContact O-OG1 2.94Å; L49-I53 HydrophobicContact CD1-CD1 3.87Å; L49-I53 HydrophobicContact CD1-CG1 4.15Å; L49-I53 HydrophobicContact CG-CD1 3.74Å; L49-I53 HydrophobicContact CG-CG1 4.47Å; L49-I53 WeakPolarHBondContact O-CB 3.29Å; L49-I53 VanDerWaalsContact O-CD1 3.25Å; L49-I53 WeakPolarHBondContact O-CD1 3.39Å; L49-I53 WeakPolarHBondContact O-CG1 3.4Å; L49-I53 PolarHBondContact O-N 3.05Å
50	S	74.3	Confident	72.3	Confident	63 Å²	63	72.1 Å²	72.1	44%	0.441	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-35.8	175.9	-166.4	0	0	0	0	112.6	S46 C47 E54	S46-S50 WeakPolarHBondContact O-CB 3.46Å; S46-S50 PolarHBondContact O-N 3.07Å; C47-S50 WeakPolarHBondContact O-CB 3.38Å; C47-S50 PolarHBondContact O-N 2.73Å; S50-E54 PolarHBondContact O-N 3.21Å; S50-E54 VanDerWaalsContact O-N 3.13Å
51	M	75.9	Confident	71.3	Confident	107 Å²	107	71.9 Å²	71.9	53%	0.527	36%	0.36	S	S	.	.	H	α-helix	trans	-66.8	-51.8	176.6	-71.4	-178	65.5	0	0	111.5	C47 K48 L49 I53 E54 E55	C47-M51 PolarHBondContact O-N 2.83Å; K48-M51 PolarHBondContact O-N 3.31Å; L49-M51 VanDerWaalsContact C-N 3.32Å; L49-M51 PolarHBondContact O-N 3.06Å; M51-I53 VanDerWaalsContact C-N 3.26Å; M51-I53 PolarHBondContact O-N 3.34Å; M51-E54 PolarHBondContact O-N 3.37Å; M51-E55 WeakPolarHBondContact O-CG 3.44Å; M51-E55 PolarHBondContact O-N 3.18Å
52	T	71.8	Confident	70.5	Confident	27 Å²	27	74.9 Å²	74.9	17%	0.166	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-35.7	178.6	53.8	0	0	0	0	112.2	K48 L49 H56	K48-T52 PolarHBondContact O-N 2.85Å; K48-T52 VanDerWaalsContact O-N 3.13Å; K48-T52 PolarHBondContact O-OG1 2.82Å; L49-T52 PolarHBondContact O-OG1 2.94Å; T52-H56 WeakPolarHBondContact O-CB 3.12Å; T52-H56 PolarHBondContact O-CD2 3.17Å; T52-H56 PolarHBondContact O-N 2.6Å
53	I	71.2	Confident	69.9	Low	11 Å²	11	78.9 Å²	78.9	6%	0.056	39%	0.39	C	S	.	.	H	α-helix	trans	-59.9	-46	172.5	-74.3	166.6	0	0	0	112	F7 W11 L49 M51 K57 L70	F7-I53 HydrophobicContact CZ-CD1 4.48Å; W11-I53 HydrophobicContact CH2-CG1 3.96Å; W11-I53 HydrophobicContact CZ3-CG1 4.01Å; L49-I53 HydrophobicContact CD1-CD1 3.87Å; L49-I53 HydrophobicContact CD1-CG1 4.15Å; L49-I53 HydrophobicContact CG-CD1 3.74Å; L49-I53 HydrophobicContact CG-CG1 4.47Å; L49-I53 WeakPolarHBondContact O-CB 3.29Å; L49-I53 VanDerWaalsContact O-CD1 3.25Å; L49-I53 WeakPolarHBondContact O-CD1 3.39Å; L49-I53 WeakPolarHBondContact O-CG1 3.4Å; L49-I53 PolarHBondContact O-N 3.05Å; M51-I53 VanDerWaalsContact C-N 3.26Å; M51-I53 PolarHBondContact O-N 3.34Å; I53-K57 PolarHBondContact O-N 3.42Å; I53-K57 VanDerWaalsContact O-N 3.1Å; I53-L70 HydrophobicContact CB-CD1 4.42Å; I53-L70 HydrophobicContact CD1-CD1 3.5Å; I53-L70 VanDerWaalsContact CD1-CD1 3.5Å; I53-L70 HydrophobicContact CD1-CG 4.43Å; I53-L70 HydrophobicContact CG1-CD1 3.75Å; I53-L70 HydrophobicContact CG2-CD1 3.78Å; I53-L70 HydrophobicContact CG2-CD2 3.66Å; I53-L70 HydrophobicContact CG2-CG 4.05Å
54	E	73	Confident	69.2	Low	107 Å²	107	79.2 Å²	79.2	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-74.9	-33.3	-177.3	-164.9	68.2	-159.3	0	0	111.7	S50 M51 K57	S50-E54 PolarHBondContact O-N 3.21Å; S50-E54 VanDerWaalsContact O-N 3.13Å; M51-E54 PolarHBondContact O-N 3.37Å; E54-K57 VanDerWaalsContact CD-CD 3.42Å; E54-K57 HydrophobicContact CG-CD 4.47Å; E54-K57 WeakPolarHBondContact O-CB 3.44Å; E54-K57 PolarHBondContact O-N 3.32Å; E54-K57 VanDerWaalsContact OE1-CD 3.22Å; E54-K57 WeakPolarHBondContact OE1-CD 3.37Å; E54-K57 WeakPolarHBondContact OE1-CE 3.35Å; E54-K57 IonicContact OE1-NZ 2.6Å; E54-K57 PolarHBondContact OE1-NZ 3.04Å; E54-K57 WeakPolarHBondContact OE2-CD 3.11Å; E54-K57 IonicContact OE2-NZ 2.82Å; E54-K57 PolarHBondContact OE2-NZ 3.24Å
55	E	73.1	Confident	68.3	Low	123 Å²	123	81.4 Å²	81.4	58%	0.575	41%	0.41	S	S	*	.	H	α-helix	trans	-63.9	-46.5	171.1	-73.6	172.1	178.9	0	0	112.2	M51 K57	M51-E55 WeakPolarHBondContact O-CG 3.44Å; M51-E55 PolarHBondContact O-N 3.18Å; E55-K57 PolarHBondContact O-N 2.82Å
56	H	68.3	Low	68	Low	21 Å²	21	82.9 Å²	82.9	10%	0.097	42%	0.419	C	S	.	.	H	α-helix	trans	-77.2	-7.4	178.6	-65.7	-54.3	0	0	0	113.3	W11 N19 T52 Q58 K59 I60	W11-H56 HydrophobicContact CZ2-CB 4.42Å; W11-H56 AromaticContact CZ2-CD2 3.95Å; N19-H56 PolarHBondContact OD1-CE1 3.25Å; N19-H56 PolarHBondContact OD1-ND1 3.09Å; T52-H56 WeakPolarHBondContact O-CB 3.12Å; T52-H56 PolarHBondContact O-CD2 3.17Å; T52-H56 PolarHBondContact O-N 2.6Å; H56-Q58 PolarHBondContact O-N 3.38Å; H56-K59 PolarHBondContact O-N 3.23Å; H56-I60 HydrophobicContact CB-CD1 3.63Å; H56-I60 HydrophobicContact CB-CG1 3.98Å; H56-I60 VanDerWaalsContact O-CG1 3.29Å; H56-I60 WeakPolarHBondContact O-CG1 3.39Å; H56-I60 PolarHBondContact O-N 2.91Å
57	K	69.7	Low	67.7	Low	88 Å²	88	87.2 Å²	87.2	38%	0.383	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.8	-177.2	-171.2	176.6	-174.9	169.1	0	114.8	I53 E54 E55 Y62	I53-K57 PolarHBondContact O-N 3.42Å; I53-K57 VanDerWaalsContact O-N 3.1Å; E54-K57 VanDerWaalsContact CD-CD 3.42Å; E54-K57 HydrophobicContact CG-CD 4.47Å; E54-K57 WeakPolarHBondContact O-CB 3.44Å; E54-K57 PolarHBondContact O-N 3.32Å; E54-K57 VanDerWaalsContact OE1-CD 3.22Å; E54-K57 WeakPolarHBondContact OE1-CD 3.37Å; E54-K57 WeakPolarHBondContact OE1-CE 3.35Å; E54-K57 IonicContact OE1-NZ 2.6Å; E54-K57 PolarHBondContact OE1-NZ 3.04Å; E54-K57 WeakPolarHBondContact OE2-CD 3.11Å; E54-K57 IonicContact OE2-NZ 2.82Å; E54-K57 PolarHBondContact OE2-NZ 3.24Å; E55-K57 PolarHBondContact O-N 2.82Å; K57-Y62 HydrophobicContact CB-CE2 4.25Å; K57-Y62 HydrophobicContact CG-CE2 3.63Å; K57-Y62 WeakPolarHBondContact O-CD2 3.33Å; K57-Y62 WeakPolarHBondContact O-CE2 3.22Å
58	Q	65.3	Low	67.3	Low	191 Å²	191	88.5 Å²	88.5	89%	0.893	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-18.2	176.2	-61.4	-175.3	5	0	0	113.7	H56	H56-Q58 PolarHBondContact O-N 3.38Å
59	K	63.4	Low	66.7	Low	165 Å²	165	86.6 Å²	86.6	72%	0.717	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-23.4	180	-70	-178.8	178	175.7	0	113.2	H56 D61	H56-K59 PolarHBondContact O-N 3.23Å; K59-D61 PolarHBondContact O-N 3.41Å
60	I	59.7	Low	66.6	Low	20 Å²	20	87.5 Å²	87.5	10%	0.103	43%	0.428	C	S	.	.	S	Bend	trans	-78.5	112.8	176.5	-65.6	168	0	0	0	108	W11 F15 H56 Y62	W11-I60 HydrophobicContact CH2-CD1 3.58Å; W11-I60 HydrophobicContact CZ2-CD1 4.19Å; W11-I60 HydrophobicContact CZ3-CD1 4.25Å; F15-I60 HydrophobicContact CE1-CB 4.48Å; F15-I60 HydrophobicContact CE1-CD1 4.44Å; F15-I60 HydrophobicContact CE1-CG1 3.74Å; F15-I60 HydrophobicContact CE1-CG2 4.34Å; F15-I60 HydrophobicContact CE2-CD1 4.15Å; F15-I60 HydrophobicContact CE2-CG1 4.32Å; F15-I60 HydrophobicContact CZ-CB 4.31Å; F15-I60 HydrophobicContact CZ-CD1 3.93Å; F15-I60 HydrophobicContact CZ-CG1 3.62Å; F15-I60 HydrophobicContact CZ-CG2 3.83Å; H56-I60 HydrophobicContact CB-CD1 3.63Å; H56-I60 HydrophobicContact CB-CG1 3.98Å; H56-I60 VanDerWaalsContact O-CG1 3.29Å; H56-I60 WeakPolarHBondContact O-CG1 3.39Å; H56-I60 PolarHBondContact O-N 2.91Å; I60-Y62 HydrophobicContact CB-CD2 4.46Å; I60-Y62 HydrophobicContact CG2-CD2 4.42Å; I60-Y62 WeakPolarHBondContact O-CD2 3.24Å; I60-Y62 PolarHBondContact O-N 3.39Å
61	D	57.1	Low	66.5	Low	156 Å²	156	89.8 Å²	89.8	83%	0.834	43%	0.432	S	S	*	.			trans	-59.9	113.6	166.6	-163.2	1.4	0	0	0	108.2	K59 D63	K59-D61 PolarHBondContact O-N 3.41Å; D61-D63 PolarHBondContact O-N 3.33Å
62	Y	57.7	Low	66.3	Low	76 Å²	76	91.1 Å²	91.1	30%	0.298	43%	0.431	S	S	.	.			trans	-87.7	55.8	-149.6	-132.2	-76.4	0	0	0	112.4	K57 I60 S64 K67 L70	K57-Y62 HydrophobicContact CB-CE2 4.25Å; K57-Y62 HydrophobicContact CG-CE2 3.63Å; K57-Y62 WeakPolarHBondContact O-CD2 3.33Å; K57-Y62 WeakPolarHBondContact O-CE2 3.22Å; I60-Y62 HydrophobicContact CB-CD2 4.46Å; I60-Y62 HydrophobicContact CG2-CD2 4.42Å; I60-Y62 WeakPolarHBondContact O-CD2 3.24Å; I60-Y62 PolarHBondContact O-N 3.39Å; Y62-S64 PolarHBondContact O-N 2.96Å; Y62-K67 HydrophobicContact CD1-CB 3.97Å; Y62-K67 HydrophobicContact CD1-CD 4.35Å; Y62-K67 HydrophobicContact CD1-CG 4.39Å; Y62-K67 HydrophobicContact CE1-CB 3.75Å; Y62-K67 HydrophobicContact CE1-CD 4.23Å; Y62-K67 HydrophobicContact CE1-CG 3.93Å; Y62-L70 WeakPolarHBondContact OH-CD2 3.38Å
63	D	60.3	Low	66.1	Low	99 Å²	99	90 Å²	90	53%	0.529	42%	0.424	S	S	.	.			trans	-53.3	131.3	-178.5	-164.6	-0.1	0	0	0	110	D61 F65 T66	D61-D63 PolarHBondContact O-N 3.33Å; D63-F65 PolarHBondContact O-N 3.1Å; D63-T66 HydrophobicContact CB-CG2 4.48Å; D63-T66 PolarHBondContact O-N 3.11Å; D63-T66 PolarHBondContact O-OG1 2.81Å
64	S	58.9	Low	66.1	Low	85 Å²	85	93.7 Å²	93.7	59%	0.594	44%	0.443	S	S	*	.	H	α-helix	trans	-59.3	-26.6	-162.6	-164.1	0	0	0	0	112.8	Y62 E68	Y62-S64 PolarHBondContact O-N 2.96Å; S64-E68 PolarHBondContact O-N 3.44Å
65	F	57.8	Low	66.2	Low	155 Å²	155	94.3 Å²	94.3	68%	0.68	45%	0.446	S	S	*	.	H	α-helix	trans	-63.1	-40.8	172.8	-174.8	-97.3	0	0	0	113.6	D63 Y69	D63-F65 PolarHBondContact O-N 3.1Å; F65-Y69 WeakPolarHBondContact O-CB 3.32Å; F65-Y69 PolarHBondContact O-N 3.35Å
66	T	67.4	Low	66.3	Low	40 Å²	40	93 Å²	93	25%	0.245	44%	0.438	C	S	.	.	H	α-helix	trans	-65.2	-44.4	179.6	66	0	0	0	0	110.3	D63 E68 Y69 L70	D63-T66 HydrophobicContact CB-CG2 4.48Å; D63-T66 PolarHBondContact O-N 3.11Å; D63-T66 PolarHBondContact O-OG1 2.81Å; T66-E68 PolarHBondContact O-N 3.16Å; T66-Y69 PolarHBondContact O-N 2.86Å; T66-L70 WeakPolarHBondContact O-CB 3.43Å; T66-L70 PolarHBondContact O-N 2.75Å
67	K	67.7	Low	66.2	Low	126 Å²	126	92.8 Å²	92.8	55%	0.548	44%	0.438	S	S	.	.	H	α-helix	trans	-57.2	-49.5	177.7	-169.5	171.7	-178.4	175.3	0	112.9	Y62 Q71	Y62-K67 HydrophobicContact CD1-CB 3.97Å; Y62-K67 HydrophobicContact CD1-CD 4.35Å; Y62-K67 HydrophobicContact CD1-CG 4.39Å; Y62-K67 HydrophobicContact CE1-CB 3.75Å; Y62-K67 HydrophobicContact CE1-CD 4.23Å; Y62-K67 HydrophobicContact CE1-CG 3.93Å; K67-Q71 VanDerWaalsContact O-CB 3.32Å; K67-Q71 WeakPolarHBondContact O-CB 3.29Å; K67-Q71 PolarHBondContact O-N 2.95Å
68	E	67.2	Low	66.4	Low	101 Å²	101	90.6 Å²	90.6	47%	0.472	44%	0.44	S	S	.	.	H	α-helix	trans	-64.3	-40.7	177	-82	-159	-160.8	0	0	112.6	S64 T66 R72	S64-E68 PolarHBondContact O-N 3.44Å; T66-E68 PolarHBondContact O-N 3.16Å; E68-R72 VanDerWaalsContact O-CG 3.29Å; E68-R72 WeakPolarHBondContact O-CG 3.48Å; E68-R72 PolarHBondContact O-N 3.1Å; E68-R72 IonicContact OE2-CZ 3.13Å; E68-R72 IonicContact OE2-NH2 3.62Å; E68-R72 PolarHBondContact OE2-NH2 2.85Å
69	Y	67.3	Low	66.8	Low	55 Å²	55	83.8 Å²	83.8	22%	0.216	42%	0.416	C	S	.	.	H	α-helix	trans	-66.9	-46.1	-179.2	-173.3	-108.4	0	0	0	111.3	F7 L10 F65 T66 Q71 R72 C73	F7-Y69 HydrophobicContact CD2-CD1 4.41Å; F7-Y69 AromaticContact CD2-CE1 3.78Å; F7-Y69 HydrophobicContact CD2-CE1 3.78Å; F7-Y69 HydrophobicContact CE2-CE1 4.49Å; L10-Y69 HydrophobicContact CD1-CE1 4.19Å; F65-Y69 WeakPolarHBondContact O-CB 3.32Å; F65-Y69 PolarHBondContact O-N 3.35Å; T66-Y69 PolarHBondContact O-N 2.86Å; Y69-Q71 PolarHBondContact O-N 3.37Å; Y69-R72 WeakPolarHBondContact O-CB 3.41Å; Y69-R72 PolarHBondContact O-N 3.47Å; Y69-R72 VanDerWaalsContact O-N 3.15Å; Y69-C73 PolarHBondContact O-N 3.42Å; Y69-C73 PolarHBondContact O-SG 3.02Å
70	L	70.5	Confident	67	Low	21 Å²	21	78.6 Å²	78.6	11%	0.11	40%	0.396	C	S	.	.	H	α-helix	trans	-56.2	-47.8	173.8	-167.1	76.2	0	0	0	111.9	W11 I53 Y62 T66 R72 C73 I74	W11-L70 HydrophobicContact CZ3-CD1 4.2Å; I53-L70 HydrophobicContact CB-CD1 4.42Å; I53-L70 HydrophobicContact CD1-CD1 3.5Å; I53-L70 VanDerWaalsContact CD1-CD1 3.5Å; I53-L70 HydrophobicContact CD1-CG 4.43Å; I53-L70 HydrophobicContact CG1-CD1 3.75Å; I53-L70 HydrophobicContact CG2-CD1 3.78Å; I53-L70 HydrophobicContact CG2-CD2 3.66Å; I53-L70 HydrophobicContact CG2-CG 4.05Å; Y62-L70 WeakPolarHBondContact OH-CD2 3.38Å; T66-L70 WeakPolarHBondContact O-CB 3.43Å; T66-L70 PolarHBondContact O-N 2.75Å; L70-R72 VanDerWaalsContact C-N 3.31Å; L70-R72 PolarHBondContact O-N 3.46Å; L70-C73 WeakPolarHBondContact O-CA 3.47Å; L70-C73 WeakPolarHBondContact O-CB 3.37Å; L70-C73 PolarHBondContact O-N 3.24Å; L70-I74 WeakPolarHBondContact O-CG1 3.31Å; L70-I74 PolarHBondContact O-N 2.88Å
71	Q	72.4	Confident	67.3	Low	111 Å²	111	79.7 Å²	79.7	52%	0.519	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-36.3	177	-169	176.7	11.3	0	0	112	K67 Y69 I74 Q75	K67-Q71 VanDerWaalsContact O-CB 3.32Å; K67-Q71 WeakPolarHBondContact O-CB 3.29Å; K67-Q71 PolarHBondContact O-N 2.95Å; Y69-Q71 PolarHBondContact O-N 3.37Å; Q71-I74 PolarHBondContact O-N 3.32Å; Q71-Q75 WeakPolarHBondContact O-CB 3.44Å; Q71-Q75 VanDerWaalsContact O-CG 3.29Å; Q71-Q75 WeakPolarHBondContact O-CG 3.25Å; Q71-Q75 PolarHBondContact O-N 3.26Å
72	R	72.3	Confident	67.9	Low	135 Å²	135	78 Å²	78	51%	0.509	39%	0.392	S	S	.	.	H	α-helix	trans	-69.1	-30.9	172.4	-70.9	173.8	-164.9	173.2	10.4	112.8	E68 Y69 L70 K76	E68-R72 VanDerWaalsContact O-CG 3.29Å; E68-R72 WeakPolarHBondContact O-CG 3.48Å; E68-R72 PolarHBondContact O-N 3.1Å; E68-R72 IonicContact OE2-CZ 3.13Å; E68-R72 IonicContact OE2-NH2 3.62Å; E68-R72 PolarHBondContact OE2-NH2 2.85Å; Y69-R72 WeakPolarHBondContact O-CB 3.41Å; Y69-R72 PolarHBondContact O-N 3.47Å; Y69-R72 VanDerWaalsContact O-N 3.15Å; L70-R72 VanDerWaalsContact C-N 3.31Å; L70-R72 PolarHBondContact O-N 3.46Å; R72-K76 WeakPolarHBondContact O-CB 3.47Å; R72-K76 WeakPolarHBondContact O-CG 3.38Å; R72-K76 PolarHBondContact O-N 3.3Å
73	C	68.3	Low	68.3	Low	3 Å²	3	78.2 Å²	78.2	2%	0.02	40%	0.401	C	S	.	.	H	α-helix	trans	-64.9	-48.8	171.7	-65	0	0	0	0	111	F3 F7 Y69 L70 Q75 K76 L77	F3-C73 HydrophobicContact CE1-CB 4.21Å; F3-C73 HydrophobicContact CZ-CB 4.48Å; F3-C73 VanDerWaalsContact CZ-SG 3.53Å; F7-C73 HydrophobicContact CD2-CB 4.44Å; F7-C73 WeakPolarHBondContact CD2-SG 3.49Å; Y69-C73 PolarHBondContact O-N 3.42Å; Y69-C73 PolarHBondContact O-SG 3.02Å; L70-C73 WeakPolarHBondContact O-CA 3.47Å; L70-C73 WeakPolarHBondContact O-CB 3.37Å; L70-C73 PolarHBondContact O-N 3.24Å; C73-Q75 PolarHBondContact O-N 2.84Å; C73-K76 PolarHBondContact O-N 3.22Å; C73-K76 VanDerWaalsContact O-N 3.15Å; C73-L77 PolarHBondContact O-N 3.06Å
74	I	71.1	Confident	68.5	Low	90 Å²	90	75.5 Å²	75.5	46%	0.462	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-44.5	176.9	-64	164.6	0	0	0	110.8	L70 Q71 K76 L77 G78	L70-I74 WeakPolarHBondContact O-CG1 3.31Å; L70-I74 PolarHBondContact O-N 2.88Å; Q71-I74 PolarHBondContact O-N 3.32Å; I74-K76 VanDerWaalsContact C-N 3.33Å; I74-K76 PolarHBondContact O-N 3.5Å; I74-L77 WeakPolarHBondContact O-CB 3.1Å; I74-L77 PolarHBondContact O-N 3.47Å; I74-G78 PolarHBondContact O-N 3.22Å
75	Q	75	Confident	68.8	Low	119 Å²	119	73.5 Å²	73.5	56%	0.556	37%	0.371	S	S	*	.	H	α-helix	trans	-60.6	-38.7	175.2	-76	172.5	-1	0	0	113	Q71 C73 A79	Q71-Q75 WeakPolarHBondContact O-CB 3.44Å; Q71-Q75 VanDerWaalsContact O-CG 3.29Å; Q71-Q75 WeakPolarHBondContact O-CG 3.25Å; Q71-Q75 PolarHBondContact O-N 3.26Å; C73-Q75 PolarHBondContact O-N 2.84Å; Q75-A79 WeakPolarHBondContact O-CB 3.4Å; Q75-A79 PolarHBondContact O-N 3.45Å
76	K	73.9	Confident	69	Low	96 Å²	96	71.6 Å²	71.6	42%	0.417	36%	0.364	S	S	.	.	H	α-helix	trans	-72.7	-36.3	176.6	-78.2	179.2	175.2	-170.8	0	112.9	F3 R72 C73 I74 A79 I80	F3-K76 HydrophobicContact CD1-CD 3.79Å; F3-K76 HydrophobicContact CD2-CD 4.17Å; F3-K76 HydrophobicContact CE1-CB 4.31Å; F3-K76 HydrophobicContact CE1-CD 3.55Å; F3-K76 HydrophobicContact CE2-CD 3.94Å; F3-K76 HydrophobicContact CG-CD 4.09Å; F3-K76 HydrophobicContact CZ-CD 3.62Å; R72-K76 WeakPolarHBondContact O-CB 3.47Å; R72-K76 WeakPolarHBondContact O-CG 3.38Å; R72-K76 PolarHBondContact O-N 3.3Å; C73-K76 PolarHBondContact O-N 3.22Å; C73-K76 VanDerWaalsContact O-N 3.15Å; I74-K76 VanDerWaalsContact C-N 3.33Å; I74-K76 PolarHBondContact O-N 3.5Å; K76-A79 PolarHBondContact O-N 2.88Å; K76-I80 WeakPolarHBondContact O-CD1 3.49Å; K76-I80 WeakPolarHBondContact O-CG1 3.39Å; K76-I80 PolarHBondContact O-N 2.83Å
77	L	67.9	Low	68.7	Low	17 Å²	17	73.8 Å²	73.8	9%	0.089	37%	0.374	C	S	.	.	H	α-helix	trans	-58.3	-50.6	171.3	-83.1	161.5	0	0	0	110.5	F4 C73 I74 A79 I80 S81	F4-L77 HydrophobicContact CE1-CD1 4.07Å; F4-L77 HydrophobicContact CE1-CD2 3.45Å; F4-L77 VanDerWaalsContact CE1-CD2 3.45Å; F4-L77 HydrophobicContact CE1-CG 3.61Å; F4-L77 HydrophobicContact CE2-CD2 4.35Å; F4-L77 HydrophobicContact CZ-CD2 3.26Å; F4-L77 HydrophobicContact CZ-CG 3.63Å; C73-L77 PolarHBondContact O-N 3.06Å; I74-L77 WeakPolarHBondContact O-CB 3.1Å; I74-L77 PolarHBondContact O-N 3.47Å; L77-A79 PolarHBondContact O-N 2.98Å; L77-I80 PolarHBondContact O-N 2.72Å; L77-S81 PolarHBondContact O-N 3.06Å
78	G	72.1	Confident	68	Low	41 Å²	41	72.9 Å²	72.9	42%	0.423	37%	0.371	S	S	.	.	H	α-helix	trans	-58.4	-43.7	175.1	0	0	0	0	0	113.1	I74 I80 S81 Q82	I74-G78 PolarHBondContact O-N 3.22Å; G78-I80 VanDerWaalsContact C-N 3.34Å; G78-I80 PolarHBondContact O-N 3.35Å; G78-S81 PolarHBondContact O-N 3.47Å; G78-Q82 WeakPolarHBondContact O-CB 3.33Å; G78-Q82 PolarHBondContact O-N 2.92Å
79	A	73.6	Confident	67.4	Low	48 Å²	48	75.6 Å²	75.6	40%	0.397	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-35.4	177	0	0	0	0	0	113.1	Q75 K76 L77 V83	Q75-A79 WeakPolarHBondContact O-CB 3.4Å; Q75-A79 PolarHBondContact O-N 3.45Å; K76-A79 PolarHBondContact O-N 2.88Å; L77-A79 PolarHBondContact O-N 2.98Å; A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 2.66Å; A79-V83 VanDerWaalsContact O-N 3.09Å
80	I	67.7	Low	66.4	Low	56 Å²	56	78.7 Å²	78.7	29%	0.287	41%	0.408	S	S	.	.	H	α-helix	trans	-71	-42.9	176.2	-67.1	162.7	0	0	0	110.6	F4 L42 K76 L77 G78 Q82 V83 F84	F4-I80 HydrophobicContact CE2-CD1 3.82Å; F4-I80 HydrophobicContact CZ-CD1 4.11Å; L42-I80 HydrophobicContact CD2-CB 4.44Å; L42-I80 HydrophobicContact CD2-CG2 3.43Å; L42-I80 VanDerWaalsContact CD2-CG2 3.43Å; K76-I80 WeakPolarHBondContact O-CD1 3.49Å; K76-I80 WeakPolarHBondContact O-CG1 3.39Å; K76-I80 PolarHBondContact O-N 2.83Å; L77-I80 PolarHBondContact O-N 2.72Å; G78-I80 VanDerWaalsContact C-N 3.34Å; G78-I80 PolarHBondContact O-N 3.35Å; I80-Q82 VanDerWaalsContact C-N 3.31Å; I80-Q82 PolarHBondContact O-N 3.11Å; I80-V83 PolarHBondContact O-N 3.27Å; I80-F84 HydrophobicContact CG2-CD2 3.73Å; I80-F84 HydrophobicContact CG2-CE2 3.42Å; I80-F84 VanDerWaalsContact CG2-CE2 3.42Å; I80-F84 WeakPolarHBondContact O-CD2 3.45Å; I80-F84 PolarHBondContact O-N 3.22Å
