A0A077YW59_TRITR Loading...

DUF4460 and DUF4461 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YW59, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 378 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	55.2	Low	227 Å²	227	79.5 Å²	79.5	100%	1.118	40%	0.404	S	S	*	.				0	-23.3	0	-121.8	172.2	-170.2	0	0	114.8	L3 S4	M1-L3 VanDerWaalsContact C-N 3.3Å; M1-L3 PolarHBondContact O-N 3.43Å; M1-L3 VanDerWaalsContact O-N 3.13Å; M1-S4 PolarHBondContact O-OG 3.34Å
2	Q	33.4	Very low	56.9	Low	188 Å²	188	81.8 Å²	81.8	88%	0.879	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.1	-170.9	-71.2	161.3	-27	0	0	116.9	S4 G5	Q2-S4 VanDerWaalsContact C-N 3.3Å; Q2-S4 PolarHBondContact O-N 2.8Å; Q2-G5 PolarHBondContact O-N 3.15Å
3	L	38.7	Very low	58.2	Low	54 Å²	54	76.3 Å²	76.3	28%	0.283	38%	0.382	S	S	.	.	H	α-helix	trans	-69.6	-18.3	-175.9	-77.4	156.4	0	0	0	115.1	M1 G5 A6 L7 Y40 R83 V86	M1-L3 VanDerWaalsContact C-N 3.3Å; M1-L3 PolarHBondContact O-N 3.43Å; M1-L3 VanDerWaalsContact O-N 3.13Å; L3-G5 PolarHBondContact O-N 3.05Å; L3-A6 PolarHBondContact O-N 2.98Å; L3-L7 PolarHBondContact O-N 3.18Å; L3-Y40 WeakPolarHBondContact CB-OH 3.46Å; L3-R83 HydrophobicContact CD1-CG 4.04Å; L3-R83 HydrophobicContact CD2-CG 4.23Å; L3-V86 HydrophobicContact CD2-CB 4.38Å; L3-V86 HydrophobicContact CD2-CG1 4.36Å; L3-V86 HydrophobicContact CD2-CG2 4.31Å
4	S	48.3	Very low	59.5	Low	86 Å²	86	70.9 Å²	70.9	60%	0.601	36%	0.355	S	S	*	.	H	α-helix	trans	-65.6	-28.1	178.1	54.7	0	0	0	0	113	M1 Q2 R8	M1-S4 PolarHBondContact O-OG 3.34Å; Q2-S4 VanDerWaalsContact C-N 3.3Å; Q2-S4 PolarHBondContact O-N 2.8Å; S4-R8 PolarHBondContact O-N 3.28Å
5	G	53	Low	60.5	Low	18 Å²	18	71 Å²	71	19%	0.186	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-45.4	173.1	0	0	0	0	0	112.2	Q2 L3 L7 R8 I99	Q2-G5 PolarHBondContact O-N 3.15Å; L3-G5 PolarHBondContact O-N 3.05Å; G5-L7 PolarHBondContact O-N 2.83Å; G5-R8 WeakPolarHBondContact O-CB 3.37Å; G5-R8 PolarHBondContact O-N 2.61Å; G5-I99 WeakPolarHBondContact O-CD1 3.06Å
6	A	52.6	Low	61.2	Low	22 Å²	22	67.1 Å²	67.1	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-43.7	-179.8	0	0	0	0	0	112.6	L3 R8 V86 L90	L3-A6 PolarHBondContact O-N 2.98Å; A6-R8 PolarHBondContact O-N 2.76Å; A6-V86 HydrophobicContact CB-CG1 3.49Å; A6-V86 VanDerWaalsContact CB-CG1 3.49Å; A6-L90 HydrophobicContact CB-CD1 4.26Å
7	L	67.2	Low	61.9	Low	15 Å²	15	68.3 Å²	68.3	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-67.4	-20.1	175	-71.1	173.4	0	0	0	113.4	L3 G5 S9 F10 Y11 Y40 V86 L89	L3-L7 PolarHBondContact O-N 3.18Å; G5-L7 PolarHBondContact O-N 2.83Å; L7-S9 PolarHBondContact O-N 3.4Å; L7-F10 WeakPolarHBondContact O-CB 3.26Å; L7-F10 PolarHBondContact O-N 2.81Å; L7-F10 VanDerWaalsContact O-N 3.11Å; L7-Y11 HydrophobicContact CB-CD2 4.11Å; L7-Y11 HydrophobicContact CB-CE2 3.77Å; L7-Y11 WeakPolarHBondContact O-CD2 3.39Å; L7-Y11 PolarHBondContact O-N 3.3Å; L7-Y40 HydrophobicContact CD1-CD2 4.38Å; L7-Y40 HydrophobicContact CD1-CE2 4.23Å; L7-V86 HydrophobicContact CD1-CG2 4.41Å; L7-V86 HydrophobicContact CD2-CG2 3.97Å; L7-V86 HydrophobicContact CG-CG2 4.02Å; L7-L89 HydrophobicContact CD2-CD1 3.84Å
8	R	62.2	Low	62.4	Low	164 Å²	164	70.6 Å²	70.6	62%	0.619	35%	0.35	S	S	*	.	H	α-helix	trans	-60.6	-43	-178.5	-166.2	178.3	-177.4	163.7	0.2	112.5	S4 G5 A6 F10 Y11 F12	S4-R8 PolarHBondContact O-N 3.28Å; G5-R8 WeakPolarHBondContact O-CB 3.37Å; G5-R8 PolarHBondContact O-N 2.61Å; A6-R8 PolarHBondContact O-N 2.76Å; R8-F10 VanDerWaalsContact C-N 3.3Å; R8-F10 PolarHBondContact O-N 2.9Å; R8-Y11 PolarHBondContact O-N 3.26Å; R8-F12 HydrophobicContact CG-CD2 4.02Å; R8-F12 HydrophobicContact CG-CE2 3.74Å; R8-F12 VanDerWaalsContact O-CD2 3.26Å; R8-F12 WeakPolarHBondContact O-CD2 2.79Å; R8-F12 PolarHBondContact O-N 2.89Å
9	S	68	Low	62.9	Low	34 Å²	34	67.1 Å²	67.1	24%	0.238	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-33.6	175.5	-72.1	0	0	0	0	112.4	L7 I99	L7-S9 PolarHBondContact O-N 3.4Å; S9-I99 WeakPolarHBondContact OG-CD1 3.24Å; S9-I99 WeakPolarHBondContact OG-CG1 3.35Å
10	F	74.5	Confident	63.2	Low	1 Å²	1	67.8 Å²	67.8	0%	0.004	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-51.2	172.2	177	-96.5	0	0	0	111.3	L7 R8 F12 L13 V14 L33 L36 F58 I73 L89 C93	L7-F10 WeakPolarHBondContact O-CB 3.26Å; L7-F10 PolarHBondContact O-N 2.81Å; L7-F10 VanDerWaalsContact O-N 3.11Å; R8-F10 VanDerWaalsContact C-N 3.3Å; R8-F10 PolarHBondContact O-N 2.9Å; F10-F12 VanDerWaalsContact C-N 3.29Å; F10-F12 PolarHBondContact O-N 3.13Å; F10-L13 PolarHBondContact O-N 3.46Å; F10-V14 HydrophobicContact CD1-CG2 4.02Å; F10-V14 HydrophobicContact CE1-CG2 3.6Å; F10-V14 HydrophobicContact CE2-CG1 4.14Å; F10-V14 HydrophobicContact CZ-CG1 4.07Å; F10-V14 HydrophobicContact CZ-CG2 3.92Å; F10-V14 PolarHBondContact O-N 3.2Å; F10-L33 HydrophobicContact CE1-CD2 3.87Å; F10-L36 HydrophobicContact CD1-CD2 4.4Å; F10-L36 HydrophobicContact CE1-CD2 3.68Å; F10-L36 HydrophobicContact CZ-CD2 4.18Å; F10-F58 HydrophobicContact CE1-CE1 4.24Å; F10-F58 HydrophobicContact CE1-CZ 4.35Å; F10-F58 HydrophobicContact CZ-CD1 4.01Å; F10-F58 HydrophobicContact CZ-CD2 4.01Å; F10-F58 HydrophobicContact CZ-CE1 4.01Å; F10-F58 HydrophobicContact CZ-CE2 4Å; F10-F58 HydrophobicContact CZ-CG 4.01Å; F10-F58 HydrophobicContact CZ-CZ 4Å; F10-I73 HydrophobicContact CE2-CD1 3.98Å; F10-L89 HydrophobicContact CD2-CB 4.42Å; F10-L89 HydrophobicContact CD2-CD2 3.98Å; F10-L89 HydrophobicContact CE1-CD2 4.28Å; F10-L89 HydrophobicContact CE2-CD2 3.52Å; F10-L89 HydrophobicContact CZ-CD2 3.69Å; F10-C93 VanDerWaalsContact CD2-SG 3.55Å
11	Y	76.1	Confident	63.8	Low	65 Å²	65	72.7 Å²	72.7	26%	0.255	37%	0.366	S	S	.	.	H	α-helix	trans	-55.5	-41.6	177.5	-74.3	-67.8	0	0	0	112.6	L7 R8 L13 V14 H15 L33 Q37	L7-Y11 HydrophobicContact CB-CD2 4.11Å; L7-Y11 HydrophobicContact CB-CE2 3.77Å; L7-Y11 WeakPolarHBondContact O-CD2 3.39Å; L7-Y11 PolarHBondContact O-N 3.3Å; R8-Y11 PolarHBondContact O-N 3.26Å; Y11-L13 PolarHBondContact O-N 3.31Å; Y11-L13 VanDerWaalsContact O-N 3.14Å; Y11-V14 PolarHBondContact O-N 3.15Å; Y11-H15 WeakPolarHBondContact O-CB 3.26Å; Y11-H15 PolarHBondContact O-N 3.47Å; Y11-L33 HydrophobicContact CD1-CD1 4.31Å; Y11-L33 HydrophobicContact CD1-CD2 3.84Å; Y11-L33 HydrophobicContact CE1-CD1 4.48Å; Y11-L33 HydrophobicContact CE1-CD2 3.64Å; Y11-Q37 VanDerWaalsContact OH-CG 3.24Å; Y11-Q37 WeakPolarHBondContact OH-CG 3.37Å; Y11-Q37 PolarHBondContact OH-NE2 2.9Å
12	F	74.7	Confident	65.8	Low	108 Å²	108	65.4 Å²	65.4	47%	0.474	33%	0.329	S	S	.	.	H	α-helix	trans	-64.4	-12.4	176.9	-82.4	-55.4	0	0	0	115.2	R8 F10 F18 R61	R8-F12 HydrophobicContact CG-CD2 4.02Å; R8-F12 HydrophobicContact CG-CE2 3.74Å; R8-F12 VanDerWaalsContact O-CD2 3.26Å; R8-F12 WeakPolarHBondContact O-CD2 2.79Å; R8-F12 PolarHBondContact O-N 2.89Å; F10-F12 VanDerWaalsContact C-N 3.29Å; F10-F12 PolarHBondContact O-N 3.13Å; F12-F18 VanDerWaalsContact O-CE2 3.31Å; F12-F18 WeakPolarHBondContact O-CE2 3.35Å; F12-R61 WeakPolarHBondContact O-CD 3.35Å; F12-R61 PolarHBondContact O-NE 3.29Å; F12-R61 VanDerWaalsContact O-NE 3.11Å
13	L	74.6	Confident	67.9	Low	10 Å²	10	61 Å²	61	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-98.5	-27	173.7	-62.8	-176	0	0	0	114	F10 Y11 V60 R61 T63 C93 L95	F10-L13 PolarHBondContact O-N 3.46Å; Y11-L13 PolarHBondContact O-N 3.31Å; Y11-L13 VanDerWaalsContact O-N 3.14Å; L13-V60 HydrophobicContact CB-CG1 3.85Å; L13-V60 HydrophobicContact CD1-CG1 3.88Å; L13-V60 HydrophobicContact CG-CG1 4.4Å; L13-R61 HydrophobicContact CD2-CG 3.96Å; L13-R61 PolarHBondContact O-N 2.99Å; L13-T63 HydrophobicContact CD2-CG2 3.49Å; L13-T63 VanDerWaalsContact CD2-CG2 3.49Å; L13-C93 HydrophobicContact CD1-CB 4.3Å; L13-L95 HydrophobicContact CD1-CD1 3.85Å; L13-L95 HydrophobicContact CD1-CD2 4.12Å; L13-L95 HydrophobicContact CD1-CG 4.07Å
14	V	76.3	Confident	69.9	Low	0 Å²	0	69 Å²	69	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-115.4	-0.1	-171.8	-53.3	0	0	0	0	114.3	F10 Y11 N29 L33 F58 V60	F10-V14 HydrophobicContact CD1-CG2 4.02Å; F10-V14 HydrophobicContact CE1-CG2 3.6Å; F10-V14 HydrophobicContact CE2-CG1 4.14Å; F10-V14 HydrophobicContact CZ-CG1 4.07Å; F10-V14 HydrophobicContact CZ-CG2 3.92Å; F10-V14 PolarHBondContact O-N 3.2Å; Y11-V14 PolarHBondContact O-N 3.15Å; V14-N29 PolarHBondContact O-ND2 3.16Å; V14-L33 HydrophobicContact CG2-CD1 4.24Å; V14-L33 HydrophobicContact CG2-CD2 3.74Å; V14-L33 HydrophobicContact CG2-CG 4.23Å; V14-F58 HydrophobicContact CB-CD1 4.24Å; V14-F58 HydrophobicContact CG1-CB 4.03Å; V14-F58 HydrophobicContact CG1-CD1 4.36Å; V14-F58 HydrophobicContact CG1-CG 4.47Å; V14-F58 HydrophobicContact CG2-CD1 4.23Å; V14-V60 HydrophobicContact CG1-CG2 4.22Å
15	H	74.5	Confident	71.6	Confident	73 Å²	73	67 Å²	67	34%	0.338	33%	0.325	S	S	.	.			trans	-56.8	134	-174.9	-160.7	-105.2	0	0	0	112.7	Y11 D17 F18 F19	Y11-H15 WeakPolarHBondContact O-CB 3.26Å; Y11-H15 PolarHBondContact O-N 3.47Å; H15-D17 IonicContact CE1-OD2 2.75Å; H15-D17 PolarHBondContact CE1-OD2 3.13Å; H15-D17 IonicContact ND1-OD2 2.78Å; H15-D17 PolarHBondContact ND1-OD2 3.41Å; H15-D17 PolarHBondContact O-N 3.01Å; H15-F18 HydrophobicContact CB-CD2 3.73Å; H15-F18 HydrophobicContact CB-CE2 3.75Å; H15-F18 PolarHBondContact O-N 3.39Å; H15-F18 VanDerWaalsContact O-N 3.13Å; H15-F19 WeakPolarHBondContact O-CD2 3.45Å
16	P	72	Confident	72.8	Confident	9 Å²	9	70 Å²	70	6%	0.058	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-54.7	-27.8	-175.9	-29.2	36.8	0	0	0	115.1	F18 F19 R26 E30 L33	P16-F18 VanDerWaalsContact C-N 3.35Å; P16-F18 PolarHBondContact O-N 3.08Å; P16-F19 PolarHBondContact O-N 3.17Å; P16-F19 VanDerWaalsContact O-N 3.11Å; P16-R26 HydrophobicContact CB-CG 3.66Å; P16-R26 WeakPolarHBondContact O-CG 3.44Å; P16-R26 PolarHBondContact O-NH1 2.8Å; P16-R26 VanDerWaalsContact O-NH1 3.15Å; P16-E30 HydrophobicContact CG-CB 3.96Å; P16-E30 HydrophobicContact CG-CG 4.3Å; P16-L33 HydrophobicContact CG-CD1 4.4Å
17	D	72.8	Confident	74	Confident	87 Å²	87	71.6 Å²	71.6	47%	0.465	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-70.9	-24.3	-178.6	-63.9	-32	0	0	0	114.7	H15 F19 S20 R26	H15-D17 IonicContact CE1-OD2 2.75Å; H15-D17 PolarHBondContact CE1-OD2 3.13Å; H15-D17 IonicContact ND1-OD2 2.78Å; H15-D17 PolarHBondContact ND1-OD2 3.41Å; H15-D17 PolarHBondContact O-N 3.01Å; D17-F19 PolarHBondContact O-N 3.16Å; D17-S20 PolarHBondContact O-N 3.02Å; D17-R26 IonicContact OD1-CZ 2.62Å; D17-R26 VanDerWaalsContact OD1-CZ 3.26Å; D17-R26 IonicContact OD1-NH1 2.99Å; D17-R26 PolarHBondContact OD1-NH1 2.96Å; D17-R26 IonicContact OD1-NH2 2.91Å; D17-R26 PolarHBondContact OD1-NH2 2.65Å
18	F	70.6	Confident	74.8	Confident	109 Å²	109	72.9 Å²	72.9	48%	0.478	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-70.3	-15.2	171.3	-60.9	-61.6	0	0	0	112.7	F12 H15 P16	F12-F18 VanDerWaalsContact O-CE2 3.31Å; F12-F18 WeakPolarHBondContact O-CE2 3.35Å; H15-F18 HydrophobicContact CB-CD2 3.73Å; H15-F18 HydrophobicContact CB-CE2 3.75Å; H15-F18 PolarHBondContact O-N 3.39Å; H15-F18 VanDerWaalsContact O-N 3.13Å; P16-F18 VanDerWaalsContact C-N 3.35Å; P16-F18 PolarHBondContact O-N 3.08Å
19	F	72.6	Confident	75.8	Confident	4 Å²	4	65 Å²	65	2%	0.018	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-109.4	27.7	-179	-57.8	-83.3	0	0	0	112	H15 P16 D17 Q21 H22 M25 R26 N29 F59 R61 I70	H15-F19 WeakPolarHBondContact O-CD2 3.45Å; P16-F19 PolarHBondContact O-N 3.17Å; P16-F19 VanDerWaalsContact O-N 3.11Å; D17-F19 PolarHBondContact O-N 3.16Å; F19-Q21 VanDerWaalsContact C-N 3.26Å; F19-Q21 PolarHBondContact O-N 3.32Å; F19-H22 HydrophobicContact CB-CB 4.39Å; F19-H22 CarbonylContact O-C 3.23Å; F19-H22 VanDerWaalsContact O-C 3.28Å; F19-H22 WeakPolarHBondContact O-CA 3.3Å; F19-H22 PolarHBondContact O-N 2.8Å; F19-M25 HydrophobicContact CB-CB 4.16Å; F19-M25 HydrophobicContact CD1-CB 3.91Å; F19-M25 HydrophobicContact CD1-SD 3.88Å; F19-M25 HydrophobicContact CE1-SD 4.29Å; F19-M25 HydrophobicContact CG-CB 4.17Å; F19-R26 HydrophobicContact CB-CB 4.29Å; F19-N29 VanDerWaalsContact CE2-ND2 3.28Å; F19-N29 WeakPolarHBondContact CE2-ND2 3.28Å; F19-F59 HydrophobicContact CE1-CB 3.88Å; F19-F59 HydrophobicContact CZ-CB 3.97Å; F19-F59 VanDerWaalsContact CZ-O 3.26Å; F19-F59 WeakPolarHBondContact CZ-O 3.47Å; F19-R61 HydrophobicContact CZ-CB 4.39Å; F19-I70 HydrophobicContact CE1-CD1 4.45Å; F19-I70 HydrophobicContact CE1-CG2 4.19Å
20	S	68.7	Low	76.5	Confident	82 Å²	82	67 Å²	67	57%	0.573	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.5	178	55.5	0	0	0	0	113.5	D17 H22	D17-S20 PolarHBondContact O-N 3.02Å; S20-H22 PolarHBondContact O-N 2.89Å
21	Q	74.5	Confident	76.8	Confident	170 Å²	170	73.8 Å²	73.8	79%	0.794	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.4	174.6	-60.4	-177.2	6.1	0	0	113.7	F19	F19-Q21 VanDerWaalsContact C-N 3.26Å; F19-Q21 PolarHBondContact O-N 3.32Å
22	H	76	Confident	77.2	Confident	74 Å²	74	71.2 Å²	71.2	34%	0.343	35%	0.351	S	S	.	.			trans	-132.7	73	-174	-62.1	-31.7	0	0	0	111.7	F19 S20 R24 M25 R26	F19-H22 HydrophobicContact CB-CB 4.39Å; F19-H22 CarbonylContact O-C 3.23Å; F19-H22 VanDerWaalsContact O-C 3.28Å; F19-H22 WeakPolarHBondContact O-CA 3.3Å; F19-H22 PolarHBondContact O-N 2.8Å; S20-H22 PolarHBondContact O-N 2.89Å; H22-R24 VanDerWaalsContact C-N 3.25Å; H22-R24 PolarHBondContact O-N 3.21Å; H22-R24 VanDerWaalsContact O-N 3.07Å; H22-M25 HydrophobicContact CB-CB 3.97Å; H22-M25 HydrophobicContact CB-CE 3.82Å; H22-M25 HydrophobicContact CB-CG 3.86Å; H22-M25 HydrophobicContact CB-SD 3.68Å; H22-M25 VanDerWaalsContact CD2-CE 3.49Å; H22-M25 WeakPolarHBondContact CD2-CE 2.97Å; H22-M25 VanDerWaalsContact CD2-SD 3.58Å; H22-M25 WeakPolarHBondContact O-CB 3.44Å; H22-M25 PolarHBondContact O-N 2.66Å; H22-R26 PolarHBondContact O-N 2.87Å
23	P	78.1	Confident	77.6	Confident	95 Å²	95	66.6 Å²	66.6	62%	0.617	33%	0.332	S	S	*	.	H	α-helix	trans	-53.6	-35.9	-172.6	-28.7	35.7	0	0	0	115	R26 A27	P23-R26 WeakPolarHBondContact O-CB 3.3Å; P23-R26 PolarHBondContact O-N 2.66Å; P23-A27 WeakPolarHBondContact O-CB 3.28Å; P23-A27 PolarHBondContact O-N 2.68Å
24	R	79.8	Confident	77.9	Confident	224 Å²	224	71.9 Å²	71.9	85%	0.845	35%	0.354	S	S	*	.	H	α-helix	trans	-64.9	-42	175.8	-67.8	-177.6	178	173.8	-0.7	112.4	H22 T28	H22-R24 VanDerWaalsContact C-N 3.25Å; H22-R24 PolarHBondContact O-N 3.21Å; H22-R24 VanDerWaalsContact O-N 3.07Å; R24-T28 PolarHBondContact O-N 3.41Å; R24-T28 VanDerWaalsContact O-N 3.1Å; R24-T28 PolarHBondContact O-OG1 2.9Å
25	M	84	Confident	78.1	Confident	42 Å²	42	73.6 Å²	73.6	21%	0.207	37%	0.369	C	S	.	.	H	α-helix	trans	-69.6	-41.9	176.9	-56.4	-179.3	-152.1	0	0	110.7	F19 H22 A27 T28 N29 F59 I70	F19-M25 HydrophobicContact CB-CB 4.16Å; F19-M25 HydrophobicContact CD1-CB 3.91Å; F19-M25 HydrophobicContact CD1-SD 3.88Å; F19-M25 HydrophobicContact CE1-SD 4.29Å; F19-M25 HydrophobicContact CG-CB 4.17Å; H22-M25 HydrophobicContact CB-CB 3.97Å; H22-M25 HydrophobicContact CB-CE 3.82Å; H22-M25 HydrophobicContact CB-CG 3.86Å; H22-M25 HydrophobicContact CB-SD 3.68Å; H22-M25 VanDerWaalsContact CD2-CE 3.49Å; H22-M25 WeakPolarHBondContact CD2-CE 2.97Å; H22-M25 VanDerWaalsContact CD2-SD 3.58Å; H22-M25 WeakPolarHBondContact O-CB 3.44Å; H22-M25 PolarHBondContact O-N 2.66Å; M25-A27 PolarHBondContact O-N 2.91Å; M25-T28 PolarHBondContact O-N 3.18Å; M25-N29 WeakPolarHBondContact O-CB 3.39Å; M25-N29 PolarHBondContact O-N 3.31Å; M25-F59 HydrophobicContact CB-CB 4.31Å; M25-F59 HydrophobicContact CB-CD1 4.44Å; M25-F59 HydrophobicContact CB-CD2 3.73Å; M25-F59 HydrophobicContact CB-CE2 4.11Å; M25-F59 HydrophobicContact CB-CG 3.91Å; M25-F59 HydrophobicContact CG-CD1 3.92Å; M25-F59 HydrophobicContact CG-CD2 3.96Å; M25-F59 HydrophobicContact CG-CE1 3.97Å; M25-F59 HydrophobicContact CG-CE2 4.02Å; M25-F59 HydrophobicContact CG-CG 3.9Å; M25-F59 HydrophobicContact CG-CZ 4.02Å; M25-F59 HydrophobicContact SD-CD1 4.01Å; M25-F59 HydrophobicContact SD-CE1 4.39Å; M25-F59 HydrophobicContact SD-CG 4.27Å; M25-I70 HydrophobicContact CE-CD1 4.21Å; M25-I70 HydrophobicContact SD-CD1 3.95Å; M25-I70 HydrophobicContact SD-CG2 4.49Å
26	R	78.9	Confident	78.5	Confident	82 Å²	82	70.4 Å²	70.4	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-52.4	-53.2	173.6	-173.4	-175.6	178.9	94.3	2.5	111.2	P16 D17 F19 H22 P23 N29 E30	P16-R26 HydrophobicContact CB-CG 3.66Å; P16-R26 WeakPolarHBondContact O-CG 3.44Å; P16-R26 PolarHBondContact O-NH1 2.8Å; P16-R26 VanDerWaalsContact O-NH1 3.15Å; D17-R26 IonicContact OD1-CZ 2.62Å; D17-R26 VanDerWaalsContact OD1-CZ 3.26Å; D17-R26 IonicContact OD1-NH1 2.99Å; D17-R26 PolarHBondContact OD1-NH1 2.96Å; D17-R26 IonicContact OD1-NH2 2.91Å; D17-R26 PolarHBondContact OD1-NH2 2.65Å; F19-R26 HydrophobicContact CB-CB 4.29Å; H22-R26 PolarHBondContact O-N 2.87Å; P23-R26 WeakPolarHBondContact O-CB 3.3Å; P23-R26 PolarHBondContact O-N 2.66Å; R26-N29 PolarHBondContact O-N 3.12Å; R26-E30 WeakPolarHBondContact O-CB 3.44Å; R26-E30 PolarHBondContact O-N 3.38Å
27	A	78.8	Confident	78.7	Confident	56 Å²	56	74 Å²	74	46%	0.463	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-45.9	179.9	0	0	0	0	0	112.6	P23 M25 N29 E30 E31	P23-A27 WeakPolarHBondContact O-CB 3.28Å; P23-A27 PolarHBondContact O-N 2.68Å; M25-A27 PolarHBondContact O-N 2.91Å; A27-N29 VanDerWaalsContact C-N 3.34Å; A27-N29 PolarHBondContact O-N 3.42Å; A27-E30 PolarHBondContact O-N 3.46Å; A27-E31 WeakPolarHBondContact O-CB 3.39Å; A27-E31 PolarHBondContact O-N 2.83Å
28	T	82.3	Confident	78.9	Confident	41 Å²	41	78.3 Å²	78.3	25%	0.252	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-41.5	178.2	-56.4	0	0	0	0	112.2	R24 M25 S32 K57 F59	R24-T28 PolarHBondContact O-N 3.41Å; R24-T28 VanDerWaalsContact O-N 3.1Å; R24-T28 PolarHBondContact O-OG1 2.9Å; M25-T28 PolarHBondContact O-N 3.18Å; T28-S32 VanDerWaalsContact O-CB 3.23Å; T28-S32 WeakPolarHBondContact O-CB 3.21Å; T28-S32 PolarHBondContact O-N 3.36Å; T28-S32 PolarHBondContact O-OG 3.49Å; T28-K57 HydrophobicContact CG2-CB 4.19Å; T28-K57 HydrophobicContact CG2-CD 4.23Å; T28-K57 HydrophobicContact CG2-CG 4.11Å; T28-K57 WeakPolarHBondContact CG2-O 3.39Å; T28-F59 HydrophobicContact CG2-CD2 4.31Å; T28-F59 HydrophobicContact CG2-CE2 3.89Å
29	N	84.4	Confident	79.1	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-69.8	-39.7	176.8	-79.8	13.7	0	0	0	111.9	V14 F19 M25 R26 A27 S32 L33 F59	V14-N29 PolarHBondContact O-ND2 3.16Å; F19-N29 VanDerWaalsContact CE2-ND2 3.28Å; F19-N29 WeakPolarHBondContact CE2-ND2 3.28Å; M25-N29 WeakPolarHBondContact O-CB 3.39Å; M25-N29 PolarHBondContact O-N 3.31Å; R26-N29 PolarHBondContact O-N 3.12Å; A27-N29 VanDerWaalsContact C-N 3.34Å; A27-N29 PolarHBondContact O-N 3.42Å; N29-S32 PolarHBondContact O-N 2.88Å; N29-L33 WeakPolarHBondContact O-CB 3.49Å; N29-L33 WeakPolarHBondContact O-CG 3.48Å; N29-L33 PolarHBondContact O-N 2.87Å; N29-F59 PolarHBondContact ND2-O 2.71Å; N29-F59 PolarHBondContact OD1-N 3.41Å