81	S	66.5	Low	65	Low	43 Å²	43	79.7 Å²	79.7	30%	0.301	42%	0.423	S	S	.	.	H	α-helix	trans	-57.2	-44.3	172.4	175.8	0	0	0	0	111.2	L77 G78 V83 F84 S85	L77-S81 PolarHBondContact O-N 3.06Å; G78-S81 PolarHBondContact O-N 3.47Å; S81-V83 PolarHBondContact O-N 2.92Å; S81-F84 PolarHBondContact O-N 3.32Å; S81-F84 VanDerWaalsContact O-N 3.15Å; S81-S85 PolarHBondContact O-N 2.93Å; S81-S85 PolarHBondContact O-OG 2.82Å
82	Q	69.6	Low	63.3	Low	121 Å²	121	80.1 Å²	80.1	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-60.9	-42.1	176.6	-172.7	174.7	0.5	0	0	113.1	G78 I80 F84 S85 E86	G78-Q82 WeakPolarHBondContact O-CB 3.33Å; G78-Q82 PolarHBondContact O-N 2.92Å; I80-Q82 VanDerWaalsContact C-N 3.31Å; I80-Q82 PolarHBondContact O-N 3.11Å; Q82-F84 VanDerWaalsContact C-N 3.32Å; Q82-F84 PolarHBondContact O-N 2.95Å; Q82-S85 PolarHBondContact O-N 3.46Å; Q82-E86 PolarHBondContact O-N 3.19Å
83	V	67.4	Low	61.5	Low	80 Å²	80	83 Å²	83	49%	0.485	45%	0.452	S	S	.	.	H	α-helix	trans	-63.2	-37.8	175	169.5	0	0	0	0	111.5	A79 I80 S81 E86 I87	A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 2.66Å; A79-V83 VanDerWaalsContact O-N 3.09Å; I80-V83 PolarHBondContact O-N 3.27Å; S81-V83 PolarHBondContact O-N 2.92Å; V83-E86 PolarHBondContact O-N 2.94Å; V83-I87 HydrophobicContact CG1-CD1 4.25Å; V83-I87 WeakPolarHBondContact O-CG1 3.44Å; V83-I87 PolarHBondContact O-N 3.19Å; V83-I87 VanDerWaalsContact O-N 3.16Å
84	F	63.5	Low	60	Low	42 Å²	42	89.1 Å²	89.1	18%	0.184	49%	0.489	C	S	.	.	H	α-helix	trans	-68.7	-35.5	174.9	-75	-61.3	0	0	0	112.9	V35 K39 L42 I80 S81 Q82 E86 I87 E88	V35-F84 HydrophobicContact CG1-CD1 3.99Å; V35-F84 HydrophobicContact CG1-CE1 3.83Å; K39-F84 HydrophobicContact CB-CG 4.49Å; K39-F84 HydrophobicContact CD-CB 4.04Å; K39-F84 HydrophobicContact CG-CB 4.1Å; K39-F84 HydrophobicContact CG-CG 4.44Å; L42-F84 HydrophobicContact CD2-CD2 4.45Å; L42-F84 HydrophobicContact CD2-CE2 3.9Å; I80-F84 HydrophobicContact CG2-CD2 3.73Å; I80-F84 HydrophobicContact CG2-CE2 3.42Å; I80-F84 VanDerWaalsContact CG2-CE2 3.42Å; I80-F84 WeakPolarHBondContact O-CD2 3.45Å; I80-F84 PolarHBondContact O-N 3.22Å; S81-F84 PolarHBondContact O-N 3.32Å; S81-F84 VanDerWaalsContact O-N 3.15Å; Q82-F84 VanDerWaalsContact C-N 3.32Å; Q82-F84 PolarHBondContact O-N 2.95Å; F84-E86 VanDerWaalsContact C-N 3.34Å; F84-I87 HydrophobicContact CD1-CD1 4.1Å; F84-I87 PolarHBondContact O-N 3.26Å; F84-E88 PolarHBondContact O-N 2.93Å
85	S	65.1	Low	58.3	Low	44 Å²	44	89.5 Å²	89.5	31%	0.308	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-34.2	171.3	-58.7	0	0	0	0	113	S81 Q82 E88 H89	S81-S85 PolarHBondContact O-N 2.93Å; S81-S85 PolarHBondContact O-OG 2.82Å; Q82-S85 PolarHBondContact O-N 3.46Å; S85-E88 PolarHBondContact O-N 2.91Å; S85-H89 PolarHBondContact O-CD2 3.47Å
86	E	62.7	Low	56.1	Low	115 Å²	115	87.7 Å²	87.7	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-66.8	-36.2	173.2	-74.7	177.8	-175.8	0	0	112	Q82 V83 F84 H89	Q82-E86 PolarHBondContact O-N 3.19Å; V83-E86 PolarHBondContact O-N 2.94Å; F84-E86 VanDerWaalsContact C-N 3.34Å; E86-H89 PolarHBondContact O-N 3.33Å
87	I	60	Low	54.2	Low	86 Å²	86	87.9 Å²	87.9	44%	0.441	53%	0.526	S	S	.	.	H	α-helix	trans	-65.9	-37.7	176.9	-67.5	164.3	0	0	0	111.6	V83 F84 H89 V90	V83-I87 HydrophobicContact CG1-CD1 4.25Å; V83-I87 WeakPolarHBondContact O-CG1 3.44Å; V83-I87 PolarHBondContact O-N 3.19Å; V83-I87 VanDerWaalsContact O-N 3.16Å; F84-I87 HydrophobicContact CD1-CD1 4.1Å; F84-I87 PolarHBondContact O-N 3.26Å; I87-H89 PolarHBondContact O-N 2.8Å; I87-V90 PolarHBondContact O-N 3.21Å
88	E	54.1	Low	52.6	Low	106 Å²	106	92.3 Å²	92.3	50%	0.495	56%	0.559	S	S	.	*	H	α-helix	trans	-61.3	-29.7	175.5	-73.3	170	161.6	0	0	112.7	K39 F84 S85 V90 G91	K39-E88 WeakPolarHBondContact CD-OE1 3.23Å; K39-E88 IonicContact NZ-OE1 3.88Å; K39-E88 PolarHBondContact NZ-OE1 3.18Å; K39-E88 IonicContact NZ-OE2 2.66Å; K39-E88 PolarHBondContact NZ-OE2 2.86Å; F84-E88 PolarHBondContact O-N 2.93Å; S85-E88 PolarHBondContact O-N 2.91Å; E88-V90 VanDerWaalsContact C-N 3.29Å; E88-V90 PolarHBondContact O-N 2.99Å; E88-G91 PolarHBondContact O-N 3.24Å
89	H	53.6	Low	50.7	Low	158 Å²	158	95.5 Å²	95.5	73%	0.731	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-2.8	175.3	-69.2	-47.9	0	0	0	114.7	S85 E86 I87	S85-H89 PolarHBondContact O-CD2 3.47Å; E86-H89 PolarHBondContact O-N 3.33Å; I87-H89 PolarHBondContact O-N 2.8Å
90	V	48.1	Very low	48.9	Very low	121 Å²	121	98.1 Å²	98.1	73%	0.733	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	17	173	-166	0	0	0	0	111.5	I87 E88	I87-V90 PolarHBondContact O-N 3.21Å; E88-V90 VanDerWaalsContact C-N 3.29Å; E88-V90 PolarHBondContact O-N 2.99Å
91	G	39.4	Very low	47.1	Very low	41 Å²	41	103.9 Å²	103.9	42%	0.423	62%	0.616	S	S	.	*	S	Bend	trans	-53.9	147.7	157.3	0	0	0	0	0	110.7	E88 K93	E88-G91 PolarHBondContact O-N 3.24Å; G91-K93 PolarHBondContact O-N 2.95Å; G91-K93 VanDerWaalsContact O-N 3.07Å
92	P	36.5	Very low	45.4	Very low	120 Å²	120	109.7 Å²	109.7	78%	0.779	64%	0.643	S	S	*	*			trans	-58.5	119.7	-173.6	23.5	-33.4	0	0	0	110.3	V94	P92-V94 PolarHBondContact O-N 2.81Å
93	K	36.3	Very low	43.5	Very low	195 Å²	195	108.1 Å²	108.1	85%	0.848	65%	0.645	S	S	*	*			trans	-67.4	81.9	168.3	-75.7	-175.8	177.7	178.3	0	108.9	G91 S95	G91-K93 PolarHBondContact O-N 2.95Å; G91-K93 VanDerWaalsContact O-N 3.07Å; K93-S95 PolarHBondContact O-N 3.05Å
94	V	36	Very low	41.9	Very low	132 Å²	132	112.1 Å²	112.1	80%	0.8	66%	0.658	S	S	*	*			trans	-71	82.7	160.9	-170.4	0	0	0	0	106.2	P92 G96	P92-V94 PolarHBondContact O-N 2.81Å; V94-G96 PolarHBondContact O-N 3.26Å
95	S	35.3	Very low	40.5	Very low	99 Å²	99	117.5 Å²	117.5	69%	0.692	69%	0.687	S	S	*	*			trans	-62.9	106.2	173.2	50.2	0	0	0	0	108.1	K93 S97	K93-S95 PolarHBondContact O-N 3.05Å; S95-S97 PolarHBondContact O-N 3.05Å
96	G	29.3	Very low	38.7	Very low	81 Å²	81	119.6 Å²	119.6	84%	0.835	70%	0.701	S	S	*	*			trans	-63	116.9	179.4	0	0	0	0	0	111.1	V94	V94-G96 PolarHBondContact O-N 3.26Å
97	S	34.2	Very low	37.3	Very low	100 Å²	100	121.4 Å²	121.4	70%	0.699	72%	0.715	S	S	*	*			trans	-147.3	121.2	163.3	53.1	0	0	0	0	109.8	S95	S95-S97 PolarHBondContact O-N 3.05Å
98	S	32.8	Very low	35.8	Very low	110 Å²	110	127.1 Å²	127.1	77%	0.769	74%	0.737	S	S	*	*			trans	63	116.8	163.5	56.2	0	0	0	0	120.2
99	S	33.3	Very low	34.8	Very low	108 Å²	108	127.9 Å²	127.9	76%	0.755	75%	0.751	S	S	*	*			trans	92.9	101.4	131.1	-58.2	0	0	0	0	121
100	S	34.7	Very low	33.7	Very low	103 Å²	103	123.7 Å²	123.7	72%	0.72	75%	0.75	S	S	*	*				74.6	109.5	119.6	-53.5	0	0	0	0	120.6
101	Q	31.7	Very low	32.6	Very low	177 Å²	177	125.3 Å²	125.3	83%	0.827	76%	0.755	S	S	*	*			trans	60.5	119.8	149.4	-50.1	-175.5	0.7	0	0	116.2
102	L	30.3	Very low	32.2	Very low	165 Å²	165	131.1 Å²	131.1	86%	0.864	78%	0.775	S	S	*	*				-153.8	143.9	68.1	-113.3	86.9	0	0	0	112.1
103	S	29.2	Very low	31.7	Very low	88 Å²	88	131.1 Å²	131.1	62%	0.615	78%	0.777	S	S	*	*			trans	-76.9	140.7	161.7	45	0	0	0	0	110.9
104	H	33.8	Very low	31.5	Very low	164 Å²	164	127.1 Å²	127.1	76%	0.759	77%	0.774	S	S	*	*				167	153	112.7	-98.4	-77.4	0	0	0	114.2
105	I	34.1	Very low	31	Very low	154 Å²	154	128.1 Å²	128.1	79%	0.79	78%	0.775	S	S	*	*			trans	80.4	94.5	161.1	-59.7	143.5	0	0	0	116.5
106	S	27.7	Very low	30.7	Very low	88 Å²	88	130.9 Å²	130.9	62%	0.615	78%	0.781	S	S	*	*			trans	-58.4	152.3	150.8	50.9	0	0	0	0	113
107	N	32.1	Very low	30.5	Very low	153 Å²	153	136 Å²	136	82%	0.818	78%	0.78	S	S	*	*				-173	162.7	113.1	-87.9	-17	0	0	0	112.8
108	F	28.3	Very low	30.3	Very low	206 Å²	206	135.4 Å²	135.4	90%	0.904	78%	0.776	S	S	*	*			trans	-82.5	169.8	-162.4	-99.6	-112	0	0	0	115.1
109	P	33.7	Very low	30.1	Very low	123 Å²	123	137.7 Å²	137.7	80%	0.799	77%	0.774	S	S	*	*			trans	-96.2	177.3	-167.1	39.8	-35.1	0	0	0	114.2
110	G	31.8	Very low	29.9	Very low	69 Å²	69	138.7 Å²	138.7	71%	0.711	77%	0.771	S	S	*	*			trans	-159.8	150.2	169.6	0	0	0	0	0	111.8
111	D	24.8	Very low	29.7	Very low	155 Å²	155	139.3 Å²	139.3	83%	0.829	77%	0.771	S	S	*	*			trans	-71	164.6	-169.3	-53.5	-83.4	0	0	0	115.4
112	I	31.1	Very low	29.6	Very low	163 Å²	163	136.7 Å²	136.7	84%	0.836	77%	0.767	S	S	*	*				-173.8	131.5	120.6	-91.6	150.2	0	0	0	109.5
113	S	24.3	Very low	29.5	Very low	120 Å²	120	134 Å²	134	84%	0.839	76%	0.759	S	S	*	*			trans	-84.9	137.2	174	-44.4	0	0	0	0	111.8
114	S	32.9	Very low	29.6	Very low	112 Å²	112	136 Å²	136	78%	0.783	77%	0.772	S	S	*	*			trans	-163.5	132.2	147.8	52.6	0	0	0	0	112.2
115	N	24.7	Very low	29.1	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	77%	0.774	S	S	*	*			trans	-52.7	152.8	164.9	-64.8	-60.4	0	0	0	111.5
116	I	29.9	Very low	29	Very low	158 Å²	158	135.1 Å²	135.1	81%	0.81	77%	0.77	S	S	*	*				175.8	109.5	116.2	-86.8	152.4	0	0	0	110.1
117	F	25.5	Very low	29.2	Very low	188 Å²	188	137.9 Å²	137.9	83%	0.825	78%	0.778	S	S	*	*			trans	14.4	110.7	132.1	-151.8	-93.7	0	0	0	117.8
118	S	29.5	Very low	29.1	Very low	87 Å²	87	138 Å²	138	61%	0.608	78%	0.779	S	S	*	*				174.8	122.2	124.1	-83.4	0	0	0	0	116
119	Q	29.4	Very low	29.4	Very low	159 Å²	159	132.8 Å²	132.8	74%	0.743	77%	0.766	S	S	*	*			trans	73.3	162.6	131.9	-60.5	179.3	20.8	0	0	121.2
120	N	29.2	Very low	29.4	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	76%	0.761	S	S	*	*			trans	81	97.3	164.6	-61	-19.3	0	0	0	115.8
121	T	29.4	Very low	29.1	Very low	116 Å²	116	135.3 Å²	135.3	71%	0.712	76%	0.764	S	S	*	*				69.5	130.9	91.5	60.4	0	0	0	0	112
122	T	29.7	Very low	29.5	Very low	122 Å²	122	138 Å²	138	75%	0.748	77%	0.769	S	S	*	*			cis	-165.2	160.7	21.1	-0.3	0	0	0	0	108.4
123	P	28.7	Very low	29.3	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	76%	0.76	S	S	*	*			trans	-88.5	143.8	-179.8	34.8	-31.2	0	0	0	112.5
124	C	30.7	Very low	29.6	Very low	130 Å²	130	137 Å²	137	88%	0.878	76%	0.762	S	S	*	*			trans	-114.4	116.5	171.4	-71.9	0	0	0	0	112
125	F	24.6	Very low	29.6	Very low	183 Å²	183	138.6 Å²	138.6	80%	0.803	76%	0.761	S	S	*	*			trans	-56.6	157.1	158.6	-71.6	-111.1	0	0	0	109.6
126	T	31	Very low	30	Very low	116 Å²	116	137 Å²	137	71%	0.712	76%	0.759	S	S	*	*				-177.2	154.7	75.7	36.2	0	0	0	0	113.2
127	N	32.7	Very low	30	Very low	147 Å²	147	137 Å²	137	79%	0.786	76%	0.756	S	S	*	*			trans	68.3	88.6	147.1	-57.4	-12.4	0	0	0	122.2
128	N	28.4	Very low	30	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	75%	0.752	S	S	*	*				5.3	165.5	107.1	-116.1	0.2	0	0	0	119.4
129	P	35.6	Very low	30.4	Very low	97 Å²	97	137 Å²	137	63%	0.63	76%	0.763	S	S	*	*			cis	-136.3	-171.3	-20.9	32.6	-10.6	0	0	0	114.2
130	S	32.5	Very low	30.5	Very low	101 Å²	101	133.3 Å²	133.3	71%	0.706	76%	0.76	S	S	*	*			trans	96	122.9	144.8	77.8	0	0	0	0	121.1
131	N	26.9	Very low	30.5	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	76%	0.763	S	S	*	*			trans	33.5	110.9	143	-56.9	-22.7	0	0	0	119.3
132	F	32.3	Very low	30.4	Very low	211 Å²	211	131.8 Å²	131.8	93%	0.925	76%	0.764	S	S	*	*				-148.3	131	116.7	-114.5	-75.9	0	0	0	113
133	S	27.5	Very low	30.5	Very low	93 Å²	93	133.3 Å²	133.3	65%	0.65	77%	0.767	S	S	*	*			trans	-74.2	163	179.4	-31.8	0	0	0	0	112.6
134	L	31.4	Very low	30.8	Very low	169 Å²	169	134.8 Å²	134.8	89%	0.885	77%	0.767	S	S	*	*			trans	93.1	117.9	151.7	-61.7	157.2	0	0	0	120.4
135	L	32.2	Very low	30.7	Very low	147 Å²	147	136.1 Å²	136.1	77%	0.77	77%	0.766	S	S	*	*			trans	-43.7	156.8	150.4	-94.6	150.6	0	0	0	114.4
136	P	32.2	Very low	31	Very low	119 Å²	119	132.5 Å²	132.5	77%	0.773	76%	0.763	S	S	*	*				-136.9	148.5	81	30.4	-11.5	0	0	0	113.9
137	Q	30.2	Very low	31.2	Very low	158 Å²	158	130.9 Å²	130.9	74%	0.738	76%	0.761	S	S	*	*				61.7	123.1	69.6	-99.5	-168.9	10.5	0	0	116.7
138	C	26.1	Very low	31.2	Very low	108 Å²	108	129.3 Å²	129.3	73%	0.73	76%	0.762	S	S	*	*			trans	73.1	107.6	149.4	-58.5	0	0	0	0	121.4
139	I	37	Very low	31.7	Very low	167 Å²	167	127.8 Å²	127.8	86%	0.856	76%	0.76	S	S	*	*				-137.9	105.7	127.6	-50.9	-177.5	0	0	0	103.9
140	A	32.8	Very low	31.6	Very low	81 Å²	81	130.7 Å²	130.7	67%	0.669	77%	0.77	S	S	*	*				60.8	139.7	76.9	0	0	0	0	0	112.4
141	S	29	Very low	31.8	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	77%	0.773	S	S	*	*			cis	-159	172.1	-11.7	-95.5	0	0	0	0	107.9
142	S	27.9	Very low	32	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	77%	0.774	S	S	*	*			trans	6	134.9	151	-44.6	0	0	0	0	119.1
143	L	31.6	Very low	32.3	Very low	154 Å²	154	124.8 Å²	124.8	81%	0.806	77%	0.765	S	S	*	*				-173.3	130.5	110.4	-91.8	167.9	0	0	0	111.9
144	I	34.1	Very low	32.7	Very low	138 Å²	138	127.1 Å²	127.1	71%	0.708	78%	0.775	S	S	*	*			trans	66.8	107.8	144.1	-61.8	172	0	0	0	119.2
145	N	28.8	Very low	32.9	Very low	159 Å²	159	122.5 Å²	122.5	85%	0.85	76%	0.761	S	S	*	*			trans	-59	132.4	145.2	-64.3	-51.9	0	0	0	110
146	S	30.6	Very low	33.1	Very low	106 Å²	106	122.3 Å²	122.3	74%	0.741	77%	0.766	S	S	*	*				168.8	157	124.4	48.8	0	0	0	0	114.3
147	A	34.3	Very low	33.3	Very low	82 Å²	82	121 Å²	121	68%	0.678	76%	0.76	S	S	*	*			trans	61	96	147.5	0	0	0	0	0	120.2
148	S	34.5	Very low	33.7	Very low	114 Å²	114	119.5 Å²	119.5	80%	0.797	76%	0.762	S	S	*	*				71.9	140.7	120.5	-55.3	0	0	0	0	121.2
149	P	37.6	Very low	34.2	Very low	122 Å²	122	118.4 Å²	118.4	79%	0.792	76%	0.76	S	S	*	*			trans	-82.8	152.4	168.7	36.2	-33.9	0	0	0	111
150	L	34.2	Very low	34.1	Very low	158 Å²	158	115.7 Å²	115.7	83%	0.827	75%	0.753	S	S	*	*			trans	-172	152.9	149.9	-109	178.8	0	0	0	112.2
151	L	35.8	Very low	34.4	Very low	148 Å²	148	121 Å²	121	78%	0.775	76%	0.762	S	S	*	*			trans	66.1	111.4	165.3	-57.8	162.7	0	0	0	115.9
152	A	32.1	Very low	34.6	Very low	95 Å²	95	122 Å²	122	79%	0.785	76%	0.758	S	S	*	*				72.5	88.3	51.2	0	0	0	0	0	114.3
153	A	37.6	Very low	34.9	Very low	89 Å²	89	125.7 Å²	125.7	74%	0.736	76%	0.761	S	S	*	*			trans	-139.9	118	151.4	0	0	0	0	0	105.5
154	V	36.3	Very low	35.2	Very low	142 Å²	142	123 Å²	123	86%	0.861	75%	0.753	S	S	*	*				60.8	116.8	70.9	-179.2	0	0	0	0	109.8
155	A	36.7	Very low	35.2	Very low	73 Å²	73	121.2 Å²	121.2	60%	0.603	75%	0.753	S	S	*	*			cis	-164.2	175.8	-5.4	0	0	0	0	0	109.7
156	T	35.1	Very low	35.3	Very low	142 Å²	142	119.3 Å²	119.3	87%	0.871	75%	0.747	S	S	*	*			trans	62	138.2	163.9	53	0	0	0	0	116.7
157	S	37.7	Very low	35.5	Very low	92 Å²	92	122.2 Å²	122.2	64%	0.643	75%	0.753	S	S	*	*			cis	-156.5	147.7	30.1	-164.8	0	0	0	0	112.5
158	T	37.2	Very low	35.6	Very low	127 Å²	127	123.2 Å²	123.2	78%	0.779	75%	0.751	S	S	*	*			trans	33.1	122	144.5	57.3	0	0	0	0	119
159	A	37.9	Very low	35.5	Very low	84 Å²	84	125.3 Å²	125.3	69%	0.694	75%	0.748	S	S	*	*			cis	-174.6	148.5	47.3	0	0	0	0	0	112.1
160	P	34.4	Very low	35.3	Very low	110 Å²	110	129.3 Å²	129.3	71%	0.714	75%	0.753	S	S	*	*			trans	-112.7	139.3	166.9	36.4	-26.3	0	0	0	113.4
161	F	37.9	Very low	35.2	Very low	194 Å²	194	126.4 Å²	126.4	85%	0.851	75%	0.746	S	S	*	*			trans	-130.8	112	156.1	-78.6	-90.5	0	0	0	105.9
162	L	34.1	Very low	34.7	Very low	128 Å²	128	125 Å²	125	67%	0.67	75%	0.747	S	S	*	*				84.1	133.5	56.2	-74.2	176.2	0	0	0	114.3
163	F	34.8	Very low	35.1	Very low	183 Å²	183	126.4 Å²	126.4	80%	0.803	75%	0.748	S	S	*	*			trans	84.7	145.2	165.7	-69.8	-67.7	0	0	0	119.1
164	P	37.7	Very low	34.7	Very low	97 Å²	97	129.2 Å²	129.2	63%	0.63	75%	0.751	S	S	*	*				-145	-156.9	-125.5	37.9	-12.2	0	0	0	112.9
165	S	34.6	Very low	34.6	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	75%	0.747	S	S	*	*			trans	61.4	155.2	144	-64	0	0	0	0	119.1
166	T	30	Very low	34.3	Very low	118 Å²	118	131.9 Å²	131.9	72%	0.724	75%	0.753	S	S	*	*			cis	-171.4	129.1	-13.7	25.3	0	0	0	0	105.5
167	L	35.7	Very low	34.4	Very low	167 Å²	167	134 Å²	134	87%	0.874	75%	0.75	S	S	*	*			trans	-151.7	87.2	157.8	-86.8	177.5	0	0	0	106.9
168	T	36	Very low	34.4	Very low	104 Å²	104	134.2 Å²	134.2	64%	0.638	75%	0.752	S	S	*	*				75.8	117	83.6	59.6	0	0	0	0	115.2
169	H	32.9	Very low	34.5	Very low	158 Å²	158	135.5 Å²	135.5	73%	0.731	75%	0.754	S	S	*	*			trans	55.4	121.3	148	-77	-105.9	0	0	0	119.7
170	F	32.1	Very low	34.6	Very low	205 Å²	205	136.7 Å²	136.7	90%	0.899	76%	0.755	S	S	*	*				-160.7	150.2	86.9	-112.1	-85.7	0	0	0	111
171	S	32.9	Very low	34.8	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	76%	0.757	S	S	*	*			trans	-111.5	156	-171	-53.1	0	0	0	0	112.8
172	C	25.4	Very low	34.7	Very low	119 Å²	119	136 Å²	136	80%	0.804	75%	0.749	S	S	*	*			trans	19.7	146.5	138	-62.3	0	0	0	0	120.1
173	P	39.4	Very low	34.9	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	75%	0.751	S	S	*	*				-152.1	176.5	61.2	40.6	-19.6	0	0	0	119.1
174	D	29.4	Very low	34.8	Very low	148 Å²	148	131.6 Å²	131.6	79%	0.791	75%	0.747	S	S	*	*			trans	-60.8	165.5	169.4	-52.6	-88.1	0	0	0	114.6
175	V	34.1	Very low	34.8	Very low	128 Å²	128	136.3 Å²	136.3	78%	0.776	76%	0.76	S	S	*	*			trans	-173.8	114.7	132.5	142.3	0	0	0	0	113.7
176	I	31.8	Very low	34.6	Very low	144 Å²	144	136.4 Å²	136.4	74%	0.738	76%	0.761	S	S	*	*			trans	38.7	124.7	133.3	-33.6	170.2	0	0	0	120.9
177	K	36.9	Very low	34.8	Very low	186 Å²	186	138.8 Å²	138.8	81%	0.809	77%	0.769	S	S	*	*				170.8	139.8	113.6	-94	-179.6	-179.3	178.9	0	117.4
178	S	37.4	Very low	34.5	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	77%	0.769	S	S	*	*			trans	55.5	143.9	147.6	54.6	0	0	0	0	121.2
179	D	38.2	Very low	34.5	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	77%	0.771	S	S	*	*			cis	-161.8	167.2	-11.6	-103.3	-41.4	0	0	0	109.9
180	P	41.2	Very low	34.4	Very low	109 Å²	109	146.2 Å²	146.2	71%	0.708	78%	0.781	S	S	*	*			trans	-109.5	160.6	-168.3	40.5	-34.1	0	0	0	116.2
181	D	37.7	Very low	34.4	Very low	141 Å²	141	139.6 Å²	139.6	75%	0.754	77%	0.77	S	S	*	*			trans	-177.2	151.3	157.5	-117.2	9.4	0	0	0	108.7
182	Q	37.3	Very low	34.6	Very low	149 Å²	149	141.1 Å²	141.1	70%	0.696	78%	0.781	S	S	*	*			cis	-143.7	167.2	-4.5	-83.9	-153.9	6.9	0	0	112.5
183	V	37.1	Very low	34.9	Very low	115 Å²	115	138.8 Å²	138.8	70%	0.697	78%	0.777	S	S	*	*			trans	29.7	105.2	137.4	-175.8	0	0	0	0	117.1
184	S	32.7	Very low	34.9	Very low	103 Å²	103	141 Å²	141	72%	0.72	78%	0.782	S	S	*	*				69.2	123.7	50.3	-54.7	0	0	0	0	117
185	Q	37.7	Very low	35.1	Very low	196 Å²	196	141.7 Å²	141.7	92%	0.916	78%	0.781	S	S	*	*			trans	113.9	125.1	154.2	-59	-171.9	9.3	0	0	118.8
186	S	31.5	Very low	35	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	79%	0.788	S	S	*	*			trans	-75.2	144	171.7	51	0	0	0	0	112.7
187	N	34.3	Very low	35	Very low	167 Å²	167	140.8 Å²	140.8	89%	0.893	78%	0.781	S	S	*	*			trans	-153.8	144.5	144	-97.9	-37.7	0	0	0	113.1
188	R	28.3	Very low	35	Very low	232 Å²	232	138.7 Å²	138.7	88%	0.875	78%	0.784	S	S	*	*			trans	-94.4	-176.4	168.9	-87.1	-176.7	176.5	-169	1.2	108.5