30	E	83.2	Confident	79.2	Confident	75 Å²	75	76.3 Å²	76.3	35%	0.35	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-44.8	178.4	-165.3	-173.5	136.1	0	0	111.8	P16 R26 A27 K34	P16-E30 HydrophobicContact CG-CB 3.96Å; P16-E30 HydrophobicContact CG-CG 4.3Å; R26-E30 WeakPolarHBondContact O-CB 3.44Å; R26-E30 PolarHBondContact O-N 3.38Å; A27-E30 PolarHBondContact O-N 3.46Å; E30-K34 HydrophobicContact CG-CD 4.39Å; E30-K34 WeakPolarHBondContact O-CB 3.37Å; E30-K34 WeakPolarHBondContact O-CD 3.48Å; E30-K34 VanDerWaalsContact O-CG 3.28Å; E30-K34 WeakPolarHBondContact O-CG 3.47Å; E30-K34 PolarHBondContact O-N 3.03Å; E30-K34 IonicContact OE1-NZ 3.22Å; E30-K34 PolarHBondContact OE1-NZ 2.79Å
31	E	79.7	Confident	79.4	Confident	144 Å²	144	78.3 Å²	78.3	67%	0.673	37%	0.373	S	S	*	.	H	α-helix	trans	-64.5	-46	175.5	-173.1	176.3	-167.8	0	0	111.6	A27 L33 K34 A35	A27-E31 WeakPolarHBondContact O-CB 3.39Å; A27-E31 PolarHBondContact O-N 2.83Å; E31-L33 PolarHBondContact O-N 3.32Å; E31-K34 PolarHBondContact O-N 3.09Å; E31-A35 WeakPolarHBondContact O-CB 3.2Å; E31-A35 PolarHBondContact O-N 3.5Å
32	S	84.9	Confident	79.3	Confident	10 Å²	10	71.2 Å²	71.2	7%	0.07	34%	0.341	C	S	.	.	H	α-helix	trans	-67.8	-34.7	179.1	-60.6	0	0	0	0	112.4	T28 N29 A35 L36 L56 K57 F58	T28-S32 VanDerWaalsContact O-CB 3.23Å; T28-S32 WeakPolarHBondContact O-CB 3.21Å; T28-S32 PolarHBondContact O-N 3.36Å; T28-S32 PolarHBondContact O-OG 3.49Å; N29-S32 PolarHBondContact O-N 2.88Å; S32-A35 PolarHBondContact O-N 3.32Å; S32-L36 VanDerWaalsContact O-CB 3.27Å; S32-L36 WeakPolarHBondContact O-CB 3.37Å; S32-L36 PolarHBondContact O-N 2.95Å; S32-L56 WeakPolarHBondContact O-CD1 3.18Å; S32-K57 PolarHBondContact OG-O 3.03Å; S32-F58 WeakPolarHBondContact O-CZ 3.48Å
33	L	83.5	Confident	79	Confident	11 Å²	11	68.8 Å²	68.8	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-66	-44.3	172.9	-79.9	179.7	0	0	0	111.6	F10 Y11 V14 P16 N29 E31 A35 L36 Q37 F58	F10-L33 HydrophobicContact CE1-CD2 3.87Å; Y11-L33 HydrophobicContact CD1-CD1 4.31Å; Y11-L33 HydrophobicContact CD1-CD2 3.84Å; Y11-L33 HydrophobicContact CE1-CD1 4.48Å; Y11-L33 HydrophobicContact CE1-CD2 3.64Å; V14-L33 HydrophobicContact CG2-CD1 4.24Å; V14-L33 HydrophobicContact CG2-CD2 3.74Å; V14-L33 HydrophobicContact CG2-CG 4.23Å; P16-L33 HydrophobicContact CG-CD1 4.4Å; N29-L33 WeakPolarHBondContact O-CB 3.49Å; N29-L33 WeakPolarHBondContact O-CG 3.48Å; N29-L33 PolarHBondContact O-N 2.87Å; E31-L33 PolarHBondContact O-N 3.32Å; L33-A35 VanDerWaalsContact C-N 3.33Å; L33-A35 PolarHBondContact O-N 3.12Å; L33-L36 PolarHBondContact O-N 3.45Å; L33-Q37 WeakPolarHBondContact O-CB 3.34Å; L33-Q37 VanDerWaalsContact O-CG 3.28Å; L33-Q37 WeakPolarHBondContact O-CG 3.3Å; L33-Q37 PolarHBondContact O-N 3.35Å; L33-F58 HydrophobicContact CD2-CE1 3.8Å; L33-F58 HydrophobicContact CG-CE1 3.94Å
34	K	81.3	Confident	78.4	Confident	121 Å²	121	67.2 Å²	67.2	53%	0.526	33%	0.331	S	S	.	.	H	α-helix	trans	-59.7	-44	174.6	-75.9	165.8	172.2	171.1	0	111.3	E30 E31 R38	E30-K34 HydrophobicContact CG-CD 4.39Å; E30-K34 WeakPolarHBondContact O-CB 3.37Å; E30-K34 WeakPolarHBondContact O-CD 3.48Å; E30-K34 VanDerWaalsContact O-CG 3.28Å; E30-K34 WeakPolarHBondContact O-CG 3.47Å; E30-K34 PolarHBondContact O-N 3.03Å; E30-K34 IonicContact OE1-NZ 3.22Å; E30-K34 PolarHBondContact OE1-NZ 2.79Å; E31-K34 PolarHBondContact O-N 3.09Å; K34-R38 WeakPolarHBondContact O-CB 3.39Å; K34-R38 PolarHBondContact O-N 3.14Å
35	A	80.2	Confident	78	Confident	37 Å²	37	62.1 Å²	62.1	31%	0.306	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-43.5	176.7	0	0	0	0	0	112.4	E31 S32 L33 R38 Y39 L56	E31-A35 WeakPolarHBondContact O-CB 3.2Å; E31-A35 PolarHBondContact O-N 3.5Å; S32-A35 PolarHBondContact O-N 3.32Å; L33-A35 VanDerWaalsContact C-N 3.33Å; L33-A35 PolarHBondContact O-N 3.12Å; A35-R38 PolarHBondContact O-N 2.81Å; A35-Y39 WeakPolarHBondContact O-CB 3.31Å; A35-Y39 PolarHBondContact O-N 3.08Å; A35-L56 HydrophobicContact CB-CD1 4.08Å; A35-L56 HydrophobicContact CB-CD2 3.69Å
36	L	81.5	Confident	76.6	Confident	6 Å²	6	65.9 Å²	65.9	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-65	-45.8	177.9	-179.3	64.8	0	0	0	112.1	F10 S32 L33 R38 Y39 Y40 L56 F58 L77 L85 L89	F10-L36 HydrophobicContact CD1-CD2 4.4Å; F10-L36 HydrophobicContact CE1-CD2 3.68Å; F10-L36 HydrophobicContact CZ-CD2 4.18Å; S32-L36 VanDerWaalsContact O-CB 3.27Å; S32-L36 WeakPolarHBondContact O-CB 3.37Å; S32-L36 PolarHBondContact O-N 2.95Å; L33-L36 PolarHBondContact O-N 3.45Å; L36-R38 VanDerWaalsContact C-N 3.32Å; L36-R38 PolarHBondContact O-N 3.43Å; L36-Y39 PolarHBondContact O-N 3.26Å; L36-Y40 WeakPolarHBondContact O-CB 3.43Å; L36-Y40 PolarHBondContact O-N 3.35Å; L36-L56 HydrophobicContact CB-CD1 3.71Å; L36-L56 HydrophobicContact CD1-CD1 4.36Å; L36-F58 HydrophobicContact CB-CZ 4.12Å; L36-F58 HydrophobicContact CD2-CE2 4.49Å; L36-F58 HydrophobicContact CD2-CZ 3.95Å; L36-L77 HydrophobicContact CD1-CD2 3.78Å; L36-L85 HydrophobicContact CD1-CD2 4.17Å; L36-L89 HydrophobicContact CD1-CD1 4.13Å; L36-L89 HydrophobicContact CD2-CD1 4Å; L36-L89 HydrophobicContact CD2-CD2 4.08Å
37	Q	77.8	Confident	75.7	Confident	84 Å²	84	69.9 Å²	69.9	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-59.7	-43.9	176.1	-76.6	174.3	-7.5	0	0	111.2	Y11 L33 Y40 L41	Y11-Q37 VanDerWaalsContact OH-CG 3.24Å; Y11-Q37 WeakPolarHBondContact OH-CG 3.37Å; Y11-Q37 PolarHBondContact OH-NE2 2.9Å; L33-Q37 WeakPolarHBondContact O-CB 3.34Å; L33-Q37 VanDerWaalsContact O-CG 3.28Å; L33-Q37 WeakPolarHBondContact O-CG 3.3Å; L33-Q37 PolarHBondContact O-N 3.35Å; Q37-Y40 PolarHBondContact O-N 2.99Å; Q37-L41 WeakPolarHBondContact O-CB 3.49Å; Q37-L41 VanDerWaalsContact O-CG 3.29Å; Q37-L41 WeakPolarHBondContact O-CG 3.41Å; Q37-L41 PolarHBondContact O-N 2.9Å
38	R	75.4	Confident	75	Confident	177 Å²	177	70.8 Å²	70.8	67%	0.668	36%	0.362	S	S	*	.	H	α-helix	trans	-62.5	-47.7	176.2	-176.2	172	-178.7	146.7	1.7	111.9	K34 A35 L36 Y40 L41 D42	K34-R38 WeakPolarHBondContact O-CB 3.39Å; K34-R38 PolarHBondContact O-N 3.14Å; A35-R38 PolarHBondContact O-N 2.81Å; L36-R38 VanDerWaalsContact C-N 3.32Å; L36-R38 PolarHBondContact O-N 3.43Å; R38-Y40 VanDerWaalsContact C-N 3.35Å; R38-Y40 PolarHBondContact O-N 3.4Å; R38-L41 PolarHBondContact O-N 2.82Å; R38-D42 IonicContact NE-OD2 3.75Å; R38-D42 WeakPolarHBondContact O-CB 3.46Å; R38-D42 PolarHBondContact O-N 2.89Å
39	Y	75.5	Confident	74	Confident	12 Å²	12	79.3 Å²	79.3	5%	0.047	39%	0.39	C	S	.	.	H	α-helix	trans	-59.8	-44.7	177	-175.1	-99.5	0	0	0	111.8	A35 L36 L41 D42 L43 Y48 P50 L77 D79 L85	A35-Y39 WeakPolarHBondContact O-CB 3.31Å; A35-Y39 PolarHBondContact O-N 3.08Å; L36-Y39 PolarHBondContact O-N 3.26Å; Y39-L41 PolarHBondContact O-N 2.68Å; Y39-D42 PolarHBondContact O-N 3.38Å; Y39-L43 HydrophobicContact CD1-CD1 4.02Å; Y39-L43 HydrophobicContact CD1-CG 4.15Å; Y39-L43 HydrophobicContact CE1-CD1 3.62Å; Y39-L43 HydrophobicContact CE1-CD2 4.04Å; Y39-L43 HydrophobicContact CE1-CG 3.83Å; Y39-L43 WeakPolarHBondContact O-CG 3.36Å; Y39-L43 PolarHBondContact O-N 3.41Å; Y39-Y48 HydrophobicContact CE2-CE1 4.26Å; Y39-P50 HydrophobicContact CE2-CB 3.99Å; Y39-P50 VanDerWaalsContact OH-CB 3.3Å; Y39-P50 WeakPolarHBondContact OH-CB 3.31Å; Y39-L77 HydrophobicContact CD1-CB 4.17Å; Y39-L77 HydrophobicContact CD1-CD1 4.33Å; Y39-L77 HydrophobicContact CD1-CD2 3.78Å; Y39-L77 HydrophobicContact CD1-CG 4.32Å; Y39-L77 HydrophobicContact CD2-CB 4.22Å; Y39-L77 HydrophobicContact CD2-CD1 4.07Å; Y39-L77 HydrophobicContact CE1-CB 4Å; Y39-L77 HydrophobicContact CE1-CD2 4.22Å; Y39-L77 HydrophobicContact CE2-CB 4.07Å; Y39-L77 HydrophobicContact CG-CB 4.28Å; Y39-L77 HydrophobicContact CG-CD1 3.86Å; Y39-L77 HydrophobicContact CG-CD2 4.16Å; Y39-L77 HydrophobicContact CG-CG 4.34Å; Y39-L77 PolarHBondContact OH-O 2.75Å; Y39-D79 PolarHBondContact OH-O 3.29Å; Y39-L85 HydrophobicContact CD1-CD2 3.74Å; Y39-L85 HydrophobicContact CE1-CD2 3.95Å
40	Y	75	Confident	72.9	Confident	60 Å²	60	81.1 Å²	81.1	24%	0.235	40%	0.402	C	S	.	.	H	α-helix	trans	-62.7	-38.5	177.8	-173.9	-86.3	0	0	0	112.9	L3 L7 L36 Q37 R38 P82 L85 V86	L3-Y40 WeakPolarHBondContact CB-OH 3.46Å; L7-Y40 HydrophobicContact CD1-CD2 4.38Å; L7-Y40 HydrophobicContact CD1-CE2 4.23Å; L36-Y40 WeakPolarHBondContact O-CB 3.43Å; L36-Y40 PolarHBondContact O-N 3.35Å; Q37-Y40 PolarHBondContact O-N 2.99Å; R38-Y40 VanDerWaalsContact C-N 3.35Å; R38-Y40 PolarHBondContact O-N 3.4Å; Y40-P82 HydrophobicContact CD2-CB 4.32Å; Y40-P82 HydrophobicContact CE2-CB 3.73Å; Y40-L85 HydrophobicContact CD2-CD2 4.35Å; Y40-V86 HydrophobicContact CE2-CG2 3.92Å
41	L	72.4	Confident	71.8	Confident	123 Å²	123	87.3 Å²	87.3	64%	0.644	43%	0.427	S	S	*	.	H	α-helix	trans	-70	-36.9	173.2	-71.5	169.3	0	0	0	112.3	Q37 R38 Y39 G44	Q37-L41 WeakPolarHBondContact O-CB 3.49Å; Q37-L41 VanDerWaalsContact O-CG 3.29Å; Q37-L41 WeakPolarHBondContact O-CG 3.41Å; Q37-L41 PolarHBondContact O-N 2.9Å; R38-L41 PolarHBondContact O-N 2.82Å; Y39-L41 PolarHBondContact O-N 2.68Å; L41-G44 PolarHBondContact O-N 3.46Å
42	D	71.7	Confident	70.9	Confident	22 Å²	22	81.9 Å²	81.9	12%	0.118	41%	0.405	C	S	.	.	H	α-helix	trans	-68.9	-37	178.3	-77.1	-25	0	0	0	112	R38 Y39 G44 K45 Y48	R38-D42 IonicContact NE-OD2 3.75Å; R38-D42 WeakPolarHBondContact O-CB 3.46Å; R38-D42 PolarHBondContact O-N 2.89Å; Y39-D42 PolarHBondContact O-N 3.38Å; D42-G44 PolarHBondContact O-N 3.28Å; D42-G44 VanDerWaalsContact O-N 3.16Å; D42-K45 WeakPolarHBondContact O-CB 3.34Å; D42-K45 PolarHBondContact O-N 2.98Å; D42-K45 WeakPolarHBondContact OD1-CE 3.29Å; D42-K45 IonicContact OD1-NZ 3.01Å; D42-K45 PolarHBondContact OD1-NZ 3.33Å; D42-Y48 HydrophobicContact CB-CD1 4.33Å; D42-Y48 HydrophobicContact CB-CD2 4Å; D42-Y48 HydrophobicContact CB-CE1 4.03Å; D42-Y48 HydrophobicContact CB-CE2 3.67Å; D42-Y48 HydrophobicContact CB-CG 4.31Å; D42-Y48 VanDerWaalsContact O-CB 3.28Å; D42-Y48 WeakPolarHBondContact O-CB 3.46Å
43	L	69.6	Low	69.4	Low	22 Å²	22	88.5 Å²	88.5	12%	0.115	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.6	172.3	-74.6	-178.7	0	0	0	113.7	Y39 K45 Y48 P82 L85	Y39-L43 HydrophobicContact CD1-CD1 4.02Å; Y39-L43 HydrophobicContact CD1-CG 4.15Å; Y39-L43 HydrophobicContact CE1-CD1 3.62Å; Y39-L43 HydrophobicContact CE1-CD2 4.04Å; Y39-L43 HydrophobicContact CE1-CG 3.83Å; Y39-L43 WeakPolarHBondContact O-CG 3.36Å; Y39-L43 PolarHBondContact O-N 3.41Å; L43-K45 VanDerWaalsContact C-N 3.26Å; L43-K45 PolarHBondContact O-N 3.43Å; L43-Y48 HydrophobicContact CD2-CD1 4.23Å; L43-Y48 HydrophobicContact CD2-CE1 4.25Å; L43-P82 HydrophobicContact CB-CG 3.88Å; L43-P82 HydrophobicContact CD1-CG 4.03Å; L43-L85 HydrophobicContact CD1-CD2 4.12Å
44	G	67	Low	68.6	Low	63 Å²	63	95.8 Å²	95.8	65%	0.649	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.7	177.4	0	0	0	0	0	114.7	L41 D42	L41-G44 PolarHBondContact O-N 3.46Å; D42-G44 PolarHBondContact O-N 3.28Å; D42-G44 VanDerWaalsContact O-N 3.16Å
45	K	71.3	Confident	68.5	Low	117 Å²	117	92.5 Å²	92.5	51%	0.509	47%	0.469	S	S	.	.	S	Bend	trans	-89.1	130.9	-174.6	-65.1	173.5	179.7	170.6	0	111.4	D42 L43 N47 Y48	D42-K45 WeakPolarHBondContact O-CB 3.34Å; D42-K45 PolarHBondContact O-N 2.98Å; D42-K45 WeakPolarHBondContact OD1-CE 3.29Å; D42-K45 IonicContact OD1-NZ 3.01Å; D42-K45 PolarHBondContact OD1-NZ 3.33Å; L43-K45 VanDerWaalsContact C-N 3.26Å; L43-K45 PolarHBondContact O-N 3.43Å; K45-N47 PolarHBondContact O-N 3.37Å; K45-Y48 PolarHBondContact O-N 2.59Å; K45-Y48 VanDerWaalsContact O-N 3.15Å
46	P	54.4	Low	68.8	Low	120 Å²	120	91.6 Å²	91.6	78%	0.779	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	133.9	170.6	26.5	-33.1	0	0	0	109.4
47	N	58.9	Low	69	Low	166 Å²	166	94.9 Å²	94.9	89%	0.888	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.3	-175.4	-52.1	-34.8	0	0	0	117.3	K45 R49	K45-N47 PolarHBondContact O-N 3.37Å; N47-R49 PolarHBondContact O-N 3.46Å
48	Y	64.1	Low	69.4	Low	75 Å²	75	90.9 Å²	90.9	29%	0.294	45%	0.454	S	S	.	.			trans	-71	110.8	168.1	-175	-104.4	0	0	0	111.2	Y39 D42 L43 K45 P50	Y39-Y48 HydrophobicContact CE2-CE1 4.26Å; D42-Y48 HydrophobicContact CB-CD1 4.33Å; D42-Y48 HydrophobicContact CB-CD2 4Å; D42-Y48 HydrophobicContact CB-CE1 4.03Å; D42-Y48 HydrophobicContact CB-CE2 3.67Å; D42-Y48 HydrophobicContact CB-CG 4.31Å; D42-Y48 VanDerWaalsContact O-CB 3.28Å; D42-Y48 WeakPolarHBondContact O-CB 3.46Å; L43-Y48 HydrophobicContact CD2-CD1 4.23Å; L43-Y48 HydrophobicContact CD2-CE1 4.25Å; K45-Y48 PolarHBondContact O-N 2.59Å; K45-Y48 VanDerWaalsContact O-N 3.15Å; Y48-P50 HydrophobicContact CD1-CB 4.5Å; Y48-P50 HydrophobicContact CE1-CB 3.91Å
49	R	61.6	Low	69.7	Low	220 Å²	220	84.2 Å²	84.2	83%	0.83	43%	0.43	S	S	*	.			trans	-92.6	114.2	166	-67.7	-173.4	-178.7	-174.1	1	108.6	N47 K51	N47-R49 PolarHBondContact O-N 3.46Å; R49-K51 PolarHBondContact O-N 3.43Å
50	P	62.5	Low	70	Confident	39 Å²	39	83.9 Å²	83.9	25%	0.253	43%	0.429	S	S	.	.			trans	-64.2	105.9	179.9	24.4	-32.7	0	0	0	111	Y39 Y48 S52 T80	Y39-P50 HydrophobicContact CE2-CB 3.99Å; Y39-P50 VanDerWaalsContact OH-CB 3.3Å; Y39-P50 WeakPolarHBondContact OH-CB 3.31Å; Y48-P50 HydrophobicContact CD1-CB 4.5Å; Y48-P50 HydrophobicContact CE1-CB 3.91Å; P50-S52 PolarHBondContact O-N 2.93Å; P50-T80 HydrophobicContact CG-CG2 4.39Å
51	K	60.3	Low	70.1	Confident	205 Å²	205	85.8 Å²	85.8	89%	0.891	44%	0.436	S	S	*	.			trans	-85.5	82.9	167.5	-69	-175.7	179.6	-177.8	0	108.3	R49	R49-K51 PolarHBondContact O-N 3.43Å
52	S	59.5	Low	69.9	Low	29 Å²	29	81.9 Å²	81.9	20%	0.203	42%	0.418	C	S	.	.			trans	-135.1	127.5	-170.3	-174.4	0	0	0	0	114.5	P50 L77	P50-S52 PolarHBondContact O-N 2.93Å; S52-L77 WeakPolarHBondContact CB-O 3.06Å; S52-L77 WeakPolarHBondContact OG-CB 3.09Å; S52-L77 PolarHBondContact OG-O 3.33Å
53	T	54.6	Low	69.5	Low	149 Å²	149	83.5 Å²	83.5	91%	0.914	43%	0.429	S	S	*	.			trans	-146.6	38.1	163.2	-36.9	0	0	0	0	108.6
54	K	66.7	Low	69	Low	165 Å²	165	92.1 Å²	92.1	72%	0.717	47%	0.469	S	S	*	.			trans	-108.4	113.1	175.4	-72.9	-167.1	176.2	-171.8	0	109.2
55	S	79.3	Confident	68.5	Low	52 Å²	52	93.8 Å²	93.8	36%	0.364	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	120.2	170	-161.7	0	0	0	0	109.3	D76	S55-D76 WeakPolarHBondContact CB-OD1 3.43Å; S55-D76 PolarHBondContact OG-OD1 2.59Å
56	L	85.3	Confident	67.6	Low	18 Å²	18	89.3 Å²	89.3	9%	0.094	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	139.7	177	-64.8	-175.4	0	0	0	110.8	S32 A35 L36 F58 Y74 V75 L77	S32-L56 WeakPolarHBondContact O-CD1 3.18Å; A35-L56 HydrophobicContact CB-CD1 4.08Å; A35-L56 HydrophobicContact CB-CD2 3.69Å; L36-L56 HydrophobicContact CB-CD1 3.71Å; L36-L56 HydrophobicContact CD1-CD1 4.36Å; L56-F58 HydrophobicContact CB-CD2 4.38Å; L56-F58 HydrophobicContact CB-CE2 3.66Å; L56-F58 HydrophobicContact CB-CZ 4.24Å; L56-F58 HydrophobicContact CD1-CE2 4.21Å; L56-F58 HydrophobicContact CD1-CZ 4.15Å; L56-Y74 CarbonylContact O-C 3.52Å; L56-Y74 WeakPolarHBondContact O-CA 3.47Å; L56-V75 HydrophobicContact CB-CB 4.39Å; L56-V75 PolarHBondContact N-O 2.95Å; L56-V75 PolarHBondContact O-N 2.93Å; L56-L77 HydrophobicContact CD1-CD1 3.81Å; L56-L77 HydrophobicContact CD1-CD2 4.02Å; L56-L77 HydrophobicContact CD1-CG 4.13Å; L56-L77 HydrophobicContact CD2-CD1 4.39Å; L56-L77 HydrophobicContact CG-CD1 3.87Å; L56-L77 HydrophobicContact CG-CD2 4.45Å; L56-L77 HydrophobicContact CG-CG 4.1Å
57	K	85.2	Confident	67.6	Low	75 Å²	75	95.3 Å²	95.3	33%	0.326	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.3	-174.9	179.7	176.5	174.3	168.8	0	110	T28 S32 L72 Y74	T28-K57 HydrophobicContact CG2-CB 4.19Å; T28-K57 HydrophobicContact CG2-CD 4.23Å; T28-K57 HydrophobicContact CG2-CG 4.11Å; T28-K57 WeakPolarHBondContact CG2-O 3.39Å; S32-K57 PolarHBondContact OG-O 3.03Å; K57-L72 HydrophobicContact CD-CD1 4.23Å; K57-L72 VanDerWaalsContact CE-CD1 3.42Å; K57-L72 HydrophobicContact CG-CD1 3.76Å; K57-L72 HydrophobicContact CG-CG 4.4Å; K57-Y74 HydrophobicContact CB-CD1 4.41Å; K57-Y74 HydrophobicContact CB-CE1 4.08Å; K57-Y74 HydrophobicContact CD-CE1 4.25Å; K57-Y74 HydrophobicContact CG-CE1 4.11Å
58	F	86.8	Confident	67.8	Low	0 Å²	0	90.4 Å²	90.4	0%	0	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.5	175.7	-60.9	-88.2	0	0	0	112.1	F10 V14 S32 L33 L36 L56 L72 I73 V75	F10-F58 HydrophobicContact CE1-CE1 4.24Å; F10-F58 HydrophobicContact CE1-CZ 4.35Å; F10-F58 HydrophobicContact CZ-CD1 4.01Å; F10-F58 HydrophobicContact CZ-CD2 4.01Å; F10-F58 HydrophobicContact CZ-CE1 4.01Å; F10-F58 HydrophobicContact CZ-CE2 4Å; F10-F58 HydrophobicContact CZ-CG 4.01Å; F10-F58 HydrophobicContact CZ-CZ 4Å; V14-F58 HydrophobicContact CB-CD1 4.24Å; V14-F58 HydrophobicContact CG1-CB 4.03Å; V14-F58 HydrophobicContact CG1-CD1 4.36Å; V14-F58 HydrophobicContact CG1-CG 4.47Å; V14-F58 HydrophobicContact CG2-CD1 4.23Å; S32-F58 WeakPolarHBondContact O-CZ 3.48Å; L33-F58 HydrophobicContact CD2-CE1 3.8Å; L33-F58 HydrophobicContact CG-CE1 3.94Å; L36-F58 HydrophobicContact CB-CZ 4.12Å; L36-F58 HydrophobicContact CD2-CE2 4.49Å; L36-F58 HydrophobicContact CD2-CZ 3.95Å; L56-F58 HydrophobicContact CB-CD2 4.38Å; L56-F58 HydrophobicContact CB-CE2 3.66Å; L56-F58 HydrophobicContact CB-CZ 4.24Å; L56-F58 HydrophobicContact CD1-CE2 4.21Å; L56-F58 HydrophobicContact CD1-CZ 4.15Å; F58-L72 WeakPolarHBondContact O-CD1 3.48Å; F58-I73 HydrophobicContact CB-CD1 4.12Å; F58-I73 HydrophobicContact CB-CG1 3.73Å; F58-I73 HydrophobicContact CD2-CG1 4.49Å; F58-I73 PolarHBondContact N-O 3Å; F58-I73 PolarHBondContact O-N 3.49Å; F58-V75 HydrophobicContact CD2-CB 4.45Å; F58-V75 HydrophobicContact CD2-CG2 3.76Å; F58-V75 HydrophobicContact CE2-CB 4.16Å; F58-V75 HydrophobicContact CE2-CG2 3.84Å
59	F	82.5	Confident	68	Low	36 Å²	36	91.2 Å²	91.2	16%	0.158	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.9	163.6	-63.5	-86.6	0	0	0	108.9	F19 M25 T28 N29 I70 L72	F19-F59 HydrophobicContact CE1-CB 3.88Å; F19-F59 HydrophobicContact CZ-CB 3.97Å; F19-F59 VanDerWaalsContact CZ-O 3.26Å; F19-F59 WeakPolarHBondContact CZ-O 3.47Å; M25-F59 HydrophobicContact CB-CB 4.31Å; M25-F59 HydrophobicContact CB-CD1 4.44Å; M25-F59 HydrophobicContact CB-CD2 3.73Å; M25-F59 HydrophobicContact CB-CE2 4.11Å; M25-F59 HydrophobicContact CB-CG 3.91Å; M25-F59 HydrophobicContact CG-CD1 3.92Å; M25-F59 HydrophobicContact CG-CD2 3.96Å; M25-F59 HydrophobicContact CG-CE1 3.97Å; M25-F59 HydrophobicContact CG-CE2 4.02Å; M25-F59 HydrophobicContact CG-CG 3.9Å; M25-F59 HydrophobicContact CG-CZ 4.02Å; M25-F59 HydrophobicContact SD-CD1 4.01Å; M25-F59 HydrophobicContact SD-CE1 4.39Å; M25-F59 HydrophobicContact SD-CG 4.27Å; T28-F59 HydrophobicContact CG2-CD2 4.31Å; T28-F59 HydrophobicContact CG2-CE2 3.89Å; N29-F59 PolarHBondContact ND2-O 2.71Å; N29-F59 PolarHBondContact OD1-N 3.41Å; F59-I70 HydrophobicContact CB-CG2 4.18Å; F59-I70 HydrophobicContact CD1-CG2 4.15Å; F59-L72 HydrophobicContact CD1-CD1 3.66Å; F59-L72 HydrophobicContact CD2-CD1 4.37Å; F59-L72 HydrophobicContact CE1-CD1 3.58Å; F59-L72 HydrophobicContact CE2-CD1 4.29Å; F59-L72 HydrophobicContact CG-CD1 4.08Å; F59-L72 HydrophobicContact CZ-CD1 3.91Å