189	P	36	Very low	34.7	Very low	103 Å²	103	141 Å²	141	67%	0.669	78%	0.784	S	S	*	*			cis	-137.3	-174	-44.1	39.2	-22.5	0	0	0	113.5
190	R	30.7	Very low	34.5	Very low	250 Å²	250	140.4 Å²	140.4	94%	0.943	78%	0.781	S	S	*	*			trans	72.7	149.4	158.4	-66.3	-176.1	-175.4	-159.8	1.6	119.8
191	G	33.7	Very low	34.3	Very low	66 Å²	66	143.2 Å²	143.2	68%	0.68	78%	0.784	S	S	*	*			trans	123.9	103.3	177.1	0	0	0	0	0	110.3
192	S	35.8	Very low	34	Very low	129 Å²	129	144.3 Å²	144.3	90%	0.902	78%	0.784	S	S	*	*				50.2	118.5	89.4	66.3	0	0	0	0	113.3
193	G	33	Very low	34.1	Very low	70 Å²	70	145 Å²	145	72%	0.722	79%	0.787	S	S	*	*			cis	144.1	137.6	3	0	0	0	0	0	108.5
194	D	37.5	Very low	34.1	Very low	172 Å²	172	147.2 Å²	147.2	92%	0.92	79%	0.79	S	S	*	*			trans	-145.1	144.3	178.7	-102	-45.1	0	0	0	113.6
195	H	35	Very low	34	Very low	162 Å²	162	146.4 Å²	146.4	75%	0.75	78%	0.784	S	S	*	*			trans	-82.8	149.5	-172.3	-91.9	-125	0	0	0	113.1
196	C	30.9	Very low	33.7	Very low	137 Å²	137	146 Å²	146	93%	0.926	78%	0.78	S	S	*	*			trans	-150.4	99.2	140	-126.4	0	0	0	0	109.9
197	L	32.8	Very low	33.5	Very low	116 Å²	116	147.7 Å²	147.7	61%	0.607	78%	0.781	S	S	*	*			trans	-107.9	124.8	-179	-131.3	170	0	0	0	107.6	Q199	L197-Q199 HydrophobicContact CD2-CG 3.82Å
198	V	35.7	Very low	33.5	Very low	142 Å²	142	147 Å²	147	86%	0.861	78%	0.776	S	S	*	*			trans	-127.1	100.3	164.6	-178.7	0	0	0	0	107.9
199	Q	32.4	Very low	33.7	Very low	145 Å²	145	141 Å²	141	68%	0.678	77%	0.766	S	S	*	*			trans	-88.9	-178.6	162.7	-84.5	175.1	-43.2	0	0	110	L197	L197-Q199 HydrophobicContact CD2-CG 3.82Å
200	N	33.1	Very low	33.4	Very low	142 Å²	142	142.5 Å²	142.5	76%	0.759	78%	0.776	S	S	*	*			trans	93.7	129.7	174.5	-51	-22.1	0	0	0	113.8
201	H	37.4	Very low	33.5	Very low	167 Å²	167	135.7 Å²	135.7	77%	0.773	77%	0.766	S	S	*	*			cis	-143.2	150.4	6.2	-129.2	-71.5	0	0	0	111.4
202	E	31.8	Very low	33.6	Very low	164 Å²	164	138 Å²	138	77%	0.766	77%	0.769	S	S	*	*			trans	-68.9	153.2	174.2	-63.7	154.3	88.2	0	0	112.9
203	H	38.7	Very low	33.4	Very low	163 Å²	163	138.8 Å²	138.8	76%	0.755	76%	0.762	S	S	*	*			trans	-157.6	103.6	136.9	-109	-80.5	0	0	0	111.8
204	Q	36.3	Very low	33.5	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.762	76%	0.764	S	S	*	*			trans	56.9	111.4	137.3	-67.8	163.4	-10.8	0	0	121.2
205	S	31.1	Very low	33.1	Very low	85 Å²	85	141.5 Å²	141.5	59%	0.594	75%	0.754	S	S	*	*			trans	-36.2	147.2	147	47.1	0	0	0	0	116.5
206	F	32.8	Very low	32.9	Very low	189 Å²	189	141.1 Å²	141.1	83%	0.829	76%	0.757	S	S	*	*				-176.9	169.1	98.6	-96.3	-68.6	0	0	0	111.9
207	D	27.3	Very low	32.9	Very low	137 Å²	137	140.8 Å²	140.8	73%	0.733	75%	0.746	S	S	*	*			trans	-60	157.2	-170.5	-59.6	-88.4	0	0	0	116.3
208	L	32.6	Very low	32.8	Very low	152 Å²	152	145 Å²	145	80%	0.796	76%	0.759	S	S	*	*				179.1	121	114.7	-92.3	166.1	0	0	0	113.1
209	T	32.3	Very low	32.4	Very low	107 Å²	107	143 Å²	143	66%	0.656	75%	0.751	S	S	*	*			trans	31.4	123.7	144	58.8	0	0	0	0	121.5
210	P	30.5	Very low	32.5	Very low	135 Å²	135	142.3 Å²	142.3	88%	0.877	76%	0.762	S	S	*	*			trans	-88.2	119	161.1	33.7	-28.2	0	0	0	111.7
211	S	32.3	Very low	32.5	Very low	107 Å²	107	139 Å²	139	75%	0.748	76%	0.762	S	S	*	*			trans	-125.9	144.4	171.5	-74.2	0	0	0	0	111.8
212	P	36.6	Very low	32.3	Very low	113 Å²	113	137 Å²	137	73%	0.734	76%	0.761	S	S	*	*			trans	-97.5	-154.2	-173.5	38	-31.3	0	0	0	112.3
213	I	30.9	Very low	32.4	Very low	147 Å²	147	135.2 Å²	135.2	75%	0.754	76%	0.757	S	S	*	*			trans	80.8	118.3	175.4	-38.5	159	0	0	0	111.5
214	H	34.9	Very low	32.2	Very low	167 Å²	167	137.8 Å²	137.8	77%	0.773	76%	0.762	S	S	*	*				-159.8	145.9	60.8	-143.9	-77.3	0	0	0	112.9
215	N	29.4	Very low	32.3	Very low	131 Å²	131	135.1 Å²	135.1	70%	0.701	76%	0.758	S	S	*	*			trans	-67.5	152.2	163.4	-78.2	-43.8	0	0	0	110.7
216	N	32.2	Very low	33	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	77%	0.767	S	S	*	*			trans	-151.9	104.3	138	-97.1	-24.5	0	0	0	110
217	L	29.6	Very low	33.3	Very low	130 Å²	130	133 Å²	133	68%	0.681	76%	0.762	S	S	*	*			trans	-73.4	149.3	152.9	-77.2	88.3	0	0	0	107.9
218	F	30.2	Very low	33.8	Very low	204 Å²	204	132.8 Å²	132.8	90%	0.895	77%	0.765	S	S	*	*			trans	-140.8	122.3	141.9	-118.9	-83.5	0	0	0	110.1
219	C	28.7	Very low	34	Very low	100 Å²	100	130.2 Å²	130.2	68%	0.676	77%	0.766	S	S	*	*			trans	-93.9	151.5	171.5	-70.2	0	0	0	0	110.1
220	S	33.4	Very low	34.4	Very low	131 Å²	131	130.9 Å²	130.9	92%	0.916	78%	0.775	S	S	*	*			trans	-178.4	147.8	141.4	-80.2	0	0	0	0	108.6
221	G	33.9	Very low	34.7	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	78%	0.776	S	S	*	*			cis	-149.1	-179.3	4.3	0	0	0	0	0	113.2
222	T	33.6	Very low	35.1	Very low	124 Å²	124	135 Å²	135	76%	0.761	77%	0.769	S	S	*	*			trans	-99.7	172.1	-165.3	47.1	0	0	0	0	113.7
223	N	33	Very low	35.4	Very low	126 Å²	126	137.3 Å²	137.3	67%	0.674	77%	0.774	S	S	*	*				164.8	119.2	115.9	-78.2	-20.3	0	0	0	112.7
224	Y	34	Very low	35.7	Very low	218 Å²	218	135.3 Å²	135.3	86%	0.855	77%	0.771	S	S	*	*				176.6	156.2	103.3	-99.8	-86.1	0	0	0	110
225	P	38.5	Very low	35.7	Very low	106 Å²	106	135.4 Å²	135.4	69%	0.688	77%	0.771	S	S	*	*			trans	-113.1	176.9	-152.6	42.6	-35.8	0	0	0	116.2
226	P	46.3	Very low	35.9	Very low	119 Å²	119	136 Å²	136	77%	0.773	77%	0.77	S	S	*	*			trans	-110.2	165.7	173.2	40.7	-32.5	0	0	0	114.5
227	P	39.6	Very low	35.9	Very low	112 Å²	112	135.3 Å²	135.3	73%	0.727	77%	0.771	S	S	*	*			trans	-140.8	123.9	144.1	36.9	-21.5	0	0	0	113.6
228	T	38.3	Very low	35.9	Very low	131 Å²	131	132.9 Å²	132.9	80%	0.804	78%	0.778	S	S	*	*				90.5	127.2	91.1	60.3	0	0	0	0	117.6
229	A	36.9	Very low	36	Very low	98 Å²	98	128.4 Å²	128.4	81%	0.81	77%	0.772	S	S	*	*			trans	62.1	142	155.9	0	0	0	0	0	118.5
230	S	39.2	Very low	35.8	Very low	121 Å²	121	129.9 Å²	129.9	85%	0.846	78%	0.782	S	S	*	*			cis	-145.5	161.2	24.1	-66.5	0	0	0	0	114.3
231	R	37.1	Very low	35.7	Very low	236 Å²	236	129.1 Å²	129.1	89%	0.891	77%	0.772	S	S	*	*			trans	-82.9	-175.1	173.4	-114	-171.1	163.9	-152.9	0.1	111.5
232	P	40.9	Very low	35.5	Very low	92 Å²	92	135.4 Å²	135.4	60%	0.597	78%	0.778	S	S	*	*			cis	-137.5	173.5	-28.1	29.4	-8.1	0	0	0	115.2
233	L	41.8	Very low	35.2	Very low	163 Å²	163	133.3 Å²	133.3	85%	0.853	77%	0.768	S	S	*	*			trans	141.1	153.2	131.4	-73	-178.3	0	0	0	114.6
234	P	38.4	Very low	35	Very low	105 Å²	105	134.3 Å²	134.3	68%	0.682	77%	0.773	S	S	*	*			trans	-120.3	158.3	-151.6	40.9	-29.2	0	0	0	115.6
235	H	35.7	Very low	34.8	Very low	168 Å²	168	134.5 Å²	134.5	78%	0.778	77%	0.774	S	S	*	*			trans	-153.4	120.6	139.4	-127.4	-94.4	0	0	0	112.7
236	E	32.6	Very low	34.4	Very low	145 Å²	145	135.4 Å²	135.4	68%	0.678	78%	0.783	S	S	*	*			trans	45.3	131.3	140.6	-67.1	-157.5	123.5	0	0	125.9
237	T	31.8	Very low	33.6	Very low	138 Å²	138	132.5 Å²	132.5	85%	0.847	78%	0.775	S	S	*	*			trans	80.9	133.5	143.8	63.6	0	0	0	0	120.6
238	G	30.6	Very low	33.2	Very low	80 Å²	80	138.6 Å²	138.6	83%	0.825	78%	0.783	S	S	*	*			trans	112.6	26.9	151.1	0	0	0	0	0	119.9
239	S	30.8	Very low	33.1	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	78%	0.782	S	S	*	*			trans	-97	115.1	176.1	-164.5	0	0	0	0	114.2	V241	S239-V241 PolarHBondContact O-N 3.13Å
240	C	24.6	Very low	32.8	Very low	131 Å²	131	142.7 Å²	142.7	89%	0.885	79%	0.786	S	S	*	*			trans	-72.5	112.5	168.2	-76.6	0	0	0	0	111.1
241	V	32.7	Very low	32.7	Very low	115 Å²	115	144.3 Å²	144.3	70%	0.697	79%	0.785	S	S	*	*			trans	-96.9	111.4	175.4	-177.9	0	0	0	0	111.5	S239 S243	S239-V241 PolarHBondContact O-N 3.13Å; V241-S243 WeakPolarHBondContact CG1-OG 3.33Å
242	K	28.1	Very low	32.4	Very low	205 Å²	205	136.6 Å²	136.6	89%	0.891	78%	0.779	S	S	*	*			trans	-76.4	120.1	151.6	-70.2	166.3	177.2	162.7	0	108.2
243	S	28.6	Very low	32.2	Very low	80 Å²	80	140.5 Å²	140.5	56%	0.559	79%	0.794	S	S	*	*			trans	-170.5	131.5	147.6	40.7	0	0	0	0	112.8	V241	V241-S243 WeakPolarHBondContact CG1-OG 3.33Å
244	D	27.8	Very low	31.9	Very low	147 Å²	147	139.7 Å²	139.7	79%	0.786	80%	0.796	S	S	*	*				34	106.9	127.9	-45.9	-45.3	0	0	0	119.1
245	Y	30.2	Very low	31.7	Very low	223 Å²	223	138.3 Å²	138.3	88%	0.875	80%	0.8	S	S	*	*			trans	-130.1	102.5	150.4	-112.8	-89.5	0	0	0	111.4
246	S	30.4	Very low	31.6	Very low	125 Å²	125	135.4 Å²	135.4	87%	0.874	80%	0.799	S	S	*	*			trans	-129.5	80.1	175.8	-70.8	0	0	0	0	111.4
247	G	29.4	Very low	31.8	Very low	58 Å²	58	134.1 Å²	134.1	60%	0.598	80%	0.801	S	S	*	*			trans	85.2	174	158.9	0	0	0	0	0	117
248	R	31.6	Very low	32.2	Very low	240 Å²	240	133.2 Å²	133.2	91%	0.906	80%	0.796	S	S	*	*			trans	70.2	136.8	-159.8	-47.6	179.4	-170.7	-159.6	1	110.6
249	L	36.4	Very low	32.3	Very low	149 Å²	149	137 Å²	137	78%	0.78	80%	0.797	S	S	*	*			cis	-124.6	153.3	18.4	-68.2	154.6	0	0	0	112
250	N	29.7	Very low	32.7	Very low	165 Å²	165	136.5 Å²	136.5	88%	0.882	80%	0.8	S	S	*	*			trans	-158.8	73	160.3	-122.9	23.8	0	0	0	108.4
251	D	37	Very low	33.1	Very low	155 Å²	155	140.1 Å²	140.1	83%	0.829	80%	0.804	S	S	*	*			trans	-140.2	132	164.5	-58.8	-70.3	0	0	0	102.9
252	G	31.3	Very low	33.1	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	81%	0.808	S	S	*	*			cis	131.5	66.9	25.1	0	0	0	0	0	107.3
253	L	36.9	Very low	33.3	Very low	175 Å²	175	134.5 Å²	134.5	92%	0.916	81%	0.808	S	S	*	*			trans	-129.5	115.4	175.1	-82.5	175.9	0	0	0	110.9
254	T	35.2	Very low	33.5	Very low	146 Å²	146	135.6 Å²	135.6	90%	0.896	82%	0.821	S	S	*	*			trans	-67.7	131	168.1	47.1	0	0	0	0	110.3
255	G	34.9	Very low	33.8	Very low	75 Å²	75	133.6 Å²	133.6	77%	0.773	83%	0.825	S	S	*	*			trans	-161.8	102.1	175.1	0	0	0	0	0	110.1
256	S	33.1	Very low	34.1	Very low	107 Å²	107	127.8 Å²	127.8	75%	0.748	82%	0.823	S	S	*	*			trans	-65.2	139.1	172.2	50.9	0	0	0	0	111.3
257	T	37.6	Very low	34.4	Very low	119 Å²	119	128.4 Å²	128.4	73%	0.73	82%	0.821	S	S	*	*				160.5	130.8	113.4	45.7	0	0	0	0	109.6
258	T	39.3	Very low	34.6	Very low	118 Å²	118	130.7 Å²	130.7	72%	0.724	84%	0.835	S	S	*	*			trans	25.9	104.3	148.3	56.8	0	0	0	0	118
259	D	33.2	Very low	35	Very low	159 Å²	159	123.6 Å²	123.6	85%	0.85	83%	0.828	S	S	*	*				173.3	170.7	115.6	-83.1	-17.7	0	0	0	111.6
260	A	37.7	Very low	35.2	Very low	101 Å²	101	120.3 Å²	120.3	84%	0.835	82%	0.822	S	S	*	*			trans	75.8	41.6	176.3	0	0	0	0	0	118.8
261	Q	33	Very low	35.8	Very low	207 Å²	207	122.5 Å²	122.5	97%	0.967	82%	0.824	S	S	*	*			trans	-94.4	67	144.4	-80.6	-171.7	-68	0	0	110.6
262	A	33.7	Very low	35.8	Very low	95 Å²	95	118.4 Å²	118.4	79%	0.785	82%	0.819	S	S	*	*			trans	-159.1	73.7	177.7	0	0	0	0	0	113.3
263	A	33.3	Very low	36.3	Very low	107 Å²	107	122.7 Å²	122.7	88%	0.884	82%	0.823	S	S	*	*			trans	-154.4	46.7	173.2	0	0	0	0	0	113.1
264	A	32.7	Very low	36.3	Very low	102 Å²	102	121.6 Å²	121.6	84%	0.843	82%	0.818	S	S	*	*			trans	-153.3	53	-178.6	0	0	0	0	0	114.3
265	A	32.9	Very low	36.1	Very low	106 Å²	106	123.8 Å²	123.8	88%	0.876	82%	0.816	S	S	*	*			trans	-171.7	95.2	163.6	0	0	0	0	0	113.3
266	A	37.3	Very low	36.3	Very low	100 Å²	100	126.9 Å²	126.9	83%	0.826	82%	0.82	S	S	*	*			trans	179	133.2	157.8	0	0	0	0	0	105.9
267	V	36.2	Very low	36.5	Very low	138 Å²	138	125.9 Å²	125.9	84%	0.836	83%	0.826	S	S	*	*			cis	-134	133.4	23.1	173.8	0	0	0	0	109.6
268	A	33.6	Very low	36.4	Very low	106 Å²	106	124.2 Å²	124.2	88%	0.876	83%	0.832	S	S	*	*			trans	-139.2	88.4	171.3	0	0	0	0	0	110.2
269	A	39.1	Very low	36.1	Very low	92 Å²	92	122.4 Å²	122.4	76%	0.76	84%	0.837	S	S	*	*			trans	-174	107	164.3	0	0	0	0	0	110.7
270	A	40.9	Very low	36.3	Very low	80 Å²	80	120.6 Å²	120.6	66%	0.661	83%	0.834	S	S	*	*	S	Bend	trans	171.4	129.5	145.5	0	0	0	0	0	109.8
271	F	42.6	Very low	36.2	Very low	210 Å²	210	123.4 Å²	123.4	92%	0.921	84%	0.835	S	S	*	*			trans	53.3	93.5	172.6	-42.4	-73.3	0	0	0	115.2
272	G	37.6	Very low	36.4	Very low	70 Å²	70	120 Å²	120	72%	0.722	83%	0.828	S	S	*	*			cis	79.5	89	23.6	0	0	0	0	0	111.4
273	L	42.5	Very low	36.5	Very low	164 Å²	164	119.2 Å²	119.2	86%	0.859	83%	0.829	S	S	*	*			trans	-173.7	104.8	140.9	-99.1	177.6	0	0	0	112
274	N	35.9	Very low	36.6	Very low	151 Å²	151	121.2 Å²	121.2	81%	0.807	83%	0.825	S	S	*	*			trans	32.1	133.1	148.2	-62.5	-15.6	0	0	0	124.4
275	F	30.8	Very low	36.7	Very low	193 Å²	193	122.8 Å²	122.8	85%	0.846	82%	0.819	S	S	*	*			trans	-64.9	157.5	158.6	-75.3	-117.9	0	0	0	112.8
276	T	38.7	Very low	36.7	Very low	140 Å²	140	124.2 Å²	124.2	86%	0.859	81%	0.812	S	S	*	*				166.3	146.2	107.8	37.5	0	0	0	0	112.7
277	G	37	Very low	36.7	Very low	85 Å²	85	126.5 Å²	126.5	88%	0.876	82%	0.815	S	S	*	*			trans	74	141.7	172	0	0	0	0	0	115.5
278	G	35.5	Very low	36.7	Very low	84 Å²	84	128.5 Å²	128.5	87%	0.866	82%	0.817	S	S	*	*			cis	140.9	109.7	2.9	0	0	0	0	0	111.4
279	G	34.7	Very low	36.6	Very low	80 Å²	80	126.6 Å²	126.6	83%	0.825	81%	0.808	S	S	*	*			trans	117.5	124	156.7	0	0	0	0	0	116.2
280	P	37.5	Very low	36.4	Very low	121 Å²	121	132.3 Å²	132.3	79%	0.786	82%	0.816	S	S	*	*			trans	-112.8	151.7	-174.2	39.1	-31	0	0	0	114.7
281	L	35.5	Very low	35.9	Very low	161 Å²	161	135.5 Å²	135.5	84%	0.843	82%	0.822	S	S	*	*			trans	-144.2	115.6	158.8	-77	-178	0	0	0	113
282	T	36.7	Very low	35.5	Very low	136 Å²	136	134.8 Å²	134.8	83%	0.834	82%	0.819	S	S	*	*			trans	38.8	123.4	138.6	59.5	0	0	0	0	121.8
283	G	34.8	Very low	35.5	Very low	77 Å²	77	139.6 Å²	139.6	79%	0.794	82%	0.822	S	S	*	*			trans	179.5	83.5	166.6	0	0	0	0	0	115.7
284	N	36	Very low	35	Very low	150 Å²	150	141.2 Å²	141.2	80%	0.802	82%	0.817	S	S	*	*			trans	-28.9	154.6	166.4	-56.8	-21.7	0	0	0	116.3
285	N	35.6	Very low	34.6	Very low	135 Å²	135	142.4 Å²	142.4	72%	0.722	82%	0.824	S	S	*	*			cis	179.9	164.9	-16.9	-103.8	-28.5	0	0	0	106.9
286	N	31.8	Very low	34.8	Very low	135 Å²	135	140 Å²	140	72%	0.722	82%	0.815	S	S	*	*			trans	73.2	74.9	163	-60.2	-15.1	0	0	0	119.6
287	V	37	Very low	34.4	Very low	149 Å²	149	139.7 Å²	139.7	90%	0.903	82%	0.818	S	S	*	*			trans	-123.8	104.8	146.9	179.3	0	0	0	0	109.1
288	M	36.8	Very low	34.2	Very low	179 Å²	179	138.1 Å²	138.1	88%	0.882	80%	0.802	S	S	*	*			trans	-107.7	139.6	169.6	-69.9	-174	-80.5	0	0	109.2
289	G	31.6	Very low	34.1	Very low	66 Å²	66	140.6 Å²	140.6	68%	0.68	81%	0.806	S	S	*	*			cis	-176.8	98.3	-5.3	0	0	0	0	0	110	N291	G289-N291 PolarHBondContact O-N 3.13Å
290	F	34.3	Very low	34.1	Very low	212 Å²	212	141.9 Å²	141.9	93%	0.93	80%	0.803	S	S	*	*			trans	-77.9	101	175.9	-86.9	-84	0	0	0	110.4	K292	F290-K292 PolarHBondContact O-N 3.29Å
291	N	32.1	Very low	34.3	Very low	147 Å²	147	142 Å²	142	79%	0.786	80%	0.796	S	S	*	*			trans	-74.4	97.7	179.8	-158.4	-8.2	0	0	0	111.4	G289 Q293	G289-N291 PolarHBondContact O-N 3.13Å; N291-Q293 PolarHBondContact O-N 3.06Å; N291-Q293 VanDerWaalsContact O-N 3.13Å
292	K	33	Very low	34.7	Very low	195 Å²	195	139.2 Å²	139.2	85%	0.848	78%	0.782	S	S	*	*			trans	-76	86	-177.9	-177.2	179.3	-178.1	175.1	0	111	F290	F290-K292 PolarHBondContact O-N 3.29Å
293	Q	36.8	Very low	34.8	Very low	171 Å²	171	139.6 Å²	139.6	80%	0.799	77%	0.774	S	S	*	*			trans	-97.6	101.8	167.2	-76	-162.2	-22.4	0	0	112.5	N291 N295	N291-Q293 PolarHBondContact O-N 3.06Å; N291-Q293 VanDerWaalsContact O-N 3.13Å; Q293-N295 PolarHBondContact O-N 3.42Å
294	R	32.6	Very low	35.4	Very low	198 Å²	198	137.6 Å²	137.6	75%	0.747	75%	0.745	S	S	*	*			trans	-2	105.6	162.8	-71.9	170.4	175.4	148.8	1.9	116.7	Q296	R294-Q296 VanDerWaalsContact C-N 3.29Å; R294-Q296 HydrophobicContact CB-CB 4.5Å; R294-Q296 HydrophobicContact CB-CG 4.13Å; R294-Q296 HydrophobicContact CG-CG 4.28Å; R294-Q296 PolarHBondContact O-N 3.24Å; R294-Q296 VanDerWaalsContact O-N 3.12Å
295	N	28.7	Very low	35.5	Very low	177 Å²	177	133.6 Å²	133.6	95%	0.947	73%	0.728	S	S	*	*			trans	-65.6	97.7	134.1	-86.9	-17.1	0	0	0	107.7	Q293	Q293-N295 PolarHBondContact O-N 3.42Å
296	Q	34.6	Very low	35.7	Very low	141 Å²	141	130.9 Å²	130.9	66%	0.659	72%	0.718	S	S	*	*			trans	-111.8	110.8	158.2	-84	-179.9	-18.2	0	0	107.5	R294 G298	R294-Q296 VanDerWaalsContact C-N 3.29Å; R294-Q296 HydrophobicContact CB-CB 4.5Å; R294-Q296 HydrophobicContact CB-CG 4.13Å; R294-Q296 HydrophobicContact CG-CG 4.28Å; R294-Q296 PolarHBondContact O-N 3.24Å; R294-Q296 VanDerWaalsContact O-N 3.12Å; Q296-G298 PolarHBondContact O-N 2.94Å
297	S	30	Very low	36.2	Very low	134 Å²	134	132.2 Å²	132.2	94%	0.937	72%	0.722	S	S	*	*			trans	-61.5	97.9	165.3	46.5	0	0	0	0	108.9
298	G	32.9	Very low	36.2	Very low	52 Å²	52	130 Å²	130	54%	0.536	71%	0.713	S	S	.	*			trans	-167.8	124.9	-178.4	0	0	0	0	0	111.2	Q296 S300	Q296-G298 PolarHBondContact O-N 2.94Å; G298-S300 PolarHBondContact O-N 2.99Å
299	S	33.7	Very low	36.2	Very low	136 Å²	136	125.4 Å²	125.4	95%	0.951	70%	0.699	S	S	*	*			trans	-59.8	83.8	-174	-57.7	0	0	0	0	113.7
300	S	33.8	Very low	36.7	Very low	107 Å²	107	130.1 Å²	130.1	75%	0.748	71%	0.706	S	S	*	*			trans	-100.3	102.9	175.4	-66.4	0	0	0	0	110.8	G298 L302	G298-S300 PolarHBondContact O-N 2.99Å; S300-L302 PolarHBondContact O-N 3.07Å
301	L	42.8	Very low	36.7	Very low	123 Å²	123	125.1 Å²	125.1	64%	0.644	69%	0.69	S	S	*	*			trans	-60	115.2	172.4	-74.2	165.9	0	0	0	110	Q303 L390	L301-Q303 WeakPolarHBondContact O-CG 3.5Å; L301-Q303 PolarHBondContact O-N 3.15Å; L301-L390 HydrophobicContact CD2-CD2 4.22Å
302	L	43.2	Very low	36.7	Very low	104 Å²	104	121.1 Å²	121.1	55%	0.545	68%	0.683	S	S	.	*			trans	-67.1	94.8	170.5	-72.8	176.8	0	0	0	109.6	S300 I304 Y382	S300-L302 PolarHBondContact O-N 3.07Å; L302-I304 PolarHBondContact O-N 3.39Å; L302-I304 VanDerWaalsContact O-N 3.09Å; L302-Y382 HydrophobicContact CD1-CD1 4.33Å; L302-Y382 HydrophobicContact CD1-CE1 4.03Å
303	Q	38.7	Very low	37	Very low	144 Å²	144	118.4 Å²	118.4	67%	0.673	68%	0.683	S	S	*	*			trans	-73.8	95.5	-171.7	-62.8	-168.7	-18.5	0	0	111.9	L301 S305 R385	L301-Q303 WeakPolarHBondContact O-CG 3.5Å; L301-Q303 PolarHBondContact O-N 3.15Å; Q303-S305 PolarHBondContact O-N 3.48Å; Q303-R385 VanDerWaalsContact C-NH2 3.33Å; Q303-R385 PolarHBondContact O-NH2 2.86Å
304	I	47.8	Very low	37.2	Very low	35 Å²	35	117.3 Å²	117.3	18%	0.179	68%	0.682	C	S	.	*	P	Polyproline II helix	trans	-82.2	117.9	172.7	-59.4	157.2	0	0	0	109.6	L302 Y382 R385 Q394 V397	L302-I304 PolarHBondContact O-N 3.39Å; L302-I304 VanDerWaalsContact O-N 3.09Å; I304-Y382 HydrophobicContact CD1-CD1 4.35Å; I304-R385 PolarHBondContact O-NE 3.03Å; I304-Q394 HydrophobicContact CD1-CG 3.83Å; I304-V397 HydrophobicContact CD1-CB 4.32Å; I304-V397 HydrophobicContact CD1-CG1 4.23Å