60	V	82.1	Confident	68.7	Low	6 Å²	6	84 Å²	84	4%	0.036	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.4	-175.4	-175.1	0	0	0	0	107.9	L13 V14 R71 I73	L13-V60 HydrophobicContact CB-CG1 3.85Å; L13-V60 HydrophobicContact CD1-CG1 3.88Å; L13-V60 HydrophobicContact CG-CG1 4.4Å; V14-V60 HydrophobicContact CG1-CG2 4.22Å; V60-R71 HydrophobicContact CB-CB 4.15Å; V60-R71 PolarHBondContact N-O 3.4Å; V60-R71 PolarHBondContact O-N 3Å; V60-R71 VanDerWaalsContact O-N 3.09Å; V60-I73 HydrophobicContact CG2-CB 4.37Å; V60-I73 HydrophobicContact CG2-CD1 3.6Å; V60-I73 HydrophobicContact CG2-CG1 3.68Å; V60-I73 HydrophobicContact CG2-CG2 3.89Å
61	R	76.1	Confident	69.4	Low	99 Å²	99	86 Å²	86	37%	0.374	45%	0.447	S	S	.	.			trans	-62.2	150.9	178	80.6	-177.7	-168.9	81.5	-5.1	110.9	F12 L13 F19 T63	F12-R61 WeakPolarHBondContact O-CD 3.35Å; F12-R61 PolarHBondContact O-NE 3.29Å; F12-R61 VanDerWaalsContact O-NE 3.11Å; L13-R61 HydrophobicContact CD2-CG 3.96Å; L13-R61 PolarHBondContact O-N 2.99Å; F19-R61 HydrophobicContact CZ-CB 4.39Å; R61-T63 PolarHBondContact O-N 3.35Å
62	P	69	Low	70.4	Confident	42 Å²	42	79.6 Å²	79.6	27%	0.273	42%	0.422	S	S	.	.			trans	-58.7	135.1	172.1	-19.5	30.6	0	0	0	111.5	G68 I70	P62-G68 VanDerWaalsContact CG-O 3.28Å; P62-G68 WeakPolarHBondContact CG-O 3.25Å; P62-I70 HydrophobicContact CG-CG1 4.42Å
63	T	63.6	Low	71.5	Confident	55 Å²	55	78.8 Å²	78.8	34%	0.337	42%	0.415	S	S	.	.			trans	-108.6	167.3	164.5	48.4	0	0	0	0	109.9	L13 R61 A65 T66	L13-T63 HydrophobicContact CD2-CG2 3.49Å; L13-T63 VanDerWaalsContact CD2-CG2 3.49Å; R61-T63 PolarHBondContact O-N 3.35Å; T63-A65 PolarHBondContact O-N 3.48Å; T63-A65 VanDerWaalsContact O-N 3.15Å; T63-T66 PolarHBondContact N-OG1 2.68Å; T63-T66 CarbonylContact O-C 3.16Å; T63-T66 WeakPolarHBondContact O-CA 3.5Å; T63-T66 PolarHBondContact O-N 3.28Å; T63-T66 PolarHBondContact O-OG1 2.93Å; T63-T66 PolarHBondContact OG1-OG1 3.13Å
64	E	58.4	Low	72.8	Confident	204 Å²	204	77.2 Å²	77.2	95%	0.953	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.3	-177.4	-64.9	175.1	174	0	0	113.5	T66	E64-T66 PolarHBondContact O-N 2.66Å
65	A	56.2	Low	73.5	Confident	97 Å²	97	69.3 Å²	69.3	80%	0.802	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.3	174.7	0	0	0	0	0	114	T63	T63-A65 PolarHBondContact O-N 3.48Å; T63-A65 VanDerWaalsContact O-N 3.15Å
66	T	52.3	Low	73.4	Confident	24 Å²	24	70.1 Å²	70.1	15%	0.147	36%	0.359	C	S	.	.	S	Bend	trans	-120.1	105.1	-176.5	55.4	0	0	0	0	109.3	T63 E64 G68	T63-T66 PolarHBondContact N-OG1 2.68Å; T63-T66 CarbonylContact O-C 3.16Å; T63-T66 WeakPolarHBondContact O-CA 3.5Å; T63-T66 PolarHBondContact O-N 3.28Å; T63-T66 PolarHBondContact O-OG1 2.93Å; T63-T66 PolarHBondContact OG1-OG1 3.13Å; E64-T66 PolarHBondContact O-N 2.66Å; T66-G68 VanDerWaalsContact C-N 3.29Å; T66-G68 PolarHBondContact O-N 3.34Å
67	R	54.4	Low	73	Confident	245 Å²	245	69.8 Å²	69.8	93%	0.925	36%	0.358	S	S	*	.			trans	-59.9	76.6	-171.4	-62.9	-179.6	-179.1	177.1	-0.4	114.1	T69	R67-T69 VanDerWaalsContact C-N 3.29Å; R67-T69 PolarHBondContact O-N 2.88Å
68	G	63.1	Low	72.1	Confident	63 Å²	63	70.9 Å²	70.9	65%	0.649	37%	0.371	S	S	*	.	S	Bend	trans	75.3	-8.6	170.8	0	0	0	0	0	117.4	P62 T66	P62-G68 VanDerWaalsContact CG-O 3.28Å; P62-G68 WeakPolarHBondContact CG-O 3.25Å; T66-G68 VanDerWaalsContact C-N 3.29Å; T66-G68 PolarHBondContact O-N 3.34Å
69	T	69.3	Low	71	Confident	93 Å²	93	72.8 Å²	72.8	57%	0.571	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-90.6	133.5	-173.4	51.4	0	0	0	0	113.6	R67 R71	R67-T69 VanDerWaalsContact C-N 3.29Å; R67-T69 PolarHBondContact O-N 2.88Å; T69-R71 PolarHBondContact O-N 3.45Å
70	I	76.2	Confident	70.1	Confident	68 Å²	68	75.9 Å²	75.9	35%	0.349	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-68	121.8	172.5	-63.2	170.6	0	0	0	108.1	F19 M25 F59 P62	F19-I70 HydrophobicContact CE1-CD1 4.45Å; F19-I70 HydrophobicContact CE1-CG2 4.19Å; M25-I70 HydrophobicContact CE-CD1 4.21Å; M25-I70 HydrophobicContact SD-CD1 3.95Å; M25-I70 HydrophobicContact SD-CG2 4.49Å; F59-I70 HydrophobicContact CB-CG2 4.18Å; F59-I70 HydrophobicContact CD1-CG2 4.15Å; P62-I70 HydrophobicContact CG-CG1 4.42Å
71	R	77.3	Confident	69.3	Low	81 Å²	81	78.3 Å²	78.3	31%	0.306	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	147	177.4	-77.2	175.3	61.9	-169	-1.6	110.6	V60 T69 K92 S94	V60-R71 HydrophobicContact CB-CB 4.15Å; V60-R71 PolarHBondContact N-O 3.4Å; V60-R71 PolarHBondContact O-N 3Å; V60-R71 VanDerWaalsContact O-N 3.09Å; T69-R71 PolarHBondContact O-N 3.45Å; R71-K92 PolarHBondContact NH2-O 3.3Å; R71-S94 PolarHBondContact NH1-OG 2.87Å; R71-S94 PolarHBondContact NH2-OG 2.86Å
72	L	81.2	Confident	68.9	Low	71 Å²	71	75 Å²	75	37%	0.372	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.5	170.1	-168.1	74.2	0	0	0	109.3	K57 F58 F59 Y74	K57-L72 HydrophobicContact CD-CD1 4.23Å; K57-L72 VanDerWaalsContact CE-CD1 3.42Å; K57-L72 HydrophobicContact CG-CD1 3.76Å; K57-L72 HydrophobicContact CG-CG 4.4Å; F58-L72 WeakPolarHBondContact O-CD1 3.48Å; F59-L72 HydrophobicContact CD1-CD1 3.66Å; F59-L72 HydrophobicContact CD2-CD1 4.37Å; F59-L72 HydrophobicContact CE1-CD1 3.58Å; F59-L72 HydrophobicContact CE2-CD1 4.29Å; F59-L72 HydrophobicContact CG-CD1 4.08Å; F59-L72 HydrophobicContact CZ-CD1 3.91Å; L72-Y74 HydrophobicContact CD2-CE2 3.53Å; L72-Y74 HydrophobicContact CG-CE2 4.05Å
73	I	82.5	Confident	68.9	Low	11 Å²	11	80.9 Å²	80.9	6%	0.056	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.6	174.7	65.1	175.7	0	0	0	110.9	F10 F58 V60 V75 C93	F10-I73 HydrophobicContact CE2-CD1 3.98Å; F58-I73 HydrophobicContact CB-CD1 4.12Å; F58-I73 HydrophobicContact CB-CG1 3.73Å; F58-I73 HydrophobicContact CD2-CG1 4.49Å; F58-I73 PolarHBondContact N-O 3Å; F58-I73 PolarHBondContact O-N 3.49Å; V60-I73 HydrophobicContact CG2-CB 4.37Å; V60-I73 HydrophobicContact CG2-CD1 3.6Å; V60-I73 HydrophobicContact CG2-CG1 3.68Å; V60-I73 HydrophobicContact CG2-CG2 3.89Å; I73-V75 HydrophobicContact CD1-CG2 4.39Å; I73-C93 WeakPolarHBondContact CD1-SG 3.5Å
74	Y	82.1	Confident	69.1	Low	116 Å²	116	82.7 Å²	82.7	46%	0.455	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.3	177.9	-76.4	-85.4	0	0	0	109.2	L56 K57 L72 K92	L56-Y74 CarbonylContact O-C 3.52Å; L56-Y74 WeakPolarHBondContact O-CA 3.47Å; K57-Y74 HydrophobicContact CB-CD1 4.41Å; K57-Y74 HydrophobicContact CB-CE1 4.08Å; K57-Y74 HydrophobicContact CD-CE1 4.25Å; K57-Y74 HydrophobicContact CG-CE1 4.11Å; L72-Y74 HydrophobicContact CD2-CE2 3.53Å; L72-Y74 HydrophobicContact CG-CE2 4.05Å; Y74-K92 WeakPolarHBondContact O-CD 3.45Å; Y74-K92 WeakPolarHBondContact O-CE 3.1Å; Y74-K92 PolarHBondContact O-NZ 3Å
75	V	81.6	Confident	69.8	Low	0 Å²	0	73 Å²	73	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	100	-175.5	-176.4	0	0	0	0	108.7	L56 F58 I73 L77 L85 L89	L56-V75 HydrophobicContact CB-CB 4.39Å; L56-V75 PolarHBondContact N-O 2.95Å; L56-V75 PolarHBondContact O-N 2.93Å; F58-V75 HydrophobicContact CD2-CB 4.45Å; F58-V75 HydrophobicContact CD2-CG2 3.76Å; F58-V75 HydrophobicContact CE2-CB 4.16Å; F58-V75 HydrophobicContact CE2-CG2 3.84Å; I73-V75 HydrophobicContact CD1-CG2 4.39Å; V75-L77 HydrophobicContact CG1-CD2 4.38Å; V75-L77 PolarHBondContact O-N 3.42Å; V75-L85 HydrophobicContact CG1-CD1 4.36Å; V75-L89 HydrophobicContact CB-CD2 4.26Å; V75-L89 HydrophobicContact CG1-CD2 3.66Å; V75-L89 HydrophobicContact CG1-CG 4.11Å; V75-L89 HydrophobicContact CG2-CD2 3.63Å
76	D	77	Confident	70.6	Confident	68 Å²	68	68.6 Å²	68.6	36%	0.364	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	114.9	177.6	-41.3	-67.6	0	0	0	108.7	S55 V78 K92	S55-D76 WeakPolarHBondContact CB-OD1 3.43Å; S55-D76 PolarHBondContact OG-OD1 2.59Å; D76-V78 HydrophobicContact CB-CG2 3.73Å; D76-V78 WeakPolarHBondContact O-CG2 3.4Å; D76-V78 PolarHBondContact O-N 2.85Å; D76-K92 IonicContact OD2-NZ 3.92Å; D76-K92 PolarHBondContact OD2-NZ 3.37Å
77	L	75.7	Confident	71.4	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.058	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	59.1	-178.6	-61.4	178.7	0	0	0	110.9	L36 Y39 S52 L56 V75 L85	L36-L77 HydrophobicContact CD1-CD2 3.78Å; Y39-L77 HydrophobicContact CD1-CB 4.17Å; Y39-L77 HydrophobicContact CD1-CD1 4.33Å; Y39-L77 HydrophobicContact CD1-CD2 3.78Å; Y39-L77 HydrophobicContact CD1-CG 4.32Å; Y39-L77 HydrophobicContact CD2-CB 4.22Å; Y39-L77 HydrophobicContact CD2-CD1 4.07Å; Y39-L77 HydrophobicContact CE1-CB 4Å; Y39-L77 HydrophobicContact CE1-CD2 4.22Å; Y39-L77 HydrophobicContact CE2-CB 4.07Å; Y39-L77 HydrophobicContact CG-CB 4.28Å; Y39-L77 HydrophobicContact CG-CD1 3.86Å; Y39-L77 HydrophobicContact CG-CD2 4.16Å; Y39-L77 HydrophobicContact CG-CG 4.34Å; Y39-L77 PolarHBondContact OH-O 2.75Å; S52-L77 WeakPolarHBondContact CB-O 3.06Å; S52-L77 WeakPolarHBondContact OG-CB 3.09Å; S52-L77 PolarHBondContact OG-O 3.33Å; L56-L77 HydrophobicContact CD1-CD1 3.81Å; L56-L77 HydrophobicContact CD1-CD2 4.02Å; L56-L77 HydrophobicContact CD1-CG 4.13Å; L56-L77 HydrophobicContact CD2-CD1 4.39Å; L56-L77 HydrophobicContact CG-CD1 3.87Å; L56-L77 HydrophobicContact CG-CD2 4.45Å; L56-L77 HydrophobicContact CG-CG 4.1Å; V75-L77 HydrophobicContact CG1-CD2 4.38Å; V75-L77 PolarHBondContact O-N 3.42Å; L77-L85 HydrophobicContact CD2-CD1 4.03Å
78	V	66.6	Low	72.1	Confident	99 Å²	99	62.4 Å²	62.4	60%	0.6	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-23.8	-178.2	-110.7	0	0	0	0	113.3	D76	D76-V78 HydrophobicContact CB-CG2 3.73Å; D76-V78 WeakPolarHBondContact O-CG2 3.4Å; D76-V78 PolarHBondContact O-N 2.85Å
79	D	64.4	Low	72.7	Confident	39 Å²	39	59.5 Å²	59.5	21%	0.209	30%	0.3	C	S	.	.			trans	-69.3	133.6	-174.1	-65.1	-57.9	0	0	0	112.6	Y39 L84 L85	Y39-D79 PolarHBondContact OH-O 3.29Å; D79-L84 HydrophobicContact CB-CB 4.18Å; D79-L85 HydrophobicContact CB-CB 4.06Å; D79-L85 WeakPolarHBondContact OD2-CA 3.34Å
80	T	62.1	Low	72.9	Confident	101 Å²	101	55.2 Å²	55.2	62%	0.62	27%	0.273	S	S	*	.	S	Bend	trans	-88.6	-22.5	174.4	-43.7	0	0	0	0	112.7	P50	P50-T80 HydrophobicContact CG-CG2 4.39Å
81	D	66.2	Low	72.7	Confident	57 Å²	57	55 Å²	55	31%	0.305	28%	0.278	S	S	.	.	S	Bend	trans	-98.5	122.8	174.6	-173.8	-20.1	0	0	0	110.2	R83 L84 L85	D81-R83 PolarHBondContact O-N 2.87Å; D81-R83 VanDerWaalsContact O-N 3.08Å; D81-R83 WeakPolarHBondContact OD1-CB 3.5Å; D81-R83 WeakPolarHBondContact OD1-CG 3.26Å; D81-R83 PolarHBondContact OD1-N 3.2Å; D81-R83 IonicContact OD1-NH1 3.87Å; D81-R83 IonicContact OD2-NH1 2.93Å; D81-L84 HydrophobicContact CB-CB 4.34Å; D81-L84 HydrophobicContact CB-CD1 4.05Å; D81-L84 HydrophobicContact CB-CG 4.02Å; D81-L84 PolarHBondContact O-N 3.49Å; D81-L85 PolarHBondContact O-N 3.37Å; D81-L85 VanDerWaalsContact O-N 3.17Å
82	P	68.5	Low	72.4	Confident	29 Å²	29	54.3 Å²	54.3	19%	0.188	28%	0.277	C	S	.	.	H	α-helix	trans	-48.4	-31.9	171.3	-29.5	35.2	0	0	0	115.1	Y40 L43 V86	Y40-P82 HydrophobicContact CD2-CB 4.32Å; Y40-P82 HydrophobicContact CE2-CB 3.73Å; L43-P82 HydrophobicContact CB-CG 3.88Å; L43-P82 HydrophobicContact CD1-CG 4.03Å; P82-V86 VanDerWaalsContact O-CG2 3.28Å; P82-V86 WeakPolarHBondContact O-CG2 3.19Å; P82-V86 PolarHBondContact O-N 3.46Å; P82-V86 VanDerWaalsContact O-N 3.13Å
83	R	68.4	Low	71.8	Confident	166 Å²	166	51.3 Å²	51.3	63%	0.626	26%	0.262	S	S	*	.	H	α-helix	trans	-68.7	-41.5	177.4	-63	-175.2	-178.1	90.3	-6.7	112.2	L3 D81 V86 K87	L3-R83 HydrophobicContact CD1-CG 4.04Å; L3-R83 HydrophobicContact CD2-CG 4.23Å; D81-R83 PolarHBondContact O-N 2.87Å; D81-R83 VanDerWaalsContact O-N 3.08Å; D81-R83 WeakPolarHBondContact OD1-CB 3.5Å; D81-R83 WeakPolarHBondContact OD1-CG 3.26Å; D81-R83 PolarHBondContact OD1-N 3.2Å; D81-R83 IonicContact OD1-NH1 3.87Å; D81-R83 IonicContact OD2-NH1 2.93Å; R83-V86 PolarHBondContact O-N 2.87Å; R83-K87 PolarHBondContact O-N 2.88Å
84	L	67.8	Low	70.9	Confident	93 Å²	93	54.7 Å²	54.7	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-67.4	-42.5	178.3	-66.1	177.7	0	0	0	110.4	D79 D81 V86 K87 S88	D79-L84 HydrophobicContact CB-CB 4.18Å; D81-L84 HydrophobicContact CB-CB 4.34Å; D81-L84 HydrophobicContact CB-CD1 4.05Å; D81-L84 HydrophobicContact CB-CG 4.02Å; D81-L84 PolarHBondContact O-N 3.49Å; L84-V86 VanDerWaalsContact C-N 3.34Å; L84-V86 PolarHBondContact O-N 3.25Å; L84-K87 PolarHBondContact O-N 3.23Å; L84-K87 VanDerWaalsContact O-N 3.15Å; L84-S88 VanDerWaalsContact O-CB 3.3Å; L84-S88 WeakPolarHBondContact O-CB 3.35Å; L84-S88 PolarHBondContact O-N 2.85Å
85	L	73.3	Confident	69.9	Low	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.3	-45.5	173.9	-179.1	63.9	0	0	0	112.1	L36 Y39 Y40 L43 V75 L77 D79 D81 S88 L89	L36-L85 HydrophobicContact CD1-CD2 4.17Å; Y39-L85 HydrophobicContact CD1-CD2 3.74Å; Y39-L85 HydrophobicContact CE1-CD2 3.95Å; Y40-L85 HydrophobicContact CD2-CD2 4.35Å; L43-L85 HydrophobicContact CD1-CD2 4.12Å; V75-L85 HydrophobicContact CG1-CD1 4.36Å; L77-L85 HydrophobicContact CD2-CD1 4.03Å; D79-L85 HydrophobicContact CB-CB 4.06Å; D79-L85 WeakPolarHBondContact OD2-CA 3.34Å; D81-L85 PolarHBondContact O-N 3.37Å; D81-L85 VanDerWaalsContact O-N 3.17Å; L85-S88 PolarHBondContact O-N 3.24Å; L85-L89 HydrophobicContact CD1-CD1 4.47Å; L85-L89 HydrophobicContact CG-CD1 4.12Å; L85-L89 WeakPolarHBondContact O-CB 3.19Å; L85-L89 WeakPolarHBondContact O-CD1 3.25Å; L85-L89 VanDerWaalsContact O-CG 3.31Å; L85-L89 WeakPolarHBondContact O-CG 3.4Å; L85-L89 PolarHBondContact O-N 3.33Å
86	V	72.1	Confident	68.4	Low	6 Å²	6	54.4 Å²	54.4	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-40.5	177.1	170	0	0	0	0	111.6	L3 A6 L7 Y40 P82 R83 L84 L89 L90	L3-V86 HydrophobicContact CD2-CB 4.38Å; L3-V86 HydrophobicContact CD2-CG1 4.36Å; L3-V86 HydrophobicContact CD2-CG2 4.31Å; A6-V86 HydrophobicContact CB-CG1 3.49Å; A6-V86 VanDerWaalsContact CB-CG1 3.49Å; L7-V86 HydrophobicContact CD1-CG2 4.41Å; L7-V86 HydrophobicContact CD2-CG2 3.97Å; L7-V86 HydrophobicContact CG-CG2 4.02Å; Y40-V86 HydrophobicContact CE2-CG2 3.92Å; P82-V86 VanDerWaalsContact O-CG2 3.28Å; P82-V86 WeakPolarHBondContact O-CG2 3.19Å; P82-V86 PolarHBondContact O-N 3.46Å; P82-V86 VanDerWaalsContact O-N 3.13Å; R83-V86 PolarHBondContact O-N 2.87Å; L84-V86 VanDerWaalsContact C-N 3.34Å; L84-V86 PolarHBondContact O-N 3.25Å; V86-L89 WeakPolarHBondContact O-CB 3.27Å; V86-L89 PolarHBondContact O-N 3.19Å; V86-L90 HydrophobicContact CG1-CD1 4.15Å; V86-L90 WeakPolarHBondContact O-CG 3.23Å; V86-L90 PolarHBondContact O-N 3.45Å
87	K	68.5	Low	66.8	Low	109 Å²	109	55.3 Å²	55.3	47%	0.474	30%	0.302	S	S	.	.	H	α-helix	trans	-66.8	-40.3	175.9	-163.1	-178.4	-175.4	-174.2	0	112.5	R83 L84 L90 S91 D97	R83-K87 PolarHBondContact O-N 2.88Å; L84-K87 PolarHBondContact O-N 3.23Å; L84-K87 VanDerWaalsContact O-N 3.15Å; K87-L90 PolarHBondContact O-N 2.96Å; K87-S91 WeakPolarHBondContact O-CB 3.29Å; K87-S91 PolarHBondContact O-N 3.44Å; K87-S91 PolarHBondContact O-OG 3.11Å; K87-D97 WeakPolarHBondContact CE-OD2 3.46Å; K87-D97 HydrophobicContact CG-CB 4.4Å; K87-D97 WeakPolarHBondContact CG-OD1 3.36Å; K87-D97 IonicContact NZ-OD2 3.39Å
88	S	69.9	Low	64.9	Low	30 Å²	30	58.7 Å²	58.7	21%	0.21	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-42.8	174	-177.2	0	0	0	0	111.4	L84 L85 S91 K92	L84-S88 VanDerWaalsContact O-CB 3.3Å; L84-S88 WeakPolarHBondContact O-CB 3.35Å; L84-S88 PolarHBondContact O-N 2.85Å; L85-S88 PolarHBondContact O-N 3.24Å; S88-S91 PolarHBondContact O-OG 3.41Å; S88-S91 VanDerWaalsContact O-OG 3.14Å; S88-K92 VanDerWaalsContact O-CB 3.31Å; S88-K92 WeakPolarHBondContact O-CB 3.48Å; S88-K92 VanDerWaalsContact O-CG 3.3Å; S88-K92 WeakPolarHBondContact O-CG 3.42Å; S88-K92 PolarHBondContact O-N 2.91Å; S88-K92 VanDerWaalsContact O-N 3.08Å
89	L	76.4	Confident	63.6	Low	2 Å²	2	55.9 Å²	55.9	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-62.7	-48.3	174.3	-80.2	161.7	0	0	0	112.8	L7 F10 L36 V75 L85 V86 C93	L7-L89 HydrophobicContact CD2-CD1 3.84Å; F10-L89 HydrophobicContact CD2-CB 4.42Å; F10-L89 HydrophobicContact CD2-CD2 3.98Å; F10-L89 HydrophobicContact CE1-CD2 4.28Å; F10-L89 HydrophobicContact CE2-CD2 3.52Å; F10-L89 HydrophobicContact CZ-CD2 3.69Å; L36-L89 HydrophobicContact CD1-CD1 4.13Å; L36-L89 HydrophobicContact CD2-CD1 4Å; L36-L89 HydrophobicContact CD2-CD2 4.08Å; V75-L89 HydrophobicContact CB-CD2 4.26Å; V75-L89 HydrophobicContact CG1-CD2 3.66Å; V75-L89 HydrophobicContact CG1-CG 4.11Å; V75-L89 HydrophobicContact CG2-CD2 3.63Å; L85-L89 HydrophobicContact CD1-CD1 4.47Å; L85-L89 HydrophobicContact CG-CD1 4.12Å; L85-L89 WeakPolarHBondContact O-CB 3.19Å; L85-L89 WeakPolarHBondContact O-CD1 3.25Å; L85-L89 VanDerWaalsContact O-CG 3.31Å; L85-L89 WeakPolarHBondContact O-CG 3.4Å; L85-L89 PolarHBondContact O-N 3.33Å; V86-L89 WeakPolarHBondContact O-CB 3.27Å; V86-L89 PolarHBondContact O-N 3.19Å; L89-C93 WeakPolarHBondContact O-CB 3.08Å; L89-C93 PolarHBondContact O-N 3.11Å; L89-C93 VanDerWaalsContact O-N 3.11Å
90	L	71.9	Confident	62	Low	2 Å²	2	57.1 Å²	57.1	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-48.6	-178.6	-70	174.6	0	0	0	111.5	A6 V86 K87 K92 C93 S94 L95 D97	A6-L90 HydrophobicContact CB-CD1 4.26Å; V86-L90 HydrophobicContact CG1-CD1 4.15Å; V86-L90 WeakPolarHBondContact O-CG 3.23Å; V86-L90 PolarHBondContact O-N 3.45Å; K87-L90 PolarHBondContact O-N 2.96Å; L90-K92 PolarHBondContact O-N 3Å; L90-C93 CarbonylContact O-C 3.53Å; L90-C93 WeakPolarHBondContact O-CB 3.38Å; L90-C93 PolarHBondContact O-N 3.11Å; L90-C93 VanDerWaalsContact O-N 3.11Å; L90-S94 PolarHBondContact O-N 3.39Å; L90-L95 CarbonylContact C-O 3.1Å; L90-L95 HydrophobicContact CB-CB 4.2Å; L90-L95 HydrophobicContact CD2-CB 3.75Å; L90-L95 HydrophobicContact CD2-CD1 3.65Å; L90-L95 HydrophobicContact CD2-CG 4.37Å; L90-L95 PolarHBondContact O-N 2.83Å; L90-D97 WeakPolarHBondContact CD1-O 3.41Å
91	S	72.1	Confident	60.7	Low	65 Å²	65	58.6 Å²	58.6	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-60.8	-43.2	178.4	56.7	0	0	0	0	112.7	K87 S88 C93 S94	K87-S91 WeakPolarHBondContact O-CB 3.29Å; K87-S91 PolarHBondContact O-N 3.44Å; K87-S91 PolarHBondContact O-OG 3.11Å; S88-S91 PolarHBondContact O-OG 3.41Å; S88-S91 VanDerWaalsContact O-OG 3.14Å; S91-C93 VanDerWaalsContact C-N 3.3Å; S91-C93 PolarHBondContact O-N 3.47Å; S91-S94 PolarHBondContact O-N 2.92Å
92	K	72.1	Confident	59.3	Low	66 Å²	66	59.8 Å²	59.8	29%	0.287	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-32.7	173.8	-76.1	178.1	168.8	-174.9	0	113.4	R71 Y74 D76 S88 L90 S94	R71-K92 PolarHBondContact NH2-O 3.3Å; Y74-K92 WeakPolarHBondContact O-CD 3.45Å; Y74-K92 WeakPolarHBondContact O-CE 3.1Å; Y74-K92 PolarHBondContact O-NZ 3Å; D76-K92 IonicContact OD2-NZ 3.92Å; D76-K92 PolarHBondContact OD2-NZ 3.37Å; S88-K92 VanDerWaalsContact O-CB 3.31Å; S88-K92 WeakPolarHBondContact O-CB 3.48Å; S88-K92 VanDerWaalsContact O-CG 3.3Å; S88-K92 WeakPolarHBondContact O-CG 3.42Å; S88-K92 PolarHBondContact O-N 2.91Å; S88-K92 VanDerWaalsContact O-N 3.08Å; L90-K92 PolarHBondContact O-N 3Å; K92-S94 VanDerWaalsContact C-N 3.26Å; K92-S94 PolarHBondContact O-N 2.98Å
93	C	68.9	Low	57.5	Low	7 Å²	7	65.8 Å²	65.8	5%	0.047	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.1	172.6	-78.4	0	0	0	0	114.5	F10 L13 I73 L89 L90 S91 L95	F10-C93 VanDerWaalsContact CD2-SG 3.55Å; L13-C93 HydrophobicContact CD1-CB 4.3Å; I73-C93 WeakPolarHBondContact CD1-SG 3.5Å; L89-C93 WeakPolarHBondContact O-CB 3.08Å; L89-C93 PolarHBondContact O-N 3.11Å; L89-C93 VanDerWaalsContact O-N 3.11Å; L90-C93 CarbonylContact O-C 3.53Å; L90-C93 WeakPolarHBondContact O-CB 3.38Å; L90-C93 PolarHBondContact O-N 3.11Å; L90-C93 VanDerWaalsContact O-N 3.11Å; S91-C93 VanDerWaalsContact C-N 3.3Å; S91-C93 PolarHBondContact O-N 3.47Å; C93-L95 HydrophobicContact CB-CB 4.36Å; C93-L95 HydrophobicContact CB-CD1 3.73Å; C93-L95 HydrophobicContact CB-CG 3.8Å; C93-L95 PolarHBondContact O-N 3.33Å
94	S	62.5	Low	56	Low	83 Å²	83	63.1 Å²	63.1	58%	0.58	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	29.1	-168.7	-44.8	0	0	0	0	112.9	R71 L90 S91 K92	R71-S94 PolarHBondContact NH1-OG 2.87Å; R71-S94 PolarHBondContact NH2-OG 2.86Å; L90-S94 PolarHBondContact O-N 3.39Å; S91-S94 PolarHBondContact O-N 2.92Å; K92-S94 VanDerWaalsContact C-N 3.26Å; K92-S94 PolarHBondContact O-N 2.98Å
95	L	60.7	Low	54.5	Low	34 Å²	34	61.9 Å²	61.9	18%	0.178	34%	0.343	C	S	.	.			trans	-91.9	146.7	172.2	-69.3	170	0	0	0	109.4	L13 L90 C93 D97	L13-L95 HydrophobicContact CD1-CD1 3.85Å; L13-L95 HydrophobicContact CD1-CD2 4.12Å; L13-L95 HydrophobicContact CD1-CG 4.07Å; L90-L95 CarbonylContact C-O 3.1Å; L90-L95 HydrophobicContact CB-CB 4.2Å; L90-L95 HydrophobicContact CD2-CB 3.75Å; L90-L95 HydrophobicContact CD2-CD1 3.65Å; L90-L95 HydrophobicContact CD2-CG 4.37Å; L90-L95 PolarHBondContact O-N 2.83Å; C93-L95 HydrophobicContact CB-CB 4.36Å; C93-L95 HydrophobicContact CB-CD1 3.73Å; C93-L95 HydrophobicContact CB-CG 3.8Å; C93-L95 PolarHBondContact O-N 3.33Å; L95-D97 PolarHBondContact O-N 2.87Å
96	P	50.1	Low	52.4	Low	76 Å²	76	65.7 Å²	65.7	49%	0.494	36%	0.362	S	S	.	.			trans	-65.1	136.3	178.2	28.4	-35.3	0	0	0	111.2	S98 I99	P96-S98 WeakPolarHBondContact CB-O 3.1Å; P96-S98 CarbonylContact O-C 3.56Å; P96-S98 PolarHBondContact O-N 3.48Å; P96-S98 VanDerWaalsContact O-N 3.12Å; P96-I99 PolarHBondContact O-N 3.46Å
97	D	45.2	Very low	50.3	Low	87 Å²	87	70.5 Å²	70.5	47%	0.465	39%	0.385	S	S	.	.	S	Bend	trans	-53.3	-33.9	-174.9	-80.9	-18.7	0	0	0	113.7	K87 L90 L95	K87-D97 WeakPolarHBondContact CE-OD2 3.46Å; K87-D97 HydrophobicContact CG-CB 4.4Å; K87-D97 WeakPolarHBondContact CG-OD1 3.36Å; K87-D97 IonicContact NZ-OD2 3.39Å; L90-D97 WeakPolarHBondContact CD1-O 3.41Å; L95-D97 PolarHBondContact O-N 2.87Å
98	S	35.8	Very low	48.5	Very low	82 Å²	82	74.5 Å²	74.5	57%	0.573	40%	0.397	S	S	*	.	S	Bend	trans	-105.6	122.5	153.5	57.6	0	0	0	0	107.5	P96 P100	P96-S98 WeakPolarHBondContact CB-O 3.1Å; P96-S98 CarbonylContact O-C 3.56Å; P96-S98 PolarHBondContact O-N 3.48Å; P96-S98 VanDerWaalsContact O-N 3.12Å; S98-P100 WeakPolarHBondContact O-CD 3.45Å; S98-P100 VanDerWaalsContact O-N 3.13Å
99	I	39	Very low	46.7	Very low	39 Å²	39	75.7 Å²	75.7	20%	0.2	40%	0.404	C	S	.	.			trans	-53.9	121.1	146.3	-50.2	165.8	0	0	0	104	G5 S9 P96 M101	G5-I99 WeakPolarHBondContact O-CD1 3.06Å; S9-I99 WeakPolarHBondContact OG-CD1 3.24Å; S9-I99 WeakPolarHBondContact OG-CG1 3.35Å; P96-I99 PolarHBondContact O-N 3.46Å; I99-M101 PolarHBondContact O-N 2.91Å
100	P	30.8	Very low	44.4	Very low	66 Å²	66	80.3 Å²	80.3	43%	0.429	43%	0.428	S	S	.	.			trans	-62.2	99.1	157	-7	24.1	0	0	0	102.7	S98 D102 R103	S98-P100 WeakPolarHBondContact O-CD 3.45Å; S98-P100 VanDerWaalsContact O-N 3.13Å; P100-D102 PolarHBondContact O-N 3.24Å; P100-R103 HydrophobicContact CB-CB 4.49Å; P100-R103 PolarHBondContact O-N 2.75Å
101	M	34	Very low	42.2	Very low	131 Å²	131	82.9 Å²	82.9	65%	0.645	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.8	134.6	171.1	-99.9	-70.2	-66.9	0	0	105.6	I99	I99-M101 PolarHBondContact O-N 2.91Å
102	D	37	Very low	40.3	Very low	83 Å²	83	86.1 Å²	86.1	44%	0.444	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	21.8	-177.7	-64	-60.3	0	0	0	115.1	P100 V104 V105 L106	P100-D102 PolarHBondContact O-N 3.24Å; D102-V104 PolarHBondContact O-N 2.94Å; D102-V105 HydrophobicContact CB-CB 3.56Å; D102-V105 HydrophobicContact CB-CG1 3.78Å; D102-V105 HydrophobicContact CB-CG2 4.32Å; D102-V105 CarbonylContact O-C 3.54Å; D102-V105 WeakPolarHBondContact O-CA 3.28Å; D102-V105 VanDerWaalsContact O-CB 3.27Å; D102-V105 WeakPolarHBondContact O-CB 3.27Å; D102-V105 PolarHBondContact O-N 2.86Å; D102-V105 WeakPolarHBondContact OD1-CG2 3.36Å; D102-L106 WeakPolarHBondContact O-CA 3.34Å; D102-L106 VanDerWaalsContact O-CB 3.25Å; D102-L106 WeakPolarHBondContact O-CB 3.44Å; D102-L106 PolarHBondContact O-N 3.04Å
103	R	31.6	Very low	38.3	Very low	154 Å²	154	89.7 Å²	89.7	58%	0.581	48%	0.482	S	S	*	.	H	α-helix	trans	-54	-45.8	172.7	-171.3	-172.4	164.3	135.6	-0.4	113.7	P100 V105 L106 E107	P100-R103 HydrophobicContact CB-CB 4.49Å; P100-R103 PolarHBondContact O-N 2.75Å; R103-V105 PolarHBondContact O-N 2.78Å; R103-L106 CarbonylContact O-C 3.58Å; R103-L106 WeakPolarHBondContact O-CA 3.45Å; R103-L106 WeakPolarHBondContact O-CB 3.36Å; R103-L106 PolarHBondContact O-N 3.34Å; R103-E107 IonicContact CZ-OE1 2.66Å; R103-E107 VanDerWaalsContact CZ-OE1 3.22Å; R103-E107 IonicContact NE-OE1 2.68Å; R103-E107 PolarHBondContact NE-OE1 3.34Å; R103-E107 IonicContact NH2-OE1 3Å; R103-E107 PolarHBondContact NH2-OE1 2.93Å; R103-E107 PolarHBondContact O-N 2.67Å
104	V	35.6	Very low	36.6	Very low	111 Å²	111	98.1 Å²	98.1	67%	0.673	52%	0.518	S	S	*	.	H	α-helix	trans	-67.1	-24	174.5	172.7	0	0	0	0	111.9	D102 R108	D102-V104 PolarHBondContact O-N 2.94Å; V104-R108 PolarHBondContact O-N 3.15Å
105	V	36.7	Very low	35.2	Very low	67 Å²	67	104 Å²	104	41%	0.406	53%	0.528	S	S	.	.	H	α-helix	trans	-81.3	-20.6	169.9	165.8	0	0	0	0	111	D102 R103 R108 C109	D102-V105 HydrophobicContact CB-CB 3.56Å; D102-V105 HydrophobicContact CB-CG1 3.78Å; D102-V105 HydrophobicContact CB-CG2 4.32Å; D102-V105 CarbonylContact O-C 3.54Å; D102-V105 WeakPolarHBondContact O-CA 3.28Å; D102-V105 VanDerWaalsContact O-CB 3.27Å; D102-V105 WeakPolarHBondContact O-CB 3.27Å; D102-V105 PolarHBondContact O-N 2.86Å; D102-V105 WeakPolarHBondContact OD1-CG2 3.36Å; R103-V105 PolarHBondContact O-N 2.78Å; V105-R108 CarbonylContact O-C 3.56Å; V105-R108 WeakPolarHBondContact O-CA 3.23Å; V105-R108 WeakPolarHBondContact O-CB 3.31Å; V105-R108 PolarHBondContact O-N 2.98Å; V105-C109 WeakPolarHBondContact O-CA 3.39Å; V105-C109 WeakPolarHBondContact O-CB 3.48Å; V105-C109 PolarHBondContact O-N 2.99Å; V105-C109 PolarHBondContact O-SG 3.43Å
106	L	29.6	Very low	34	Very low	79 Å²	79	108.6 Å²	108.6	41%	0.414	55%	0.552	S	S	.	*	H	α-helix	trans	-91	-25.5	179	-162.4	82.2	0	0	0	110.8	D102 R103 R108 C109 I110	D102-L106 WeakPolarHBondContact O-CA 3.34Å; D102-L106 VanDerWaalsContact O-CB 3.25Å; D102-L106 WeakPolarHBondContact O-CB 3.44Å; D102-L106 PolarHBondContact O-N 3.04Å; R103-L106 CarbonylContact O-C 3.58Å; R103-L106 WeakPolarHBondContact O-CA 3.45Å; R103-L106 WeakPolarHBondContact O-CB 3.36Å; R103-L106 PolarHBondContact O-N 3.34Å; L106-R108 VanDerWaalsContact C-N 3.31Å; L106-C109 CarbonylContact O-C 3.28Å; L106-C109 PolarHBondContact O-N 3.31Å; L106-I110 HydrophobicContact CD2-CD1 3.8Å; L106-I110 HydrophobicContact CG-CD1 3.65Å; L106-I110 HydrophobicContact CG-CG1 4.05Å; L106-I110 WeakPolarHBondContact O-CA 3.31Å; L106-I110 WeakPolarHBondContact O-CB 3.31Å; L106-I110 WeakPolarHBondContact O-CD1 3.24Å; L106-I110 WeakPolarHBondContact O-CG1 3.41Å; L106-I110 PolarHBondContact O-N 2.93Å
107	E	27.3	Very low	33.6	Very low	108 Å²	108	110.2 Å²	110.2	51%	0.505	57%	0.572	S	S	.	*	H	α-helix	trans	-72.6	-31.1	159.9	-80.8	169.4	-162.7	0	0	110.3	R103 G111	R103-E107 IonicContact CZ-OE1 2.66Å; R103-E107 VanDerWaalsContact CZ-OE1 3.22Å; R103-E107 IonicContact NE-OE1 2.68Å; R103-E107 PolarHBondContact NE-OE1 3.34Å; R103-E107 IonicContact NH2-OE1 3Å; R103-E107 PolarHBondContact NH2-OE1 2.93Å; R103-E107 PolarHBondContact O-N 2.67Å; E107-G111 VanDerWaalsContact O-CA 3.31Å; E107-G111 WeakPolarHBondContact O-CA 3.36Å; E107-G111 PolarHBondContact O-N 3.21Å
108	R	30.5	Very low	33.6	Very low	192 Å²	192	111.5 Å²	111.5	73%	0.725	58%	0.579	S	S	*	*	H	α-helix	trans	-69.7	-32.6	164.1	-73.2	-179.9	168.9	-168.4	-5.4	112.9	V104 V105 L106 M112	V104-R108 PolarHBondContact O-N 3.15Å; V105-R108 CarbonylContact O-C 3.56Å; V105-R108 WeakPolarHBondContact O-CA 3.23Å; V105-R108 WeakPolarHBondContact O-CB 3.31Å; V105-R108 PolarHBondContact O-N 2.98Å; L106-R108 VanDerWaalsContact C-N 3.31Å; R108-M112 WeakPolarHBondContact O-CB 3.26Å; R108-M112 VanDerWaalsContact O-CG 3.23Å; R108-M112 WeakPolarHBondContact O-CG 3.4Å; R108-M112 PolarHBondContact O-N 2.95Å
109	C	32.1	Very low	34.1	Very low	55 Å²	55	113.3 Å²	113.3	37%	0.372	59%	0.592	S	S	.	*	H	α-helix	trans	-99.8	6.5	-179.5	-66.7	0	0	0	0	115.5	V105 L106 M112	V105-C109 WeakPolarHBondContact O-CA 3.39Å; V105-C109 WeakPolarHBondContact O-CB 3.48Å; V105-C109 PolarHBondContact O-N 2.99Å; V105-C109 PolarHBondContact O-SG 3.43Å; L106-C109 CarbonylContact O-C 3.28Å; L106-C109 PolarHBondContact O-N 3.31Å; C109-M112 CarbonylContact C-O 3.53Å
110	I	28.6	Very low	34.9	Very low	100 Å²	100	115.3 Å²	115.3	51%	0.513	60%	0.603	S	S	.	*	H	α-helix	trans	-114.1	-33.4	164.7	-67.6	165	0	0	0	108.5	L106 M112 H113	L106-I110 HydrophobicContact CD2-CD1 3.8Å; L106-I110 HydrophobicContact CG-CD1 3.65Å; L106-I110 HydrophobicContact CG-CG1 4.05Å; L106-I110 WeakPolarHBondContact O-CA 3.31Å; L106-I110 WeakPolarHBondContact O-CB 3.31Å; L106-I110 WeakPolarHBondContact O-CD1 3.24Å; L106-I110 WeakPolarHBondContact O-CG1 3.41Å; L106-I110 PolarHBondContact O-N 2.93Å; I110-M112 VanDerWaalsContact C-C 3.46Å; I110-M112 CarbonylContact C-O 3.13Å; I110-M112 VanDerWaalsContact CA-O 3.25Å; I110-M112 WeakPolarHBondContact CA-O 3.34Å; I110-M112 PolarHBondContact N-O 3.49Å; I110-M112 CarbonylContact O-C 3.58Å; I110-M112 VanDerWaalsContact O-C 3.23Å; I110-H113 WeakPolarHBondContact O-CA 3.49Å; I110-H113 PolarHBondContact O-N 3.33Å
111	G	27	Very low	36.6	Very low	55 Å²	55	115.1 Å²	115.1	57%	0.567	60%	0.603	S	S	*	*	H	α-helix	trans	-60.2	-44.4	163.7	0	0	0	0	0	111.3	E107 H113	E107-G111 VanDerWaalsContact O-CA 3.31Å; E107-G111 WeakPolarHBondContact O-CA 3.36Å; E107-G111 PolarHBondContact O-N 3.21Å; G111-H113 VanDerWaalsContact C-N 3.29Å; G111-H113 PolarHBondContact O-N 2.96Å; G111-H113 PolarHBondContact O-ND1 3.14Å
112	M	31.9	Very low	38	Very low	134 Å²	134	115.3 Å²	115.3	66%	0.66	61%	0.606	S	S	*	*	S	Bend	trans	-63.6	101.3	147	-67	172.4	70.1	0	0	106.5	R108 C109 I110 F114	R108-M112 WeakPolarHBondContact O-CB 3.26Å; R108-M112 VanDerWaalsContact O-CG 3.23Å; R108-M112 WeakPolarHBondContact O-CG 3.4Å; R108-M112 PolarHBondContact O-N 2.95Å; C109-M112 CarbonylContact C-O 3.53Å; I110-M112 VanDerWaalsContact C-C 3.46Å; I110-M112 CarbonylContact C-O 3.13Å; I110-M112 VanDerWaalsContact CA-O 3.25Å; I110-M112 WeakPolarHBondContact CA-O 3.34Å; I110-M112 PolarHBondContact N-O 3.49Å; I110-M112 CarbonylContact O-C 3.58Å; I110-M112 VanDerWaalsContact O-C 3.23Å; M112-F114 PolarHBondContact O-N 2.97Å
113	H	30	Very low	39.7	Very low	141 Å²	141	116.2 Å²	116.2	65%	0.653	62%	0.615	S	S	*	*			trans	-50.1	143.3	170.8	-61.3	11.4	0	0	0	108	I110 G111 R115	I110-H113 WeakPolarHBondContact O-CA 3.49Å; I110-H113 PolarHBondContact O-N 3.33Å; G111-H113 VanDerWaalsContact C-N 3.29Å; G111-H113 PolarHBondContact O-N 2.96Å; G111-H113 PolarHBondContact O-ND1 3.14Å; H113-R115 HydrophobicContact CB-CG 4.08Å; H113-R115 PolarHBondContact O-N 3.07Å
114	F	32.5	Very low	41.5	Very low	183 Å²	183	113.4 Å²	113.4	80%	0.803	61%	0.608	S	S	*	*			trans	-62.1	72.5	142.9	-76.9	-101.9	0	0	0	106.6	M112 N116	M112-F114 PolarHBondContact O-N 2.97Å; F114-N116 PolarHBondContact O-N 3.28Å
115	R	32.5	Very low	42.9	Very low	207 Å²	207	115 Å²	115	78%	0.781	60%	0.602	S	S	*	*			trans	-49.7	137.4	150.6	-66	-168.6	-175.7	-141.1	-0.7	104.1	H113	H113-R115 HydrophobicContact CB-CG 4.08Å; H113-R115 PolarHBondContact O-N 3.07Å
116	N	35.5	Very low	44.5	Very low	131 Å²	131	115 Å²	115	70%	0.701	60%	0.602	S	S	*	*			trans	-38.6	147.4	178.9	-59.4	-35.6	0	0	0	110.1	F114 D118	F114-N116 PolarHBondContact O-N 3.28Å; N116-D118 PolarHBondContact O-N 3.36Å
117	A	42.4	Very low	46.7	Very low	110 Å²	110	113 Å²	113	91%	0.909	60%	0.601	S	S	*	*			trans	-65.3	73.9	161	0	0	0	0	0	108	S119	A117-S119 PolarHBondContact O-N 3.23Å
118	D	45.7	Very low	49	Very low	113 Å²	113	114.1 Å²	114.1	60%	0.604	60%	0.6	S	S	*	*			trans	-58.4	92.7	163.6	-76.7	-21.4	0	0	0	104.7	N116 N120	N116-D118 PolarHBondContact O-N 3.36Å; D118-N120 WeakPolarHBondContact O-CB 3.32Å; D118-N120 PolarHBondContact O-N 3.3Å; D118-N120 PolarHBondContact O-OD1 3.29Å
119	S	46.6	Very low	50.7	Low	121 Å²	121	108.4 Å²	108.4	85%	0.846	58%	0.584	S	S	*	*	S	Bend	trans	36.8	6.7	151	-160.7	0	0	0	0	120.8	A117 S121	A117-S119 PolarHBondContact O-N 3.23Å; S119-S121 PolarHBondContact O-N 2.94Å
120	N	55	Low	52.8	Low	80 Å²	80	109.2 Å²	109.2	43%	0.428	59%	0.587	S	S	.	*			trans	-88.3	104.2	-178.7	-70.6	36.2	0	0	0	105.5	D118 E124	D118-N120 WeakPolarHBondContact O-CB 3.32Å; D118-N120 PolarHBondContact O-N 3.3Å; D118-N120 PolarHBondContact O-OD1 3.29Å; N120-E124 HydrophobicContact CB-CB 4.33Å; N120-E124 WeakPolarHBondContact CB-OE2 3.21Å; N120-E124 VanDerWaalsContact CG-OE2 3.23Å; N120-E124 PolarHBondContact ND2-OE2 2.81Å
121	S	66.9	Low	55.1	Low	62 Å²	62	107.1 Å²	107.1	43%	0.434	59%	0.585	S	S	.	*			trans	-40.2	148.8	179.7	168.6	0	0	0	0	112.1	S119 T123 E124 W125	S119-S121 PolarHBondContact O-N 2.94Å; S121-T123 VanDerWaalsContact CB-OG1 3.26Å; S121-T123 WeakPolarHBondContact CB-OG1 3.2Å; S121-T123 PolarHBondContact O-N 2.84Å; S121-T123 PolarHBondContact OG-N 2.92Å; S121-T123 PolarHBondContact OG-OG1 2.97Å; S121-E124 PolarHBondContact O-N 3.23Å; S121-W125 PolarHBondContact O-N 3.41Å
122	L	63.9	Low	57.4	Low	135 Å²	135	110.6 Å²	110.6	71%	0.707	59%	0.586	S	S	*	*	H	α-helix	trans	-41.7	-36.2	170.4	-170.6	83.7	0	0	0	111.9	E124 W125 V126	L122-E124 PolarHBondContact O-N 2.87Å; L122-W125 PolarHBondContact O-N 3.49Å; L122-V126 HydrophobicContact CG-CG2 4.28Å; L122-V126 WeakPolarHBondContact O-CB 3.3Å; L122-V126 VanDerWaalsContact O-CG2 3.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.5Å; L122-V126 PolarHBondContact O-N 2.95Å
123	T	71.5	Confident	59.2	Low	102 Å²	102	107.1 Å²	107.1	63%	0.626	58%	0.579	S	S	*	*	H	α-helix	trans	-58.4	-40.5	176.2	55.9	0	0	0	0	114.2	S121 G127	S121-T123 VanDerWaalsContact CB-OG1 3.26Å; S121-T123 WeakPolarHBondContact CB-OG1 3.2Å; S121-T123 PolarHBondContact O-N 2.84Å; S121-T123 PolarHBondContact OG-N 2.92Å; S121-T123 PolarHBondContact OG-OG1 2.97Å; T123-G127 PolarHBondContact O-N 2.98Å
124	E	69.5	Low	61.6	Low	96 Å²	96	105.3 Å²	105.3	45%	0.449	57%	0.57	S	S	.	*	H	α-helix	trans	-73.2	-40.6	177.1	-71.4	-169.9	-161.3	0	0	112.1	N120 S121 L122 G127 R128	N120-E124 HydrophobicContact CB-CB 4.33Å; N120-E124 WeakPolarHBondContact CB-OE2 3.21Å; N120-E124 VanDerWaalsContact CG-OE2 3.23Å; N120-E124 PolarHBondContact ND2-OE2 2.81Å; S121-E124 PolarHBondContact O-N 3.23Å; L122-E124 PolarHBondContact O-N 2.87Å; E124-G127 PolarHBondContact O-N 2.99Å; E124-R128 WeakPolarHBondContact O-CG 3.21Å; E124-R128 PolarHBondContact O-N 3.48Å
125	W	65.2	Low	63.7	Low	145 Å²	145	100.1 Å²	100.1	55%	0.549	55%	0.549	S	S	.	.	H	α-helix	trans	-65.6	-45.2	178.3	-177.7	88.1	0	0	0	111.4	S121 L122 R128 L129	S121-W125 PolarHBondContact O-N 3.41Å; L122-W125 PolarHBondContact O-N 3.49Å; W125-R128 PolarHBondContact O-N 3.31Å; W125-L129 HydrophobicContact CD2-CD1 4.02Å; W125-L129 HydrophobicContact CE3-CD1 3.92Å; W125-L129 HydrophobicContact CH2-CD1 3.38Å; W125-L129 HydrophobicContact CZ2-CD1 3.47Å; W125-L129 VanDerWaalsContact CZ2-CD1 3.47Å; W125-L129 HydrophobicContact CZ3-CD1 3.6Å; W125-L129 PolarHBondContact O-N 2.96Å; W125-L129 VanDerWaalsContact O-N 3.12Å
126	V	70.8	Confident	65.8	Low	65 Å²	65	94.4 Å²	94.4	39%	0.394	53%	0.531	S	S	.	.	H	α-helix	trans	-60.3	-45.9	171.3	171.7	0	0	0	0	110.3	L122 R128 L129 T130	L122-V126 HydrophobicContact CG-CG2 4.28Å; L122-V126 WeakPolarHBondContact O-CB 3.3Å; L122-V126 VanDerWaalsContact O-CG2 3.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.5Å; L122-V126 PolarHBondContact O-N 2.95Å; V126-R128 PolarHBondContact O-N 2.83Å; V126-L129 PolarHBondContact O-N 3.04Å; V126-L129 VanDerWaalsContact O-N 3.16Å; V126-T130 PolarHBondContact O-N 3.03Å; V126-T130 PolarHBondContact O-OG1 2.62Å; V126-T130 VanDerWaalsContact O-OG1 3.09Å
127	G	75.5	Confident	67.7	Low	38 Å²	38	91.9 Å²	91.9	39%	0.392	52%	0.523	S	S	.	.	H	α-helix	trans	-57.2	-43.4	178.2	0	0	0	0	0	113.7	T123 E124 T130 A131	T123-G127 PolarHBondContact O-N 2.98Å; E124-G127 PolarHBondContact O-N 2.99Å; G127-T130 PolarHBondContact O-N 3Å; G127-A131 WeakPolarHBondContact O-CB 3.46Å; G127-A131 PolarHBondContact O-N 2.86Å
128	R	74.9	Confident	69.5	Low	131 Å²	131	91.8 Å²	91.8	49%	0.494	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-47.1	173.7	-72.6	-167.4	-62.5	-122.5	2.4	111.9	E124 W125 V126 T130 A131 E132	E124-R128 WeakPolarHBondContact O-CG 3.21Å; E124-R128 PolarHBondContact O-N 3.48Å; W125-R128 PolarHBondContact O-N 3.31Å; V126-R128 PolarHBondContact O-N 2.83Å; R128-T130 PolarHBondContact O-N 3.38Å; R128-A131 PolarHBondContact O-N 2.79Å; R128-E132 WeakPolarHBondContact O-CG 3.23Å; R128-E132 PolarHBondContact O-N 3.44Å
129	L	66	Low	70.9	Confident	73 Å²	73	92.7 Å²	92.7	38%	0.382	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-36.8	178.6	-74.1	-178.1	0	0	0	113.2	W125 V126 E132 A133	W125-L129 HydrophobicContact CD2-CD1 4.02Å; W125-L129 HydrophobicContact CE3-CD1 3.92Å; W125-L129 HydrophobicContact CH2-CD1 3.38Å; W125-L129 HydrophobicContact CZ2-CD1 3.47Å; W125-L129 VanDerWaalsContact CZ2-CD1 3.47Å; W125-L129 HydrophobicContact CZ3-CD1 3.6Å; W125-L129 PolarHBondContact O-N 2.96Å; W125-L129 VanDerWaalsContact O-N 3.12Å; V126-L129 PolarHBondContact O-N 3.04Å; V126-L129 VanDerWaalsContact O-N 3.16Å; L129-E132 PolarHBondContact O-N 3.38Å; L129-A133 WeakPolarHBondContact O-CB 3.48Å; L129-A133 PolarHBondContact O-N 3.37Å