305	S	37.9	Very low	37.3	Very low	65 Å²	65	111.6 Å²	111.6	46%	0.455	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-71.7	150.1	172.7	-65.5	0	0	0	0	110.4	Q303 M307 R385	Q303-S305 PolarHBondContact O-N 3.48Å; S305-M307 PolarHBondContact O-N 2.93Å; S305-R385 VanDerWaalsContact N-NH2 3.12Å; S305-R385 PolarHBondContact OG-NH1 3.05Å; S305-R385 PolarHBondContact OG-NH2 3.07Å
306	P	39.8	Very low	37.8	Very low	79 Å²	79	112 Å²	112	51%	0.513	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-63.4	119	171.1	-14.4	28.9	0	0	0	109.4	L401	P306-L401 HydrophobicContact CB-CD2 4.12Å; P306-L401 HydrophobicContact CG-CD2 4.34Å
307	M	42	Very low	37.8	Very low	163 Å²	163	114.5 Å²	114.5	80%	0.803	69%	0.69	S	S	*	*			trans	-85	113	168.2	-64.4	-109	72.3	0	0	107.5	S305	S305-M307 PolarHBondContact O-N 2.93Å
308	S	36.7	Very low	38.4	Very low	103 Å²	103	115.9 Å²	115.9	72%	0.72	68%	0.681	S	S	*	*			trans	-66.2	129.9	174.3	28.5	0	0	0	0	111	I310	S308-I310 PolarHBondContact O-N 3.09Å
309	S	38.1	Very low	38.5	Very low	82 Å²	82	121.3 Å²	121.3	57%	0.573	70%	0.698	S	S	*	*			trans	27.6	79.6	157	-66.3	0	0	0	0	119.1
310	I	41.4	Very low	39	Very low	164 Å²	164	118.2 Å²	118.2	84%	0.841	68%	0.677	S	S	*	*			trans	-94.9	77.3	147.9	43	169.9	0	0	0	110.1	S308	S308-I310 PolarHBondContact O-N 3.09Å
311	N	34.6	Very low	39.5	Very low	108 Å²	108	118.7 Å²	118.7	58%	0.578	68%	0.68	S	S	*	*			trans	-122.4	113.9	156.7	-59.7	-70.4	0	0	0	106.2	P409	N311-P409 WeakPolarHBondContact OD1-CB 3.45Å
312	G	31.5	Very low	40.6	Very low	63 Å²	63	117.4 Å²	117.4	65%	0.649	68%	0.677	S	S	*	*			trans	133.4	67	-171.2	0	0	0	0	0	111.4
313	V	39.5	Very low	41.7	Very low	138 Å²	138	119.9 Å²	119.9	84%	0.836	69%	0.686	S	S	*	*			trans	-130.3	74.8	155.3	-167.5	0	0	0	0	105.7
314	D	41.5	Very low	43.6	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	68%	0.68	S	S	*	*			trans	-60.8	157.8	153.9	-63	-69.4	0	0	0	108.6	K316	D314-K316 PolarHBondContact O-N 2.94Å
315	G	34.5	Very low	45.2	Very low	78 Å²	78	122.5 Å²	122.5	80%	0.804	70%	0.698	S	S	*	*			trans	-55.6	129.6	-158.9	0	0	0	0	0	115.2
316	K	39.5	Very low	47.4	Very low	187 Å²	187	122.6 Å²	122.6	81%	0.813	69%	0.69	S	S	*	*			trans	-111.7	116.7	136.1	-82.7	-171.2	172.5	-174.9	0	108.2	D314 E318	D314-K316 PolarHBondContact O-N 2.94Å; K316-E318 PolarHBondContact O-N 3.31Å
317	E	34.4	Very low	49.5	Very low	193 Å²	193	124 Å²	124	90%	0.902	69%	0.69	S	S	*	*			trans	-71.4	99	162.4	-65.5	171.4	145	0	0	106.6	D319	E317-D319 PolarHBondContact O-N 3.36Å
318	E	41.4	Very low	51.7	Low	162 Å²	162	116.3 Å²	116.3	76%	0.757	65%	0.652	S	S	*	*			trans	-85.8	91.6	161.8	-78.8	-175.6	163.6	0	0	107.8	K316 S320	K316-E318 PolarHBondContact O-N 3.31Å; E318-S320 VanDerWaalsContact C-N 3.32Å; E318-S320 PolarHBondContact O-N 3.16Å; E318-S320 PolarHBondContact O-OG 3.2Å
319	D	36	Very low	53.9	Low	167 Å²	167	120.2 Å²	120.2	89%	0.893	66%	0.661	S	S	*	*			trans	-58.6	98.6	164.1	-173.6	19.5	0	0	0	108.7	E317	E317-D319 PolarHBondContact O-N 3.36Å
320	S	44.3	Very low	56.1	Low	71 Å²	71	120.5 Å²	120.5	50%	0.497	66%	0.66	S	S	.	*			trans	-148.2	121.4	178.6	51.3	0	0	0	0	106.9	E318 V322	E318-S320 VanDerWaalsContact C-N 3.32Å; E318-S320 PolarHBondContact O-N 3.16Å; E318-S320 PolarHBondContact O-OG 3.2Å; S320-V322 PolarHBondContact O-N 3.35Å
321	S	44	Very low	58.4	Low	116 Å²	116	114.9 Å²	114.9	81%	0.811	63%	0.634	S	S	*	*			trans	-71.7	68.7	-167.6	57.7	0	0	0	0	112.5	E323	S321-E323 VanDerWaalsContact C-N 3.27Å; S321-E323 PolarHBondContact O-N 3.35Å
322	V	66.6	Low	60.7	Low	96 Å²	96	113.6 Å²	113.6	58%	0.582	63%	0.634	S	S	*	*			trans	-71.8	88.8	169.5	-177	0	0	0	0	107.5	S320 R324	S320-V322 PolarHBondContact O-N 3.35Å; V322-R324 HydrophobicContact CG1-CG 4.34Å; V322-R324 WeakPolarHBondContact O-CG 3.29Å; V322-R324 PolarHBondContact O-N 2.9Å
323	E	66.3	Low	63.2	Low	157 Å²	157	113.9 Å²	113.9	73%	0.734	62%	0.616	S	S	*	*			trans	-56.1	131.4	170.8	-66.3	-166.7	156.5	0	0	109.8	S321 P325	S321-E323 VanDerWaalsContact C-N 3.27Å; S321-E323 PolarHBondContact O-N 3.35Å; E323-P325 VanDerWaalsContact O-CD 3.29Å; E323-P325 WeakPolarHBondContact O-CD 3.47Å
324	R	78.9	Confident	65.4	Low	148 Å²	148	109.1 Å²	109.1	56%	0.558	59%	0.588	S	S	*	*			trans	-120.2	62.1	177.7	-64	167.2	79.5	138.8	10.3	108.9	V322 F326 S334 F335	V322-R324 HydrophobicContact CG1-CG 4.34Å; V322-R324 WeakPolarHBondContact O-CG 3.29Å; V322-R324 PolarHBondContact O-N 2.9Å; R324-F326 PolarHBondContact O-N 3.13Å; R324-F326 VanDerWaalsContact O-N 3.12Å; R324-S334 PolarHBondContact NE-O 3.3Å; R324-S334 PolarHBondContact NH2-O 2.91Å; R324-S334 WeakPolarHBondContact O-CB 3.29Å; R324-F335 CarbonylContact C-O 3.5Å; R324-F335 WeakPolarHBondContact CA-O 3.29Å
325	P	80.8	Confident	67.6	Low	85 Å²	85	104.2 Å²	104.2	55%	0.552	56%	0.56	S	S	*	*			trans	-66.4	-19.4	-168.5	27.8	-35.8	0	0	0	113	E323 Q327	E323-P325 VanDerWaalsContact O-CD 3.29Å; E323-P325 WeakPolarHBondContact O-CD 3.47Å; P325-Q327 PolarHBondContact O-N 2.93Å
326	F	83	Confident	70.2	Confident	67 Å²	67	103.8 Å²	103.8	29%	0.294	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	86.6	-177	-56.8	-69.1	0	0	0	111.3	R324 F335 K338 L341	R324-F326 PolarHBondContact O-N 3.13Å; R324-F326 VanDerWaalsContact O-N 3.12Å; F326-F335 HydrophobicContact CB-CB 4.39Å; F326-F335 WeakPolarHBondContact CB-O 3.38Å; F326-F335 PolarHBondContact N-O 2.86Å; F326-F335 PolarHBondContact O-N 2.98Å; F326-K338 HydrophobicContact CD1-CB 3.87Å; F326-K338 HydrophobicContact CD1-CD 4.47Å; F326-K338 HydrophobicContact CD1-CG 4Å; F326-K338 HydrophobicContact CD2-CB 4.15Å; F326-K338 HydrophobicContact CE1-CB 3.72Å; F326-K338 HydrophobicContact CE1-CD 3.99Å; F326-K338 HydrophobicContact CE1-CG 3.95Å; F326-K338 HydrophobicContact CE2-CB 3.99Å; F326-K338 HydrophobicContact CG-CB 4.09Å; F326-K338 HydrophobicContact CZ-CB 3.79Å; F326-K338 HydrophobicContact CZ-CG 4.49Å; F326-L341 HydrophobicContact CB-CB 3.85Å; F326-L341 HydrophobicContact CB-CD2 3.78Å; F326-L341 HydrophobicContact CB-CG 4.42Å
327	Q	83.9	Confident	72.5	Confident	109 Å²	109	99 Å²	99	51%	0.509	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	140.6	176	-163.4	174.4	29.6	0	0	112.8	P325 S332	P325-Q327 PolarHBondContact O-N 2.93Å; Q327-S332 PolarHBondContact NE2-O 3.42Å
328	C	88.3	Confident	75	Confident	1 Å²	1	95.3 Å²	95.3	1%	0.007	51%	0.512	C	S	.	.			trans	-83.7	118.2	169.9	177.2	0	0	0	0	111.1	T330 C331 S332 R333 L341 H344 M345 H348	C328-T330 PolarHBondContact O-N 2.83Å; C328-T330 PolarHBondContact SG-N 3.28Å; C328-T330 VanDerWaalsContact SG-N 3.44Å; C328-C331 PolarHBondContact O-N 2.99Å; C328-S332 WeakPolarHBondContact O-CA 3.42Å; C328-S332 PolarHBondContact O-N 2.91Å; C328-R333 PolarHBondContact N-O 3.05Å; C328-L341 HydrophobicContact CB-CD1 3.7Å; C328-H344 PolarHBondContact SG-NE2 3.46Å; C328-H344 VanDerWaalsContact SG-NE2 3.36Å; C328-M345 HydrophobicContact CB-SD 4.27Å; C328-M345 PolarHBondContact SG-SD 3.4Å; C328-H348 PolarHBondContact SG-NE2 3.02Å
329	M	84.4	Confident	77.1	Confident	185 Å²	185	90.9 Å²	90.9	91%	0.911	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.6	178.2	-58.3	-169.8	-61.8	0	0	113.9
330	T	84.4	Confident	79.6	Confident	88 Å²	88	84 Å²	84	54%	0.54	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-22.4	-176.2	-41.9	0	0	0	0	113.9	C328 H348	C328-T330 PolarHBondContact O-N 2.83Å; C328-T330 PolarHBondContact SG-N 3.28Å; C328-T330 VanDerWaalsContact SG-N 3.44Å; T330-H348 HydrophobicContact CG2-CB 4.3Å
331	C	87.9	Confident	81.7	Confident	46 Å²	46	81.9 Å²	81.9	31%	0.311	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	19.7	178.6	73.5	0	0	0	0	114.4	C328 R333 H344	C328-C331 PolarHBondContact O-N 2.99Å; C331-R333 PolarHBondContact O-N 3.06Å; C331-H344 VanDerWaalsContact SG-CE1 3.54Å; C331-H344 PolarHBondContact SG-NE2 3.15Å
332	S	83.3	Confident	83.7	Confident	81 Å²	81	80 Å²	80	57%	0.566	44%	0.437	S	S	*	.			trans	54.4	12.6	174.8	-51.8	0	0	0	0	116.4	Q327 C328	Q327-S332 PolarHBondContact NE2-O 3.42Å; C328-S332 WeakPolarHBondContact O-CA 3.42Å; C328-S332 PolarHBondContact O-N 2.91Å
333	R	84.5	Confident	84.6	Confident	70 Å²	70	79.7 Å²	79.7	26%	0.264	43%	0.43	S	S	.	.			trans	-73.5	127.6	178	-73.4	-174.9	-176.4	-161.9	10.4	111.7	C328 C331 F335 S542 K543	C328-R333 PolarHBondContact N-O 3.05Å; C331-R333 PolarHBondContact O-N 3.06Å; R333-F335 HydrophobicContact CB-CE2 3.75Å; R333-F335 HydrophobicContact CB-CZ 4.09Å; R333-F335 WeakPolarHBondContact O-CD2 3.45Å; R333-F335 WeakPolarHBondContact O-CE2 3.35Å; R333-S542 VanDerWaalsContact NH2-C 3.32Å; R333-S542 VanDerWaalsContact NH2-CB 3.33Å; R333-S542 PolarHBondContact NH2-O 3.48Å; R333-S542 PolarHBondContact NH2-OG 3.31Å; R333-K543 VanDerWaalsContact NH2-CB 3.35Å; R333-K543 VanDerWaalsContact NH2-CG 3.29Å
334	S	86.8	Confident	85.7	Confident	37 Å²	37	72.8 Å²	72.8	26%	0.259	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	137.2	178.6	-47.3	0	0	0	0	112.7	R324	R324-S334 PolarHBondContact NE-O 3.3Å; R324-S334 PolarHBondContact NH2-O 2.91Å; R324-S334 WeakPolarHBondContact O-CB 3.29Å
335	F	87.3	Confident	86	Confident	45 Å²	45	68.6 Å²	68.6	20%	0.197	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.2	-179.5	-60.5	-93.6	0	0	0	109.9	R324 F326 R333 V337 L341 H344	R324-F335 CarbonylContact C-O 3.5Å; R324-F335 WeakPolarHBondContact CA-O 3.29Å; F326-F335 HydrophobicContact CB-CB 4.39Å; F326-F335 WeakPolarHBondContact CB-O 3.38Å; F326-F335 PolarHBondContact N-O 2.86Å; F326-F335 PolarHBondContact O-N 2.98Å; R333-F335 HydrophobicContact CB-CE2 3.75Å; R333-F335 HydrophobicContact CB-CZ 4.09Å; R333-F335 WeakPolarHBondContact O-CD2 3.45Å; R333-F335 WeakPolarHBondContact O-CE2 3.35Å; F335-V337 VanDerWaalsContact C-N 3.3Å; F335-L341 HydrophobicContact CB-CB 4.43Å; F335-L341 HydrophobicContact CD2-CB 4.12Å; F335-L341 HydrophobicContact CD2-CD1 4.05Å; F335-L341 HydrophobicContact CE2-CD1 4.26Å; F335-L341 HydrophobicContact CG-CB 4.44Å; F335-H344 HydrophobicContact CE1-CB 3.99Å; F335-H344 HydrophobicContact CE2-CB 3.82Å; F335-H344 AromaticContact CE2-CD2 3.37Å; F335-H344 WeakPolarHBondContact CE2-CD2 3.08Å; F335-H344 AromaticContact CE2-CG 3.62Å; F335-H344 HydrophobicContact CZ-CB 3.41Å; F335-H344 VanDerWaalsContact CZ-CB 3.41Å; F335-H344 AromaticContact CZ-CD2 3.54Å; F335-H344 AromaticContact CZ-CG 3.29Å; F335-H344 AromaticContact CZ-ND1 3.95Å
336	S	88.9	Confident	86.3	Confident	69 Å²	69	67.3 Å²	67.3	48%	0.483	37%	0.369	S	S	.	.	S	Bend	trans	-71.7	-24	174.6	47.2	0	0	0	0	113
337	V	87.5	Confident	86.5	Confident	85 Å²	85	66.6 Å²	66.6	52%	0.515	37%	0.37	S	S	.	.	S	Bend	trans	-127	131.4	-175.9	-173.3	0	0	0	0	111	F335 A339 G340 L341	F335-V337 VanDerWaalsContact C-N 3.3Å; V337-A339 HydrophobicContact CG1-CB 4.09Å; V337-A339 PolarHBondContact O-N 3.24Å; V337-G340 WeakPolarHBondContact O-CA 3.39Å; V337-G340 PolarHBondContact O-N 2.87Å; V337-L341 PolarHBondContact O-N 3.12Å
338	K	86.8	Confident	86.7	Confident	117 Å²	117	64.5 Å²	64.5	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-53.9	-36.2	178.8	-168	171.4	-178.2	172.8	0	113	F326 G340 L341 V342	F326-K338 HydrophobicContact CD1-CB 3.87Å; F326-K338 HydrophobicContact CD1-CD 4.47Å; F326-K338 HydrophobicContact CD1-CG 4Å; F326-K338 HydrophobicContact CD2-CB 4.15Å; F326-K338 HydrophobicContact CE1-CB 3.72Å; F326-K338 HydrophobicContact CE1-CD 3.99Å; F326-K338 HydrophobicContact CE1-CG 3.95Å; F326-K338 HydrophobicContact CE2-CB 3.99Å; F326-K338 HydrophobicContact CG-CB 4.09Å; F326-K338 HydrophobicContact CZ-CB 3.79Å; F326-K338 HydrophobicContact CZ-CG 4.49Å; K338-G340 VanDerWaalsContact C-N 3.3Å; K338-G340 PolarHBondContact O-N 2.87Å; K338-L341 PolarHBondContact O-N 2.88Å; K338-V342 WeakPolarHBondContact O-CG2 3.49Å; K338-V342 PolarHBondContact O-N 2.79Å
339	A	86.3	Confident	86.3	Confident	68 Å²	68	68 Å²	68	56%	0.562	38%	0.382	S	S	*	.	H	α-helix	trans	-62	-35.4	174.4	0	0	0	0	0	112.9	V337 Q343	V337-A339 HydrophobicContact CG1-CB 4.09Å; V337-A339 PolarHBondContact O-N 3.24Å; A339-Q343 VanDerWaalsContact O-CB 3.24Å; A339-Q343 WeakPolarHBondContact O-CB 3.32Å; A339-Q343 PolarHBondContact O-N 2.81Å
340	G	87.3	Confident	86.1	Confident	22 Å²	22	62.9 Å²	62.9	23%	0.227	36%	0.358	C	S	.	.	H	α-helix	trans	-66.4	-41.9	172.7	0	0	0	0	0	112	V337 K338 H344	V337-G340 WeakPolarHBondContact O-CA 3.39Å; V337-G340 PolarHBondContact O-N 2.87Å; K338-G340 VanDerWaalsContact C-N 3.3Å; K338-G340 PolarHBondContact O-N 2.87Å; G340-H344 VanDerWaalsContact O-CB 3.25Å; G340-H344 WeakPolarHBondContact O-CB 3.44Å; G340-H344 PolarHBondContact O-N 3.32Å
341	L	88.3	Confident	86.1	Confident	28 Å²	28	63.6 Å²	63.6	15%	0.147	36%	0.355	C	S	.	.	H	α-helix	trans	-62.1	-49.9	172.4	176	61.1	0	0	0	111.6	F326 C328 F335 V337 K338 Q343 H344 M345	F326-L341 HydrophobicContact CB-CB 3.85Å; F326-L341 HydrophobicContact CB-CD2 3.78Å; F326-L341 HydrophobicContact CB-CG 4.42Å; C328-L341 HydrophobicContact CB-CD1 3.7Å; F335-L341 HydrophobicContact CB-CB 4.43Å; F335-L341 HydrophobicContact CD2-CB 4.12Å; F335-L341 HydrophobicContact CD2-CD1 4.05Å; F335-L341 HydrophobicContact CE2-CD1 4.26Å; F335-L341 HydrophobicContact CG-CB 4.44Å; V337-L341 PolarHBondContact O-N 3.12Å; K338-L341 PolarHBondContact O-N 2.88Å; L341-Q343 VanDerWaalsContact C-N 3.35Å; L341-Q343 PolarHBondContact O-N 3.46Å; L341-H344 CarbonylContact O-C 3.48Å; L341-H344 WeakPolarHBondContact O-CA 3.44Å; L341-H344 WeakPolarHBondContact O-CB 3.47Å; L341-H344 PolarHBondContact O-N 3.07Å; L341-M345 HydrophobicContact CD1-CG 4.16Å; L341-M345 HydrophobicContact CD1-SD 3.99Å; L341-M345 HydrophobicContact CG-CG 4.35Å; L341-M345 WeakPolarHBondContact O-CG 3.13Å; L341-M345 PolarHBondContact O-N 3.27Å
342	V	85.8	Confident	86.1	Confident	76 Å²	76	67.6 Å²	67.6	46%	0.461	36%	0.364	S	S	.	.	H	α-helix	trans	-59.9	-43.9	178.9	172.5	0	0	0	0	111.6	K338 H344 M345 R346	K338-V342 WeakPolarHBondContact O-CG2 3.49Å; K338-V342 PolarHBondContact O-N 2.79Å; V342-H344 PolarHBondContact O-N 3.4Å; V342-M345 PolarHBondContact O-N 3.39Å; V342-R346 PolarHBondContact O-N 2.89Å
343	Q	86.2	Confident	86.3	Confident	89 Å²	89	66.7 Å²	66.7	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-33.2	174.8	-175	-177.4	83.2	0	0	112	A339 L341 Q365	A339-Q343 VanDerWaalsContact O-CB 3.24Å; A339-Q343 WeakPolarHBondContact O-CB 3.32Å; A339-Q343 PolarHBondContact O-N 2.81Å; L341-Q343 VanDerWaalsContact C-N 3.35Å; L341-Q343 PolarHBondContact O-N 3.46Å; Q343-Q365 HydrophobicContact CG-CG 4.09Å
344	H	88.5	Confident	86.5	Confident	13 Å²	13	66.8 Å²	66.8	6%	0.06	36%	0.357	C	S	.	.	H	α-helix	trans	-75.3	-33.9	173.5	172.6	59.4	0	0	0	113.3	C328 C331 F335 G340 L341 V342 R346 T347 H348	C328-H344 PolarHBondContact SG-NE2 3.46Å; C328-H344 VanDerWaalsContact SG-NE2 3.36Å; C331-H344 VanDerWaalsContact SG-CE1 3.54Å; C331-H344 PolarHBondContact SG-NE2 3.15Å; F335-H344 HydrophobicContact CE1-CB 3.99Å; F335-H344 HydrophobicContact CE2-CB 3.82Å; F335-H344 AromaticContact CE2-CD2 3.37Å; F335-H344 WeakPolarHBondContact CE2-CD2 3.08Å; F335-H344 AromaticContact CE2-CG 3.62Å; F335-H344 HydrophobicContact CZ-CB 3.41Å; F335-H344 VanDerWaalsContact CZ-CB 3.41Å; F335-H344 AromaticContact CZ-CD2 3.54Å; F335-H344 AromaticContact CZ-CG 3.29Å; F335-H344 AromaticContact CZ-ND1 3.95Å; G340-H344 VanDerWaalsContact O-CB 3.25Å; G340-H344 WeakPolarHBondContact O-CB 3.44Å; G340-H344 PolarHBondContact O-N 3.32Å; L341-H344 CarbonylContact O-C 3.48Å; L341-H344 WeakPolarHBondContact O-CA 3.44Å; L341-H344 WeakPolarHBondContact O-CB 3.47Å; L341-H344 PolarHBondContact O-N 3.07Å; V342-H344 PolarHBondContact O-N 3.4Å; H344-R346 PolarHBondContact O-N 3.19Å; H344-T347 PolarHBondContact CE1-OG1 3.36Å; H344-T347 VanDerWaalsContact CE1-OG1 3.27Å; H344-T347 PolarHBondContact ND1-OG1 3.39Å; H344-T347 VanDerWaalsContact ND1-OG1 3.09Å; H344-T347 WeakPolarHBondContact O-CA 3.32Å; H344-T347 VanDerWaalsContact O-CB 3.26Å; H344-T347 WeakPolarHBondContact O-CB 3.49Å; H344-T347 PolarHBondContact O-N 3.27Å; H344-T347 PolarHBondContact O-OG1 2.84Å; H344-H348 AromaticContact CD2-NE2 3.99Å; H344-H348 AromaticContact CE1-CE1 3.97Å; H344-H348 AromaticContact CE1-NE2 3.4Å; H344-H348 PolarHBondContact CE1-NE2 3.3Å; H344-H348 AromaticContact NE2-CD2 3.95Å; H344-H348 AromaticContact NE2-CE1 3.98Å; H344-H348 AromaticContact NE2-NE2 3.09Å; H344-H348 PolarHBondContact NE2-NE2 2.77Å
345	M	86.6	Confident	86.6	Confident	59 Å²	59	68.9 Å²	68.9	29%	0.291	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-33.7	176.1	-67.8	-51.1	-66.2	0	0	111.9	C328 L341 V342 T347 H348 T349	C328-M345 HydrophobicContact CB-SD 4.27Å; C328-M345 PolarHBondContact SG-SD 3.4Å; L341-M345 HydrophobicContact CD1-CG 4.16Å; L341-M345 HydrophobicContact CD1-SD 3.99Å; L341-M345 HydrophobicContact CG-CG 4.35Å; L341-M345 WeakPolarHBondContact O-CG 3.13Å; L341-M345 PolarHBondContact O-N 3.27Å; V342-M345 PolarHBondContact O-N 3.39Å; M345-T347 PolarHBondContact O-N 3.47Å; M345-H348 WeakPolarHBondContact O-CA 3.38Å; M345-H348 PolarHBondContact O-N 3.29Å; M345-T349 PolarHBondContact O-N 2.94Å
346	R	87.1	Confident	86.8	Confident	58 Å²	58	66.9 Å²	66.9	22%	0.219	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-18.9	168.9	-61.8	179.1	-177.4	169.7	1.9	113.7	V342 H344 H348 D350 E351 K364	V342-R346 PolarHBondContact O-N 2.89Å; H344-R346 PolarHBondContact O-N 3.19Å; R346-H348 VanDerWaalsContact C-N 3.29Å; R346-D350 PolarHBondContact O-N 3.01Å; R346-E351 HydrophobicContact CG-CB 4.4Å; R346-K364 HydrophobicContact CB-CD 4.46Å; R346-K364 PolarHBondContact NH1-O 2.92Å; R346-K364 VanDerWaalsContact NH1-O 3.11Å; R346-K364 VanDerWaalsContact O-CD 3.3Å; R346-K364 WeakPolarHBondContact O-CD 3.47Å; R346-K364 VanDerWaalsContact O-CE 3.29Å; R346-K364 WeakPolarHBondContact O-CE 3.5Å; R346-K364 PolarHBondContact O-NZ 3.28Å
347	T	86.5	Confident	86.8	Confident	53 Å²	53	71 Å²	71	33%	0.325	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-24.4	172.2	70.5	0	0	0	0	112.8	H344 M345	H344-T347 PolarHBondContact CE1-OG1 3.36Å; H344-T347 VanDerWaalsContact CE1-OG1 3.27Å; H344-T347 PolarHBondContact ND1-OG1 3.39Å; H344-T347 VanDerWaalsContact ND1-OG1 3.09Å; H344-T347 WeakPolarHBondContact O-CA 3.32Å; H344-T347 VanDerWaalsContact O-CB 3.26Å; H344-T347 WeakPolarHBondContact O-CB 3.49Å; H344-T347 PolarHBondContact O-N 3.27Å; H344-T347 PolarHBondContact O-OG1 2.84Å; M345-T347 PolarHBondContact O-N 3.47Å