130	T	77.2	Confident	72.3	Confident	71 Å²	71	89.6 Å²	89.6	44%	0.436	48%	0.48	S	S	.	.	H	α-helix	trans	-63.8	-44.5	173.9	-59	0	0	0	0	110.8	V126 G127 R128 A133 E134	V126-T130 PolarHBondContact O-N 3.03Å; V126-T130 PolarHBondContact O-OG1 2.62Å; V126-T130 VanDerWaalsContact O-OG1 3.09Å; G127-T130 PolarHBondContact O-N 3Å; R128-T130 PolarHBondContact O-N 3.38Å; T130-A133 PolarHBondContact O-N 2.91Å; T130-E134 WeakPolarHBondContact O-CB 3.28Å; T130-E134 WeakPolarHBondContact O-CG 3.45Å; T130-E134 PolarHBondContact O-N 2.92Å
131	A	76.2	Confident	73.4	Confident	56 Å²	56	88.7 Å²	88.7	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-43	176.6	0	0	0	0	0	112.6	G127 R128 E134 E135	G127-A131 WeakPolarHBondContact O-CB 3.46Å; G127-A131 PolarHBondContact O-N 2.86Å; R128-A131 PolarHBondContact O-N 2.79Å; A131-E134 PolarHBondContact O-N 2.86Å; A131-E135 WeakPolarHBondContact O-CB 3.46Å; A131-E135 PolarHBondContact O-N 2.93Å
132	E	75.1	Confident	74.2	Confident	128 Å²	128	91.2 Å²	91.2	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-41.5	174.4	-74.7	179.2	-166.4	0	0	112.2	R128 L129 E135 Q136	R128-E132 WeakPolarHBondContact O-CG 3.23Å; R128-E132 PolarHBondContact O-N 3.44Å; L129-E132 PolarHBondContact O-N 3.38Å; E132-E135 PolarHBondContact O-N 2.83Å; E132-Q136 VanDerWaalsContact O-CB 3.26Å; E132-Q136 WeakPolarHBondContact O-CB 3.39Å; E132-Q136 PolarHBondContact O-N 3.3Å
133	A	71.4	Confident	74.9	Confident	61 Å²	61	86.5 Å²	86.5	50%	0.504	47%	0.468	S	S	.	.	H	α-helix	trans	-66.6	-41.2	177.5	0	0	0	0	0	112.3	L129 T130 S137	L129-A133 WeakPolarHBondContact O-CB 3.48Å; L129-A133 PolarHBondContact O-N 3.37Å; T130-A133 PolarHBondContact O-N 2.91Å; A133-S137 VanDerWaalsContact O-CB 3.23Å; A133-S137 WeakPolarHBondContact O-CB 3.18Å; A133-S137 PolarHBondContact O-N 3.3Å
134	E	79.6	Confident	75.4	Confident	103 Å²	103	85 Å²	85	48%	0.481	46%	0.456	S	S	.	.	H	α-helix	trans	-60.8	-48.1	172.9	-83.5	-169.6	-154.9	0	0	112	T130 A131 S137 K138	T130-E134 WeakPolarHBondContact O-CB 3.28Å; T130-E134 WeakPolarHBondContact O-CG 3.45Å; T130-E134 PolarHBondContact O-N 2.92Å; A131-E134 PolarHBondContact O-N 2.86Å; E134-S137 WeakPolarHBondContact O-CB 3.47Å; E134-S137 PolarHBondContact O-N 3.1Å; E134-K138 VanDerWaalsContact O-CG 3.29Å; E134-K138 WeakPolarHBondContact O-CG 3.5Å; E134-K138 PolarHBondContact O-N 3.15Å; E134-K138 IonicContact OE2-NZ 3.51Å; E134-K138 PolarHBondContact OE2-NZ 3.27Å
135	E	77.4	Confident	76.1	Confident	75 Å²	75	83.3 Å²	83.3	35%	0.35	45%	0.45	S	S	.	.	H	α-helix	trans	-66.1	-39.6	-179	175.3	57.2	-165.2	0	0	111.4	A131 E132 S137 K138 R139	A131-E135 WeakPolarHBondContact O-CB 3.46Å; A131-E135 PolarHBondContact O-N 2.93Å; E132-E135 PolarHBondContact O-N 2.83Å; E135-S137 VanDerWaalsContact C-N 3.33Å; E135-S137 PolarHBondContact O-N 2.96Å; E135-K138 PolarHBondContact O-N 3.37Å; E135-R139 VanDerWaalsContact O-CG 3.31Å; E135-R139 WeakPolarHBondContact O-CG 3.44Å; E135-R139 PolarHBondContact O-N 3.31Å; E135-R139 IonicContact OE1-CZ 3.99Å; E135-R139 IonicContact OE1-NE 2.84Å; E135-R139 PolarHBondContact OE1-NE 2.8Å; E135-R139 IonicContact OE1-NH2 3.26Å; E135-R139 PolarHBondContact OE1-NH2 3.48Å
136	Q	75	Confident	77	Confident	87 Å²	87	80.9 Å²	80.9	41%	0.407	45%	0.445	S	S	.	.	H	α-helix	trans	-66.6	-34.7	172.8	-171.3	64.8	-0.6	0	0	112.3	E132 A140	E132-Q136 VanDerWaalsContact O-CB 3.26Å; E132-Q136 WeakPolarHBondContact O-CB 3.39Å; E132-Q136 PolarHBondContact O-N 3.3Å; Q136-A140 VanDerWaalsContact O-CB 3.31Å; Q136-A140 WeakPolarHBondContact O-CB 3.25Å; Q136-A140 PolarHBondContact O-N 2.89Å
137	S	75.8	Confident	77.6	Confident	77 Å²	77	78 Å²	78	54%	0.538	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-45.2	173.1	-171.7	0	0	0	0	111.6	A133 E134 E135 R139 A140 A141	A133-S137 VanDerWaalsContact O-CB 3.23Å; A133-S137 WeakPolarHBondContact O-CB 3.18Å; A133-S137 PolarHBondContact O-N 3.3Å; E134-S137 WeakPolarHBondContact O-CB 3.47Å; E134-S137 PolarHBondContact O-N 3.1Å; E135-S137 VanDerWaalsContact C-N 3.33Å; E135-S137 PolarHBondContact O-N 2.96Å; S137-R139 PolarHBondContact O-N 3.46Å; S137-A140 PolarHBondContact O-N 3.5Å; S137-A141 WeakPolarHBondContact O-CB 3.29Å; S137-A141 PolarHBondContact O-N 2.93Å
138	K	79.9	Confident	78	Confident	108 Å²	108	80.3 Å²	80.3	47%	0.47	43%	0.433	S	S	.	.	H	α-helix	trans	-57.4	-47.8	174.1	-70.8	162.4	-166.4	158.2	0	111.1	E134 E135 A141 L142	E134-K138 VanDerWaalsContact O-CG 3.29Å; E134-K138 WeakPolarHBondContact O-CG 3.5Å; E134-K138 PolarHBondContact O-N 3.15Å; E134-K138 IonicContact OE2-NZ 3.51Å; E134-K138 PolarHBondContact OE2-NZ 3.27Å; E135-K138 PolarHBondContact O-N 3.37Å; K138-A141 PolarHBondContact O-N 2.83Å; K138-L142 WeakPolarHBondContact O-CG 3.25Å; K138-L142 PolarHBondContact O-N 2.93Å
139	R	76.1	Confident	78.6	Confident	132 Å²	132	81.8 Å²	81.8	50%	0.498	44%	0.439	S	S	.	.	H	α-helix	trans	-60.7	-46.6	175.3	-69.3	169	-168.9	163.3	1.1	112.3	E135 S137 A141 L142 T143	E135-R139 VanDerWaalsContact O-CG 3.31Å; E135-R139 WeakPolarHBondContact O-CG 3.44Å; E135-R139 PolarHBondContact O-N 3.31Å; E135-R139 IonicContact OE1-CZ 3.99Å; E135-R139 IonicContact OE1-NE 2.84Å; E135-R139 PolarHBondContact OE1-NE 2.8Å; E135-R139 IonicContact OE1-NH2 3.26Å; E135-R139 PolarHBondContact OE1-NH2 3.48Å; S137-R139 PolarHBondContact O-N 3.46Å; R139-A141 VanDerWaalsContact C-N 3.32Å; R139-A141 PolarHBondContact O-N 3.41Å; R139-L142 PolarHBondContact O-N 3Å; R139-T143 PolarHBondContact O-N 2.69Å; R139-T143 PolarHBondContact O-OG1 3.43Å
140	A	76.2	Confident	79.5	Confident	57 Å²	57	80.4 Å²	80.4	47%	0.471	43%	0.432	S	S	.	.	H	α-helix	trans	-62.4	-38.4	178.4	0	0	0	0	0	112.3	Q136 S137 N144	Q136-A140 VanDerWaalsContact O-CB 3.31Å; Q136-A140 WeakPolarHBondContact O-CB 3.25Å; Q136-A140 PolarHBondContact O-N 2.89Å; S137-A140 PolarHBondContact O-N 3.5Å; A140-N144 VanDerWaalsContact O-CB 3.24Å; A140-N144 WeakPolarHBondContact O-CB 3.41Å; A140-N144 PolarHBondContact O-N 3.11Å
141	A	78.4	Confident	79.9	Confident	60 Å²	60	78.3 Å²	78.3	50%	0.496	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-45.1	175.3	0	0	0	0	0	112.1	S137 K138 R139 N144 D145	S137-A141 WeakPolarHBondContact O-CB 3.29Å; S137-A141 PolarHBondContact O-N 2.93Å; K138-A141 PolarHBondContact O-N 2.83Å; R139-A141 VanDerWaalsContact C-N 3.32Å; R139-A141 PolarHBondContact O-N 3.41Å; A141-N144 PolarHBondContact O-N 3.12Å; A141-D145 PolarHBondContact O-N 2.89Å
142	L	82	Confident	80.5	Confident	116 Å²	116	83.3 Å²	83.3	61%	0.607	43%	0.43	S	S	*	.	H	α-helix	trans	-61	-47.6	175.9	-71.7	168.9	0	0	0	112.2	K138 R139 N144 D145 Q146	K138-L142 WeakPolarHBondContact O-CG 3.25Å; K138-L142 PolarHBondContact O-N 2.93Å; R139-L142 PolarHBondContact O-N 3Å; L142-N144 VanDerWaalsContact C-N 3.27Å; L142-N144 PolarHBondContact O-N 3.46Å; L142-D145 PolarHBondContact O-N 2.97Å; L142-Q146 WeakPolarHBondContact O-CG 3.31Å; L142-Q146 PolarHBondContact O-N 3.49Å
143	T	79.6	Confident	81.1	Confident	35 Å²	35	81.4 Å²	81.4	22%	0.215	42%	0.421	C	S	.	.	H	α-helix	trans	-61.8	-36.1	175.2	-55.6	0	0	0	0	111.7	R139 N147 L175	R139-T143 PolarHBondContact O-N 2.69Å; R139-T143 PolarHBondContact O-OG1 3.43Å; T143-N147 WeakPolarHBondContact O-CB 3.29Å; T143-N147 PolarHBondContact O-N 3.19Å; T143-N147 PolarHBondContact O-ND2 3.32Å; T143-N147 VanDerWaalsContact O-ND2 3.1Å; T143-L175 HydrophobicContact CG2-CB 4.11Å; T143-L175 HydrophobicContact CG2-CD2 4.13Å
144	N	80.9	Confident	81.7	Confident	71 Å²	71	78.7 Å²	78.7	38%	0.38	40%	0.398	S	S	.	.	H	α-helix	trans	-69.1	-42.7	178.4	-167.9	77.5	0	0	0	112.7	A140 A141 L142 N147 V148	A140-N144 VanDerWaalsContact O-CB 3.24Å; A140-N144 WeakPolarHBondContact O-CB 3.41Å; A140-N144 PolarHBondContact O-N 3.11Å; A141-N144 PolarHBondContact O-N 3.12Å; L142-N144 VanDerWaalsContact C-N 3.27Å; L142-N144 PolarHBondContact O-N 3.46Å; N144-N147 PolarHBondContact O-N 3.45Å; N144-V148 WeakPolarHBondContact O-CG2 3.43Å; N144-V148 PolarHBondContact O-N 3.36Å
145	D	84.1	Confident	82.1	Confident	61 Å²	61	75 Å²	75	33%	0.326	38%	0.383	S	S	.	.	H	α-helix	trans	-60.4	-44.9	172.7	167.2	78.4	0	0	0	111.6	A141 L142 N147 V148 R149	A141-D145 PolarHBondContact O-N 2.89Å; L142-D145 PolarHBondContact O-N 2.97Å; D145-N147 PolarHBondContact O-N 2.85Å; D145-V148 PolarHBondContact O-N 3.09Å; D145-R149 WeakPolarHBondContact O-CG 3.28Å; D145-R149 PolarHBondContact O-N 2.81Å; D145-R149 IonicContact OD1-CZ 2.93Å; D145-R149 VanDerWaalsContact OD1-CZ 3.23Å; D145-R149 IonicContact OD1-NE 3.13Å; D145-R149 PolarHBondContact OD1-NE 2.91Å; D145-R149 IonicContact OD1-NH2 3.1Å; D145-R149 PolarHBondContact OD1-NH2 3.42Å; D145-R149 IonicContact OD2-CZ 3.37Å; D145-R149 IonicContact OD2-NE 2.76Å; D145-R149 PolarHBondContact OD2-NE 3.13Å; D145-R149 IonicContact OD2-NH1 2.68Å; D145-R149 IonicContact OD2-NH2 3.39Å; D145-R149 PolarHBondContact OD2-NH2 3.03Å
146	Q	85.6	Confident	82.5	Confident	93 Å²	93	76.4 Å²	76.4	44%	0.435	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-45.6	174.4	-72.8	175.2	-27.5	0	0	112.3	L142 V148 R149 L150 L175	L142-Q146 WeakPolarHBondContact O-CG 3.31Å; L142-Q146 PolarHBondContact O-N 3.49Å; Q146-V148 PolarHBondContact O-N 3.09Å; Q146-R149 PolarHBondContact O-N 3.29Å; Q146-L150 WeakPolarHBondContact O-CB 3.32Å; Q146-L150 WeakPolarHBondContact O-CG 3.44Å; Q146-L150 PolarHBondContact O-N 3.39Å; Q146-L175 HydrophobicContact CB-CD1 4.12Å; Q146-L175 HydrophobicContact CB-CD2 4.28Å
147	N	83.5	Confident	82.9	Confident	5 Å²	5	76.8 Å²	76.8	3%	0.027	40%	0.402	C	S	.	.	H	α-helix	trans	-59.1	-46.4	175.4	-75.8	-34.3	0	0	0	112	T143 N144 D145 L150 T151 F174 L175 L178	T143-N147 WeakPolarHBondContact O-CB 3.29Å; T143-N147 PolarHBondContact O-N 3.19Å; T143-N147 PolarHBondContact O-ND2 3.32Å; T143-N147 VanDerWaalsContact O-ND2 3.1Å; N144-N147 PolarHBondContact O-N 3.45Å; D145-N147 PolarHBondContact O-N 2.85Å; N147-L150 PolarHBondContact O-N 2.82Å; N147-T151 VanDerWaalsContact O-CB 3.29Å; N147-T151 WeakPolarHBondContact O-CB 3.39Å; N147-T151 PolarHBondContact O-N 2.82Å; N147-T151 PolarHBondContact O-OG1 2.96Å; N147-T151 VanDerWaalsContact O-OG1 3.12Å; N147-F174 HydrophobicContact CB-CD1 3.86Å; N147-F174 HydrophobicContact CB-CE1 4.02Å; N147-F174 VanDerWaalsContact CG-CD1 3.43Å; N147-L175 VanDerWaalsContact OD1-CA 3.25Å; N147-L175 WeakPolarHBondContact OD1-CA 3.31Å; N147-L175 VanDerWaalsContact OD1-CB 3.29Å; N147-L175 WeakPolarHBondContact OD1-CB 3.26Å; N147-L175 PolarHBondContact OD1-N 2.93Å; N147-L178 HydrophobicContact CB-CD1 4.46Å
148	V	84.2	Confident	83.2	Confident	86 Å²	86	75.7 Å²	75.7	52%	0.521	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-43.7	178.6	170.5	0	0	0	0	111.3	N144 D145 Q146 K152	N144-V148 WeakPolarHBondContact O-CG2 3.43Å; N144-V148 PolarHBondContact O-N 3.36Å; D145-V148 PolarHBondContact O-N 3.09Å; Q146-V148 PolarHBondContact O-N 3.09Å; V148-K152 VanDerWaalsContact O-CB 3.31Å; V148-K152 WeakPolarHBondContact O-CB 3.49Å; V148-K152 PolarHBondContact O-N 3.45Å
149	R	87.3	Confident	83.3	Confident	162 Å²	162	77.9 Å²	77.9	61%	0.611	40%	0.403	S	S	*	.	H	α-helix	trans	-63.1	-47.2	177.7	-70.4	176.7	-166.5	-165	10.4	112.1	D145 Q146 K152 H153	D145-R149 WeakPolarHBondContact O-CG 3.28Å; D145-R149 PolarHBondContact O-N 2.81Å; D145-R149 IonicContact OD1-CZ 2.93Å; D145-R149 VanDerWaalsContact OD1-CZ 3.23Å; D145-R149 IonicContact OD1-NE 3.13Å; D145-R149 PolarHBondContact OD1-NE 2.91Å; D145-R149 IonicContact OD1-NH2 3.1Å; D145-R149 PolarHBondContact OD1-NH2 3.42Å; D145-R149 IonicContact OD2-CZ 3.37Å; D145-R149 IonicContact OD2-NE 2.76Å; D145-R149 PolarHBondContact OD2-NE 3.13Å; D145-R149 IonicContact OD2-NH1 2.68Å; D145-R149 IonicContact OD2-NH2 3.39Å; D145-R149 PolarHBondContact OD2-NH2 3.03Å; Q146-R149 PolarHBondContact O-N 3.29Å; R149-K152 PolarHBondContact O-N 3.33Å; R149-H153 WeakPolarHBondContact O-CB 3.23Å; R149-H153 PolarHBondContact O-N 2.92Å
150	L	84.9	Confident	83.6	Confident	44 Å²	44	74.7 Å²	74.7	23%	0.23	40%	0.398	C	S	.	.	H	α-helix	trans	-67.4	-43.3	179.9	-73.4	169.7	0	0	0	112.1	Q146 N147 K152 H153 L154 L175 L178 N179	Q146-L150 WeakPolarHBondContact O-CB 3.32Å; Q146-L150 WeakPolarHBondContact O-CG 3.44Å; Q146-L150 PolarHBondContact O-N 3.39Å; N147-L150 PolarHBondContact O-N 2.82Å; L150-K152 PolarHBondContact O-N 3.27Å; L150-H153 PolarHBondContact O-N 3.1Å; L150-L154 WeakPolarHBondContact O-CB 3.44Å; L150-L154 VanDerWaalsContact O-CG 3.31Å; L150-L154 WeakPolarHBondContact O-CG 3.45Å; L150-L154 PolarHBondContact O-N 3.41Å; L150-L175 HydrophobicContact CD1-CD1 3.34Å; L150-L178 HydrophobicContact CB-CD1 4.47Å; L150-N179 VanDerWaalsContact CD1-OD1 3.27Å; L150-N179 WeakPolarHBondContact CD1-OD1 3.47Å
151	T	85.6	Confident	83.8	Confident	28 Å²	28	82.1 Å²	82.1	17%	0.172	42%	0.42	C	S	.	.	H	α-helix	trans	-58.8	-47.8	173.8	-70.2	0	0	0	0	111.1	N147 H153 L154 C155 I163	N147-T151 VanDerWaalsContact O-CB 3.29Å; N147-T151 WeakPolarHBondContact O-CB 3.39Å; N147-T151 PolarHBondContact O-N 2.82Å; N147-T151 PolarHBondContact O-OG1 2.96Å; N147-T151 VanDerWaalsContact O-OG1 3.12Å; T151-H153 VanDerWaalsContact C-N 3.33Å; T151-H153 PolarHBondContact O-N 3.36Å; T151-L154 PolarHBondContact O-N 2.72Å; T151-C155 WeakPolarHBondContact O-CB 3.32Å; T151-C155 PolarHBondContact O-N 2.88Å; T151-C155 PolarHBondContact O-SG 2.9Å; T151-C155 VanDerWaalsContact O-SG 3.39Å; T151-I163 HydrophobicContact CG2-CB 4.01Å; T151-I163 HydrophobicContact CG2-CD1 4.47Å; T151-I163 HydrophobicContact CG2-CG1 4.49Å
152	K	87.6	Confident	84.1	Confident	161 Å²	161	86 Å²	86	70%	0.7	43%	0.427	S	S	*	.	H	α-helix	trans	-61.5	-40.3	176.8	-172.5	174.8	-178.5	177.4	0	112.1	V148 R149 L150 S156	V148-K152 VanDerWaalsContact O-CB 3.31Å; V148-K152 WeakPolarHBondContact O-CB 3.49Å; V148-K152 PolarHBondContact O-N 3.45Å; R149-K152 PolarHBondContact O-N 3.33Å; L150-K152 PolarHBondContact O-N 3.27Å; K152-S156 VanDerWaalsContact O-CB 3.29Å; K152-S156 WeakPolarHBondContact O-CB 3.33Å; K152-S156 PolarHBondContact O-N 2.86Å
153	H	87.1	Confident	84.1	Confident	88 Å²	88	82.3 Å²	82.3	41%	0.407	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-47.4	175.5	-179.1	70.7	0	0	0	112	R149 L150 T151 S156 K157 F182	R149-H153 WeakPolarHBondContact O-CB 3.23Å; R149-H153 PolarHBondContact O-N 2.92Å; L150-H153 PolarHBondContact O-N 3.1Å; T151-H153 VanDerWaalsContact C-N 3.33Å; T151-H153 PolarHBondContact O-N 3.36Å; H153-S156 PolarHBondContact O-N 3.14Å; H153-K157 WeakPolarHBondContact NE2-CD 3.39Å; H153-K157 WeakPolarHBondContact O-CB 3.49Å; H153-K157 PolarHBondContact O-N 2.79Å; H153-F182 AromaticContact CD2-CE2 3.78Å; H153-F182 AromaticContact NE2-CE2 3.68Å
154	L	85.9	Confident	83.9	Confident	4 Å²	4	85.7 Å²	85.7	2%	0.021	43%	0.429	C	S	.	.	H	α-helix	trans	-58.9	-50.5	176.6	-77	168.8	0	0	0	112	L150 T151 S156 K157 Y158 I163 L178 F182	L150-L154 WeakPolarHBondContact O-CB 3.44Å; L150-L154 VanDerWaalsContact O-CG 3.31Å; L150-L154 WeakPolarHBondContact O-CG 3.45Å; L150-L154 PolarHBondContact O-N 3.41Å; T151-L154 PolarHBondContact O-N 2.72Å; L154-S156 PolarHBondContact O-N 3.43Å; L154-K157 PolarHBondContact O-N 3.46Å; L154-Y158 HydrophobicContact CD2-CD2 3.8Å; L154-Y158 HydrophobicContact CD2-CE2 3.65Å; L154-Y158 PolarHBondContact O-N 3.41Å; L154-I163 HydrophobicContact CB-CD1 3.68Å; L154-I163 HydrophobicContact CD1-CD1 3.71Å; L154-I163 HydrophobicContact CG-CD1 4.32Å; L154-L178 HydrophobicContact CD1-CD2 3.95Å; L154-F182 HydrophobicContact CD2-CB 4.13Å; L154-F182 HydrophobicContact CD2-CD2 3.73Å; L154-F182 HydrophobicContact CD2-CG 4.43Å
155	C	87	Confident	83.3	Confident	24 Å²	24	86.2 Å²	86.2	16%	0.162	43%	0.425	C	S	.	.	H	α-helix	trans	-56.4	-48.9	176.5	-75.2	0	0	0	0	111.6	T151 N159 V160	T151-C155 WeakPolarHBondContact O-CB 3.32Å; T151-C155 PolarHBondContact O-N 2.88Å; T151-C155 PolarHBondContact O-SG 2.9Å; T151-C155 VanDerWaalsContact O-SG 3.39Å; C155-N159 CarbonylContact O-C 3.58Å; C155-N159 VanDerWaalsContact O-CA 3.24Å; C155-N159 WeakPolarHBondContact O-CA 3.33Å; C155-N159 PolarHBondContact O-N 3.37Å; C155-V160 WeakPolarHBondContact CA-O 3.49Å; C155-V160 WeakPolarHBondContact CB-O 3.21Å; C155-V160 PolarHBondContact O-N 2.9Å; C155-V160 VanDerWaalsContact O-N 3.12Å; C155-V160 PolarHBondContact SG-O 3.15Å
156	S	86.7	Confident	82.4	Confident	105 Å²	105	85.2 Å²	85.2	73%	0.734	42%	0.423	S	S	*	.	H	α-helix	trans	-69	-36.5	-179.8	-173.3	0	0	0	0	113.7	K152 H153 L154	K152-S156 VanDerWaalsContact O-CB 3.29Å; K152-S156 WeakPolarHBondContact O-CB 3.33Å; K152-S156 PolarHBondContact O-N 2.86Å; H153-S156 PolarHBondContact O-N 3.14Å; L154-S156 PolarHBondContact O-N 3.43Å
157	K	83.2	Confident	81.1	Confident	95 Å²	95	89 Å²	89	41%	0.413	45%	0.446	S	S	.	.	H	α-helix	trans	-79.1	-35.4	-175.4	-176.3	179.1	178.6	-168.2	0	112.7	H153 L154 F182	H153-K157 WeakPolarHBondContact NE2-CD 3.39Å; H153-K157 WeakPolarHBondContact O-CB 3.49Å; H153-K157 PolarHBondContact O-N 2.79Å; L154-K157 PolarHBondContact O-N 3.46Å; K157-F182 HydrophobicContact CD-CE2 4.31Å
158	Y	82	Confident	79.8	Confident	55 Å²	55	95.8 Å²	95.8	22%	0.216	48%	0.478	C	S	.	.	H	α-helix	trans	-112	10.3	-175	-56.7	-55.8	0	0	0	113.6	L154 V160 F182 I185 T186 L189	L154-Y158 HydrophobicContact CD2-CD2 3.8Å; L154-Y158 HydrophobicContact CD2-CE2 3.65Å; L154-Y158 PolarHBondContact O-N 3.41Å; Y158-V160 PolarHBondContact O-N 2.93Å; Y158-F182 HydrophobicContact CE2-CD2 4.38Å; Y158-I185 HydrophobicContact CD1-CG2 4.2Å; Y158-I185 HydrophobicContact CD2-CG2 4.16Å; Y158-I185 HydrophobicContact CE1-CG2 3.79Å; Y158-I185 HydrophobicContact CE2-CB 4.49Å; Y158-I185 HydrophobicContact CE2-CG2 3.73Å; Y158-I185 HydrophobicContact CG-CG2 4.38Å; Y158-T186 PolarHBondContact OH-OG1 2.83Å; Y158-L189 HydrophobicContact CD1-CD1 3.84Å; Y158-L189 HydrophobicContact CE1-CD1 3.27Å
159	N	81.9	Confident	78.6	Confident	153 Å²	153	97 Å²	97	82%	0.818	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	35.4	-178.3	-161.5	32.6	0	0	0	113.5	C155	C155-N159 CarbonylContact O-C 3.58Å; C155-N159 VanDerWaalsContact O-CA 3.24Å; C155-N159 WeakPolarHBondContact O-CA 3.33Å; C155-N159 PolarHBondContact O-N 3.37Å
160	V	82	Confident	77.4	Confident	65 Å²	65	91.9 Å²	91.9	39%	0.394	47%	0.465	S	S	.	.			trans	-84.2	122.2	177.4	177	0	0	0	0	108.3	C155 Y158 E162 I163	C155-V160 WeakPolarHBondContact CA-O 3.49Å; C155-V160 WeakPolarHBondContact CB-O 3.21Å; C155-V160 PolarHBondContact O-N 2.9Å; C155-V160 VanDerWaalsContact O-N 3.12Å; C155-V160 PolarHBondContact SG-O 3.15Å; Y158-V160 PolarHBondContact O-N 2.93Å; V160-E162 VanDerWaalsContact C-N 3.33Å; V160-E162 WeakPolarHBondContact CG1-O 3.5Å; V160-E162 PolarHBondContact O-N 3.01Å; V160-I163 HydrophobicContact CG1-CG1 4.14Å
161	K	79.9	Confident	76.3	Confident	214 Å²	214	98.4 Å²	98.4	93%	0.93	49%	0.486	S	S	*	.	S	Bend	trans	-54.1	-46.7	-176.3	-70	-175.3	176	-177.6	0	113
162	E	84.4	Confident	75.4	Confident	140 Å²	140	102.9 Å²	102.9	65%	0.654	51%	0.505	S	S	*	.			trans	-160.2	149.8	-178.9	-169.6	173.5	-166.2	0	0	110	V160 V164	V160-E162 VanDerWaalsContact C-N 3.33Å; V160-E162 WeakPolarHBondContact CG1-O 3.5Å; V160-E162 PolarHBondContact O-N 3.01Å; E162-V164 HydrophobicContact CB-CG2 4.42Å; E162-V164 HydrophobicContact CG-CG2 3.78Å
163	I	81.8	Confident	74.5	Confident	39 Å²	39	100.1 Å²	100.1	20%	0.2	50%	0.498	C	S	.	.			trans	-113.1	94	166.7	-58.5	174.8	0	0	0	107.2	T151 L154 V160 L178	T151-I163 HydrophobicContact CG2-CB 4.01Å; T151-I163 HydrophobicContact CG2-CD1 4.47Å; T151-I163 HydrophobicContact CG2-CG1 4.49Å; L154-I163 HydrophobicContact CB-CD1 3.68Å; L154-I163 HydrophobicContact CD1-CD1 3.71Å; L154-I163 HydrophobicContact CG-CD1 4.32Å; V160-I163 HydrophobicContact CG1-CG1 4.14Å; I163-L178 HydrophobicContact CG2-CD2 4.21Å
164	V	75.8	Confident	74	Confident	107 Å²	107	97 Å²	97	65%	0.648	48%	0.483	S	S	*	.			trans	-78.5	144.3	177.7	-177	0	0	0	0	109.7	E162	E162-V164 HydrophobicContact CB-CG2 4.42Å; E162-V164 HydrophobicContact CG-CG2 3.78Å
165	W	68.3	Low	73.6	Confident	81 Å²	81	98 Å²	98	31%	0.307	49%	0.489	S	S	.	.			trans	-125.3	148.7	173	-140.8	59.4	0	0	0	110.8	F169 S170 F174	W165-F169 HydrophobicContact CE3-CB 4.17Å; W165-F169 HydrophobicContact CH2-CB 3.12Å; W165-F169 HydrophobicContact CH2-CG 4.26Å; W165-F169 HydrophobicContact CZ2-CB 3.53Å; W165-F169 HydrophobicContact CZ2-CG 4.22Å; W165-F169 HydrophobicContact CZ3-CB 3.47Å; W165-F169 VanDerWaalsContact CZ3-CB 3.47Å; W165-F169 WeakPolarHBondContact CZ3-O 3.32Å; W165-S170 WeakPolarHBondContact CH2-O 3.49Å; W165-F174 HydrophobicContact CB-CE2 4.21Å; W165-F174 HydrophobicContact CB-CZ 4.19Å; W165-F174 AromaticContact CD1-CD2 3.44Å; W165-F174 VanDerWaalsContact CD1-CD2 3.44Å; W165-F174 AromaticContact CD1-CE2 3.28Å; W165-F174 HydrophobicContact CD2-CB 4.23Å; W165-F174 AromaticContact CD2-CD2 3.76Å; W165-F174 HydrophobicContact CD2-CD2 3.76Å; W165-F174 HydrophobicContact CD2-CE2 4.19Å; W165-F174 AromaticContact CD2-CG 3.94Å; W165-F174 HydrophobicContact CD2-CG 3.94Å; W165-F174 AromaticContact CE2-CD2 3.42Å; W165-F174 VanDerWaalsContact CE2-CD2 3.42Å; W165-F174 AromaticContact CE2-CG 3.84Å; W165-F174 HydrophobicContact CE3-CB 4.34Å; W165-F174 HydrophobicContact CE3-CG 4.37Å; W165-F174 AromaticContact CG-CD2 3.74Å; W165-F174 HydrophobicContact CG-CD2 3.74Å; W165-F174 AromaticContact CG-CE2 3.67Å; W165-F174 HydrophobicContact CG-CE2 3.67Å; W165-F174 HydrophobicContact CG-CG 4.24Å; W165-F174 HydrophobicContact CG-CZ 4.1Å; W165-F174 HydrophobicContact CH2-CB 3.78Å; W165-F174 HydrophobicContact CZ2-CB 3.69Å; W165-F174 HydrophobicContact CZ2-CD2 4.01Å; W165-F174 HydrophobicContact CZ2-CG 4.16Å; W165-F174 HydrophobicContact CZ3-CB 4.12Å; W165-F174 AromaticContact NE1-CD2 3.26Å; W165-F174 VanDerWaalsContact NE1-CD2 3.26Å; W165-F174 AromaticContact NE1-CE2 3.61Å
166	S	64.7	Low	73.3	Confident	41 Å²	41	100.5 Å²	100.5	29%	0.287	50%	0.504	S	S	.	.			trans	-98	140.2	-175.2	56.4	0	0	0	0	112.6	H168 F169	S166-H168 WeakPolarHBondContact CB-CE1 3.25Å; S166-H168 WeakPolarHBondContact CB-NE2 3.5Å; S166-H168 PolarHBondContact O-N 2.86Å; S166-H168 PolarHBondContact OG-CD2 3.36Å; S166-H168 PolarHBondContact OG-CE1 3.08Å; S166-H168 VanDerWaalsContact OG-CE1 3.23Å; S166-H168 PolarHBondContact OG-NE2 3.38Å; S166-F169 PolarHBondContact O-N 3.32Å; S166-F169 WeakPolarHBondContact OG-CD2 3.21Å; S166-F169 VanDerWaalsContact OG-CE2 3.3Å; S166-F169 WeakPolarHBondContact OG-CE2 3.46Å
167	D	59.6	Low	73.1	Confident	171 Å²	171	98.8 Å²	98.8	91%	0.914	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.3	-170.1	-56.4	-47.5	0	0	0	115.5
168	H	56.2	Low	73.1	Confident	149 Å²	149	94.5 Å²	94.5	69%	0.69	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.6	-175.7	43.3	-103.9	0	0	0	114.8	S166	S166-H168 WeakPolarHBondContact CB-CE1 3.25Å; S166-H168 WeakPolarHBondContact CB-NE2 3.5Å; S166-H168 PolarHBondContact O-N 2.86Å; S166-H168 PolarHBondContact OG-CD2 3.36Å; S166-H168 PolarHBondContact OG-CE1 3.08Å; S166-H168 VanDerWaalsContact OG-CE1 3.23Å; S166-H168 PolarHBondContact OG-NE2 3.38Å
169	F	58.4	Low	73.3	Confident	112 Å²	112	94.8 Å²	94.8	49%	0.491	48%	0.479	S	S	.	.	S	Bend	trans	-95.8	154.9	176.1	-64	-72.5	0	0	0	112.3	W165 S166	W165-F169 HydrophobicContact CE3-CB 4.17Å; W165-F169 HydrophobicContact CH2-CB 3.12Å; W165-F169 HydrophobicContact CH2-CG 4.26Å; W165-F169 HydrophobicContact CZ2-CB 3.53Å; W165-F169 HydrophobicContact CZ2-CG 4.22Å; W165-F169 HydrophobicContact CZ3-CB 3.47Å; W165-F169 VanDerWaalsContact CZ3-CB 3.47Å; W165-F169 WeakPolarHBondContact CZ3-O 3.32Å; S166-F169 PolarHBondContact O-N 3.32Å; S166-F169 WeakPolarHBondContact OG-CD2 3.21Å; S166-F169 VanDerWaalsContact OG-CE2 3.3Å; S166-F169 WeakPolarHBondContact OG-CE2 3.46Å
170	S	62	Low	73.5	Confident	54 Å²	54	89.7 Å²	89.7	38%	0.378	46%	0.455	S	S	.	.			trans	-78.7	123.8	177.9	175.3	0	0	0	0	111.2	W165 Q172 L173	W165-S170 WeakPolarHBondContact CH2-O 3.49Å; S170-Q172 PolarHBondContact O-N 3.03Å; S170-Q172 PolarHBondContact OG-N 3.37Å; S170-L173 WeakPolarHBondContact O-CB 3.27Å; S170-L173 PolarHBondContact O-N 3.48Å
171	R	62.9	Low	73.7	Confident	180 Å²	180	90.1 Å²	90.1	68%	0.679	46%	0.455	S	S	*	.	H	α-helix	trans	-49.9	-24.6	177.5	-68.5	-176.4	-177.6	160.9	0.5	114.4	L173 F174	R171-L173 VanDerWaalsContact C-N 3.31Å; R171-L173 PolarHBondContact O-N 3.21Å; R171-F174 WeakPolarHBondContact O-CB 3.3Å; R171-F174 PolarHBondContact O-N 3.4Å
172	Q	65.8	Low	74	Confident	122 Å²	122	82.3 Å²	82.3	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-65.6	-29	174.5	-65.5	173.5	-22.9	0	0	113.5	S170 P176	S170-Q172 PolarHBondContact O-N 3.03Å; S170-Q172 PolarHBondContact OG-N 3.37Å; Q172-P176 VanDerWaalsContact O-CD 3.25Å; Q172-P176 WeakPolarHBondContact O-CD 3.42Å
173	L	69.3	Low	74.1	Confident	103 Å²	103	79.8 Å²	79.8	54%	0.539	41%	0.412	S	S	.	.	H	α-helix	trans	-82.6	-19.9	176.2	-62.7	173.7	0	0	0	112.6	S170 R171 P176 S177	S170-L173 WeakPolarHBondContact O-CB 3.27Å; S170-L173 PolarHBondContact O-N 3.48Å; R171-L173 VanDerWaalsContact C-N 3.31Å; R171-L173 PolarHBondContact O-N 3.21Å; L173-P176 WeakPolarHBondContact O-CD 3.28Å; L173-S177 PolarHBondContact O-N 3.03Å; L173-S177 PolarHBondContact O-OG 2.91Å
174	F	75.9	Confident	74.5	Confident	24 Å²	24	86.2 Å²	86.2	11%	0.105	43%	0.434	C	S	.	.	H	α-helix	trans	-63.9	-45.2	-175.8	-171.9	-147.4	0	0	0	112	N147 W165 R171 S177 L178	N147-F174 HydrophobicContact CB-CD1 3.86Å; N147-F174 HydrophobicContact CB-CE1 4.02Å; N147-F174 VanDerWaalsContact CG-CD1 3.43Å; W165-F174 HydrophobicContact CB-CE2 4.21Å; W165-F174 HydrophobicContact CB-CZ 4.19Å; W165-F174 AromaticContact CD1-CD2 3.44Å; W165-F174 VanDerWaalsContact CD1-CD2 3.44Å; W165-F174 AromaticContact CD1-CE2 3.28Å; W165-F174 HydrophobicContact CD2-CB 4.23Å; W165-F174 AromaticContact CD2-CD2 3.76Å; W165-F174 HydrophobicContact CD2-CD2 3.76Å; W165-F174 HydrophobicContact CD2-CE2 4.19Å; W165-F174 AromaticContact CD2-CG 3.94Å; W165-F174 HydrophobicContact CD2-CG 3.94Å; W165-F174 AromaticContact CE2-CD2 3.42Å; W165-F174 VanDerWaalsContact CE2-CD2 3.42Å; W165-F174 AromaticContact CE2-CG 3.84Å; W165-F174 HydrophobicContact CE3-CB 4.34Å; W165-F174 HydrophobicContact CE3-CG 4.37Å; W165-F174 AromaticContact CG-CD2 3.74Å; W165-F174 HydrophobicContact CG-CD2 3.74Å; W165-F174 AromaticContact CG-CE2 3.67Å; W165-F174 HydrophobicContact CG-CE2 3.67Å; W165-F174 HydrophobicContact CG-CG 4.24Å; W165-F174 HydrophobicContact CG-CZ 4.1Å; W165-F174 HydrophobicContact CH2-CB 3.78Å; W165-F174 HydrophobicContact CZ2-CB 3.69Å; W165-F174 HydrophobicContact CZ2-CD2 4.01Å; W165-F174 HydrophobicContact CZ2-CG 4.16Å; W165-F174 HydrophobicContact CZ3-CB 4.12Å; W165-F174 AromaticContact NE1-CD2 3.26Å; W165-F174 VanDerWaalsContact NE1-CD2 3.26Å; W165-F174 AromaticContact NE1-CE2 3.61Å; R171-F174 WeakPolarHBondContact O-CB 3.3Å; R171-F174 PolarHBondContact O-N 3.4Å; F174-S177 PolarHBondContact O-N 2.97Å; F174-L178 HydrophobicContact CD1-CD1 4.1Å; F174-L178 HydrophobicContact CD2-CD1 4.09Å; F174-L178 HydrophobicContact CD2-CD2 4.32Å; F174-L178 HydrophobicContact CD2-CG 3.81Å; F174-L178 HydrophobicContact CE1-CD1 3.78Å; F174-L178 HydrophobicContact CE1-CG 4.47Å; F174-L178 HydrophobicContact CE2-CD1 3.79Å; F174-L178 HydrophobicContact CE2-CD2 3.63Å; F174-L178 HydrophobicContact CE2-CG 3.57Å; F174-L178 HydrophobicContact CG-CD1 4.25Å; F174-L178 HydrophobicContact CG-CG 4.38Å; F174-L178 HydrophobicContact CZ-CD1 3.63Å; F174-L178 HydrophobicContact CZ-CD2 3.97Å; F174-L178 HydrophobicContact CZ-CG 3.94Å; F174-L178 WeakPolarHBondContact O-CG 3.38Å; F174-L178 PolarHBondContact O-N 3.33Å
175	L	78.1	Confident	75	Confident	25 Å²	25	83.3 Å²	83.3	13%	0.131	42%	0.415	C	S	.	.	H	α-helix	trans	-62.4	-49.4	-178.5	178.6	63.9	0	0	0	112.7	T143 Q146 N147 L150 S177 L178 N179	T143-L175 HydrophobicContact CG2-CB 4.11Å; T143-L175 HydrophobicContact CG2-CD2 4.13Å; Q146-L175 HydrophobicContact CB-CD1 4.12Å; Q146-L175 HydrophobicContact CB-CD2 4.28Å; N147-L175 VanDerWaalsContact OD1-CA 3.25Å; N147-L175 WeakPolarHBondContact OD1-CA 3.31Å; N147-L175 VanDerWaalsContact OD1-CB 3.29Å; N147-L175 WeakPolarHBondContact OD1-CB 3.26Å; N147-L175 PolarHBondContact OD1-N 2.93Å; L150-L175 HydrophobicContact CD1-CD1 3.34Å; L175-S177 VanDerWaalsContact C-N 3.32Å; L175-S177 PolarHBondContact O-N 2.96Å; L175-L178 PolarHBondContact O-N 3.17Å; L175-N179 PolarHBondContact O-N 3.16Å; L175-N179 PolarHBondContact O-ND2 3.18Å
176	P	81	Confident	75.8	Confident	76 Å²	76	82.1 Å²	82.1	49%	0.494	42%	0.416	S	S	.	.	H	α-helix	trans	-56	-41	170.8	-27.7	34.4	0	0	0	114.1	Q172 L173 S180	Q172-P176 VanDerWaalsContact O-CD 3.25Å; Q172-P176 WeakPolarHBondContact O-CD 3.42Å; L173-P176 WeakPolarHBondContact O-CD 3.28Å; P176-S180 WeakPolarHBondContact O-CB 3.45Å; P176-S180 PolarHBondContact O-N 3.36Å
177	S	81.4	Confident	76.9	Confident	69 Å²	69	84.3 Å²	84.3	48%	0.483	42%	0.424	S	S	.	.	H	α-helix	trans	-67.3	-41.8	178	-64.6	0	0	0	0	112.7	L173 F174 L175 S180 L181	L173-S177 PolarHBondContact O-N 3.03Å; L173-S177 PolarHBondContact O-OG 2.91Å; F174-S177 PolarHBondContact O-N 2.97Å; L175-S177 VanDerWaalsContact C-N 3.32Å; L175-S177 PolarHBondContact O-N 2.96Å; S177-S180 PolarHBondContact O-N 2.84Å; S177-L181 VanDerWaalsContact O-CB 3.31Å; S177-L181 WeakPolarHBondContact O-CB 3.37Å; S177-L181 PolarHBondContact O-N 2.91Å
178	L	83.4	Confident	78.2	Confident	4 Å²	4	81.4 Å²	81.4	2%	0.021	40%	0.403	C	S	.	.	H	α-helix	trans	-63.5	-43.2	175	-75.7	-179.8	0	0	0	112	N147 L150 L154 I163 F174 L175 L181 F182	N147-L178 HydrophobicContact CB-CD1 4.46Å; L150-L178 HydrophobicContact CB-CD1 4.47Å; L154-L178 HydrophobicContact CD1-CD2 3.95Å; I163-L178 HydrophobicContact CG2-CD2 4.21Å; F174-L178 HydrophobicContact CD1-CD1 4.1Å; F174-L178 HydrophobicContact CD2-CD1 4.09Å; F174-L178 HydrophobicContact CD2-CD2 4.32Å; F174-L178 HydrophobicContact CD2-CG 3.81Å; F174-L178 HydrophobicContact CE1-CD1 3.78Å; F174-L178 HydrophobicContact CE1-CG 4.47Å; F174-L178 HydrophobicContact CE2-CD1 3.79Å; F174-L178 HydrophobicContact CE2-CD2 3.63Å; F174-L178 HydrophobicContact CE2-CG 3.57Å; F174-L178 HydrophobicContact CG-CD1 4.25Å; F174-L178 HydrophobicContact CG-CG 4.38Å; F174-L178 HydrophobicContact CZ-CD1 3.63Å; F174-L178 HydrophobicContact CZ-CD2 3.97Å; F174-L178 HydrophobicContact CZ-CG 3.94Å; F174-L178 WeakPolarHBondContact O-CG 3.38Å; F174-L178 PolarHBondContact O-N 3.33Å; L175-L178 PolarHBondContact O-N 3.17Å; L178-L181 WeakPolarHBondContact O-CB 3.31Å; L178-L181 PolarHBondContact O-N 3.4Å; L178-F182 WeakPolarHBondContact O-CB 3.38Å; L178-F182 PolarHBondContact O-N 3.39Å
179	N	85.7	Confident	79.6	Confident	61 Å²	61	77.9 Å²	77.9	33%	0.326	39%	0.389	S	S	.	.	H	α-helix	trans	-63.1	-48.6	176.2	-72.8	-26.6	0	0	0	110.9	L150 L175 L181 F182 D183	L150-N179 VanDerWaalsContact CD1-OD1 3.27Å; L150-N179 WeakPolarHBondContact CD1-OD1 3.47Å; L175-N179 PolarHBondContact O-N 3.16Å; L175-N179 PolarHBondContact O-ND2 3.18Å; N179-L181 VanDerWaalsContact C-N 3.25Å; N179-L181 PolarHBondContact O-N 2.82Å; N179-F182 WeakPolarHBondContact O-CB 3.2Å; N179-F182 PolarHBondContact O-N 3.18Å; N179-F182 VanDerWaalsContact O-N 3.12Å; N179-D183 VanDerWaalsContact O-CG 3.27Å; N179-D183 PolarHBondContact O-N 3.2Å
180	S	87.8	Confident	81.1	Confident	46 Å²	46	80.6 Å²	80.6	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-35.1	176.5	-165.4	0	0	0	0	112.6	P176 S177 R184	P176-S180 WeakPolarHBondContact O-CB 3.45Å; P176-S180 PolarHBondContact O-N 3.36Å; S177-S180 PolarHBondContact O-N 2.84Å; S180-R184 VanDerWaalsContact O-CB 3.28Å; S180-R184 WeakPolarHBondContact O-CB 3.35Å; S180-R184 WeakPolarHBondContact O-CD 3.29Å; S180-R184 WeakPolarHBondContact O-CG 3.13Å; S180-R184 PolarHBondContact O-N 3Å; S180-R184 PolarHBondContact OG-NE 3.24Å
181	L	85	Confident	82.4	Confident	75 Å²	75	83.4 Å²	83.4	39%	0.393	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-47.2	173.5	-178.8	63.9	0	0	0	111.6	S177 L178 N179 D183 R184 I185	S177-L181 VanDerWaalsContact O-CB 3.31Å; S177-L181 WeakPolarHBondContact O-CB 3.37Å; S177-L181 PolarHBondContact O-N 2.91Å; L178-L181 WeakPolarHBondContact O-CB 3.31Å; L178-L181 PolarHBondContact O-N 3.4Å; N179-L181 VanDerWaalsContact C-N 3.25Å; N179-L181 PolarHBondContact O-N 2.82Å; L181-D183 PolarHBondContact O-N 3.44Å; L181-R184 PolarHBondContact O-N 2.89Å; L181-I185 HydrophobicContact CD1-CD1 3.76Å; L181-I185 HydrophobicContact CD1-CG1 4.14Å; L181-I185 HydrophobicContact CD2-CD1 4.49Å; L181-I185 HydrophobicContact CG-CD1 3.77Å; L181-I185 HydrophobicContact CG-CG1 4.46Å; L181-I185 WeakPolarHBondContact O-CB 3.49Å; L181-I185 VanDerWaalsContact O-CG1 3.26Å; L181-I185 WeakPolarHBondContact O-CG1 3.5Å; L181-I185 PolarHBondContact O-N 3.3Å
182	F	86.3	Confident	83.7	Confident	49 Å²	49	76 Å²	76	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-45.3	177	176.4	-97.6	0	0	0	112.2	H153 L154 K157 Y158 L178 N179 T186	H153-F182 AromaticContact CD2-CE2 3.78Å; H153-F182 AromaticContact NE2-CE2 3.68Å; L154-F182 HydrophobicContact CD2-CB 4.13Å; L154-F182 HydrophobicContact CD2-CD2 3.73Å; L154-F182 HydrophobicContact CD2-CG 4.43Å; K157-F182 HydrophobicContact CD-CE2 4.31Å; Y158-F182 HydrophobicContact CE2-CD2 4.38Å; L178-F182 WeakPolarHBondContact O-CB 3.38Å; L178-F182 PolarHBondContact O-N 3.39Å; N179-F182 WeakPolarHBondContact O-CB 3.2Å; N179-F182 PolarHBondContact O-N 3.18Å; N179-F182 VanDerWaalsContact O-N 3.12Å; F182-T186 VanDerWaalsContact O-CB 3.26Å; F182-T186 WeakPolarHBondContact O-CB 3.5Å; F182-T186 PolarHBondContact O-N 3.11Å; F182-T186 PolarHBondContact O-OG1 3.28Å
183	D	87.5	Confident	84.8	Confident	87 Å²	87	74 Å²	74	47%	0.465	38%	0.376	S	S	.	.	H	α-helix	trans	-62.9	-48.9	177.9	-66.4	-26	0	0	0	110.7	N179 L181 I185 T186 I187	N179-D183 VanDerWaalsContact O-CG 3.27Å; N179-D183 PolarHBondContact O-N 3.2Å; L181-D183 PolarHBondContact O-N 3.44Å; D183-I185 PolarHBondContact O-N 3.46Å; D183-T186 PolarHBondContact O-N 3.46Å; D183-I187 WeakPolarHBondContact O-CB 3.48Å; D183-I187 VanDerWaalsContact O-CG1 3.24Å; D183-I187 WeakPolarHBondContact O-CG1 3.42Å; D183-I187 PolarHBondContact O-N 3.38Å
184	R	88.4	Confident	85.9	Confident	174 Å²	174	73 Å²	73	66%	0.657	38%	0.378	S	S	*	.	H	α-helix	trans	-61.6	-44.5	178.5	-73.2	169.7	-171.8	-81.4	0.4	112.2	S180 L181 F188	S180-R184 VanDerWaalsContact O-CB 3.28Å; S180-R184 WeakPolarHBondContact O-CB 3.35Å; S180-R184 WeakPolarHBondContact O-CD 3.29Å; S180-R184 WeakPolarHBondContact O-CG 3.13Å; S180-R184 PolarHBondContact O-N 3Å; S180-R184 PolarHBondContact OG-NE 3.24Å; L181-R184 PolarHBondContact O-N 2.89Å; R184-F188 WeakPolarHBondContact O-CB 3.24Å; R184-F188 PolarHBondContact O-N 2.98Å
185	I	86.9	Confident	86.7	Confident	47 Å²	47	76.4 Å²	76.4	24%	0.241	39%	0.39	C	S	.	.	H	α-helix	trans	-63.7	-43.3	176.2	-69.4	171.4	0	0	0	110.5	Y158 L181 D183 F188 L189	Y158-I185 HydrophobicContact CD1-CG2 4.2Å; Y158-I185 HydrophobicContact CD2-CG2 4.16Å; Y158-I185 HydrophobicContact CE1-CG2 3.79Å; Y158-I185 HydrophobicContact CE2-CB 4.49Å; Y158-I185 HydrophobicContact CE2-CG2 3.73Å; Y158-I185 HydrophobicContact CG-CG2 4.38Å; L181-I185 HydrophobicContact CD1-CD1 3.76Å; L181-I185 HydrophobicContact CD1-CG1 4.14Å; L181-I185 HydrophobicContact CD2-CD1 4.49Å; L181-I185 HydrophobicContact CG-CD1 3.77Å; L181-I185 HydrophobicContact CG-CG1 4.46Å; L181-I185 WeakPolarHBondContact O-CB 3.49Å; L181-I185 VanDerWaalsContact O-CG1 3.26Å; L181-I185 WeakPolarHBondContact O-CG1 3.5Å; L181-I185 PolarHBondContact O-N 3.3Å; D183-I185 PolarHBondContact O-N 3.46Å; I185-F188 PolarHBondContact O-N 3.37Å; I185-L189 HydrophobicContact CG2-CD1 3.72Å; I185-L189 HydrophobicContact CG2-CG 4.25Å; I185-L189 WeakPolarHBondContact O-CB 3.26Å; I185-L189 VanDerWaalsContact O-CG 3.31Å; I185-L189 WeakPolarHBondContact O-CG 3.48Å; I185-L189 PolarHBondContact O-N 3.29Å
186	T	85.7	Confident	87.4	Confident	56 Å²	56	76.3 Å²	76.3	34%	0.344	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-44.2	179.8	-62.1	0	0	0	0	111.6	Y158 F182 D183 R190	Y158-T186 PolarHBondContact OH-OG1 2.83Å; F182-T186 VanDerWaalsContact O-CB 3.26Å; F182-T186 WeakPolarHBondContact O-CB 3.5Å; F182-T186 PolarHBondContact O-N 3.11Å; F182-T186 PolarHBondContact O-OG1 3.28Å; D183-T186 PolarHBondContact O-N 3.46Å; T186-R190 WeakPolarHBondContact O-CB 3.29Å; T186-R190 PolarHBondContact O-N 3Å; T186-R190 VanDerWaalsContact O-N 3.1Å
187	I	87.8	Confident	87.9	Confident	87 Å²	87	75.4 Å²	75.4	45%	0.446	39%	0.389	S	S	.	.	H	α-helix	trans	-61.2	-49.6	174.4	-70.1	166.1	0	0	0	110.4	D183 L189 R190 H191	D183-I187 WeakPolarHBondContact O-CB 3.48Å; D183-I187 VanDerWaalsContact O-CG1 3.24Å; D183-I187 WeakPolarHBondContact O-CG1 3.42Å; D183-I187 PolarHBondContact O-N 3.38Å; I187-L189 PolarHBondContact O-N 2.87Å; I187-R190 WeakPolarHBondContact O-CB 3.48Å; I187-R190 PolarHBondContact O-N 2.96Å; I187-H191 PolarHBondContact O-CD2 2.84Å; I187-H191 PolarHBondContact O-N 3.15Å
188	F	87.2	Confident	88.6	Confident	109 Å²	109	75 Å²	75	48%	0.478	39%	0.39	S	S	.	.	H	α-helix	trans	-57.8	-48.8	179.7	176.9	-113	0	0	0	112.7	R184 I185 R190 H191 I192 F221	R184-F188 WeakPolarHBondContact O-CB 3.24Å; R184-F188 PolarHBondContact O-N 2.98Å; I185-F188 PolarHBondContact O-N 3.37Å; F188-R190 VanDerWaalsContact C-N 3.31Å; F188-R190 PolarHBondContact O-N 3.46Å; F188-H191 PolarHBondContact O-N 2.99Å; F188-I192 HydrophobicContact CD1-CD1 3.64Å; F188-I192 HydrophobicContact CD2-CD1 4.16Å; F188-I192 HydrophobicContact CE1-CD1 3.46Å; F188-I192 VanDerWaalsContact CE1-CD1 3.46Å; F188-I192 HydrophobicContact CE2-CD1 4Å; F188-I192 HydrophobicContact CG-CD1 4.02Å; F188-I192 HydrophobicContact CZ-CD1 3.68Å; F188-I192 WeakPolarHBondContact O-CG1 3.34Å; F188-I192 PolarHBondContact O-N 2.76Å; F188-F221 HydrophobicContact CE1-CZ 4.32Å; F188-F221 HydrophobicContact CE2-CZ 4.05Å; F188-F221 HydrophobicContact CZ-CE2 4.14Å; F188-F221 AromaticContact CZ-CZ 3.53Å; F188-F221 HydrophobicContact CZ-CZ 3.53Å