348	H	87.4	Confident	86.7	Confident	65 Å²	65	72.8 Å²	72.8	30%	0.301	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-42.3	176.4	-55.3	-59.6	0	0	0	113.2	C328 T330 H344 M345 R346 D350	C328-H348 PolarHBondContact SG-NE2 3.02Å; T330-H348 HydrophobicContact CG2-CB 4.3Å; H344-H348 AromaticContact CD2-NE2 3.99Å; H344-H348 AromaticContact CE1-CE1 3.97Å; H344-H348 AromaticContact CE1-NE2 3.4Å; H344-H348 PolarHBondContact CE1-NE2 3.3Å; H344-H348 AromaticContact NE2-CD2 3.95Å; H344-H348 AromaticContact NE2-CE1 3.98Å; H344-H348 AromaticContact NE2-NE2 3.09Å; H344-H348 PolarHBondContact NE2-NE2 2.77Å; M345-H348 WeakPolarHBondContact O-CA 3.38Å; M345-H348 PolarHBondContact O-N 3.29Å; R346-H348 VanDerWaalsContact C-N 3.29Å; H348-D350 PolarHBondContact O-N 3.36Å
349	T	81.5	Confident	86.8	Confident	74 Å²	74	69.6 Å²	69.6	45%	0.454	37%	0.371	S	S	.	.	S	Bend	trans	-78.1	-1.5	-179.1	63	0	0	0	0	114.1	M345 E351	M345-T349 PolarHBondContact O-N 2.94Å; T349-E351 VanDerWaalsContact CB-OE1 3.28Å; T349-E351 WeakPolarHBondContact CB-OE1 3.33Å; T349-E351 PolarHBondContact O-N 3.09Å; T349-E351 VanDerWaalsContact OG1-CD 3.24Å; T349-E351 WeakPolarHBondContact OG1-CG 3.41Å; T349-E351 PolarHBondContact OG1-OE1 3.33Å
350	D	80	Confident	86.9	Confident	77 Å²	77	69.3 Å²	69.3	41%	0.412	37%	0.374	S	S	.	.			trans	51.2	6.8	-173.2	-107.3	-33	0	0	0	117.6	R346 H348 R352 K364	R346-D350 PolarHBondContact O-N 3.01Å; H348-D350 PolarHBondContact O-N 3.36Å; D350-R352 WeakPolarHBondContact O-CG 3.48Å; D350-R352 PolarHBondContact O-N 2.89Å; D350-K364 VanDerWaalsContact OD1-CE 3.28Å; D350-K364 WeakPolarHBondContact OD1-CE 3.48Å; D350-K364 IonicContact OD1-NZ 2.72Å; D350-K364 PolarHBondContact OD1-NZ 3.39Å
351	E	83.6	Confident	86.9	Confident	103 Å²	103	76.4 Å²	76.4	48%	0.481	39%	0.394	S	S	.	.			trans	-51.5	130.2	174.2	-77.1	167.6	-124.6	0	0	112.8	R346 T349 K364	R346-E351 HydrophobicContact CG-CB 4.4Å; T349-E351 VanDerWaalsContact CB-OE1 3.28Å; T349-E351 WeakPolarHBondContact CB-OE1 3.33Å; T349-E351 PolarHBondContact O-N 3.09Å; T349-E351 VanDerWaalsContact OG1-CD 3.24Å; T349-E351 WeakPolarHBondContact OG1-CG 3.41Å; T349-E351 PolarHBondContact OG1-OE1 3.33Å; E351-K364 WeakPolarHBondContact O-CG 3.33Å
352	R	87.5	Confident	86.9	Confident	131 Å²	131	76.2 Å²	76.2	49%	0.494	40%	0.397	S	S	.	.			trans	-130.2	79.2	179.9	-71.4	154.6	179.6	-111.5	11.8	110.1	D350 Y354 A362 F363 K364	D350-R352 WeakPolarHBondContact O-CG 3.48Å; D350-R352 PolarHBondContact O-N 2.89Å; R352-Y354 PolarHBondContact O-N 3.43Å; R352-A362 HydrophobicContact CB-CB 3.45Å; R352-A362 VanDerWaalsContact CB-CB 3.45Å; R352-A362 WeakPolarHBondContact CD-O 3.41Å; R352-A362 HydrophobicContact CG-CB 4.37Å; R352-A362 WeakPolarHBondContact CG-O 3.25Å; R352-A362 PolarHBondContact NH1-O 2.98Å; R352-F363 CarbonylContact C-O 3.44Å; R352-F363 VanDerWaalsContact C-O 3.25Å; R352-F363 VanDerWaalsContact CA-O 3.26Å; R352-F363 WeakPolarHBondContact CA-O 3.43Å; R352-K364 HydrophobicContact CG-CG 3.87Å
353	P	87.2	Confident	87	Confident	62 Å²	62	74.6 Å²	74.6	40%	0.403	38%	0.383	S	S	.	.			trans	-67.5	-5.6	-172.4	-22.1	34.8	0	0	0	115.5	P355	P353-P355 VanDerWaalsContact O-CD 3.27Å; P353-P355 WeakPolarHBondContact O-CD 3.29Å
354	Y	89.8	Confident	87.1	Confident	72 Å²	72	71.8 Å²	71.8	28%	0.282	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	81.9	-172.3	-54.2	-72	0	0	0	111	R352 A362 F363 K366	R352-Y354 PolarHBondContact O-N 3.43Å; Y354-A362 WeakPolarHBondContact O-CA 3.37Å; Y354-F363 WeakPolarHBondContact CD2-O 3.38Å; Y354-F363 PolarHBondContact N-O 2.96Å; Y354-F363 PolarHBondContact O-N 3.06Å; Y354-K366 HydrophobicContact CD1-CB 4.22Å; Y354-K366 HydrophobicContact CE1-CB 3.98Å; Y354-K366 HydrophobicContact CE2-CB 4.47Å
355	P	88.8	Confident	87.1	Confident	81 Å²	81	73.7 Å²	73.7	53%	0.526	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	143	173.8	29.8	-34.5	0	0	0	111.9	P353 A362	P353-P355 VanDerWaalsContact O-CD 3.27Å; P353-P355 WeakPolarHBondContact O-CD 3.29Å; P355-A362 HydrophobicContact CB-CB 4.47Å
356	C	91.7	Very high	87.2	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.014	40%	0.395	C	S	.	.			trans	-85.4	120	168.3	178.3	0	0	0	0	110.6	H358 C359 G360 R361 F363 L369 H372 M373 H376	C356-H358 VanDerWaalsContact C-N 3.27Å; C356-H358 PolarHBondContact O-N 3.24Å; C356-C359 PolarHBondContact O-N 2.91Å; C356-C359 VanDerWaalsContact SG-SG 3.61Å; C356-G360 WeakPolarHBondContact O-CA 3.47Å; C356-G360 PolarHBondContact O-N 2.88Å; C356-R361 VanDerWaalsContact CB-O 3.27Å; C356-R361 WeakPolarHBondContact CB-O 3.24Å; C356-R361 PolarHBondContact N-O 3.15Å; C356-F363 HydrophobicContact CB-CE2 4.28Å; C356-L369 HydrophobicContact CB-CD1 3.77Å; C356-H372 VanDerWaalsContact SG-CD2 3.54Å; C356-H372 PolarHBondContact SG-NE2 3.42Å; C356-H372 VanDerWaalsContact SG-NE2 3.44Å; C356-M373 VanDerWaalsContact SG-SD 3.64Å; C356-H376 VanDerWaalsContact SG-CD2 3.55Å; C356-H376 PolarHBondContact SG-NE2 2.93Å
357	I	88.4	Confident	87.3	Confident	157 Å²	157	81 Å²	81	81%	0.805	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-37.2	-177.7	-57.7	171.3	0	0	0	111.7
358	H	85.8	Confident	87.4	Confident	122 Å²	122	81.8 Å²	81.8	57%	0.565	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-13.4	-175.8	-58	-60.6	0	0	0	115.7	C356 M373 H376	C356-H358 VanDerWaalsContact C-N 3.27Å; C356-H358 PolarHBondContact O-N 3.24Å; H358-M373 VanDerWaalsContact CD2-CE 3.44Å; H358-M373 WeakPolarHBondContact CD2-CE 3.42Å; H358-H376 AromaticContact CD2-CD2 3.97Å; H358-H376 AromaticContact CD2-CG 3.82Å
359	C	89.4	Confident	87.6	Confident	50 Å²	50	80.1 Å²	80.1	34%	0.338	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	10.8	-176	70.1	0	0	0	0	115.8	C356 R361 H372 H376	C356-C359 PolarHBondContact O-N 2.91Å; C356-C359 VanDerWaalsContact SG-SG 3.61Å; C359-R361 PolarHBondContact O-N 3.46Å; C359-H372 PolarHBondContact SG-NE2 2.81Å; C359-H376 WeakPolarHBondContact CB-CE1 3.4Å; C359-H376 PolarHBondContact SG-CE1 3.45Å; C359-H376 PolarHBondContact SG-NE2 2.83Å
360	G	86.5	Confident	87.9	Confident	62 Å²	62	80.2 Å²	80.2	64%	0.639	41%	0.409	S	S	*	.			trans	65.8	-7.5	179.8	0	0	0	0	0	115.8	C356 A362	C356-G360 WeakPolarHBondContact O-CA 3.47Å; C356-G360 PolarHBondContact O-N 2.88Å; G360-A362 PolarHBondContact O-N 3.05Å
361	R	88	Confident	88.4	Confident	170 Å²	170	78.2 Å²	78.2	64%	0.642	40%	0.4	S	S	*	.			trans	-65.4	119	-178.4	-70.8	-174.7	178.2	-171	1.3	110.6	C356 C359 F363	C356-R361 VanDerWaalsContact CB-O 3.27Å; C356-R361 WeakPolarHBondContact CB-O 3.24Å; C356-R361 PolarHBondContact N-O 3.15Å; C359-R361 PolarHBondContact O-N 3.46Å; R361-F363 HydrophobicContact CB-CE2 4.06Å; R361-F363 HydrophobicContact CB-CZ 4.21Å; R361-F363 WeakPolarHBondContact O-CD2 3.25Å; R361-F363 WeakPolarHBondContact O-CE2 3.39Å
362	A	88.8	Confident	88.7	Confident	25 Å²	25	74.3 Å²	74.3	21%	0.207	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.3	-179.6	0	0	0	0	0	112.8	R352 Y354 P355 G360	R352-A362 HydrophobicContact CB-CB 3.45Å; R352-A362 VanDerWaalsContact CB-CB 3.45Å; R352-A362 WeakPolarHBondContact CD-O 3.41Å; R352-A362 HydrophobicContact CG-CB 4.37Å; R352-A362 WeakPolarHBondContact CG-O 3.25Å; R352-A362 PolarHBondContact NH1-O 2.98Å; Y354-A362 WeakPolarHBondContact O-CA 3.37Å; P355-A362 HydrophobicContact CB-CB 4.47Å; G360-A362 PolarHBondContact O-N 3.05Å
363	F	88.5	Confident	88.7	Confident	41 Å²	41	70.9 Å²	70.9	18%	0.18	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	153.5	-175.7	-62.2	-87.1	0	0	0	112.4	R352 Y354 C356 R361 Q368 L369 H372	R352-F363 CarbonylContact C-O 3.44Å; R352-F363 VanDerWaalsContact C-O 3.25Å; R352-F363 VanDerWaalsContact CA-O 3.26Å; R352-F363 WeakPolarHBondContact CA-O 3.43Å; Y354-F363 WeakPolarHBondContact CD2-O 3.38Å; Y354-F363 PolarHBondContact N-O 2.96Å; Y354-F363 PolarHBondContact O-N 3.06Å; C356-F363 HydrophobicContact CB-CE2 4.28Å; R361-F363 HydrophobicContact CB-CE2 4.06Å; R361-F363 HydrophobicContact CB-CZ 4.21Å; R361-F363 WeakPolarHBondContact O-CD2 3.25Å; R361-F363 WeakPolarHBondContact O-CE2 3.39Å; F363-Q368 HydrophobicContact CB-CB 4Å; F363-Q368 HydrophobicContact CD1-CB 3.81Å; F363-Q368 HydrophobicContact CG-CB 4.14Å; F363-L369 HydrophobicContact CB-CB 4.45Å; F363-L369 HydrophobicContact CD2-CB 4.08Å; F363-L369 HydrophobicContact CD2-CD1 3.96Å; F363-L369 HydrophobicContact CE2-CD1 4.19Å; F363-L369 HydrophobicContact CG-CB 4.46Å; F363-H372 HydrophobicContact CE1-CB 4.1Å; F363-H372 HydrophobicContact CE2-CB 3.83Å; F363-H372 AromaticContact CE2-CD2 3.34Å; F363-H372 WeakPolarHBondContact CE2-CD2 3.4Å; F363-H372 AromaticContact CE2-CG 3.56Å; F363-H372 HydrophobicContact CZ-CB 3.51Å; F363-H372 AromaticContact CZ-CD2 3.5Å; F363-H372 VanDerWaalsContact CZ-CD2 3.5Å; F363-H372 WeakPolarHBondContact CZ-CD2 3.37Å; F363-H372 AromaticContact CZ-CG 3.25Å; F363-H372 AromaticContact CZ-ND1 3.73Å
364	K	88.2	Confident	88.8	Confident	30 Å²	30	70.5 Å²	70.5	13%	0.13	36%	0.362	C	S	.	.	S	Bend	trans	-81.6	-16.6	-178.7	-54.7	-164	170.6	-170	0	113	R346 D350 E351 R352	R346-K364 HydrophobicContact CB-CD 4.46Å; R346-K364 PolarHBondContact NH1-O 2.92Å; R346-K364 VanDerWaalsContact NH1-O 3.11Å; R346-K364 VanDerWaalsContact O-CD 3.3Å; R346-K364 WeakPolarHBondContact O-CD 3.47Å; R346-K364 VanDerWaalsContact O-CE 3.29Å; R346-K364 WeakPolarHBondContact O-CE 3.5Å; R346-K364 PolarHBondContact O-NZ 3.28Å; D350-K364 VanDerWaalsContact OD1-CE 3.28Å; D350-K364 WeakPolarHBondContact OD1-CE 3.48Å; D350-K364 IonicContact OD1-NZ 2.72Å; D350-K364 PolarHBondContact OD1-NZ 3.39Å; E351-K364 WeakPolarHBondContact O-CG 3.33Å; R352-K364 HydrophobicContact CG-CG 3.87Å
365	Q	88.3	Confident	88.8	Confident	53 Å²	53	70 Å²	70	25%	0.248	37%	0.366	C	S	.	.	S	Bend	trans	-139.6	143.9	-176.4	-54.1	177.9	-0.5	0	0	111.9	Q343 I367 Q368 L369	Q343-Q365 HydrophobicContact CG-CG 4.09Å; Q365-I367 VanDerWaalsContact C-N 3.34Å; Q365-I367 PolarHBondContact O-N 2.91Å; Q365-Q368 HydrophobicContact CB-CB 4.47Å; Q365-Q368 HydrophobicContact CB-CG 4.03Å; Q365-Q368 WeakPolarHBondContact O-CB 3.41Å; Q365-Q368 PolarHBondContact O-N 2.98Å; Q365-Q368 VanDerWaalsContact O-N 3.16Å; Q365-L369 PolarHBondContact O-N 3.11Å
366	K	89	Confident	88.8	Confident	147 Å²	147	70.1 Å²	70.1	64%	0.639	36%	0.36	S	S	*	.	H	α-helix	trans	-59	-40.3	178.2	-172.5	175.6	179.4	178.3	0	112.9	Y354 Q368 L369 T370	Y354-K366 HydrophobicContact CD1-CB 4.22Å; Y354-K366 HydrophobicContact CE1-CB 3.98Å; Y354-K366 HydrophobicContact CE2-CB 4.47Å; K366-Q368 VanDerWaalsContact C-N 3.29Å; K366-Q368 PolarHBondContact O-N 3.36Å; K366-L369 WeakPolarHBondContact O-CB 3.48Å; K366-L369 PolarHBondContact O-N 3.25Å; K366-L369 VanDerWaalsContact O-N 3.13Å; K366-T370 PolarHBondContact O-N 2.89Å; K366-T370 PolarHBondContact O-OG1 2.72Å
367	I	88.2	Confident	88.5	Confident	124 Å²	124	73.4 Å²	73.4	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-60.8	-38.2	178.3	-59.1	172.2	0	0	0	111.4	Q365 T370 T371	Q365-I367 VanDerWaalsContact C-N 3.34Å; Q365-I367 PolarHBondContact O-N 2.91Å; I367-T370 PolarHBondContact O-N 2.85Å; I367-T371 HydrophobicContact CG2-CG2 4.47Å; I367-T371 WeakPolarHBondContact O-CG2 3.46Å; I367-T371 PolarHBondContact O-N 3.44Å; I367-T371 PolarHBondContact O-OG1 2.66Å
368	Q	89.5	Confident	88.3	Confident	69 Å²	69	67.7 Å²	67.7	32%	0.322	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-43.7	176.3	-65.2	170.9	-0.9	0	0	110.7	F363 Q365 K366 T371 H372	F363-Q368 HydrophobicContact CB-CB 4Å; F363-Q368 HydrophobicContact CD1-CB 3.81Å; F363-Q368 HydrophobicContact CG-CB 4.14Å; Q365-Q368 HydrophobicContact CB-CB 4.47Å; Q365-Q368 HydrophobicContact CB-CG 4.03Å; Q365-Q368 WeakPolarHBondContact O-CB 3.41Å; Q365-Q368 PolarHBondContact O-N 2.98Å; Q365-Q368 VanDerWaalsContact O-N 3.16Å; K366-Q368 VanDerWaalsContact C-N 3.29Å; K366-Q368 PolarHBondContact O-N 3.36Å; Q368-T371 PolarHBondContact O-N 2.32Å; Q368-T371 PolarHBondContact O-OG1 3.25Å; Q368-T371 VanDerWaalsContact O-OG1 3.06Å; Q368-H372 VanDerWaalsContact O-CB 3.29Å; Q368-H372 WeakPolarHBondContact O-CB 3.5Å; Q368-H372 PolarHBondContact O-N 3.38Å
369	L	90.4	Very high	88.3	Confident	31 Å²	31	67.1 Å²	67.1	16%	0.162	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-50.1	172.3	176.3	61.4	0	0	0	111.2	C356 F363 Q365 K366 T371 H372 M373	C356-L369 HydrophobicContact CB-CD1 3.77Å; F363-L369 HydrophobicContact CB-CB 4.45Å; F363-L369 HydrophobicContact CD2-CB 4.08Å; F363-L369 HydrophobicContact CD2-CD1 3.96Å; F363-L369 HydrophobicContact CE2-CD1 4.19Å; F363-L369 HydrophobicContact CG-CB 4.46Å; Q365-L369 PolarHBondContact O-N 3.11Å; K366-L369 WeakPolarHBondContact O-CB 3.48Å; K366-L369 PolarHBondContact O-N 3.25Å; K366-L369 VanDerWaalsContact O-N 3.13Å; L369-T371 PolarHBondContact O-N 3.05Å; L369-H372 CarbonylContact O-C 3.33Å; L369-H372 WeakPolarHBondContact O-CA 3.44Å; L369-H372 WeakPolarHBondContact O-CB 3.21Å; L369-H372 PolarHBondContact O-N 3.01Å; L369-M373 HydrophobicContact CD1-CG 4.2Å; L369-M373 HydrophobicContact CD1-SD 3.97Å; L369-M373 HydrophobicContact CG-CG 4.39Å; L369-M373 WeakPolarHBondContact O-CG 3.26Å; L369-M373 PolarHBondContact O-N 3.44Å
370	T	89.3	Confident	88.2	Confident	75 Å²	75	71.1 Å²	71.1	46%	0.46	37%	0.368	S	S	.	.	H	α-helix	trans	-58	-44	179.2	-55.2	0	0	0	0	112.6	K366 I367 H372 M373	K366-T370 PolarHBondContact O-N 2.89Å; K366-T370 PolarHBondContact O-OG1 2.72Å; I367-T370 PolarHBondContact O-N 2.85Å; T370-H372 VanDerWaalsContact C-N 3.28Å; T370-H372 PolarHBondContact O-N 3.39Å; T370-M373 PolarHBondContact O-N 3.26Å
371	T	88.5	Confident	88.2	Confident	36 Å²	36	70.3 Å²	70.3	22%	0.221	35%	0.352	C	S	.	.	H	α-helix	trans	-69.5	-25.4	175.2	61.8	0	0	0	0	113.1	I367 Q368 L369	I367-T371 HydrophobicContact CG2-CG2 4.47Å; I367-T371 WeakPolarHBondContact O-CG2 3.46Å; I367-T371 PolarHBondContact O-N 3.44Å; I367-T371 PolarHBondContact O-OG1 2.66Å; Q368-T371 PolarHBondContact O-N 2.32Å; Q368-T371 PolarHBondContact O-OG1 3.25Å; Q368-T371 VanDerWaalsContact O-OG1 3.06Å; L369-T371 PolarHBondContact O-N 3.05Å
372	H	90.7	Very high	88.2	Confident	20 Å²	20	64.2 Å²	64.2	9%	0.093	33%	0.329	C	S	.	.	H	α-helix	trans	-75.5	-33.8	172	174.8	65.5	0	0	0	112.9	C356 C359 F363 Q368 L369 T370 R374 V375 H376	C356-H372 VanDerWaalsContact SG-CD2 3.54Å; C356-H372 PolarHBondContact SG-NE2 3.42Å; C356-H372 VanDerWaalsContact SG-NE2 3.44Å; C359-H372 PolarHBondContact SG-NE2 2.81Å; F363-H372 HydrophobicContact CE1-CB 4.1Å; F363-H372 HydrophobicContact CE2-CB 3.83Å; F363-H372 AromaticContact CE2-CD2 3.34Å; F363-H372 WeakPolarHBondContact CE2-CD2 3.4Å; F363-H372 AromaticContact CE2-CG 3.56Å; F363-H372 HydrophobicContact CZ-CB 3.51Å; F363-H372 AromaticContact CZ-CD2 3.5Å; F363-H372 VanDerWaalsContact CZ-CD2 3.5Å; F363-H372 WeakPolarHBondContact CZ-CD2 3.37Å; F363-H372 AromaticContact CZ-CG 3.25Å; F363-H372 AromaticContact CZ-ND1 3.73Å; Q368-H372 VanDerWaalsContact O-CB 3.29Å; Q368-H372 WeakPolarHBondContact O-CB 3.5Å; Q368-H372 PolarHBondContact O-N 3.38Å; L369-H372 CarbonylContact O-C 3.33Å; L369-H372 WeakPolarHBondContact O-CA 3.44Å; L369-H372 WeakPolarHBondContact O-CB 3.21Å; L369-H372 PolarHBondContact O-N 3.01Å; T370-H372 VanDerWaalsContact C-N 3.28Å; T370-H372 PolarHBondContact O-N 3.39Å; H372-R374 PolarHBondContact O-N 2.64Å; H372-V375 WeakPolarHBondContact O-CA 3.27Å; H372-V375 WeakPolarHBondContact O-CB 3.07Å; H372-V375 VanDerWaalsContact O-CG2 3.32Å; H372-V375 WeakPolarHBondContact O-CG2 3.21Å; H372-V375 PolarHBondContact O-N 2.91Å; H372-H376 AromaticContact CD2-NE2 3.26Å; H372-H376 PolarHBondContact CD2-NE2 3.21Å; H372-H376 VanDerWaalsContact CD2-NE2 3.26Å; H372-H376 AromaticContact CE1-NE2 3.05Å; H372-H376 PolarHBondContact CE1-NE2 3.41Å; H372-H376 AromaticContact NE2-CD2 3.82Å; H372-H376 AromaticContact NE2-NE2 2.32Å; H372-H376 PolarHBondContact NE2-NE2 3.48Å
373	M	88.7	Confident	88	Confident	59 Å²	59	63.5 Å²	63.5	29%	0.291	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-29.6	176.7	-65.6	-57.1	-73.6	0	0	112.4	C356 H358 L369 T370 V375 H376 S377	C356-M373 VanDerWaalsContact SG-SD 3.64Å; H358-M373 VanDerWaalsContact CD2-CE 3.44Å; H358-M373 WeakPolarHBondContact CD2-CE 3.42Å; L369-M373 HydrophobicContact CD1-CG 4.2Å; L369-M373 HydrophobicContact CD1-SD 3.97Å; L369-M373 HydrophobicContact CG-CG 4.39Å; L369-M373 WeakPolarHBondContact O-CG 3.26Å; L369-M373 PolarHBondContact O-N 3.44Å; T370-M373 PolarHBondContact O-N 3.26Å; M373-V375 PolarHBondContact O-N 3.24Å; M373-V375 VanDerWaalsContact O-N 3.11Å; M373-H376 WeakPolarHBondContact O-CA 3.34Å; M373-H376 PolarHBondContact O-N 3.47Å; M373-S377 PolarHBondContact O-N 3.2Å
374	R	89.2	Confident	88	Confident	54 Å²	54	61.7 Å²	61.7	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-12.6	169.5	-59.2	179.6	-176.9	171	-0.6	114.1	H372 G378 E379 R392	H372-R374 PolarHBondContact O-N 2.64Å; R374-G378 PolarHBondContact O-N 3.37Å; R374-E379 HydrophobicContact CB-CB 4.43Å; R374-E379 HydrophobicContact CG-CB 4.37Å; R374-R392 PolarHBondContact NH1-O 3.26Å; R374-R392 WeakPolarHBondContact O-CD 3.26Å; R374-R392 PolarHBondContact O-NE 3.49Å
375	V	88.9	Confident	87.7	Confident	62 Å²	62	66.1 Å²	66.1	38%	0.376	33%	0.332	S	S	.	.	H	α-helix	trans	-73	-39.4	168.9	-176	0	0	0	0	110.5	H372 M373 R392	H372-V375 WeakPolarHBondContact O-CA 3.27Å; H372-V375 WeakPolarHBondContact O-CB 3.07Å; H372-V375 VanDerWaalsContact O-CG2 3.32Å; H372-V375 WeakPolarHBondContact O-CG2 3.21Å; H372-V375 PolarHBondContact O-N 2.91Å; M373-V375 PolarHBondContact O-N 3.24Å; M373-V375 VanDerWaalsContact O-N 3.11Å; V375-R392 PolarHBondContact O-NH2 2.84Å
376	H	88	Confident	87.5	Confident	84 Å²	84	68.5 Å²	68.5	39%	0.389	35%	0.346	S	S	.	.	H	α-helix	trans	-81.9	-46.2	-179	-62.3	-65	0	0	0	113	C356 H358 C359 H372 M373 G378	C356-H376 VanDerWaalsContact SG-CD2 3.55Å; C356-H376 PolarHBondContact SG-NE2 2.93Å; H358-H376 AromaticContact CD2-CD2 3.97Å; H358-H376 AromaticContact CD2-CG 3.82Å; C359-H376 WeakPolarHBondContact CB-CE1 3.4Å; C359-H376 PolarHBondContact SG-CE1 3.45Å; C359-H376 PolarHBondContact SG-NE2 2.83Å; H372-H376 AromaticContact CD2-NE2 3.26Å; H372-H376 PolarHBondContact CD2-NE2 3.21Å; H372-H376 VanDerWaalsContact CD2-NE2 3.26Å; H372-H376 AromaticContact CE1-NE2 3.05Å; H372-H376 PolarHBondContact CE1-NE2 3.41Å; H372-H376 AromaticContact NE2-CD2 3.82Å; H372-H376 AromaticContact NE2-NE2 2.32Å; H372-H376 PolarHBondContact NE2-NE2 3.48Å; M373-H376 WeakPolarHBondContact O-CA 3.34Å; M373-H376 PolarHBondContact O-N 3.47Å; H376-G378 PolarHBondContact O-N 3.44Å