189	L	86.1	Confident	89.1	Confident	75 Å²	75	75.1 Å²	75.1	39%	0.393	39%	0.391	S	S	.	.	H	α-helix	trans	-64	-35.1	177.4	-70.9	171.8	0	0	0	112.5	Y158 I185 I187 I192 S193	Y158-L189 HydrophobicContact CD1-CD1 3.84Å; Y158-L189 HydrophobicContact CE1-CD1 3.27Å; I185-L189 HydrophobicContact CG2-CD1 3.72Å; I185-L189 HydrophobicContact CG2-CG 4.25Å; I185-L189 WeakPolarHBondContact O-CB 3.26Å; I185-L189 VanDerWaalsContact O-CG 3.31Å; I185-L189 WeakPolarHBondContact O-CG 3.48Å; I185-L189 PolarHBondContact O-N 3.29Å; I187-L189 PolarHBondContact O-N 2.87Å; L189-I192 PolarHBondContact O-N 3.12Å; L189-S193 VanDerWaalsContact O-CB 3.31Å; L189-S193 WeakPolarHBondContact O-CB 3.21Å; L189-S193 PolarHBondContact O-N 3.22Å
190	R	88.4	Confident	89.5	Confident	169 Å²	169	74 Å²	74	64%	0.638	38%	0.384	S	S	*	.	H	α-helix	trans	-64	-43.5	172.9	-170.8	-176.1	68.1	147	2	111.6	T186 I187 F188 S193 S194	T186-R190 WeakPolarHBondContact O-CB 3.29Å; T186-R190 PolarHBondContact O-N 3Å; T186-R190 VanDerWaalsContact O-N 3.1Å; I187-R190 WeakPolarHBondContact O-CB 3.48Å; I187-R190 PolarHBondContact O-N 2.96Å; F188-R190 VanDerWaalsContact C-N 3.31Å; F188-R190 PolarHBondContact O-N 3.46Å; R190-S193 PolarHBondContact O-N 2.91Å; R190-S194 WeakPolarHBondContact O-CB 3.28Å; R190-S194 PolarHBondContact O-N 3.07Å
191	H	90.3	Very high	89.9	Confident	113 Å²	113	77 Å²	77	52%	0.523	39%	0.393	S	S	.	.	H	α-helix	trans	-64.3	-41.8	175.5	-75.5	-70.8	0	0	0	112.3	I187 F188 S194 R195	I187-H191 PolarHBondContact O-CD2 2.84Å; I187-H191 PolarHBondContact O-N 3.15Å; F188-H191 PolarHBondContact O-N 2.99Å; H191-S194 PolarHBondContact O-N 2.81Å; H191-R195 PolarHBondContact O-N 3.03Å
192	I	88.7	Confident	90.4	Very high	24 Å²	24	76.7 Å²	76.7	12%	0.123	39%	0.39	C	S	.	.	H	α-helix	trans	-63.2	-47.8	175.6	-66.4	163.1	0	0	0	110.8	F188 L189 S194 R195 V196 V220 F221	F188-I192 HydrophobicContact CD1-CD1 3.64Å; F188-I192 HydrophobicContact CD2-CD1 4.16Å; F188-I192 HydrophobicContact CE1-CD1 3.46Å; F188-I192 VanDerWaalsContact CE1-CD1 3.46Å; F188-I192 HydrophobicContact CE2-CD1 4Å; F188-I192 HydrophobicContact CG-CD1 4.02Å; F188-I192 HydrophobicContact CZ-CD1 3.68Å; F188-I192 WeakPolarHBondContact O-CG1 3.34Å; F188-I192 PolarHBondContact O-N 2.76Å; L189-I192 PolarHBondContact O-N 3.12Å; I192-S194 VanDerWaalsContact C-N 3.28Å; I192-S194 PolarHBondContact O-N 3.04Å; I192-R195 PolarHBondContact O-N 3.05Å; I192-R195 VanDerWaalsContact O-N 3.15Å; I192-V196 HydrophobicContact CG2-CG2 4.2Å; I192-V196 WeakPolarHBondContact O-CB 3.36Å; I192-V196 WeakPolarHBondContact O-CG2 3.31Å; I192-V196 PolarHBondContact O-N 3.17Å; I192-V220 HydrophobicContact CG2-CG1 3.99Å; I192-V220 HydrophobicContact CG2-CG2 3.85Å; I192-F221 HydrophobicContact CD1-CE1 4.25Å; I192-F221 HydrophobicContact CD1-CE2 4.49Å; I192-F221 HydrophobicContact CD1-CZ 3.63Å; I192-F221 HydrophobicContact CG1-CE1 4.25Å; I192-F221 HydrophobicContact CG1-CZ 4.14Å
193	S	89.3	Confident	90.8	Very high	81 Å²	81	74.4 Å²	74.4	57%	0.566	38%	0.38	S	S	*	.	H	α-helix	trans	-58.1	-41.1	177.6	176.7	0	0	0	0	111.8	L189 R190 A197	L189-S193 VanDerWaalsContact O-CB 3.31Å; L189-S193 WeakPolarHBondContact O-CB 3.21Å; L189-S193 PolarHBondContact O-N 3.22Å; R190-S193 PolarHBondContact O-N 2.91Å; S193-A197 WeakPolarHBondContact O-CB 3.38Å; S193-A197 PolarHBondContact O-N 3.43Å
194	S	92.5	Very high	91.2	Very high	81 Å²	81	71.3 Å²	71.3	57%	0.566	36%	0.364	S	S	*	.	H	α-helix	trans	-66.5	-40.8	174.9	-172.2	0	0	0	0	113	R190 H191 I192 A197 A198	R190-S194 WeakPolarHBondContact O-CB 3.28Å; R190-S194 PolarHBondContact O-N 3.07Å; H191-S194 PolarHBondContact O-N 2.81Å; I192-S194 VanDerWaalsContact C-N 3.28Å; I192-S194 PolarHBondContact O-N 3.04Å; S194-A197 PolarHBondContact O-N 2.95Å; S194-A198 PolarHBondContact O-N 3.37Å
195	R	92.7	Very high	91.5	Very high	97 Å²	97	68.6 Å²	68.6	37%	0.366	36%	0.362	S	S	.	.	H	α-helix	trans	-65.9	-43.7	175.6	-177.5	175.2	168.3	-160.9	-8.3	111.2	H191 I192 A197 A198 V199 L224 D225 D228	H191-R195 PolarHBondContact O-N 3.03Å; I192-R195 PolarHBondContact O-N 3.05Å; I192-R195 VanDerWaalsContact O-N 3.15Å; R195-A197 PolarHBondContact O-N 2.83Å; R195-A198 PolarHBondContact O-N 2.89Å; R195-V199 HydrophobicContact CG-CG2 4.38Å; R195-V199 WeakPolarHBondContact O-CB 3.29Å; R195-V199 WeakPolarHBondContact O-CG2 3.5Å; R195-V199 PolarHBondContact O-N 3.25Å; R195-L224 HydrophobicContact CG-CD1 4.21Å; R195-L224 HydrophobicContact CG-CD2 4.04Å; R195-D225 IonicContact NH2-OD1 3.55Å; R195-D225 PolarHBondContact NH2-OD1 3.01Å; R195-D228 IonicContact CZ-OD2 3.23Å; R195-D228 IonicContact NH2-OD2 2.83Å; R195-D228 PolarHBondContact NH2-OD2 3.28Å
196	V	92.4	Very high	91.8	Very high	22 Å²	22	67.8 Å²	67.8	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-45.7	175.5	169.3	0	0	0	0	110.9	I192 A198 V199 I200 A214 V220 W223 L224	I192-V196 HydrophobicContact CG2-CG2 4.2Å; I192-V196 WeakPolarHBondContact O-CB 3.36Å; I192-V196 WeakPolarHBondContact O-CG2 3.31Å; I192-V196 PolarHBondContact O-N 3.17Å; V196-A198 PolarHBondContact O-N 3.03Å; V196-V199 PolarHBondContact O-N 3.32Å; V196-I200 HydrophobicContact CG1-CD1 3.72Å; V196-I200 HydrophobicContact CG1-CG1 4.4Å; V196-I200 WeakPolarHBondContact O-CB 3.16Å; V196-I200 VanDerWaalsContact O-CG1 3.24Å; V196-I200 WeakPolarHBondContact O-CG1 3.46Å; V196-I200 PolarHBondContact O-N 2.93Å; V196-A214 HydrophobicContact CG1-CB 4.29Å; V196-V220 HydrophobicContact CG2-CG2 3.61Å; V196-W223 HydrophobicContact CG1-CH2 4.49Å; V196-W223 HydrophobicContact CG1-CZ3 4.09Å; V196-W223 HydrophobicContact CG2-CZ3 4.35Å; V196-L224 HydrophobicContact CG2-CD1 4.2Å; V196-L224 HydrophobicContact CG2-CD2 4Å; V196-L224 HydrophobicContact CG2-CG 4.3Å
197	A	93.4	Very high	92.2	Very high	58 Å²	58	65.1 Å²	65.1	48%	0.479	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-42.4	177.1	0	0	0	0	0	112.8	S193 S194 R195 Q201	S193-A197 WeakPolarHBondContact O-CB 3.38Å; S193-A197 PolarHBondContact O-N 3.43Å; S194-A197 PolarHBondContact O-N 2.95Å; R195-A197 PolarHBondContact O-N 2.83Å; A197-Q201 WeakPolarHBondContact O-CB 3.49Å; A197-Q201 PolarHBondContact O-N 3.39Å
198	A	94.7	Very high	92.5	Very high	60 Å²	60	62 Å²	62	50%	0.496	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-45.2	177.2	0	0	0	0	0	112.4	S194 R195 V196 Q201 E202	S194-A198 PolarHBondContact O-N 3.37Å; R195-A198 PolarHBondContact O-N 2.89Å; V196-A198 PolarHBondContact O-N 3.03Å; A198-Q201 PolarHBondContact O-N 3.49Å; A198-E202 PolarHBondContact O-N 3.32Å
199	V	94	Very high	92.9	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-40.7	178.2	169.4	0	0	0	0	111.7	R195 V196 Q201 E202 I203 L224 C227	R195-V199 HydrophobicContact CG-CG2 4.38Å; R195-V199 WeakPolarHBondContact O-CB 3.29Å; R195-V199 WeakPolarHBondContact O-CG2 3.5Å; R195-V199 PolarHBondContact O-N 3.25Å; V196-V199 PolarHBondContact O-N 3.32Å; V199-Q201 PolarHBondContact O-N 2.96Å; V199-E202 PolarHBondContact O-N 2.91Å; V199-I203 HydrophobicContact CG1-CD1 3.88Å; V199-I203 VanDerWaalsContact O-CG1 3.31Å; V199-I203 WeakPolarHBondContact O-CG1 3.48Å; V199-I203 PolarHBondContact O-N 3.4Å; V199-L224 HydrophobicContact CB-CD2 4.07Å; V199-L224 HydrophobicContact CG1-CD2 4.25Å; V199-L224 HydrophobicContact CG2-CD2 3.89Å; V199-C227 HydrophobicContact CG1-CB 3.42Å; V199-C227 VanDerWaalsContact CG1-CB 3.42Å
200	I	95	Very high	93.4	Very high	36 Å²	36	54 Å²	54	19%	0.185	30%	0.296	C	S	.	.	H	α-helix	trans	-57.3	-49.5	172.3	-74	169.7	0	0	0	110.5	V196 E202 I203 T204 V212 A214 W223	V196-I200 HydrophobicContact CG1-CD1 3.72Å; V196-I200 HydrophobicContact CG1-CG1 4.4Å; V196-I200 WeakPolarHBondContact O-CB 3.16Å; V196-I200 VanDerWaalsContact O-CG1 3.24Å; V196-I200 WeakPolarHBondContact O-CG1 3.46Å; V196-I200 PolarHBondContact O-N 2.93Å; I200-E202 VanDerWaalsContact C-N 3.32Å; I200-E202 PolarHBondContact O-N 3.47Å; I200-I203 PolarHBondContact O-N 3.38Å; I200-T204 WeakPolarHBondContact O-CB 3.16Å; I200-T204 PolarHBondContact O-N 3.44Å; I200-T204 PolarHBondContact O-OG1 3.46Å; I200-V212 HydrophobicContact CG2-CB 4.24Å; I200-V212 WeakPolarHBondContact CG2-O 3.45Å; I200-A214 HydrophobicContact CD1-CB 4.15Å; I200-W223 HydrophobicContact CD1-CH2 4.45Å; I200-W223 HydrophobicContact CG1-CH2 3.96Å
201	Q	95.4	Very high	93.8	Very high	110 Å²	110	49.6 Å²	49.6	51%	0.514	29%	0.285	S	S	.	.	H	α-helix	trans	-59.7	-42.6	179.7	-177.8	62	27.9	0	0	111.8	A197 A198 V199 T204 L205	A197-Q201 WeakPolarHBondContact O-CB 3.49Å; A197-Q201 PolarHBondContact O-N 3.39Å; A198-Q201 PolarHBondContact O-N 3.49Å; V199-Q201 PolarHBondContact O-N 2.96Å; Q201-T204 PolarHBondContact O-N 3.22Å; Q201-L205 WeakPolarHBondContact O-CG 3.31Å; Q201-L205 PolarHBondContact O-N 3.27Å
202	E	95.6	Very high	94	Very high	69 Å²	69	44.4 Å²	44.4	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-67.1	-37.1	179.5	-173.3	161.8	-139.8	0	0	112.7	A198 V199 I200 L205 C206 V231 K235	A198-E202 PolarHBondContact O-N 3.32Å; V199-E202 PolarHBondContact O-N 2.91Å; I200-E202 VanDerWaalsContact C-N 3.32Å; I200-E202 PolarHBondContact O-N 3.47Å; E202-L205 PolarHBondContact O-N 2.89Å; E202-C206 PolarHBondContact O-N 3.12Å; E202-C206 PolarHBondContact O-SG 2.87Å; E202-V231 HydrophobicContact CB-CG2 4.5Å; E202-V231 HydrophobicContact CG-CG1 3.74Å; E202-V231 HydrophobicContact CG-CG2 4.01Å; E202-K235 WeakPolarHBondContact OE1-CE 3.5Å; E202-K235 IonicContact OE1-NZ 2.67Å; E202-K235 PolarHBondContact OE1-NZ 2.88Å
203	I	95.2	Very high	94.1	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-72.4	-40.9	174.4	-61	167.8	0	0	0	111	V199 I200 L205 C206 L207 V212 C227 M230 V231 L254	V199-I203 HydrophobicContact CG1-CD1 3.88Å; V199-I203 VanDerWaalsContact O-CG1 3.31Å; V199-I203 WeakPolarHBondContact O-CG1 3.48Å; V199-I203 PolarHBondContact O-N 3.4Å; I200-I203 PolarHBondContact O-N 3.38Å; I203-L205 PolarHBondContact O-N 2.77Å; I203-C206 CarbonylContact O-C 3.35Å; I203-C206 WeakPolarHBondContact O-CA 3.4Å; I203-C206 PolarHBondContact O-N 2.87Å; I203-L207 HydrophobicContact CG2-CD1 3.75Å; I203-L207 HydrophobicContact CG2-CG 3.89Å; I203-L207 WeakPolarHBondContact O-CB 3.26Å; I203-L207 WeakPolarHBondContact O-CG 3.25Å; I203-L207 PolarHBondContact O-N 2.9Å; I203-V212 HydrophobicContact CG2-CG2 4.11Å; I203-C227 HydrophobicContact CD1-CB 3.7Å; I203-M230 HydrophobicContact CG2-CE 4.13Å; I203-M230 HydrophobicContact CG2-SD 4.48Å; I203-V231 HydrophobicContact CD1-CG2 4.29Å; I203-V231 HydrophobicContact CG1-CG2 3.46Å; I203-V231 VanDerWaalsContact CG1-CG2 3.46Å; I203-L254 HydrophobicContact CD1-CD1 3.39Å; I203-L254 HydrophobicContact CG2-CD1 4.08Å
204	T	95.6	Very high	93.9	Very high	21 Å²	21	43.7 Å²	43.7	13%	0.129	26%	0.259	C	S	.	.	H	α-helix	trans	-56	-37.8	173	-78.8	0	0	0	0	111.4	I200 Q201 L207 S208 G209 I210 V212	I200-T204 WeakPolarHBondContact O-CB 3.16Å; I200-T204 PolarHBondContact O-N 3.44Å; I200-T204 PolarHBondContact O-OG1 3.46Å; Q201-T204 PolarHBondContact O-N 3.22Å; T204-L207 CarbonylContact O-C 3.43Å; T204-L207 PolarHBondContact O-N 2.98Å; T204-S208 PolarHBondContact O-N 3.13Å; T204-G209 PolarHBondContact O-N 2.85Å; T204-I210 WeakPolarHBondContact CB-O 3.4Å; T204-I210 WeakPolarHBondContact CG2-O 3.32Å; T204-I210 PolarHBondContact OG1-O 2.97Å; T204-V212 PolarHBondContact OG1-N 3.35Å
205	L	94.3	Very high	93.4	Very high	118 Å²	118	41.4 Å²	41.4	62%	0.618	24%	0.242	S	C	*	.	H	α-helix	trans	-67.8	-44.8	171.3	-69.2	171.5	0	0	0	112.6	Q201 E202 I203 L207 S208	Q201-L205 WeakPolarHBondContact O-CG 3.31Å; Q201-L205 PolarHBondContact O-N 3.27Å; E202-L205 PolarHBondContact O-N 2.89Å; I203-L205 PolarHBondContact O-N 2.77Å; L205-L207 PolarHBondContact O-N 2.87Å; L205-S208 PolarHBondContact O-N 2.86Å; L205-S208 VanDerWaalsContact O-N 3.1Å
206	C	93.9	Very high	92.5	Very high	30 Å²	30	47.2 Å²	47.2	20%	0.203	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-25.6	175.8	-67.5	0	0	0	0	113.6	E202 I203 F234	E202-C206 PolarHBondContact O-N 3.12Å; E202-C206 PolarHBondContact O-SG 2.87Å; I203-C206 CarbonylContact O-C 3.35Å; I203-C206 WeakPolarHBondContact O-CA 3.4Å; I203-C206 PolarHBondContact O-N 2.87Å; C206-F234 HydrophobicContact CB-CB 4.07Å; C206-F234 HydrophobicContact CB-CD1 4.09Å; C206-F234 HydrophobicContact CB-CG 4.35Å
207	L	94.4	Very high	91.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	16.7	175.9	-61.3	-173.7	0	0	0	113	I203 T204 L205 G209 I210 V212 M230 F234 I241 M281	I203-L207 HydrophobicContact CG2-CD1 3.75Å; I203-L207 HydrophobicContact CG2-CG 3.89Å; I203-L207 WeakPolarHBondContact O-CB 3.26Å; I203-L207 WeakPolarHBondContact O-CG 3.25Å; I203-L207 PolarHBondContact O-N 2.9Å; T204-L207 CarbonylContact O-C 3.43Å; T204-L207 PolarHBondContact O-N 2.98Å; L205-L207 PolarHBondContact O-N 2.87Å; L207-G209 VanDerWaalsContact C-N 3.32Å; L207-G209 PolarHBondContact O-N 2.88Å; L207-I210 HydrophobicContact CB-CB 4.1Å; L207-I210 HydrophobicContact CB-CD1 4.29Å; L207-I210 HydrophobicContact CB-CG1 4.4Å; L207-I210 WeakPolarHBondContact O-CG1 3.44Å; L207-V212 HydrophobicContact CD1-CG2 3.92Å; L207-M230 HydrophobicContact CD1-CE 4.35Å; L207-M230 HydrophobicContact CD2-CE 3.99Å; L207-M230 HydrophobicContact CG-CE 4.45Å; L207-F234 HydrophobicContact CD2-CD1 4.39Å; L207-F234 HydrophobicContact CD2-CE1 3.62Å; L207-F234 HydrophobicContact CD2-CZ 4.08Å; L207-I241 HydrophobicContact CD2-CD1 3.64Å; L207-M281 HydrophobicContact CD1-CE 4.14Å; L207-M281 HydrophobicContact CD2-CE 3.88Å; L207-M281 HydrophobicContact CD2-CG 4.01Å
208	S	94.1	Very high	90.1	Very high	22 Å²	22	52.9 Å²	52.9	15%	0.154	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	41.7	172.8	-58.9	0	0	0	0	114.5	T204 L205 I241	T204-S208 PolarHBondContact O-N 3.13Å; L205-S208 PolarHBondContact O-N 2.86Å; L205-S208 VanDerWaalsContact O-N 3.1Å; S208-I241 PolarHBondContact OG-O 3.49Å
209	G	94.5	Very high	89.4	Confident	15 Å²	15	53.7 Å²	53.7	16%	0.155	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	-3.3	170.2	0	0	0	0	0	116	T204 L207 N211 H248	T204-G209 PolarHBondContact O-N 2.85Å; L207-G209 VanDerWaalsContact C-N 3.32Å; L207-G209 PolarHBondContact O-N 2.88Å; G209-N211 PolarHBondContact O-N 2.76Å; G209-H248 WeakPolarHBondContact O-CA 3.28Å
210	I	96.8	Very high	89	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.306	C	S	.	.			trans	-61.5	132.6	-180	-62.8	176.7	0	0	0	110.8	T204 L207 V212 Y247 L250 A252 L270 M281 L285	T204-I210 WeakPolarHBondContact CB-O 3.4Å; T204-I210 WeakPolarHBondContact CG2-O 3.32Å; T204-I210 PolarHBondContact OG1-O 2.97Å; L207-I210 HydrophobicContact CB-CB 4.1Å; L207-I210 HydrophobicContact CB-CD1 4.29Å; L207-I210 HydrophobicContact CB-CG1 4.4Å; L207-I210 WeakPolarHBondContact O-CG1 3.44Å; I210-V212 PolarHBondContact O-N 3.37Å; I210-Y247 WeakPolarHBondContact CA-O 3.44Å; I210-Y247 HydrophobicContact CG1-CG 4.36Å; I210-L250 HydrophobicContact CD1-CD1 4.36Å; I210-L250 HydrophobicContact CG1-CB 4.33Å; I210-L250 HydrophobicContact CG2-CB 4.19Å; I210-A252 HydrophobicContact CG2-CB 3.68Å; I210-L270 HydrophobicContact CD1-CD1 4.36Å; I210-M281 HydrophobicContact CD1-CE 4.18Å; I210-L285 HydrophobicContact CD1-CD1 3.85Å; I210-L285 HydrophobicContact CD1-CD2 3.53Å; I210-L285 HydrophobicContact CD1-CG 4.34Å
211	N	96.4	Very high	88.6	Confident	77 Å²	77	57.9 Å²	57.9	41%	0.412	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	108.7	178.1	-178.5	32.2	0	0	0	110.4	G209 L250 N251 A252	G209-N211 PolarHBondContact O-N 2.76Å; N211-L250 WeakPolarHBondContact CB-O 3.26Å; N211-L250 PolarHBondContact N-O 3.46Å; N211-N251 PolarHBondContact ND2-OD1 2.95Å; N211-N251 CarbonylContact O-C 3.55Å; N211-N251 WeakPolarHBondContact O-CA 3.45Å; N211-A252 PolarHBondContact O-N 2.78Å
212	V	95.1	Very high	88.2	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.024	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.2	-176.8	173.1	0	0	0	0	110.9	I200 I203 T204 L207 I210 L254	I200-V212 HydrophobicContact CG2-CB 4.24Å; I200-V212 WeakPolarHBondContact CG2-O 3.45Å; I203-V212 HydrophobicContact CG2-CG2 4.11Å; T204-V212 PolarHBondContact OG1-N 3.35Å; L207-V212 HydrophobicContact CD1-CG2 3.92Å; I210-V212 PolarHBondContact O-N 3.37Å; V212-L254 HydrophobicContact CG1-CD1 3.57Å; V212-L254 HydrophobicContact CG1-CG 3.83Å
213	T	90.2	Very high	87.9	Confident	51 Å²	51	55.1 Å²	55.1	31%	0.313	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144.1	176	58.8	0	0	0	0	111.2	A252 L253	T213-A252 PolarHBondContact N-O 2.89Å; T213-A252 PolarHBondContact OG1-O 3.29Å; T213-L253 WeakPolarHBondContact O-CD1 3.22Å
214	A	85.9	Confident	87.7	Confident	38 Å²	38	55 Å²	55	31%	0.314	30%	0.297	S	S	.	.			trans	-88.5	146.8	175.1	0	0	0	0	0	111.6	V196 I200 W223	V196-A214 HydrophobicContact CG1-CB 4.29Å; I200-A214 HydrophobicContact CD1-CB 4.15Å; A214-W223 HydrophobicContact CB-CH2 3.69Å; A214-W223 HydrophobicContact CB-CZ2 3.83Å; A214-W223 HydrophobicContact CB-CZ3 4.19Å
215	P	81.3	Confident	87.5	Confident	34 Å²	34	57.8 Å²	57.8	22%	0.221	31%	0.311	C	S	.	.			trans	-68.5	139.3	176.2	28.6	-34.4	0	0	0	111.7	S217 R218 W223 L253	P215-S217 PolarHBondContact O-N 3.08Å; P215-R218 HydrophobicContact CG-CB 4.45Å; P215-W223 VanDerWaalsContact CD-CE2 3.48Å; P215-W223 VanDerWaalsContact CD-NE1 3.25Å; P215-W223 HydrophobicContact CG-CD2 4.45Å; P215-W223 HydrophobicContact CG-CG 4.07Å; P215-L253 HydrophobicContact CB-CD1 4.37Å
216	K	74.6	Confident	87.4	Confident	218 Å²	218	53.2 Å²	53.2	95%	0.948	29%	0.288	S	S	*	.	S	Bend	trans	-77.6	-16.7	-175.4	-66.6	-178.4	-179.3	174.7	0	115.2
217	S	66.9	Low	87.3	Confident	113 Å²	113	51.8 Å²	51.8	79%	0.79	28%	0.279	S	S	*	.	S	Bend	trans	-129.8	2.1	-160.6	53.8	0	0	0	0	116.1	P215	P215-S217 PolarHBondContact O-N 3.08Å
218	R	68	Low	87.3	Confident	87 Å²	87	54.4 Å²	54.4	33%	0.328	29%	0.292	S	S	.	.	S	Bend	trans	-106.6	166.5	-175	-64.9	-168.9	175.5	-131.9	-9.6	112.6	P215 V220 D256 E257	P215-R218 HydrophobicContact CG-CB 4.45Å; R218-V220 PolarHBondContact O-N 3.49Å; R218-D256 WeakPolarHBondContact CD-OD1 3.38Å; R218-D256 IonicContact CZ-OD1 3.15Å; R218-D256 IonicContact NE-OD1 2.74Å; R218-D256 IonicContact NH1-OD1 2.81Å; R218-D256 PolarHBondContact NH1-OD1 3.1Å; R218-D256 IonicContact NH1-OD2 3.81Å; R218-E257 IonicContact CZ-OE2 3.35Å; R218-E257 IonicContact NH1-OE2 2.71Å; R218-E257 PolarHBondContact NH1-OE2 2.93Å; R218-E257 IonicContact NH2-OE2 3.73Å