377	S	86.1	Confident	87.4	Confident	70 Å²	70	63.8 Å²	63.8	49%	0.49	33%	0.331	S	S	.	.	S	Bend	trans	-72.3	-12.9	176.5	83.5	0	0	0	0	113.5	M373 E379	M373-S377 PolarHBondContact O-N 3.2Å; S377-E379 WeakPolarHBondContact CB-OE1 3.47Å; S377-E379 PolarHBondContact O-N 3.2Å; S377-E379 WeakPolarHBondContact OG-CB 3.16Å; S377-E379 VanDerWaalsContact OG-CG 3.27Å; S377-E379 WeakPolarHBondContact OG-CG 3.25Å; S377-E379 PolarHBondContact OG-N 3.36Å; S377-E379 PolarHBondContact OG-OE1 3.09Å
378	G	85.2	Confident	87.3	Confident	38 Å²	38	60.4 Å²	60.4	39%	0.392	33%	0.327	S	S	.	.			trans	77.6	-8.1	-177.4	0	0	0	0	0	114.8	R374 H376 R380	R374-G378 PolarHBondContact O-N 3.37Å; H376-G378 PolarHBondContact O-N 3.44Å; G378-R380 WeakPolarHBondContact O-CG 3.46Å; G378-R380 PolarHBondContact O-N 3.14Å
379	E	85	Confident	87.1	Confident	109 Å²	109	63.1 Å²	63.1	51%	0.509	34%	0.338	S	S	.	.			trans	-49.1	127.7	179	-84	163.3	-119.5	0	0	113.8	R374 S377	R374-E379 HydrophobicContact CB-CB 4.43Å; R374-E379 HydrophobicContact CG-CB 4.37Å; S377-E379 WeakPolarHBondContact CB-OE1 3.47Å; S377-E379 PolarHBondContact O-N 3.2Å; S377-E379 WeakPolarHBondContact OG-CB 3.16Å; S377-E379 VanDerWaalsContact OG-CG 3.27Å; S377-E379 WeakPolarHBondContact OG-CG 3.25Å; S377-E379 PolarHBondContact OG-N 3.36Å; S377-E379 PolarHBondContact OG-OE1 3.09Å
380	R	87.6	Confident	87	Confident	134 Å²	134	65.5 Å²	65.5	51%	0.506	35%	0.35	S	S	.	.			trans	-129.1	73.2	175.9	-67.8	168.8	-176.6	-170	4	109.8	G378 Y382 L390 F391 R392	G378-R380 WeakPolarHBondContact O-CG 3.46Å; G378-R380 PolarHBondContact O-N 3.14Å; R380-Y382 PolarHBondContact O-N 3.21Å; R380-Y382 VanDerWaalsContact O-N 3.14Å; R380-L390 HydrophobicContact CB-CB 3.49Å; R380-L390 VanDerWaalsContact CB-CB 3.49Å; R380-L390 WeakPolarHBondContact CD-O 3.45Å; R380-L390 HydrophobicContact CG-CB 4.4Å; R380-F391 CarbonylContact C-O 3.28Å; R380-F391 VanDerWaalsContact C-O 3.28Å; R380-F391 WeakPolarHBondContact CA-O 3.37Å; R380-R392 HydrophobicContact CG-CG 4Å
381	P	86.1	Confident	86.8	Confident	46 Å²	46	64.1 Å²	64.1	30%	0.299	34%	0.338	S	S	.	.			trans	-70.7	-9.1	-167.7	27.2	-35.3	0	0	0	115.1
382	Y	87.8	Confident	86.8	Confident	42 Å²	42	66.2 Å²	66.2	17%	0.165	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	112.8	-177.1	-49.6	-76.2	0	0	0	111.1	L302 I304 R380 L390 F391 Q394 V397	L302-Y382 HydrophobicContact CD1-CD1 4.33Å; L302-Y382 HydrophobicContact CD1-CE1 4.03Å; I304-Y382 HydrophobicContact CD1-CD1 4.35Å; R380-Y382 PolarHBondContact O-N 3.21Å; R380-Y382 VanDerWaalsContact O-N 3.14Å; Y382-L390 CarbonylContact O-C 3.58Å; Y382-F391 PolarHBondContact N-O 2.97Å; Y382-F391 PolarHBondContact O-N 3.2Å; Y382-Q394 HydrophobicContact CD1-CB 4.24Å; Y382-Q394 HydrophobicContact CD2-CB 4.46Å; Y382-Q394 VanDerWaalsContact CD2-N 3.33Å; Y382-Q394 HydrophobicContact CE1-CB 4.12Å; Y382-Q394 HydrophobicContact CE2-CB 4.33Å; Y382-Q394 HydrophobicContact CG-CB 4.4Å; Y382-V397 VanDerWaalsContact CB-CG2 3.42Å; Y382-V397 WeakPolarHBondContact O-CG2 3.49Å
383	G	85.2	Confident	86.7	Confident	9 Å²	9	68.3 Å²	68.3	9%	0.093	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	148.8	178.8	0	0	0	0	0	113.8
384	C	89	Confident	86.6	Confident	4 Å²	4	70.5 Å²	70.5	3%	0.027	36%	0.361	C	S	.	.			trans	-80.6	122.5	165.7	-175.7	0	0	0	0	110.8	L386 G388 K389 F391 H400 H404	C384-L386 PolarHBondContact O-N 3.21Å; C384-G388 WeakPolarHBondContact O-CA 3.45Å; C384-G388 PolarHBondContact O-N 3.12Å; C384-K389 PolarHBondContact N-O 2.98Å; C384-F391 HydrophobicContact CB-CE2 4.39Å; C384-H400 VanDerWaalsContact CB-CD2 3.49Å; C384-H400 WeakPolarHBondContact CB-CD2 3.32Å; C384-H400 PolarHBondContact SG-CD2 2.75Å; C384-H400 PolarHBondContact SG-NE2 3.28Å; C384-H404 PolarHBondContact SG-NE2 3.38Å
385	R	82	Confident	86.5	Confident	122 Å²	122	71.2 Å²	71.2	46%	0.46	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.1	177.1	-64	-168.8	-174.2	-176.4	5.4	113.7	Q303 I304 S305	Q303-R385 VanDerWaalsContact C-NH2 3.33Å; Q303-R385 PolarHBondContact O-NH2 2.86Å; I304-R385 PolarHBondContact O-NE 3.03Å; S305-R385 VanDerWaalsContact N-NH2 3.12Å; S305-R385 PolarHBondContact OG-NH1 3.05Å; S305-R385 PolarHBondContact OG-NH2 3.07Å
386	L	83.4	Confident	86.5	Confident	103 Å²	103	72.1 Å²	72.1	54%	0.539	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-12.5	-171.8	-61.9	174.8	0	0	0	114.6	C384 H404	C384-L386 PolarHBondContact O-N 3.21Å; L386-H404 HydrophobicContact CD1-CB 3.48Å; L386-H404 VanDerWaalsContact CD1-CB 3.48Å
387	C	86.8	Confident	86.5	Confident	48 Å²	48	68.1 Å²	68.1	32%	0.324	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.8	14	178.8	66.5	0	0	0	0	115.2	K389 H400 H404	C387-K389 PolarHBondContact O-N 2.6Å; C387-H400 PolarHBondContact SG-NE2 2.61Å; C387-H404 WeakPolarHBondContact CB-CE1 3.26Å; C387-H404 WeakPolarHBondContact CB-NE2 3.42Å; C387-H404 PolarHBondContact SG-CE1 3Å; C387-H404 PolarHBondContact SG-NE2 3.25Å
388	G	85.2	Confident	86.6	Confident	53 Å²	53	68 Å²	68	55%	0.546	35%	0.352	S	S	.	.			trans	66.4	-6.6	178.1	0	0	0	0	0	116.1	C384 L390	C384-G388 WeakPolarHBondContact O-CA 3.45Å; C384-G388 PolarHBondContact O-N 3.12Å; G388-L390 WeakPolarHBondContact O-CD2 3.47Å; G388-L390 PolarHBondContact O-N 2.8Å
389	K	85.4	Confident	86.7	Confident	127 Å²	127	69.6 Å²	69.6	55%	0.552	35%	0.35	S	S	*	.			trans	-59.9	124.4	-176.6	-70.9	-179.7	-174.8	178.6	0	110.9	C384 C387 F391	C384-K389 PolarHBondContact N-O 2.98Å; C387-K389 PolarHBondContact O-N 2.6Å; K389-F391 HydrophobicContact CB-CE2 3.74Å; K389-F391 HydrophobicContact CB-CZ 4.11Å; K389-F391 VanDerWaalsContact O-CD2 3.23Å; K389-F391 WeakPolarHBondContact O-CD2 3.44Å; K389-F391 WeakPolarHBondContact O-CE2 3.43Å
390	L	88.3	Confident	86.9	Confident	80 Å²	80	65.6 Å²	65.6	42%	0.419	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.9	-177.8	-55.2	-177.9	0	0	0	111.8	L301 R380 Y382 G388	L301-L390 HydrophobicContact CD2-CD2 4.22Å; R380-L390 HydrophobicContact CB-CB 3.49Å; R380-L390 VanDerWaalsContact CB-CB 3.49Å; R380-L390 WeakPolarHBondContact CD-O 3.45Å; R380-L390 HydrophobicContact CG-CB 4.4Å; Y382-L390 CarbonylContact O-C 3.58Å; G388-L390 WeakPolarHBondContact O-CD2 3.47Å; G388-L390 PolarHBondContact O-N 2.8Å
391	F	86.6	Confident	86.9	Confident	46 Å²	46	60.2 Å²	60.2	20%	0.202	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.3	-176.2	-61.8	-95.9	0	0	0	112.2	R380 Y382 C384 K389 H396 V397 H400	R380-F391 CarbonylContact C-O 3.28Å; R380-F391 VanDerWaalsContact C-O 3.28Å; R380-F391 WeakPolarHBondContact CA-O 3.37Å; Y382-F391 PolarHBondContact N-O 2.97Å; Y382-F391 PolarHBondContact O-N 3.2Å; C384-F391 HydrophobicContact CB-CE2 4.39Å; K389-F391 HydrophobicContact CB-CE2 3.74Å; K389-F391 HydrophobicContact CB-CZ 4.11Å; K389-F391 VanDerWaalsContact O-CD2 3.23Å; K389-F391 WeakPolarHBondContact O-CD2 3.44Å; K389-F391 WeakPolarHBondContact O-CE2 3.43Å; F391-H396 HydrophobicContact CB-CB 4.2Å; F391-H396 HydrophobicContact CD1-CB 3.79Å; F391-H396 HydrophobicContact CG-CB 4.28Å; F391-V397 HydrophobicContact CB-CG2 3.76Å; F391-V397 HydrophobicContact CD2-CG2 3.7Å; F391-V397 HydrophobicContact CG-CG2 3.97Å; F391-H400 HydrophobicContact CE1-CB 4.05Å; F391-H400 HydrophobicContact CE2-CB 4.07Å; F391-H400 AromaticContact CE2-CD2 3.44Å; F391-H400 VanDerWaalsContact CE2-CD2 3.44Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.44Å; F391-H400 AromaticContact CE2-CG 3.77Å; F391-H400 HydrophobicContact CZ-CB 3.55Å; F391-H400 AromaticContact CZ-CD2 3.5Å; F391-H400 VanDerWaalsContact CZ-CD2 3.5Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.49Å; F391-H400 AromaticContact CZ-CG 3.34Å; F391-H400 AromaticContact CZ-ND1 3.98Å
392	R	87.7	Confident	86.9	Confident	81 Å²	81	61 Å²	61	31%	0.306	31%	0.309	S	S	.	.	S	Bend	trans	-75.6	-21	-179.3	-62.4	-176.6	170.4	128	-9.1	114.4	R374 V375 R380	R374-R392 PolarHBondContact NH1-O 3.26Å; R374-R392 WeakPolarHBondContact O-CD 3.26Å; R374-R392 PolarHBondContact O-NE 3.49Å; V375-R392 PolarHBondContact O-NH2 2.84Å; R380-R392 HydrophobicContact CG-CG 4Å
393	Q	87.8	Confident	86.9	Confident	63 Å²	63	61.8 Å²	61.8	29%	0.294	32%	0.318	S	S	.	.	S	Bend	trans	-139	142.4	-175.6	-66.6	-176	-8.6	0	0	111	S395 H396	Q393-S395 VanDerWaalsContact C-N 3.34Å; Q393-S395 PolarHBondContact O-N 3.44Å; Q393-H396 WeakPolarHBondContact O-CB 3.4Å; Q393-H396 PolarHBondContact O-N 2.89Å
394	Q	87.9	Confident	86.9	Confident	105 Å²	105	65.5 Å²	65.5	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-60.5	-39.4	179.6	178.8	176.5	4.9	0	0	112.9	I304 Y382 H396 V397 V398	I304-Q394 HydrophobicContact CD1-CG 3.83Å; Y382-Q394 HydrophobicContact CD1-CB 4.24Å; Y382-Q394 HydrophobicContact CD2-CB 4.46Å; Y382-Q394 VanDerWaalsContact CD2-N 3.33Å; Y382-Q394 HydrophobicContact CE1-CB 4.12Å; Y382-Q394 HydrophobicContact CE2-CB 4.33Å; Y382-Q394 HydrophobicContact CG-CB 4.4Å; Q394-H396 PolarHBondContact O-N 3.26Å; Q394-V397 WeakPolarHBondContact O-CB 3.45Å; Q394-V397 PolarHBondContact O-N 2.78Å; Q394-V398 PolarHBondContact O-N 2.67Å; Q394-V398 VanDerWaalsContact O-N 3.09Å
395	S	87	Confident	86.7	Confident	70 Å²	70	68.6 Å²	68.6	49%	0.49	35%	0.352	S	S	.	.	H	α-helix	trans	-54.6	-36.9	175.2	51	0	0	0	0	112.9	Q393 Q399	Q393-S395 VanDerWaalsContact C-N 3.34Å; Q393-S395 PolarHBondContact O-N 3.44Å; S395-Q399 WeakPolarHBondContact O-CB 3.42Å; S395-Q399 PolarHBondContact O-N 2.95Å
396	H	88.4	Confident	86.7	Confident	80 Å²	80	64.4 Å²	64.4	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-72.5	-32.3	177.2	-60.9	163.6	0	0	0	112.2	F391 Q393 Q394 H400	F391-H396 HydrophobicContact CB-CB 4.2Å; F391-H396 HydrophobicContact CD1-CB 3.79Å; F391-H396 HydrophobicContact CG-CB 4.28Å; Q393-H396 WeakPolarHBondContact O-CB 3.4Å; Q393-H396 PolarHBondContact O-N 2.89Å; Q394-H396 PolarHBondContact O-N 3.26Å; H396-H400 WeakPolarHBondContact O-CB 3.16Å; H396-H400 PolarHBondContact O-N 3.42Å
397	V	88.9	Confident	86.7	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-45.9	172.2	-177.8	0	0	0	0	110.9	I304 Y382 F391 Q394 Q399 H400 L401	I304-V397 HydrophobicContact CD1-CB 4.32Å; I304-V397 HydrophobicContact CD1-CG1 4.23Å; Y382-V397 VanDerWaalsContact CB-CG2 3.42Å; Y382-V397 WeakPolarHBondContact O-CG2 3.49Å; F391-V397 HydrophobicContact CB-CG2 3.76Å; F391-V397 HydrophobicContact CD2-CG2 3.7Å; F391-V397 HydrophobicContact CG-CG2 3.97Å; Q394-V397 WeakPolarHBondContact O-CB 3.45Å; Q394-V397 PolarHBondContact O-N 2.78Å; V397-Q399 PolarHBondContact O-N 3.19Å; V397-H400 CarbonylContact O-C 3.52Å; V397-H400 PolarHBondContact O-N 2.94Å; V397-H400 VanDerWaalsContact O-N 3.14Å; V397-L401 HydrophobicContact CG1-CD1 4.04Å; V397-L401 PolarHBondContact O-N 3.38Å
398	V	87.4	Confident	86.6	Confident	67 Å²	67	65.6 Å²	65.6	41%	0.406	34%	0.342	S	S	.	.	H	α-helix	trans	-62.1	-44.5	177.3	178.1	0	0	0	0	111	Q394 H400 L401 R402	Q394-V398 PolarHBondContact O-N 2.67Å; Q394-V398 VanDerWaalsContact O-N 3.09Å; V398-H400 VanDerWaalsContact C-N 3.27Å; V398-H400 PolarHBondContact O-N 2.9Å; V398-L401 PolarHBondContact O-N 3.3Å; V398-R402 PolarHBondContact O-N 2.89Å
399	Q	86.9	Confident	86.6	Confident	72 Å²	72	64.6 Å²	64.6	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-34.7	174.9	-174.7	-178.3	62.6	0	0	112.5	S395 V397 Q421	S395-Q399 WeakPolarHBondContact O-CB 3.42Å; S395-Q399 PolarHBondContact O-N 2.95Å; V397-Q399 PolarHBondContact O-N 3.19Å; Q399-Q421 VanDerWaalsContact CD-NE2 3.35Å; Q399-Q421 HydrophobicContact CG-CG 4.02Å
400	H	89	Confident	86.6	Confident	24 Å²	24	60.9 Å²	60.9	11%	0.111	31%	0.311	C	S	.	.	H	α-helix	trans	-75.8	-33.2	175.7	169.5	57.7	0	0	0	112.9	C384 C387 F391 H396 V397 V398 R402 T403 H404	C384-H400 VanDerWaalsContact CB-CD2 3.49Å; C384-H400 WeakPolarHBondContact CB-CD2 3.32Å; C384-H400 PolarHBondContact SG-CD2 2.75Å; C384-H400 PolarHBondContact SG-NE2 3.28Å; C387-H400 PolarHBondContact SG-NE2 2.61Å; F391-H400 HydrophobicContact CE1-CB 4.05Å; F391-H400 HydrophobicContact CE2-CB 4.07Å; F391-H400 AromaticContact CE2-CD2 3.44Å; F391-H400 VanDerWaalsContact CE2-CD2 3.44Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.44Å; F391-H400 AromaticContact CE2-CG 3.77Å; F391-H400 HydrophobicContact CZ-CB 3.55Å; F391-H400 AromaticContact CZ-CD2 3.5Å; F391-H400 VanDerWaalsContact CZ-CD2 3.5Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.49Å; F391-H400 AromaticContact CZ-CG 3.34Å; F391-H400 AromaticContact CZ-ND1 3.98Å; H396-H400 WeakPolarHBondContact O-CB 3.16Å; H396-H400 PolarHBondContact O-N 3.42Å; V397-H400 CarbonylContact O-C 3.52Å; V397-H400 PolarHBondContact O-N 2.94Å; V397-H400 VanDerWaalsContact O-N 3.14Å; V398-H400 VanDerWaalsContact C-N 3.27Å; V398-H400 PolarHBondContact O-N 2.9Å; H400-R402 PolarHBondContact O-N 3.44Å; H400-T403 PolarHBondContact CE1-OG1 3.01Å; H400-T403 PolarHBondContact ND1-OG1 3.06Å; H400-T403 VanDerWaalsContact ND1-OG1 3.1Å; H400-T403 WeakPolarHBondContact O-CA 3.28Å; H400-T403 VanDerWaalsContact O-CB 3.28Å; H400-T403 WeakPolarHBondContact O-CB 3.25Å; H400-T403 PolarHBondContact O-N 2.96Å; H400-T403 PolarHBondContact O-OG1 3.26Å; H400-H404 AromaticContact CD2-NE2 3.73Å; H400-H404 AromaticContact CE1-CD2 3.91Å; H400-H404 AromaticContact CE1-NE2 3.09Å; H400-H404 PolarHBondContact CE1-NE2 2.86Å; H400-H404 AromaticContact NE2-CD2 3.73Å; H400-H404 AromaticContact NE2-NE2 2.6Å; H400-H404 PolarHBondContact NE2-NE2 3.31Å
401	L	87.6	Confident	86.4	Confident	21 Å²	21	64.5 Å²	64.5	11%	0.11	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-36.4	174.8	-114.1	67.3	0	0	0	111.8	P306 V397 V398 T403 H404 T405	P306-L401 HydrophobicContact CB-CD2 4.12Å; P306-L401 HydrophobicContact CG-CD2 4.34Å; V397-L401 HydrophobicContact CG1-CD1 4.04Å; V397-L401 PolarHBondContact O-N 3.38Å; V398-L401 PolarHBondContact O-N 3.3Å; L401-T403 PolarHBondContact O-N 3.42Å; L401-H404 WeakPolarHBondContact O-CA 3.3Å; L401-H404 WeakPolarHBondContact O-CB 3.37Å; L401-H404 PolarHBondContact O-N 3.18Å; L401-T405 PolarHBondContact O-N 3.27Å; L401-T405 PolarHBondContact O-OG1 3.4Å
402	R	87.2	Confident	86.4	Confident	64 Å²	64	62.4 Å²	62.4	24%	0.242	31%	0.314	C	S	.	.	H	α-helix	trans	-59.7	-15.3	170.9	-60.8	177.6	-178.1	-174.5	-3.3	114.4	V398 H400 G406 H410 R420	V398-R402 PolarHBondContact O-N 2.89Å; H400-R402 PolarHBondContact O-N 3.44Å; R402-G406 PolarHBondContact O-N 3.26Å; R402-H410 PolarHBondContact NH1-NE2 3.43Å; R402-R420 PolarHBondContact NH1-O 3.15Å; R402-R420 VanDerWaalsContact NH1-O 3.14Å; R402-R420 WeakPolarHBondContact O-CD 3.29Å; R402-R420 PolarHBondContact O-NE 3.09Å; R402-R420 VanDerWaalsContact O-NE 3.12Å
403	T	87	Confident	86.2	Confident	57 Å²	57	67 Å²	67	35%	0.35	33%	0.333	S	S	.	.	H	α-helix	trans	-79.4	-26.8	172.6	71.1	0	0	0	0	112.8	H400 L401 R420	H400-T403 PolarHBondContact CE1-OG1 3.01Å; H400-T403 PolarHBondContact ND1-OG1 3.06Å; H400-T403 VanDerWaalsContact ND1-OG1 3.1Å; H400-T403 WeakPolarHBondContact O-CA 3.28Å; H400-T403 VanDerWaalsContact O-CB 3.28Å; H400-T403 WeakPolarHBondContact O-CB 3.25Å; H400-T403 PolarHBondContact O-N 2.96Å; H400-T403 PolarHBondContact O-OG1 3.26Å; L401-T403 PolarHBondContact O-N 3.42Å; T403-R420 PolarHBondContact O-NH2 3.14Å; T403-R420 VanDerWaalsContact O-NH2 3.14Å
404	H	85.7	Confident	85.8	Confident	88 Å²	88	66.6 Å²	66.6	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-85.5	-50.5	173.6	-68	-72.7	0	0	0	111.9	C384 L386 C387 H400 L401 G406	C384-H404 PolarHBondContact SG-NE2 3.38Å; L386-H404 HydrophobicContact CD1-CB 3.48Å; L386-H404 VanDerWaalsContact CD1-CB 3.48Å; C387-H404 WeakPolarHBondContact CB-CE1 3.26Å; C387-H404 WeakPolarHBondContact CB-NE2 3.42Å; C387-H404 PolarHBondContact SG-CE1 3Å; C387-H404 PolarHBondContact SG-NE2 3.25Å; H400-H404 AromaticContact CD2-NE2 3.73Å; H400-H404 AromaticContact CE1-CD2 3.91Å; H400-H404 AromaticContact CE1-NE2 3.09Å; H400-H404 PolarHBondContact CE1-NE2 2.86Å; H400-H404 AromaticContact NE2-CD2 3.73Å; H400-H404 AromaticContact NE2-NE2 2.6Å; H400-H404 PolarHBondContact NE2-NE2 3.31Å; L401-H404 WeakPolarHBondContact O-CA 3.3Å; L401-H404 WeakPolarHBondContact O-CB 3.37Å; L401-H404 PolarHBondContact O-N 3.18Å; H404-G406 PolarHBondContact O-N 3.31Å; H404-G406 VanDerWaalsContact O-N 3.15Å
405	T	84.1	Confident	85.6	Confident	69 Å²	69	63.7 Å²	63.7	42%	0.423	32%	0.321	S	S	.	.	S	Bend	trans	-70.1	-9.8	-179.1	61.7	0	0	0	0	113.8	L401 E407	L401-T405 PolarHBondContact O-N 3.27Å; L401-T405 PolarHBondContact O-OG1 3.4Å; T405-E407 PolarHBondContact O-N 2.89Å; T405-E407 VanDerWaalsContact O-N 3.07Å; T405-E407 WeakPolarHBondContact OG1-CG 3.21Å
406	G	82.3	Confident	85.5	Confident	33 Å²	33	63 Å²	63	34%	0.34	33%	0.326	S	S	.	.			trans	74.5	-11.3	-177	0	0	0	0	0	114.9	R402 H404 K408	R402-G406 PolarHBondContact O-N 3.26Å; H404-G406 PolarHBondContact O-N 3.31Å; H404-G406 VanDerWaalsContact O-N 3.15Å; G406-K408 PolarHBondContact O-N 3.12Å
407	E	83	Confident	85.2	Confident	64 Å²	64	65.3 Å²	65.3	30%	0.299	33%	0.334	S	S	.	.			trans	-52.4	126.4	-173.7	-74.9	176.4	-169.7	0	0	113.9	T405 P409 R420	T405-E407 PolarHBondContact O-N 2.89Å; T405-E407 VanDerWaalsContact O-N 3.07Å; T405-E407 WeakPolarHBondContact OG1-CG 3.21Å; E407-P409 VanDerWaalsContact C-CD 3.48Å; E407-P409 WeakPolarHBondContact O-CD 3.48Å; E407-R420 WeakPolarHBondContact O-CG 3.44Å
408	K	85.1	Confident	85.1	Confident	112 Å²	112	66.9 Å²	66.9	49%	0.487	35%	0.347	S	S	.	.			trans	-121.9	71.2	179.2	-71.7	161	177.1	179.6	0	110.4	G406 H410 A418 F419 R420	G406-K408 PolarHBondContact O-N 3.12Å; K408-H410 PolarHBondContact O-N 3.01Å; K408-H410 VanDerWaalsContact O-N 3.13Å; K408-A418 HydrophobicContact CB-CB 3.57Å; K408-A418 HydrophobicContact CD-CB 4.1Å; K408-A418 WeakPolarHBondContact CD-O 3.2Å; K408-A418 HydrophobicContact CG-CB 4.39Å; K408-F419 CarbonylContact C-O 3.34Å; K408-F419 WeakPolarHBondContact CA-O 3.38Å; K408-R420 HydrophobicContact CG-CG 3.9Å
409	P	85.4	Confident	84.9	Confident	32 Å²	32	65.7 Å²	65.7	21%	0.208	34%	0.337	C	S	.	.			trans	-67.6	-13.1	-172.7	26.5	-34.9	0	0	0	114.3	N311 E407	N311-P409 WeakPolarHBondContact OD1-CB 3.45Å; E407-P409 VanDerWaalsContact C-CD 3.48Å; E407-P409 WeakPolarHBondContact O-CD 3.48Å
410	H	84.9	Confident	84.9	Confident	49 Å²	49	66.6 Å²	66.6	23%	0.227	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	88.7	-176.1	-56	-56.3	0	0	0	111	R402 K408 F419 K422 L425	R402-H410 PolarHBondContact NH1-NE2 3.43Å; K408-H410 PolarHBondContact O-N 3.01Å; K408-H410 VanDerWaalsContact O-N 3.13Å; H410-F419 HydrophobicContact CB-CB 4.43Å; H410-F419 WeakPolarHBondContact CB-O 3.27Å; H410-F419 PolarHBondContact N-O 3Å; H410-F419 VanDerWaalsContact N-O 3.13Å; H410-F419 PolarHBondContact O-N 2.86Å; H410-K422 PolarHBondContact CD2-N 3.49Å; H410-L425 HydrophobicContact CB-CB 4.13Å; H410-L425 HydrophobicContact CB-CD2 3.88Å
411	K	84.2	Confident	84.7	Confident	157 Å²	157	68.7 Å²	68.7	68%	0.683	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	141.9	175.5	-62.5	-178.9	-178.1	176.2	0	111.5	A418	K411-A418 HydrophobicContact CG-CB 3.92Å
412	C	87	Confident	84.7	Confident	1 Å²	1	74 Å²	74	1%	0.007	37%	0.369	C	S	.	.			trans	-83.9	115.5	169.6	-171.3	0	0	0	0	109.9	Q414 C415 G416 K417 F419 L425 C433	C412-Q414 PolarHBondContact O-N 2.73Å; C412-C415 PolarHBondContact O-N 2.95Å; C412-G416 WeakPolarHBondContact O-CA 3.43Å; C412-G416 PolarHBondContact O-N 3.44Å; C412-K417 PolarHBondContact N-O 3.27Å; C412-F419 HydrophobicContact CB-CE2 4.4Å; C412-L425 VanDerWaalsContact CA-CD1 3.47Å; C412-L425 HydrophobicContact CB-CD1 3.49Å; C412-L425 VanDerWaalsContact CB-CD1 3.49Å; C412-C433 VanDerWaalsContact SG-SG 3.66Å
413	Y	82.7	Confident	84.7	Confident	179 Å²	179	78.2 Å²	78.2	70%	0.702	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-33	-179.8	70.9	-90.9	0	0	0	113
414	Q	79.9	Confident	84.7	Confident	53 Å²	53	77.5 Å²	77.5	25%	0.248	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-27.6	-177.6	-67.2	-178.3	-8.3	0	0	114	C412 C433 N435	C412-Q414 PolarHBondContact O-N 2.73Å; Q414-C433 WeakPolarHBondContact CB-SG 3.34Å; Q414-C433 PolarHBondContact OE1-SG 3.18Å; Q414-N435 PolarHBondContact O-ND2 2.86Å
415	C	84.6	Confident	84.8	Confident	44 Å²	44	74.2 Å²	74.2	30%	0.297	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.1	8.3	-170.9	75.8	0	0	0	0	115.2	C412 K417 H428	C412-C415 PolarHBondContact O-N 2.95Å; C415-K417 PolarHBondContact O-N 3.35Å; C415-H428 PolarHBondContact SG-NE2 3.4Å
416	G	83.5	Confident	84.9	Confident	56 Å²	56	73.8 Å²	73.8	58%	0.577	36%	0.363	S	S	*	.			trans	70	-16.6	-179	0	0	0	0	0	116.4	C412 A418	C412-G416 WeakPolarHBondContact O-CA 3.43Å; C412-G416 PolarHBondContact O-N 3.44Å; G416-A418 PolarHBondContact O-N 3.01Å
417	K	83.5	Confident	85.2	Confident	128 Å²	128	73.2 Å²	73.2	56%	0.557	35%	0.354	S	S	*	.			trans	-60.3	125.4	-173	-68	-178.2	-178.9	179.9	0	112	C412 C415 F419	C412-K417 PolarHBondContact N-O 3.27Å; C415-K417 PolarHBondContact O-N 3.35Å; K417-F419 HydrophobicContact CB-CE2 3.87Å; K417-F419 HydrophobicContact CB-CZ 3.99Å; K417-F419 WeakPolarHBondContact O-CD2 3.5Å; K417-F419 VanDerWaalsContact O-CE2 3.26Å; K417-F419 WeakPolarHBondContact O-CE2 2.99Å
418	A	86.5	Confident	85.4	Confident	34 Å²	34	71 Å²	71	28%	0.281	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.3	-175.5	0	0	0	0	0	112.2	K408 K411 G416	K408-A418 HydrophobicContact CB-CB 3.57Å; K408-A418 HydrophobicContact CD-CB 4.1Å; K408-A418 WeakPolarHBondContact CD-O 3.2Å; K408-A418 HydrophobicContact CG-CB 4.39Å; K411-A418 HydrophobicContact CG-CB 3.92Å; G416-A418 PolarHBondContact O-N 3.01Å
419	F	84.1	Confident	85.3	Confident	43 Å²	43	68.8 Å²	68.8	19%	0.189	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	144.7	-175.5	-60.4	-85.5	0	0	0	112.4	K408 H410 C412 K417 Q421 L425 H428	K408-F419 CarbonylContact C-O 3.34Å; K408-F419 WeakPolarHBondContact CA-O 3.38Å; H410-F419 HydrophobicContact CB-CB 4.43Å; H410-F419 WeakPolarHBondContact CB-O 3.27Å; H410-F419 PolarHBondContact N-O 3Å; H410-F419 VanDerWaalsContact N-O 3.13Å; H410-F419 PolarHBondContact O-N 2.86Å; C412-F419 HydrophobicContact CB-CE2 4.4Å; K417-F419 HydrophobicContact CB-CE2 3.87Å; K417-F419 HydrophobicContact CB-CZ 3.99Å; K417-F419 WeakPolarHBondContact O-CD2 3.5Å; K417-F419 VanDerWaalsContact O-CE2 3.26Å; K417-F419 WeakPolarHBondContact O-CE2 2.99Å; F419-Q421 VanDerWaalsContact C-N 3.32Å; F419-L425 HydrophobicContact CB-CB 4.36Å; F419-L425 HydrophobicContact CD2-CB 3.93Å; F419-L425 HydrophobicContact CD2-CD1 3.97Å; F419-L425 HydrophobicContact CE2-CD1 4.16Å; F419-L425 HydrophobicContact CG-CB 4.35Å; F419-H428 HydrophobicContact CE1-CB 4.08Å; F419-H428 HydrophobicContact CE2-CB 3.87Å; F419-H428 AromaticContact CE2-CD2 3.68Å; F419-H428 AromaticContact CE2-CG 3.71Å; F419-H428 HydrophobicContact CZ-CB 3.45Å; F419-H428 VanDerWaalsContact CZ-CB 3.45Å; F419-H428 AromaticContact CZ-CD2 3.79Å; F419-H428 AromaticContact CZ-CG 3.35Å; F419-H428 AromaticContact CZ-ND1 3.87Å
420	R	85.8	Confident	85.2	Confident	91 Å²	91	77.2 Å²	77.2	34%	0.343	36%	0.363	S	S	.	.	S	Bend	trans	-70.6	-26.2	176.3	-62.9	-177.2	169.5	161.8	-9.1	113.1	R402 T403 E407 K408	R402-R420 PolarHBondContact NH1-O 3.15Å; R402-R420 VanDerWaalsContact NH1-O 3.14Å; R402-R420 WeakPolarHBondContact O-CD 3.29Å; R402-R420 PolarHBondContact O-NE 3.09Å; R402-R420 VanDerWaalsContact O-NE 3.12Å; T403-R420 PolarHBondContact O-NH2 3.14Å; T403-R420 VanDerWaalsContact O-NH2 3.14Å; E407-R420 WeakPolarHBondContact O-CG 3.44Å; K408-R420 HydrophobicContact CG-CG 3.9Å
421	Q	85.7	Confident	84.7	Confident	67 Å²	67	82.9 Å²	82.9	31%	0.313	38%	0.382	S	S	.	.	S	Bend	trans	-129.8	140.4	-174.5	-52.5	-173.8	1.9	0	0	112.1	Q399 F419 Y423 S424 L425	Q399-Q421 VanDerWaalsContact CD-NE2 3.35Å; Q399-Q421 HydrophobicContact CG-CG 4.02Å; F419-Q421 VanDerWaalsContact C-N 3.32Å; Q421-Y423 VanDerWaalsContact C-N 3.32Å; Q421-Y423 PolarHBondContact O-N 3.02Å; Q421-S424 WeakPolarHBondContact O-CB 3.41Å; Q421-S424 PolarHBondContact O-N 2.92Å; Q421-L425 PolarHBondContact O-N 3.46Å
422	K	86.8	Confident	84	Confident	132 Å²	132	81.8 Å²	81.8	57%	0.574	38%	0.381	S	S	*	.	H	α-helix	trans	-61.6	-35.9	179.3	-172.7	172.8	-177.4	171.3	0	113.2	H410 S424 L425 I426	H410-K422 PolarHBondContact CD2-N 3.49Å; K422-S424 PolarHBondContact O-N 3.46Å; K422-L425 PolarHBondContact O-N 2.7Å; K422-I426 HydrophobicContact CG-CD1 4.05Å; K422-I426 WeakPolarHBondContact O-CG1 3.34Å; K422-I426 PolarHBondContact O-N 2.72Å
423	Y	86.4	Confident	82.9	Confident	154 Å²	154	82.7 Å²	82.7	60%	0.604	39%	0.387	S	S	*	.	H	α-helix	trans	-62.3	-41.2	175.3	169.6	-103.6	0	0	0	112.3	Q421 L425 I426 S427	Q421-Y423 VanDerWaalsContact C-N 3.32Å; Q421-Y423 PolarHBondContact O-N 3.02Å; Y423-L425 VanDerWaalsContact C-N 3.33Å; Y423-L425 PolarHBondContact O-N 3.27Å; Y423-I426 PolarHBondContact O-N 3.25Å; Y423-S427 WeakPolarHBondContact O-CB 3.45Å; Y423-S427 PolarHBondContact O-N 3.48Å
424	S	87.1	Confident	81.7	Confident	41 Å²	41	85.2 Å²	85.2	29%	0.287	40%	0.395	S	S	.	.	H	α-helix	trans	-62.2	-40.7	176.8	-51.1	0	0	0	0	111.6	Q421 K422 H428	Q421-S424 WeakPolarHBondContact O-CB 3.41Å; Q421-S424 PolarHBondContact O-N 2.92Å; K422-S424 PolarHBondContact O-N 3.46Å; S424-H428 VanDerWaalsContact O-CB 3.24Å; S424-H428 WeakPolarHBondContact O-CB 3.28Å; S424-H428 PolarHBondContact O-N 3.21Å
425	L	88.9	Confident	80.5	Confident	20 Å²	20	86.5 Å²	86.5	11%	0.105	40%	0.404	C	S	.	.	H	α-helix	trans	-60.7	-49.8	172.8	171	60.5	0	0	0	111.7	H410 C412 F419 Q421 K422 Y423 S427 H428 Q429	H410-L425 HydrophobicContact CB-CB 4.13Å; H410-L425 HydrophobicContact CB-CD2 3.88Å; C412-L425 VanDerWaalsContact CA-CD1 3.47Å; C412-L425 HydrophobicContact CB-CD1 3.49Å; C412-L425 VanDerWaalsContact CB-CD1 3.49Å; F419-L425 HydrophobicContact CB-CB 4.36Å; F419-L425 HydrophobicContact CD2-CB 3.93Å; F419-L425 HydrophobicContact CD2-CD1 3.97Å; F419-L425 HydrophobicContact CE2-CD1 4.16Å; F419-L425 HydrophobicContact CG-CB 4.35Å; Q421-L425 PolarHBondContact O-N 3.46Å; K422-L425 PolarHBondContact O-N 2.7Å; Y423-L425 VanDerWaalsContact C-N 3.33Å; Y423-L425 PolarHBondContact O-N 3.27Å; L425-S427 PolarHBondContact O-N 3.16Å; L425-H428 WeakPolarHBondContact O-CB 3.43Å; L425-H428 PolarHBondContact O-N 3.34Å; L425-H428 VanDerWaalsContact O-N 3.16Å; L425-Q429 HydrophobicContact CD1-CG 4.03Å; L425-Q429 WeakPolarHBondContact O-CG 3.4Å; L425-Q429 PolarHBondContact O-N 3.33Å
426	I	86.6	Confident	78.9	Confident	59 Å²	59	96.5 Å²	96.5	30%	0.303	44%	0.436	S	S	.	.	H	α-helix	trans	-62.8	-42.3	180	-65.9	165.5	0	0	0	111	K422 Y423 H428 Q429 R430	K422-I426 HydrophobicContact CG-CD1 4.05Å; K422-I426 WeakPolarHBondContact O-CG1 3.34Å; K422-I426 PolarHBondContact O-N 2.72Å; Y423-I426 PolarHBondContact O-N 3.25Å; I426-H428 VanDerWaalsContact C-N 3.31Å; I426-H428 PolarHBondContact O-N 3.13Å; I426-Q429 PolarHBondContact O-N 3.49Å; I426-R430 HydrophobicContact CG2-CG 4.48Å; I426-R430 WeakPolarHBondContact O-CB 3.49Å; I426-R430 VanDerWaalsContact O-CG 3.31Å; I426-R430 WeakPolarHBondContact O-CG 3.37Å; I426-R430 PolarHBondContact O-N 2.66Å
427	S	87.3	Confident	77.2	Confident	22 Å²	22	98 Å²	98	15%	0.154	44%	0.437	C	S	.	.	H	α-helix	trans	-66.1	-34	176.2	-176.6	0	0	0	0	112.2	Y423 L425 R431	Y423-S427 WeakPolarHBondContact O-CB 3.45Å; Y423-S427 PolarHBondContact O-N 3.48Å; L425-S427 PolarHBondContact O-N 3.16Å; S427-R431 WeakPolarHBondContact O-CB 3.01Å; S427-R431 PolarHBondContact O-N 3.15Å; S427-R431 PolarHBondContact OG-NH1 3.28Å; S427-R431 VanDerWaalsContact OG-NH1 3.09Å
428	H	86.7	Confident	75.6	Confident	18 Å²	18	97 Å²	97	8%	0.083	45%	0.453	C	S	.	.	H	α-helix	trans	-67.6	-49.6	173.8	166	70.5	0	0	0	110.8	C415 F419 S424 L425 I426 R430 R431 M432 C433	C415-H428 PolarHBondContact SG-NE2 3.4Å; F419-H428 HydrophobicContact CE1-CB 4.08Å; F419-H428 HydrophobicContact CE2-CB 3.87Å; F419-H428 AromaticContact CE2-CD2 3.68Å; F419-H428 AromaticContact CE2-CG 3.71Å; F419-H428 HydrophobicContact CZ-CB 3.45Å; F419-H428 VanDerWaalsContact CZ-CB 3.45Å; F419-H428 AromaticContact CZ-CD2 3.79Å; F419-H428 AromaticContact CZ-CG 3.35Å; F419-H428 AromaticContact CZ-ND1 3.87Å; S424-H428 VanDerWaalsContact O-CB 3.24Å; S424-H428 WeakPolarHBondContact O-CB 3.28Å; S424-H428 PolarHBondContact O-N 3.21Å; L425-H428 WeakPolarHBondContact O-CB 3.43Å; L425-H428 PolarHBondContact O-N 3.34Å; L425-H428 VanDerWaalsContact O-N 3.16Å; I426-H428 VanDerWaalsContact C-N 3.31Å; I426-H428 PolarHBondContact O-N 3.13Å; H428-R430 VanDerWaalsContact C-N 3.3Å; H428-R430 PolarHBondContact O-N 3.48Å; H428-R431 PolarHBondContact O-N 3.19Å; H428-M432 PolarHBondContact CE1-O 3.42Å; H428-M432 CarbonylContact O-C 3.25Å; H428-M432 WeakPolarHBondContact O-CA 3.44Å; H428-M432 PolarHBondContact O-N 3.4Å; H428-C433 PolarHBondContact O-N 3.17Å
429	Q	85	Confident	73.7	Confident	64 Å²	64	98.5 Å²	98.5	30%	0.299	46%	0.461	S	S	.	.	H	α-helix	trans	-55.3	-43.2	175.4	-75.3	173.2	-35.8	0	0	112.1	L425 I426	L425-Q429 HydrophobicContact CD1-CG 4.03Å; L425-Q429 WeakPolarHBondContact O-CG 3.4Å; L425-Q429 PolarHBondContact O-N 3.33Å; I426-Q429 PolarHBondContact O-N 3.49Å
430	R	82.5	Confident	71.7	Confident	209 Å²	209	102.2 Å²	102.2	79%	0.789	48%	0.483	S	S	*	.	H	α-helix	trans	-71	-27.7	-179.6	-74.8	178	178.9	-172.2	-1.3	115.7	I426 H428	I426-R430 HydrophobicContact CG2-CG 4.48Å; I426-R430 WeakPolarHBondContact O-CB 3.49Å; I426-R430 VanDerWaalsContact O-CG 3.31Å; I426-R430 WeakPolarHBondContact O-CG 3.37Å; I426-R430 PolarHBondContact O-N 2.66Å; H428-R430 VanDerWaalsContact C-N 3.3Å; H428-R430 PolarHBondContact O-N 3.48Å
431	R	75.1	Confident	69.8	Low	169 Å²	169	103.2 Å²	103.2	64%	0.638	50%	0.501	S	S	*	.	H	α-helix	trans	-122.1	-31.6	-169	-63.2	-172.3	-171.3	136.4	2.6	115.2	S427 H428	S427-R431 WeakPolarHBondContact O-CB 3.01Å; S427-R431 PolarHBondContact O-N 3.15Å; S427-R431 PolarHBondContact OG-NH1 3.28Å; S427-R431 VanDerWaalsContact OG-NH1 3.09Å; H428-R431 PolarHBondContact O-N 3.19Å
432	M	68.7	Low	68	Low	134 Å²	134	107.2 Å²	107.2	66%	0.66	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	0.8	-159.3	-65.2	-64.7	146.3	0	0	113.2	H428 R434	H428-M432 PolarHBondContact CE1-O 3.42Å; H428-M432 CarbonylContact O-C 3.25Å; H428-M432 WeakPolarHBondContact O-CA 3.44Å; H428-M432 PolarHBondContact O-N 3.4Å; M432-R434 VanDerWaalsContact C-N 3.32Å; M432-R434 PolarHBondContact O-N 3.33Å
433	C	63.8	Low	66.1	Low	19 Å²	19	105.1 Å²	105.1	13%	0.128	53%	0.53	C	S	.	.			trans	-92	70.7	173.6	-149.9	0	0	0	0	110.1	C412 Q414 H428 N435	C412-C433 VanDerWaalsContact SG-SG 3.66Å; Q414-C433 WeakPolarHBondContact CB-SG 3.34Å; Q414-C433 PolarHBondContact OE1-SG 3.18Å; H428-C433 PolarHBondContact O-N 3.17Å; C433-N435 VanDerWaalsContact C-N 3.3Å; C433-N435 PolarHBondContact O-N 3.03Å; C433-N435 VanDerWaalsContact O-N 3.11Å
434	R	57.9	Low	63.9	Low	232 Å²	232	101.7 Å²	101.7	88%	0.875	53%	0.534	S	S	*	.			trans	-81	76	172.4	-104.5	-174.2	173.2	-179.2	-2.3	109.9	M432	M432-R434 VanDerWaalsContact C-N 3.32Å; M432-R434 PolarHBondContact O-N 3.33Å
435	N	54.5	Low	61.4	Low	81 Å²	81	103 Å²	103	43%	0.433	55%	0.554	S	S	.	*			trans	-110.3	90.5	155.3	-85.5	2.7	0	0	0	107.8	Q414 C433 S437	Q414-N435 PolarHBondContact O-ND2 2.86Å; C433-N435 VanDerWaalsContact C-N 3.3Å; C433-N435 PolarHBondContact O-N 3.03Å; C433-N435 VanDerWaalsContact O-N 3.11Å; N435-S437 PolarHBondContact O-N 3.29Å
436	R	50.8	Low	58.8	Low	254 Å²	254	111.3 Å²	111.3	96%	0.958	60%	0.595	S	S	*	*			trans	-80.8	5.7	169.2	-100.4	-170.4	-179.3	-168.8	-0.1	112.5
437	S	48.4	Very low	56.5	Low	86 Å²	86	114 Å²	114	60%	0.601	61%	0.614	S	S	*	*	S	Bend	trans	-134.1	147.1	179.5	40	0	0	0	0	109.1	N435	N435-S437 PolarHBondContact O-N 3.29Å
438	A	50	Low	53.8	Low	108 Å²	108	120.6 Å²	120.6	89%	0.893	65%	0.645	S	S	*	*	S	Bend	trans	77.8	8.9	169.3	0	0	0	0	0	121.2
439	S	45.7	Very low	51.3	Low	65 Å²	65	131.9 Å²	131.9	46%	0.455	69%	0.687	S	S	.	*			trans	-153.7	73.6	164.3	67.7	0	0	0	0	114.7
440	N	41.2	Very low	49.2	Very low	122 Å²	122	136.3 Å²	136.3	65%	0.652	71%	0.711	S	S	*	*			trans	-122.8	77.6	161.3	-159.3	17.8	0	0	0	109	I442	N440-I442 PolarHBondContact O-N 3.48Å
441	P	46.2	Very low	46.8	Very low	111 Å²	111	131.8 Å²	131.8	72%	0.721	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	14.2	-170.9	33.3	-37.5	0	0	0	113.9
442	I	49.4	Very low	44.9	Very low	152 Å²	152	129.4 Å²	129.4	78%	0.779	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-10.8	-173.5	-58.1	169.4	0	0	0	110.9	N440	N440-I442 PolarHBondContact O-N 3.48Å
443	A	45.3	Very low	43.4	Very low	87 Å²	87	125.8 Å²	125.8	72%	0.719	71%	0.714	S	S	*	*	S	Bend	trans	-112.6	1.6	-176.6	0	0	0	0	0	114.6
444	A	40.4	Very low	42.3	Very low	83 Å²	83	131.8 Å²	131.8	69%	0.686	75%	0.75	S	S	*	*	S	Bend	trans	-140.6	122.6	175.2	0	0	0	0	0	108.9
445	G	35.3	Very low	41.1	Very low	69 Å²	69	129 Å²	129	71%	0.711	75%	0.752	S	S	*	*			trans	106.8	16.4	173.2	0	0	0	0	0	117.3	T447	G445-T447 PolarHBondContact O-N 3.44Å
446	M	34.8	Very low	40.3	Very low	193 Å²	193	128 Å²	128	95%	0.951	76%	0.761	S	S	*	*	S	Bend	trans	-71.3	27.5	163.4	-157	81.6	176.4	0	0	112.1
447	T	37.5	Very low	39.5	Very low	116 Å²	116	123.2 Å²	123.2	71%	0.712	76%	0.755	S	S	*	*	S	Bend	trans	-160.3	134	-179.1	-15.1	0	0	0	0	110.1	G445	G445-T447 PolarHBondContact O-N 3.44Å
448	M	30.6	Very low	39.1	Very low	161 Å²	161	125.7 Å²	125.7	79%	0.793	77%	0.767	S	S	*	*			trans	64.3	80.4	160.9	-48.5	-156	-54.8	0	0	120
449	W	33.7	Very low	38.5	Very low	255 Å²	255	123.7 Å²	123.7	97%	0.966	76%	0.756	S	S	*	*			trans	-130.7	73.3	131	-83.9	73	0	0	0	108.6
450	I	41.1	Very low	38.1	Very low	157 Å²	157	125.6 Å²	125.6	81%	0.805	76%	0.761	S	S	*	*			trans	-80.7	140.4	153	-66.6	172.3	0	0	0	105.7
451	S	32.1	Very low	37.8	Very low	114 Å²	114	125.2 Å²	125.2	80%	0.797	76%	0.759	S	S	*	*			trans	-49.6	140.7	-171.9	-45.9	0	0	0	0	114.2
452	P	35.8	Very low	37.5	Very low	119 Å²	119	126.9 Å²	126.9	77%	0.773	76%	0.76	S	S	*	*				-130.6	155.2	115	37.5	-30.5	0	0	0	111.4
453	G	36.9	Very low	37	Very low	57 Å²	57	129.6 Å²	129.6	59%	0.588	77%	0.766	S	S	*	*			cis	-174.5	169.9	-2.9	0	0	0	0	0	111.7	D455	G453-D455 PolarHBondContact O-N 3.07Å
454	V	41.5	Very low	36.5	Very low	145 Å²	145	132.8 Å²	132.8	88%	0.879	77%	0.766	S	S	*	*			trans	22.1	93.1	140.5	-71.6	0	0	0	0	117.3	G456	V454-G456 PolarHBondContact O-N 3.28Å
455	D	31.6	Very low	36.1	Very low	173 Å²	173	137.7 Å²	137.7	93%	0.925	77%	0.772	S	S	*	*			trans	-65.5	121	140.6	-64.1	-56.2	0	0	0	107.6	G453	G453-D455 PolarHBondContact O-N 3.07Å
456	G	37.1	Very low	36.1	Very low	60 Å²	60	139.3 Å²	139.3	62%	0.619	77%	0.773	S	S	*	*			trans	168.7	96.3	-178.9	0	0	0	0	0	112.8	V454	V454-G456 PolarHBondContact O-N 3.28Å
457	D	35.1	Very low	36.2	Very low	155 Å²	155	136.2 Å²	136.2	83%	0.829	77%	0.767	S	S	*	*			trans	49.6	116.2	158	-50	-36	0	0	0	117.2
458	T	40.1	Very low	36.1	Very low	138 Å²	138	138 Å²	138	85%	0.847	77%	0.772	S	S	*	*				-169.9	131.4	65.6	43.5	0	0	0	0	113.6
459	G	36.8	Very low	36.7	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	78%	0.777	S	S	*	*			trans	50	114	133.4	0	0	0	0	0	123.3
460	N	38	Very low	36.7	Very low	105 Å²	105	130.9 Å²	130.9	56%	0.561	76%	0.76	S	S	*	*			trans	68.8	150.2	148.5	-57.8	-51.4	0	0	0	118	L481	N460-L481 WeakPolarHBondContact ND2-CD2 3.05Å
461	L	35.2	Very low	36.3	Very low	115 Å²	115	130.9 Å²	130.9	60%	0.602	76%	0.762	S	S	*	*			cis	-149	137.7	11.3	-144	151.7	0	0	0	109.9
462	I	38.8	Very low	36.5	Very low	146 Å²	146	130.6 Å²	130.6	75%	0.749	76%	0.76	S	S	*	*			trans	-73.6	131	175.6	-64.8	163	0	0	0	110.4
463	K	38.5	Very low	36.5	Very low	208 Å²	208	130 Å²	130	90%	0.904	76%	0.758	S	S	*	*			trans	-160.7	148.4	134	-111.8	166.8	-173.7	179.1	0	112.8
464	E	35.2	Very low	36.5	Very low	155 Å²	155	134.9 Å²	134.9	72%	0.724	77%	0.77	S	S	*	*			trans	-85.9	-179.7	-164.6	-59.8	178.6	119.4	0	0	114.5
465	F	32.8	Very low	36.2	Very low	185 Å²	185	132 Å²	132	81%	0.811	76%	0.761	S	S	*	*			trans	98.2	129.4	159.4	-70.2	-78.2	0	0	0	120.1
466	S	34.3	Very low	36.5	Very low	103 Å²	103	129.7 Å²	129.7	72%	0.72	76%	0.759	S	S	*	*			trans	-65.4	150.1	-172.8	-43.1	0	0	0	0	114.8	N468	S466-N468 PolarHBondContact O-N 3.11Å
467	P	37	Very low	36.8	Very low	129 Å²	129	132.1 Å²	132.1	84%	0.838	76%	0.763	S	S	*	*			trans	-86.5	90.9	154.2	33.4	-28.1	0	0	0	109.8
468	N	37	Very low	36.8	Very low	153 Å²	153	132.2 Å²	132.2	82%	0.818	76%	0.764	S	S	*	*			trans	-68.4	141.9	153.4	-165.5	5.9	0	0	0	108	S466 G470	S466-N468 PolarHBondContact O-N 3.11Å; N468-G470 PolarHBondContact O-N 3.04Å
469	K	41.3	Very low	36.6	Very low	207 Å²	207	129.6 Å²	129.6	90%	0.9	76%	0.756	S	S	*	*	S	Bend	trans	-74.1	110.1	-179.4	-76.6	-179.8	175.1	178.5	0	109.9
470	G	33.8	Very low	36.6	Very low	59 Å²	59	130.4 Å²	130.4	61%	0.608	75%	0.752	S	S	*	*			trans	168.6	82.1	172.7	0	0	0	0	0	116.4	N468	N468-G470 PolarHBondContact O-N 3.04Å
471	N	34.4	Very low	36.4	Very low	158 Å²	158	130.9 Å²	130.9	85%	0.845	75%	0.754	S	S	*	*			trans	76.2	124.9	146.8	-52.6	-7.5	0	0	0	121
472	S	36.1	Very low	36.4	Very low	107 Å²	107	130.9 Å²	130.9	75%	0.748	76%	0.763	S	S	*	*			trans	66.9	103.3	146.2	47.2	0	0	0	0	122.3
473	S	35.1	Very low	36.3	Very low	106 Å²	106	129.7 Å²	129.7	74%	0.741	76%	0.763	S	S	*	*				95.4	109.9	117.2	-60.3	0	0	0	0	122.7
474	I	35.9	Very low	36.6	Very low	161 Å²	161	124.8 Å²	124.8	83%	0.826	75%	0.752	S	S	*	*			trans	95.1	108.4	134.3	-60.2	164.3	0	0	0	120.7
475	A	35.9	Very low	36.8	Very low	85 Å²	85	124.4 Å²	124.4	70%	0.702	75%	0.754	S	S	*	*			trans	66.6	99.4	139.8	0	0	0	0	0	125
476	S	37.3	Very low	37	Very low	124 Å²	124	120.9 Å²	120.9	87%	0.867	75%	0.752	S	S	*	*				59	152.2	121.5	-59	0	0	0	0	125.6
477	P	43.6	Very low	37.2	Very low	110 Å²	110	121.4 Å²	121.4	71%	0.714	75%	0.751	S	S	*	*			trans	-130.5	-175.2	-158.5	42.9	-24.6	0	0	0	116.4
478	N	35.7	Very low	37.2	Very low	158 Å²	158	123.3 Å²	123.3	85%	0.845	75%	0.75	S	S	*	*			trans	-179.6	136.2	140.1	-93.8	-23	0	0	0	115.3
479	A	37	Very low	37.3	Very low	82 Å²	82	121 Å²	121	68%	0.678	74%	0.742	S	S	*	*			trans	48.3	151.3	133.2	0	0	0	0	0	123
480	S	36.1	Very low	37.1	Very low	83 Å²	83	116.2 Å²	116.2	58%	0.58	73%	0.734	S	S	*	*			cis	-175.3	159.8	-7.8	43.4	0	0	0	0	113.7
481	L	33.3	Very low	37.2	Very low	115 Å²	115	119.9 Å²	119.9	60%	0.602	74%	0.739	S	S	*	*			trans	67.3	125.3	146.7	-80.2	154.8	0	0	0	124.1	N460	N460-L481 WeakPolarHBondContact ND2-CD2 3.05Å
482	S	36.1	Very low	37.4	Very low	115 Å²	115	120.4 Å²	120.4	80%	0.804	74%	0.737	S	S	*	*				175.2	156.2	119.6	43.3	0	0	0	0	113.7
483	T	35.2	Very low	37.6	Very low	121 Å²	121	120.1 Å²	120.1	74%	0.742	73%	0.734	S	S	*	*			trans	-135.1	-149.3	-165.3	49.1	0	0	0	0	112.6
484	P	46.2	Very low	37.8	Very low	105 Å²	105	121 Å²	121	68%	0.682	74%	0.738	S	S	*	*				-126.2	-153	-84.8	36.9	-16.6	0	0	0	114.2
485	I	39.2	Very low	38.5	Very low	147 Å²	147	119.6 Å²	119.6	75%	0.754	74%	0.739	S	S	*	*			trans	127.8	121.9	144.9	-64	158.1	0	0	0	116.4
486	S	35.9	Very low	38.5	Very low	111 Å²	111	120.7 Å²	120.7	78%	0.776	74%	0.742	S	S	*	*			trans	154.8	149.3	134.7	-72.6	0	0	0	0	112.8
487	V	38.2	Very low	38.8	Very low	114 Å²	114	119.5 Å²	119.5	69%	0.691	73%	0.731	S	S	*	*			cis	-163.7	134.7	-16.4	136.1	0	0	0	0	108.3
488	M	37.5	Very low	38.3	Very low	168 Å²	168	123.9 Å²	123.9	83%	0.828	74%	0.739	S	S	*	*			trans	38.4	165.9	145.4	-57.2	-176.7	178.1	0	0	124.8
489	T	38.7	Very low	38.5	Very low	105 Å²	105	121.5 Å²	121.5	64%	0.644	73%	0.732	S	S	*	*			cis	178.3	142.2	-30.9	-74.3	0	0	0	0	108.9	L491	T489-L491 HydrophobicContact CG2-CD1 4.39Å
490	S	38.5	Very low	38.5	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	74%	0.74	S	S	*	*			trans	151.5	115.6	145.6	-68.9	0	0	0	0	110.5
491	L	35.6	Very low	38.4	Very low	136 Å²	136	124.7 Å²	124.7	71%	0.712	75%	0.75	S	S	*	*				67.6	132.9	62.5	-58.4	175.2	0	0	0	112.5	T489	T489-L491 HydrophobicContact CG2-CD1 4.39Å
492	Q	39	Very low	38.9	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.794	76%	0.757	S	S	*	*			cis	-122.3	147.8	14.8	-99.6	91.2	-6.7	0	0	112.1
493	S	40.3	Very low	39	Very low	100 Å²	100	125.6 Å²	125.6	70%	0.699	76%	0.757	S	S	*	*				82.7	109	61.6	-51.7	0	0	0	0	116.7
494	P	38.6	Very low	39	Very low	124 Å²	124	124.4 Å²	124.4	81%	0.805	75%	0.753	S	S	*	*			trans	-110.7	169.7	166.5	40.2	-31.8	0	0	0	113.4
495	P	49.7	Very low	38.5	Very low	132 Å²	132	126.4 Å²	126.4	86%	0.857	76%	0.758	S	S	*	*			trans	-128.8	149.4	159.8	37.3	-24.4	0	0	0	115.3
496	S	37.2	Very low	38.3	Very low	109 Å²	109	124.7 Å²	124.7	76%	0.762	76%	0.755	S	S	*	*			trans	-109.4	-162.1	164.1	61	0	0	0	0	108.5
497	P	42.7	Very low	38.5	Very low	98 Å²	98	128.4 Å²	128.4	64%	0.636	76%	0.76	S	S	*	*			cis	-133.1	166.5	-27.1	24.3	-2.6	0	0	0	114.6
498	F	32.8	Very low	38.4	Very low	203 Å²	203	127.5 Å²	127.5	89%	0.89	77%	0.765	S	S	*	*			trans	42.4	175.1	145.6	-71.9	-62	0	0	0	122.8
499	P	40.9	Very low	38.1	Very low	107 Å²	107	126.4 Å²	126.4	70%	0.695	76%	0.761	S	S	*	*			cis	-127.5	-175	-40.7	36.2	-19.3	0	0	0	113
500	S	37.5	Very low	38.1	Very low	121 Å²	121	127.3 Å²	127.3	85%	0.846	77%	0.769	S	S	*	*			trans	137.4	138.7	143.8	-60	0	0	0	0	114.8
501	S	32.6	Very low	37.9	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	77%	0.767	S	S	*	*			trans	-103.9	160.6	174	48.3	0	0	0	0	111.9
502	P	43.7	Very low	37.8	Very low	117 Å²	117	130 Å²	130	76%	0.76	77%	0.771	S	S	*	*				-156	145.6	115.8	36.8	-17.2	0	0	0	118.9
503	V	38.4	Very low	37.6	Very low	131 Å²	131	128.2 Å²	128.2	79%	0.794	76%	0.763	S	S	*	*				62.1	115.9	125.7	-174.5	0	0	0	0	123.7
504	S	35.1	Very low	37.4	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	77%	0.77	S	S	*	*			trans	64.9	130.6	139.7	-61.1	0	0	0	0	126.4
505	N	35.5	Very low	37.2	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	77%	0.767	S	S	*	*				178.9	109.6	123.4	-88.4	-22.5	0	0	0	109.3
506	T	35.9	Very low	36.2	Very low	112 Å²	112	134 Å²	134	69%	0.687	76%	0.762	S	S	*	*				81.7	145.7	79.5	51.9	0	0	0	0	116.8
507	H	39.2	Very low	36.2	Very low	188 Å²	188	134.9 Å²	134.9	87%	0.87	77%	0.766	S	S	*	*			trans	91.3	131.3	-171.1	-62.1	-83.3	0	0	0	116.6
508	A	36.9	Very low	35.6	Very low	96 Å²	96	135.5 Å²	135.5	79%	0.793	77%	0.767	S	S	*	*			cis	-156.1	158.9	-20.8	0	0	0	0	0	110.4
509	L	31.4	Very low	35.5	Very low	145 Å²	145	133.5 Å²	133.5	76%	0.759	77%	0.766	S	S	*	*			trans	-88.1	175.3	-176.5	-100.6	160.9	0	0	0	111.5	Q511	L509-Q511 HydrophobicContact CD2-CG 4.04Å
510	P	38.7	Very low	35	Very low	123 Å²	123	134.4 Å²	134.4	80%	0.799	76%	0.763	S	S	*	*			cis	-139.5	158.1	36.1	40.2	-19.8	0	0	0	119.9
511	Q	34.8	Very low	34.8	Very low	149 Å²	149	136.3 Å²	136.3	70%	0.696	76%	0.764	S	S	*	*			trans	-70	158.5	158.2	-63	169.9	-18.1	0	0	110.3	L509	L509-Q511 HydrophobicContact CD2-CG 4.04Å
512	N	33.6	Very low	34.7	Very low	151 Å²	151	134.1 Å²	134.1	81%	0.807	76%	0.759	S	S	*	*			trans	-130.7	123.6	153.9	-152.1	1.4	0	0	0	109.7
513	Q	34.3	Very low	34.2	Very low	132 Å²	132	135.8 Å²	135.8	62%	0.617	76%	0.762	S	S	*	*			trans	-93.5	147	173.6	-62	178.1	9.3	0	0	108.2
514	F	36	Very low	33.7	Very low	195 Å²	195	133.9 Å²	133.9	86%	0.855	75%	0.754	S	S	*	*			trans	-130.3	133.3	152.6	-108.7	-85.7	0	0	0	109.4
515	Q	34.5	Very low	33.8	Very low	158 Å²	158	138 Å²	138	74%	0.738	76%	0.763	S	S	*	*			trans	-83.3	164.9	-170.3	-72.8	136.2	-25.1	0	0	112.4
516	T	28.5	Very low	33.5	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	77%	0.768	S	S	*	*			trans	-68.2	172	170.8	52.2	0	0	0	0	111.4
517	P	36.6	Very low	33.5	Very low	128 Å²	128	146 Å²	146	83%	0.831	78%	0.777	S	S	*	*				-127.2	146.5	113.1	35.7	-31.7	0	0	0	113.6
518	V	29.9	Very low	33.1	Very low	110 Å²	110	144.1 Å²	144.1	67%	0.667	77%	0.773	S	S	*	*			trans	-72.2	142.4	165	170.2	0	0	0	0	108.7	I520	V518-I520 HydrophobicContact CG1-CD1 3.84Å; V518-I520 HydrophobicContact CG1-CG1 3.67Å
519	N	32.1	Very low	33	Very low	161 Å²	161	145.1 Å²	145.1	86%	0.861	77%	0.772	S	S	*	*			trans	-135.2	136.6	150.8	-153.9	-8.4	0	0	0	110.2
520	I	30.3	Very low	33.3	Very low	126 Å²	126	145 Å²	145	65%	0.646	78%	0.777	S	S	*	*			trans	-120.2	135.6	-175.2	-62.9	159.5	0	0	0	106.2	V518	V518-I520 HydrophobicContact CG1-CD1 3.84Å; V518-I520 HydrophobicContact CG1-CG1 3.67Å
521	N	33.7	Very low	32.9	Very low	162 Å²	162	143.7 Å²	143.7	87%	0.866	78%	0.776	S	S	*	*			trans	148.9	132.2	164.5	-76.4	-19.3	0	0	0	105.3
522	G	29	Very low	33	Very low	65 Å²	65	143.2 Å²	143.2	67%	0.67	78%	0.783	S	S	*	*			cis	138.4	100.7	7.1	0	0	0	0	0	107.7
523	D	33.2	Very low	32.7	Very low	153 Å²	153	147.9 Å²	147.9	82%	0.818	79%	0.79	S	S	*	*			trans	174	113.4	138.1	-98.6	-43.9	0	0	0	113.8
524	S	29.2	Very low	32.6	Very low	91 Å²	91	147.2 Å²	147.2	64%	0.636	80%	0.8	S	S	*	*				39.6	132.2	114	-43.4	0	0	0	0	121.3
525	H	37.2	Very low	32.2	Very low	183 Å²	183	149.8 Å²	149.8	85%	0.847	80%	0.804	S	S	*	*			trans	108.8	89.7	168.3	-70	-85.2	0	0	0	113.9
526	R	29.4	Very low	32	Very low	237 Å²	237	147.7 Å²	147.7	89%	0.894	81%	0.805	S	S	*	*				65.6	91.8	56.1	-164.8	-175.3	-172.2	170	3.3	113.6
527	E	34.3	Very low	32	Very low	190 Å²	190	149.6 Å²	149.6	89%	0.888	81%	0.811	S	S	*	*			trans	-157.9	163.9	135.8	-117.2	173.1	-155.6	0	0	114.8
528	N	32.7	Very low	31.8	Very low	148 Å²	148	148.1 Å²	148.1	79%	0.791	80%	0.804	S	S	*	*			trans	-66	157.8	-149.8	-82.2	-60.7	0	0	0	120.2
529	P	33.2	Very low	32	Very low	116 Å²	116	150.2 Å²	150.2	75%	0.753	81%	0.81	S	S	*	*			trans	-91.8	142.9	165	36.6	-31.4	0	0	0	113
530	V	37.6	Very low	32	Very low	144 Å²	144	146.7 Å²	146.7	87%	0.873	80%	0.798	S	S	*	*			trans	-106.3	123.8	167.7	176.6	0	0	0	0	110.4
531	A	30.9	Very low	32.4	Very low	94 Å²	94	150.1 Å²	150.1	78%	0.777	81%	0.808	S	S	*	*			trans	-83.6	132.7	-177.4	0	0	0	0	0	112.6
532	T	36.4	Very low	32.4	Very low	139 Å²	139	145.2 Å²	145.2	85%	0.853	79%	0.787	S	S	*	*			trans	-129.1	128.1	151.8	44.9	0	0	0	0	110.6
533	R	27.4	Very low	32.5	Very low	249 Å²	249	149.4 Å²	149.4	94%	0.94	79%	0.787	S	S	*	*			trans	-71.7	128.3	-176.8	-71.4	165	162.1	163.7	-6.3	110.4
534	S	32.8	Very low	32.4	Very low	119 Å²	119	151.8 Å²	151.8	83%	0.832	79%	0.786	S	S	*	*			trans	-134.9	121	157.5	-86.2	0	0	0	0	111.3	C536	S534-C536 PolarHBondContact O-N 3Å
535	R	28	Very low	32.5	Very low	249 Å²	249	155.8 Å²	155.8	94%	0.94	79%	0.794	S	S	*	*			trans	-103.8	78.8	-159.8	-164.4	-174.7	-153.4	168.4	5.5	110.6
536	C	31	Very low	32.2	Very low	113 Å²	113	155.9 Å²	155.9	76%	0.764	80%	0.8	S	S	*	*			trans	-106.8	105.7	-176.9	-72.5	0	0	0	0	113	S534 S538	S534-C536 PolarHBondContact O-N 3Å; C536-S538 PolarHBondContact O-N 2.75Å
537	N	27.9	Very low	32.5	Very low	165 Å²	165	152 Å²	152	88%	0.882	79%	0.792	S	S	*	*			trans	-71.2	102	171.4	-83.3	-28.2	0	0	0	111.2
538	S	32.6	Very low	32.4	Very low	97 Å²	97	148.8 Å²	148.8	68%	0.678	78%	0.781	S	S	*	*			trans	-122.6	76.3	174.3	-68.2	0	0	0	0	111.5	C536	C536-S538 PolarHBondContact O-N 2.75Å
539	L	33.4	Very low	32.2	Very low	153 Å²	153	153.8 Å²	153.8	80%	0.801	79%	0.788	S	S	*	*			trans	-105.3	85.5	173	-92	165.8	0	0	0	111.1	K541	L539-K541 HydrophobicContact CD2-CG 4.28Å
540	S	32.8	Very low	32.1	Very low	88 Å²	88	152.1 Å²	152.1	62%	0.615	78%	0.78	S	S	*	*			trans	-99.1	54.7	169.9	64.3	0	0	0	0	112.2	S542	S540-S542 PolarHBondContact O-N 2.63Å
541	K	38	Very low	31.9	Very low	197 Å²	197	156.6 Å²	156.6	86%	0.857	78%	0.781	S	S	*	*			trans	-67.8	125.9	172.1	-80.3	-163.6	172.6	-167.4	0	110.6	L539	L539-K541 HydrophobicContact CD2-CG 4.28Å
542	S	32.7	Very low	31.9	Very low	59 Å²	59	158 Å²	158	41%	0.413	79%	0.785	S	S	.	*			trans	-119	126	-176.2	89.6	0	0	0	0	111.7	R333 S540	R333-S542 VanDerWaalsContact NH2-C 3.32Å; R333-S542 VanDerWaalsContact NH2-CB 3.33Å; R333-S542 PolarHBondContact NH2-O 3.48Å; R333-S542 PolarHBondContact NH2-OG 3.31Å; S540-S542 PolarHBondContact O-N 2.63Å
543	K	32.9	Very low	31.9	Very low	153 Å²	153	158.9 Å²	158.9	67%	0.665	78%	0.783	S	S	*	*	S	Bend	trans	65.7	142.3	-175	-89.9	-167.4	171.2	-169.8	0	116.6	R333	R333-K543 VanDerWaalsContact NH2-CB 3.35Å; R333-K543 VanDerWaalsContact NH2-CG 3.29Å
544	Y	29.8	Very low	32	Very low	204 Å²	204	152.9 Å²	152.9	80%	0.8	78%	0.78	S	S	*	*			trans	-5.5	110.7	164	-51	-87	0	0	0	118.3
545	E	32.1	Very low	32.2	Very low	175 Å²	175	158.1 Å²	158.1	82%	0.818	78%	0.781	S	S	*	*			trans	-152.3	124.5	137.6	-118.8	165.9	-149.9	0	0	108	H547	E545-H547 PolarHBondContact O-N 3.1Å
546	L	31	Very low	32.7	Very low	184 Å²	184	155.4 Å²	155.4	96%	0.963	78%	0.779	S	S	*	*			trans	-85.1	85.2	173.3	-88.5	159.7	0	0	0	107.7
547	H	36.1	Very low	32.8	Very low	157 Å²	157	155.9 Å²	155.9	73%	0.727	78%	0.781	S	S	*	*			trans	-107.7	113.7	168	-110.8	-80.1	0	0	0	110.7	E545	E545-H547 PolarHBondContact O-N 3.1Å
548	D	31.2	Very low	33.4	Very low	122 Å²	122	153.3 Å²	153.3	65%	0.652	78%	0.776	S	S	*	*			trans	-74.4	119.4	177	-172.2	-6.1	0	0	0	109.8	S550	D548-S550 VanDerWaalsContact OD1-CB 3.25Å; D548-S550 WeakPolarHBondContact OD1-CB 3.34Å; D548-S550 PolarHBondContact OD1-N 2.78Å; D548-S550 PolarHBondContact OD1-OG 2.89Å; D548-S550 PolarHBondContact OD2-OG 3.02Å
549	W	29.6	Very low	33.5	Very low	252 Å²	252	159.2 Å²	159.2	96%	0.955	78%	0.783	S	S	*	*			trans	-119.8	68.1	172.2	-99.7	17.5	0	0	0	109.5
550	S	31.1	Very low	33.6	Very low	81 Å²	81	158 Å²	158	57%	0.566	78%	0.777	S	S	*	*			trans	-111.7	55.7	174.8	59.1	0	0	0	0	113	D548	D548-S550 VanDerWaalsContact OD1-CB 3.25Å; D548-S550 WeakPolarHBondContact OD1-CB 3.34Å; D548-S550 PolarHBondContact OD1-N 2.78Å; D548-S550 PolarHBondContact OD1-OG 2.89Å; D548-S550 PolarHBondContact OD2-OG 3.02Å
551	R	33.1	Very low	33.8	Very low	239 Å²	239	159.1 Å²	159.1	90%	0.902	78%	0.78	S	S	*	*			trans	-165	105.4	165	-99.9	143.4	-162.7	-118.2	8.6	111.8
552	S	31.2	Very low	33.7	Very low	123 Å²	123	154.5 Å²	154.5	86%	0.86	77%	0.773	S	S	*	*			trans	-176.5	77.7	152	-85.4	0	0	0	0	110.4
553	L	34.7	Very low	34	Very low	157 Å²	157	159.3 Å²	159.3	82%	0.822	79%	0.789	S	S	*	*			trans	-161.6	76.5	154	-106.7	175.7	0	0	0	108	R555	L553-R555 PolarHBondContact O-N 3.19Å
554	S	31	Very low	34.2	Very low	124 Å²	124	158.5 Å²	158.5	87%	0.867	79%	0.791	S	S	*	*			trans	-67	113.1	171.6	-54.4	0	0	0	0	109.8
555	R	36.9	Very low	34.5	Very low	228 Å²	228	155.8 Å²	155.8	86%	0.86	79%	0.791	S	S	*	*			trans	-140.8	134.7	158	-82.1	-178.1	-165.4	-117.6	-3.9	109.4	L553	L553-R555 PolarHBondContact O-N 3.19Å
556	H	38.2	Very low	34.7	Very low	192 Å²	192	151.3 Å²	151.3	89%	0.889	78%	0.779	S	S	*	*			trans	-51.7	147.5	-165.1	-67.2	-104.4	0	0	0	116.9
557	P	33.4	Very low	34.7	Very low	123 Å²	123	149 Å²	149	80%	0.799	77%	0.766	S	S	*	*			trans	-105.5	129.1	162.3	35.9	-26.2	0	0	0	113.1
558	S	39.8	Very low	34.8	Very low	111 Å²	111	149.8 Å²	149.8	78%	0.776	77%	0.769	S	S	*	*			trans	-152.3	113.1	159	-80.8	0	0	0	0	106.5
559	R	35.2	Very low	34.9	Very low	222 Å²	222	149.2 Å²	149.2	84%	0.838	78%	0.775	S	S	*	*				69.3	127.9	91.7	-77.3	-165.8	-172.2	-124.4	3.4	112.2
560	L	36	Very low	35.7	Very low	127 Å²	127	142.8 Å²	142.8	67%	0.665	77%	0.766	S	S	*	*			cis	-159.5	167.9	13.1	-100.4	154.7	0	0	0	111.3
561	T	36.5	Very low	35.9	Very low	112 Å²	112	149.7 Å²	149.7	69%	0.687	78%	0.78	S	S	*	*			trans	57.1	112.2	147.9	48.1	0	0	0	0	119.8
562	S	35	Very low	36	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	77%	0.768	S	S	*	*				85.5	151	74.5	76.6	0	0	0	0	111.7
563	E	38.7	Very low	36.2	Very low	160 Å²	160	142.9 Å²	142.9	75%	0.748	76%	0.759	S	S	*	*			cis	-144.6	153.8	17.1	-68.5	173.8	137.4	0	0	111.1
564	D	37.7	Very low	36.4	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	76%	0.762	S	S	*	*				60.7	119.8	126.6	-60.7	3.7	0	0	0	121
565	D	36.7	Very low	36.7	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	76%	0.759	S	S	*	*				74.5	146	92.1	-96.6	-28.1	0	0	0	114.2
566	S	35.4	Very low	36.8	Very low	81 Å²	81	138.9 Å²	138.9	57%	0.566	75%	0.753	S	S	*	*			cis	-170.5	167.5	-10.8	-133.2	0	0	0	0	111
567	I	32.2	Very low	36.9	Very low	137 Å²	137	134.2 Å²	134.2	70%	0.703	75%	0.748	S	S	*	*			trans	78	143.6	142.6	-70.6	164.3	0	0	0	122.9
568	H	37.3	Very low	37.3	Very low	172 Å²	172	134.9 Å²	134.9	80%	0.796	74%	0.744	S	S	*	*			trans	90	85.9	160.6	-72.9	-14.8	0	0	0	124.2
569	S	33.7	Very low	37.5	Very low	110 Å²	110	138 Å²	138	77%	0.769	75%	0.746	S	S	*	*				22.8	174	104.7	-37.9	0	0	0	0	122.9
570	P	46.2	Very low	37.8	Very low	117 Å²	117	130 Å²	130	76%	0.76	73%	0.734	S	S	*	*				-138.4	-151.5	-102.8	38.7	-13.5	0	0	0	115
571	R	34.8	Very low	38.2	Very low	227 Å²	227	133.4 Å²	133.4	86%	0.857	75%	0.746	S	S	*	*			trans	85.8	155.9	178.2	-65	-175.6	176.8	-172.9	-1.3	115
572	N	35.6	Very low	38.7	Very low	124 Å²	124	132.5 Å²	132.5	66%	0.663	75%	0.75	S	S	*	*			cis	-151	137.1	6.3	-123.3	13.5	0	0	0	108.4
573	S	34.9	Very low	39.3	Very low	94 Å²	94	133.1 Å²	133.1	66%	0.657	75%	0.751	S	S	*	*				76.1	146.2	100.3	-56.4	0	0	0	0	119.6
574	R	38.9	Very low	39.4	Very low	239 Å²	239	134.5 Å²	134.5	90%	0.902	76%	0.76	S	S	*	*			trans	80.4	153.7	165	-60.3	-176.9	173.3	-179.7	-3.1	117.3
575	S	38	Very low	39.7	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	76%	0.759	S	S	*	*			cis	-176.5	156.3	-25.4	-89.4	0	0	0	0	108.7
576	G	38.1	Very low	39.8	Very low	71 Å²	71	132.6 Å²	132.6	73%	0.732	77%	0.765	S	S	*	*			trans	104.6	128	166	0	0	0	0	0	113.9
577	A	41	Very low	40.4	Very low	95 Å²	95	139 Å²	139	79%	0.785	80%	0.801	S	S	*	*				84.6	132.4	66.6	0	0	0	0	0	110.9
578	L	42.9	Very low	40.9	Very low	137 Å²	137	139.2 Å²	139.2	72%	0.717	81%	0.806	S	S	*	*			cis	-162.8	158	4.8	-106.3	160.9	0	0	0	108.9
579	Q	43.5	Very low	41	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	81%	0.807	S	S	*	*			trans	55	148.7	153.1	-70.8	145.2	-23.5	0	0	120.4
580	G	40.2	Very low	41.5	Very low	56 Å²	56	138.9 Å²	138.9	58%	0.577	81%	0.809	S	S	*	*			cis	159.3	141.6	-7.7	0	0	0	0	0	112.7
581	H	45.3	Very low	41.2	Very low	197 Å²	197	140.2 Å²	140.2	91%	0.912	81%	0.812	S	S	*	*			trans	63.7	158	169.3	-54.2	-87	0	0	0	116.4
582	A	46	Very low	41.6	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	81%	0.809	S	S	*	*			cis	-145.7	176.6	11.2	0	0	0	0	0	111.9
583	P	47.7	Very low	42	Very low	113 Å²	113	135.5 Å²	135.5	73%	0.734	82%	0.819	S	S	*	*			trans	-115.8	169	-158.7	42.8	-35.2	0	0	0	118.1
584	M	41	Very low	42.5	Very low	190 Å²	190	138.5 Å²	138.5	94%	0.936	83%	0.83	S	S	*	*			trans	27.6	130.2	141.8	-59.5	-70.4	-78.3	0	0	122.1
585	G	45	Very low	42.7	Very low	68 Å²	68	130.8 Å²	130.8	70%	0.701	83%	0.825	S	S	*	*			trans	169.5	95.7	158.6	0	0	0	0	0	111.6
586	L	38	Very low	43.1	Very low	173 Å²	173	132.1 Å²	132.1	91%	0.906	83%	0.826	S	S	*	*				73.1	97.5	97.6	-79	176.8	0	0	0	116.4
587	T	49.2	Very low	43.6	Very low	217 Å²	217	137.6 Å²	137.6	100%	1.331	84%	0.835	S	S	*	*				-148.3	0	127.4	52.2	0	0	0	0	108.3

Retrieved 587 of 587 residues in 417.8 ms (Link to these results)

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