219	C	79.8	Confident	87.3	Confident	76 Å²	76	58.9 Å²	58.9	51%	0.514	31%	0.311	S	S	.	.			trans	-64.2	106.6	178.2	-179.1	0	0	0	0	110.7	F221 R222 W223	C219-F221 PolarHBondContact O-N 3.48Å; C219-F221 VanDerWaalsContact O-N 3.16Å; C219-R222 HydrophobicContact CB-CB 4.28Å; C219-R222 PolarHBondContact O-N 2.93Å; C219-W223 PolarHBondContact O-N 3.14Å
220	V	85.5	Confident	87.2	Confident	46 Å²	46	58.2 Å²	58.2	28%	0.279	30%	0.304	S	S	.	.	H	α-helix	trans	-56.7	-33.8	-174.9	68.7	0	0	0	0	113.2	I192 V196 R218 L224	I192-V220 HydrophobicContact CG2-CG1 3.99Å; I192-V220 HydrophobicContact CG2-CG2 3.85Å; V196-V220 HydrophobicContact CG2-CG2 3.61Å; R218-V220 PolarHBondContact O-N 3.49Å; V220-L224 HydrophobicContact CG2-CD1 4.09Å; V220-L224 HydrophobicContact CG2-CG 4.37Å; V220-L224 WeakPolarHBondContact O-CB 3.26Å; V220-L224 WeakPolarHBondContact O-CG 3.47Å; V220-L224 PolarHBondContact O-N 3.2Å
221	F	87.1	Confident	87.1	Confident	85 Å²	85	58.3 Å²	58.3	37%	0.373	31%	0.305	S	S	.	.	H	α-helix	trans	-67.7	-49.5	178.9	-63	-69.1	0	0	0	112.3	F188 I192 C219 W223 L224 D225	F188-F221 HydrophobicContact CE1-CZ 4.32Å; F188-F221 HydrophobicContact CE2-CZ 4.05Å; F188-F221 HydrophobicContact CZ-CE2 4.14Å; F188-F221 AromaticContact CZ-CZ 3.53Å; F188-F221 HydrophobicContact CZ-CZ 3.53Å; I192-F221 HydrophobicContact CD1-CE1 4.25Å; I192-F221 HydrophobicContact CD1-CE2 4.49Å; I192-F221 HydrophobicContact CD1-CZ 3.63Å; I192-F221 HydrophobicContact CG1-CE1 4.25Å; I192-F221 HydrophobicContact CG1-CZ 4.14Å; C219-F221 PolarHBondContact O-N 3.48Å; C219-F221 VanDerWaalsContact O-N 3.16Å; F221-W223 VanDerWaalsContact C-N 3.3Å; F221-W223 PolarHBondContact O-N 3.29Å; F221-L224 WeakPolarHBondContact O-CB 3.13Å; F221-L224 PolarHBondContact O-N 3.03Å; F221-D225 PolarHBondContact O-N 2.95Å
222	R	86.3	Confident	87.1	Confident	117 Å²	117	57.9 Å²	57.9	44%	0.442	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-42.1	176.1	-176.5	179.7	176.8	-160	-4.3	111.3	C219 D225 C226 E257	C219-R222 HydrophobicContact CB-CB 4.28Å; C219-R222 PolarHBondContact O-N 2.93Å; R222-D225 PolarHBondContact O-N 3.35Å; R222-C226 WeakPolarHBondContact O-CB 3.24Å; R222-C226 PolarHBondContact O-N 3.39Å; R222-C226 PolarHBondContact O-SG 3.17Å; R222-E257 IonicContact CZ-OE1 2.71Å; R222-E257 IonicContact NH1-OE1 3.15Å; R222-E257 PolarHBondContact NH1-OE1 3.44Å; R222-E257 IonicContact NH2-OE1 2.79Å; R222-E257 PolarHBondContact NH2-OE1 2.88Å
223	W	89	Confident	87	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.015	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-43	176.1	-179.6	82.7	0	0	0	112.2	V196 I200 A214 P215 C219 F221 C226 C227 L254	V196-W223 HydrophobicContact CG1-CH2 4.49Å; V196-W223 HydrophobicContact CG1-CZ3 4.09Å; V196-W223 HydrophobicContact CG2-CZ3 4.35Å; I200-W223 HydrophobicContact CD1-CH2 4.45Å; I200-W223 HydrophobicContact CG1-CH2 3.96Å; A214-W223 HydrophobicContact CB-CH2 3.69Å; A214-W223 HydrophobicContact CB-CZ2 3.83Å; A214-W223 HydrophobicContact CB-CZ3 4.19Å; P215-W223 VanDerWaalsContact CD-CE2 3.48Å; P215-W223 VanDerWaalsContact CD-NE1 3.25Å; P215-W223 HydrophobicContact CG-CD2 4.45Å; P215-W223 HydrophobicContact CG-CG 4.07Å; C219-W223 PolarHBondContact O-N 3.14Å; F221-W223 VanDerWaalsContact C-N 3.3Å; F221-W223 PolarHBondContact O-N 3.29Å; W223-C226 PolarHBondContact O-N 2.81Å; W223-C227 VanDerWaalsContact O-CB 3.32Å; W223-C227 WeakPolarHBondContact O-CB 3.4Å; W223-C227 PolarHBondContact O-N 3.34Å; W223-C227 PolarHBondContact O-SG 3.19Å; W223-L254 HydrophobicContact CZ2-CB 4.14Å; W223-L254 HydrophobicContact CZ2-CD1 4.07Å; W223-L254 PolarHBondContact NE1-O 3.03Å
224	L	91.8	Very high	87.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-46.8	173.9	-77.8	167.6	0	0	0	111.6	R195 V196 V199 V220 F221 C226 C227 D228	R195-L224 HydrophobicContact CG-CD1 4.21Å; R195-L224 HydrophobicContact CG-CD2 4.04Å; V196-L224 HydrophobicContact CG2-CD1 4.2Å; V196-L224 HydrophobicContact CG2-CD2 4Å; V196-L224 HydrophobicContact CG2-CG 4.3Å; V199-L224 HydrophobicContact CB-CD2 4.07Å; V199-L224 HydrophobicContact CG1-CD2 4.25Å; V199-L224 HydrophobicContact CG2-CD2 3.89Å; V220-L224 HydrophobicContact CG2-CD1 4.09Å; V220-L224 HydrophobicContact CG2-CG 4.37Å; V220-L224 WeakPolarHBondContact O-CB 3.26Å; V220-L224 WeakPolarHBondContact O-CG 3.47Å; V220-L224 PolarHBondContact O-N 3.2Å; F221-L224 WeakPolarHBondContact O-CB 3.13Å; F221-L224 PolarHBondContact O-N 3.03Å; L224-C226 VanDerWaalsContact C-N 3.33Å; L224-C226 PolarHBondContact O-N 2.79Å; L224-C227 CarbonylContact O-C 3.16Å; L224-C227 WeakPolarHBondContact O-CA 3.28Å; L224-C227 VanDerWaalsContact O-CB 3.31Å; L224-C227 WeakPolarHBondContact O-CB 3.36Å; L224-C227 PolarHBondContact O-N 2.75Å; L224-C227 VanDerWaalsContact O-N 3.08Å; L224-D228 VanDerWaalsContact O-CG 3.25Å; L224-D228 PolarHBondContact O-N 3.43Å
225	D	91.3	Very high	87.6	Confident	79 Å²	79	63 Å²	63	42%	0.422	31%	0.31	S	S	.	.	H	α-helix	trans	-65.8	-35.9	-179.8	-58.9	-23.6	0	0	0	111.7	R195 F221 R222 Q229	R195-D225 IonicContact NH2-OD1 3.55Å; R195-D225 PolarHBondContact NH2-OD1 3.01Å; F221-D225 PolarHBondContact O-N 2.95Å; R222-D225 PolarHBondContact O-N 3.35Å; D225-Q229 VanDerWaalsContact O-CG 3.24Å; D225-Q229 WeakPolarHBondContact O-CG 3.26Å; D225-Q229 PolarHBondContact O-N 2.98Å; D225-Q229 VanDerWaalsContact O-N 3.12Å; D225-Q229 PolarHBondContact O-NE2 2.89Å
226	C	91.6	Very high	88.2	Confident	22 Å²	22	70.9 Å²	70.9	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-66.4	-35.8	171.1	-72.4	0	0	0	0	112.7	R222 W223 L224 M230 D256 C274	R222-C226 WeakPolarHBondContact O-CB 3.24Å; R222-C226 PolarHBondContact O-N 3.39Å; R222-C226 PolarHBondContact O-SG 3.17Å; W223-C226 PolarHBondContact O-N 2.81Å; L224-C226 VanDerWaalsContact C-N 3.33Å; L224-C226 PolarHBondContact O-N 2.79Å; C226-M230 PolarHBondContact O-N 2.9Å; C226-D256 HydrophobicContact CB-CB 4.48Å; C226-C274 HydrophobicContact CB-CB 3.84Å
227	C	92.9	Very high	89.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-69.3	-44.8	175.4	-77.4	0	0	0	0	112.1	V199 I203 W223 L224 Q229 M230 V231	V199-C227 HydrophobicContact CG1-CB 3.42Å; V199-C227 VanDerWaalsContact CG1-CB 3.42Å; I203-C227 HydrophobicContact CD1-CB 3.7Å; W223-C227 VanDerWaalsContact O-CB 3.32Å; W223-C227 WeakPolarHBondContact O-CB 3.4Å; W223-C227 PolarHBondContact O-N 3.34Å; W223-C227 PolarHBondContact O-SG 3.19Å; L224-C227 CarbonylContact O-C 3.16Å; L224-C227 WeakPolarHBondContact O-CA 3.28Å; L224-C227 VanDerWaalsContact O-CB 3.31Å; L224-C227 WeakPolarHBondContact O-CB 3.36Å; L224-C227 PolarHBondContact O-N 2.75Å; L224-C227 VanDerWaalsContact O-N 3.08Å; C227-Q229 VanDerWaalsContact C-N 3.31Å; C227-Q229 PolarHBondContact O-N 3.49Å; C227-M230 WeakPolarHBondContact O-CA 3.13Å; C227-M230 WeakPolarHBondContact O-CB 3.42Å; C227-M230 PolarHBondContact O-N 3.38Å; C227-V231 WeakPolarHBondContact O-CG2 3.42Å; C227-V231 PolarHBondContact O-N 2.87Å
228	D	93.9	Very high	90.4	Very high	54 Å²	54	62.2 Å²	62.2	29%	0.289	30%	0.303	S	S	.	.	H	α-helix	trans	-59.9	-42.7	176.4	-66.5	-28.2	0	0	0	110.1	R195 L224 M230 V231 D232	R195-D228 IonicContact CZ-OD2 3.23Å; R195-D228 IonicContact NH2-OD2 2.83Å; R195-D228 PolarHBondContact NH2-OD2 3.28Å; L224-D228 VanDerWaalsContact O-CG 3.25Å; L224-D228 PolarHBondContact O-N 3.43Å; D228-M230 PolarHBondContact O-N 2.89Å; D228-V231 PolarHBondContact O-N 3.26Å; D228-D232 PolarHBondContact O-N 3.48Å
229	Q	93.5	Very high	91.5	Very high	116 Å²	116	60.6 Å²	60.6	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-36.8	172	-71.5	169.5	41.8	0	0	113.7	D225 C227 R233	D225-Q229 VanDerWaalsContact O-CG 3.24Å; D225-Q229 WeakPolarHBondContact O-CG 3.26Å; D225-Q229 PolarHBondContact O-N 2.98Å; D225-Q229 VanDerWaalsContact O-N 3.12Å; D225-Q229 PolarHBondContact O-NE2 2.89Å; C227-Q229 VanDerWaalsContact C-N 3.31Å; C227-Q229 PolarHBondContact O-N 3.49Å; Q229-R233 WeakPolarHBondContact O-CB 3.42Å; Q229-R233 PolarHBondContact O-N 3.43Å
230	M	93.6	Very high	92	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-48.7	175.7	-177.2	-179.8	167.5	0	0	110.6	I203 L207 C226 C227 D228 D232 R233 F234 L254 V272 I276	I203-M230 HydrophobicContact CG2-CE 4.13Å; I203-M230 HydrophobicContact CG2-SD 4.48Å; L207-M230 HydrophobicContact CD1-CE 4.35Å; L207-M230 HydrophobicContact CD2-CE 3.99Å; L207-M230 HydrophobicContact CG-CE 4.45Å; C226-M230 PolarHBondContact O-N 2.9Å; C227-M230 WeakPolarHBondContact O-CA 3.13Å; C227-M230 WeakPolarHBondContact O-CB 3.42Å; C227-M230 PolarHBondContact O-N 3.38Å; D228-M230 PolarHBondContact O-N 2.89Å; M230-D232 VanDerWaalsContact C-N 3.33Å; M230-D232 PolarHBondContact O-N 3.26Å; M230-R233 WeakPolarHBondContact O-CB 3.31Å; M230-R233 PolarHBondContact O-N 3.36Å; M230-F234 HydrophobicContact CE-CD2 4.43Å; M230-F234 HydrophobicContact CE-CE1 4.45Å; M230-F234 HydrophobicContact CE-CE2 3.75Å; M230-F234 HydrophobicContact CE-CZ 3.77Å; M230-F234 HydrophobicContact CG-CD2 3.92Å; M230-F234 HydrophobicContact CG-CE2 3.84Å; M230-F234 WeakPolarHBondContact O-CD2 3.34Å; M230-F234 PolarHBondContact O-N 3.13Å; M230-L254 HydrophobicContact CE-CD2 4.09Å; M230-L254 HydrophobicContact SD-CD2 3.72Å; M230-V272 HydrophobicContact CE-CG1 4.31Å; M230-I276 HydrophobicContact CE-CG2 3.78Å; M230-I276 HydrophobicContact SD-CG2 4.35Å
231	V	94.8	Very high	92.3	Very high	3 Å²	3	60 Å²	60	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-55	-48.8	175.8	168	0	0	0	0	110.7	E202 I203 C227 D228 R233 F234 K235	E202-V231 HydrophobicContact CB-CG2 4.5Å; E202-V231 HydrophobicContact CG-CG1 3.74Å; E202-V231 HydrophobicContact CG-CG2 4.01Å; I203-V231 HydrophobicContact CD1-CG2 4.29Å; I203-V231 HydrophobicContact CG1-CG2 3.46Å; I203-V231 VanDerWaalsContact CG1-CG2 3.46Å; C227-V231 WeakPolarHBondContact O-CG2 3.42Å; C227-V231 PolarHBondContact O-N 2.87Å; D228-V231 PolarHBondContact O-N 3.26Å; V231-R233 VanDerWaalsContact C-N 3.34Å; V231-R233 PolarHBondContact O-N 3.1Å; V231-F234 PolarHBondContact O-N 3.21Å; V231-K235 HydrophobicContact CG1-CD 3.85Å; V231-K235 HydrophobicContact CG1-CG 4.34Å; V231-K235 WeakPolarHBondContact O-CB 3.13Å; V231-K235 WeakPolarHBondContact O-CG 3.23Å; V231-K235 PolarHBondContact O-N 3.25Å
232	D	95.4	Very high	92.5	Very high	67 Å²	67	62.5 Å²	62.5	36%	0.358	30%	0.299	S	S	.	.	H	α-helix	trans	-60.9	-41.2	178.8	-109.7	26.6	0	0	0	112.4	D228 M230 F234 K235 R236	D228-D232 PolarHBondContact O-N 3.48Å; M230-D232 VanDerWaalsContact C-N 3.33Å; M230-D232 PolarHBondContact O-N 3.26Å; D232-F234 PolarHBondContact O-N 3.05Å; D232-K235 PolarHBondContact O-N 3.49Å; D232-R236 WeakPolarHBondContact O-CB 3.44Å; D232-R236 VanDerWaalsContact O-CG 3.23Å; D232-R236 WeakPolarHBondContact O-CG 3.31Å; D232-R236 PolarHBondContact O-N 3.45Å; D232-R236 IonicContact OD2-CZ 3.89Å; D232-R236 IonicContact OD2-NE 3.17Å; D232-R236 PolarHBondContact OD2-NE 2.84Å; D232-R236 IonicContact OD2-NH2 3.5Å; D232-R236 PolarHBondContact OD2-NH2 3.5Å
233	R	94.5	Very high	92.8	Very high	82 Å²	82	62.1 Å²	62.1	31%	0.309	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-42	175.1	-166.4	-172.5	-55.3	118.3	10.4	111.7	Q229 M230 V231 S237 C274 G275 I276	Q229-R233 WeakPolarHBondContact O-CB 3.42Å; Q229-R233 PolarHBondContact O-N 3.43Å; M230-R233 WeakPolarHBondContact O-CB 3.31Å; M230-R233 PolarHBondContact O-N 3.36Å; V231-R233 VanDerWaalsContact C-N 3.34Å; V231-R233 PolarHBondContact O-N 3.1Å; R233-S237 VanDerWaalsContact O-CB 3.31Å; R233-S237 WeakPolarHBondContact O-CB 3.43Å; R233-S237 PolarHBondContact O-N 3.28Å; R233-C274 PolarHBondContact NH1-O 3.03Å; R233-G275 PolarHBondContact NH1-O 3.49Å; R233-I276 WeakPolarHBondContact CD-O 3.41Å; R233-I276 PolarHBondContact NH1-O 2.79Å
234	F	95.2	Very high	93	Very high	11 Å²	11	63.9 Å²	63.9	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-72.2	-37.3	179.9	-85.3	-115.8	0	0	0	112.5	C206 L207 M230 V231 D232 K240 I241 I276 P278 M281	C206-F234 HydrophobicContact CB-CB 4.07Å; C206-F234 HydrophobicContact CB-CD1 4.09Å; C206-F234 HydrophobicContact CB-CG 4.35Å; L207-F234 HydrophobicContact CD2-CD1 4.39Å; L207-F234 HydrophobicContact CD2-CE1 3.62Å; L207-F234 HydrophobicContact CD2-CZ 4.08Å; M230-F234 HydrophobicContact CE-CD2 4.43Å; M230-F234 HydrophobicContact CE-CE1 4.45Å; M230-F234 HydrophobicContact CE-CE2 3.75Å; M230-F234 HydrophobicContact CE-CZ 3.77Å; M230-F234 HydrophobicContact CG-CD2 3.92Å; M230-F234 HydrophobicContact CG-CE2 3.84Å; M230-F234 WeakPolarHBondContact O-CD2 3.34Å; M230-F234 PolarHBondContact O-N 3.13Å; V231-F234 PolarHBondContact O-N 3.21Å; D232-F234 PolarHBondContact O-N 3.05Å; F234-K240 PolarHBondContact O-NZ 3.28Å; F234-I241 HydrophobicContact CE1-CD1 3.73Å; F234-I241 HydrophobicContact CE1-CG1 4.47Å; F234-I276 HydrophobicContact CE2-CG2 3.96Å; F234-I276 HydrophobicContact CZ-CG2 3.98Å; F234-P278 HydrophobicContact CB-CG 4.43Å; F234-P278 HydrophobicContact CD1-CB 4.29Å; F234-P278 HydrophobicContact CD1-CG 4Å; F234-P278 HydrophobicContact CD2-CG 3.71Å; F234-P278 HydrophobicContact CE1-CB 4.19Å; F234-P278 HydrophobicContact CE1-CG 4.13Å; F234-P278 HydrophobicContact CE2-CG 3.86Å; F234-P278 HydrophobicContact CG-CG 3.79Å; F234-P278 HydrophobicContact CZ-CB 4.37Å; F234-P278 HydrophobicContact CZ-CG 4.07Å; F234-M281 HydrophobicContact CZ-CB 4.18Å; F234-M281 HydrophobicContact CZ-CG 4.44Å
235	K	93.3	Very high	93.1	Very high	107 Å²	107	72.7 Å²	72.7	47%	0.465	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-49.1	172.8	-75.5	174.4	178.7	169	0	111.8	E202 V231 D232 K240	E202-K235 WeakPolarHBondContact OE1-CE 3.5Å; E202-K235 IonicContact OE1-NZ 2.67Å; E202-K235 PolarHBondContact OE1-NZ 2.88Å; V231-K235 HydrophobicContact CG1-CD 3.85Å; V231-K235 HydrophobicContact CG1-CG 4.34Å; V231-K235 WeakPolarHBondContact O-CB 3.13Å; V231-K235 WeakPolarHBondContact O-CG 3.23Å; V231-K235 PolarHBondContact O-N 3.25Å; D232-K235 PolarHBondContact O-N 3.49Å; K235-K240 PolarHBondContact O-NZ 3.46Å
236	R	93.8	Very high	93.3	Very high	200 Å²	200	73.3 Å²	73.3	76%	0.755	36%	0.359	S	S	*	.	H	α-helix	trans	-75.3	-21.5	-176.8	-64.4	174.3	-164	-135	9	114.4	D232	D232-R236 WeakPolarHBondContact O-CB 3.44Å; D232-R236 VanDerWaalsContact O-CG 3.23Å; D232-R236 WeakPolarHBondContact O-CG 3.31Å; D232-R236 PolarHBondContact O-N 3.45Å; D232-R236 IonicContact OD2-CZ 3.89Å; D232-R236 IonicContact OD2-NE 3.17Å; D232-R236 PolarHBondContact OD2-NE 2.84Å; D232-R236 IonicContact OD2-NH2 3.5Å; D232-R236 PolarHBondContact OD2-NH2 3.5Å
237	S	93.6	Very high	93.5	Very high	30 Å²	30	72.5 Å²	72.5	21%	0.21	35%	0.353	C	S	.	.			trans	-67.7	139.6	178.9	-172.3	0	0	0	0	112.6	R233 V239 K240	R233-S237 VanDerWaalsContact O-CB 3.31Å; R233-S237 WeakPolarHBondContact O-CB 3.43Å; R233-S237 PolarHBondContact O-N 3.28Å; S237-V239 VanDerWaalsContact C-N 3.27Å; S237-V239 PolarHBondContact OG-N 3.36Å; S237-V239 VanDerWaalsContact OG-N 3.13Å; S237-V239 PolarHBondContact OG-O 2.88Å; S237-K240 WeakPolarHBondContact O-CE 3.44Å; S237-K240 PolarHBondContact O-NZ 2.68Å
238	S	92.8	Very high	93.6	Very high	120 Å²	120	78.7 Å²	78.7	84%	0.839	38%	0.381	S	S	*	.	S	Bend	trans	-69	-25.6	167.4	52	0	0	0	0	112.7
239	V	91	Very high	93.7	Very high	53 Å²	53	81.4 Å²	81.4	32%	0.321	39%	0.393	S	S	.	.			trans	-84	121.5	174.9	-176.8	0	0	0	0	108.9	S237 P278	S237-V239 VanDerWaalsContact C-N 3.27Å; S237-V239 PolarHBondContact OG-N 3.36Å; S237-V239 VanDerWaalsContact OG-N 3.13Å; S237-V239 PolarHBondContact OG-O 2.88Å; V239-P278 HydrophobicContact CB-CB 4.37Å; V239-P278 HydrophobicContact CG1-CB 4.5Å; V239-P278 WeakPolarHBondContact O-CB 3.47Å
240	K	90.3	Very high	93.8	Very high	100 Å²	100	75.9 Å²	75.9	44%	0.435	37%	0.368	S	S	.	.			trans	-108.3	156.5	173.5	-58.7	-53.3	-174	-158.5	0	110.1	F234 K235 S237 F242	F234-K240 PolarHBondContact O-NZ 3.28Å; K235-K240 PolarHBondContact O-NZ 3.46Å; S237-K240 WeakPolarHBondContact O-CE 3.44Å; S237-K240 PolarHBondContact O-NZ 2.68Å; K240-F242 PolarHBondContact O-N 2.76Å
241	I	92.8	Very high	94	Very high	9 Å²	9	78 Å²	78	5%	0.046	38%	0.379	C	S	.	.			trans	-82.1	114.9	170.2	-66.4	176.5	0	0	0	108.2	L207 S208 F234 Y247 M281 Q282 L285	L207-I241 HydrophobicContact CD2-CD1 3.64Å; S208-I241 PolarHBondContact OG-O 3.49Å; F234-I241 HydrophobicContact CE1-CD1 3.73Å; F234-I241 HydrophobicContact CE1-CG1 4.47Å; I241-Y247 HydrophobicContact CG2-CD2 4.15Å; I241-Y247 HydrophobicContact CG2-CE2 3.66Å; I241-M281 HydrophobicContact CD1-CB 4.08Å; I241-M281 HydrophobicContact CD1-CG 3.51Å; I241-Q282 VanDerWaalsContact CA-OE1 3.3Å; I241-Q282 HydrophobicContact CG1-CB 4.46Å; I241-L285 HydrophobicContact CD1-CD1 4.04Å; I241-L285 HydrophobicContact CG2-CD1 3.85Å
242	F	91.9	Very high	94	Very high	137 Å²	137	77.9 Å²	77.9	60%	0.601	38%	0.378	S	S	*	.			trans	-65.9	132.9	176.2	-64	-75	0	0	0	109.8	K240 Y247 Q282	K240-F242 PolarHBondContact O-N 2.76Å; F242-Y247 VanDerWaalsContact O-CE2 3.25Å; F242-Y247 WeakPolarHBondContact O-CE2 3.19Å; F242-Q282 VanDerWaalsContact CD2-OE1 3.29Å
243	P	92.2	Very high	93.9	Very high	110 Å²	110	76.6 Å²	76.6	71%	0.714	37%	0.371	S	S	*	.			trans	-59.3	138.9	176.6	-25.2	34.9	0	0	0	112.6
244	D	93.8	Very high	93.7	Very high	41 Å²	41	72.7 Å²	72.7	22%	0.219	36%	0.356	C	S	.	.			trans	-138.2	137.8	174.5	-173.9	-53.2	0	0	0	108	R246 Y247	D244-R246 PolarHBondContact O-N 3.03Å; D244-R246 VanDerWaalsContact O-N 3.11Å; D244-R246 WeakPolarHBondContact OD1-CB 3.48Å; D244-R246 VanDerWaalsContact OD1-CG 3.28Å; D244-R246 WeakPolarHBondContact OD1-CG 3.36Å; D244-R246 IonicContact OD1-CZ 3.95Å; D244-R246 PolarHBondContact OD1-N 2.96Å; D244-R246 IonicContact OD1-NE 3.84Å; D244-R246 PolarHBondContact OD1-NE 2.71Å; D244-R246 IonicContact OD1-NH2 2.96Å; D244-R246 IonicContact OD2-CZ 2.79Å; D244-R246 IonicContact OD2-NE 2.72Å; D244-R246 PolarHBondContact OD2-NE 3.11Å; D244-R246 IonicContact OD2-NH2 3.7Å; D244-R246 PolarHBondContact OD2-NH2 3.49Å; D244-Y247 HydrophobicContact CB-CD1 3.74Å; D244-Y247 HydrophobicContact CB-CD2 3.85Å; D244-Y247 HydrophobicContact CB-CE1 3.58Å; D244-Y247 HydrophobicContact CB-CE2 3.71Å; D244-Y247 HydrophobicContact CB-CG 3.85Å; D244-Y247 WeakPolarHBondContact O-CB 3.31Å; D244-Y247 PolarHBondContact O-N 2.88Å
245	Q	93.4	Very high	93.4	Very high	185 Å²	185	72.9 Å²	72.9	86%	0.864	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.3	-178.4	-66.4	179.9	-9.2	0	0	112.3	Y247	Q245-Y247 VanDerWaalsContact C-N 3.33Å; Q245-Y247 PolarHBondContact O-N 3.27Å
246	R	94.8	Very high	92.8	Very high	92 Å²	92	68.8 Å²	68.8	35%	0.347	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-27	178.6	-63.6	175	-67.8	173.5	1.2	113.1	D244 H248 M249 L293	D244-R246 PolarHBondContact O-N 3.03Å; D244-R246 VanDerWaalsContact O-N 3.11Å; D244-R246 WeakPolarHBondContact OD1-CB 3.48Å; D244-R246 VanDerWaalsContact OD1-CG 3.28Å; D244-R246 WeakPolarHBondContact OD1-CG 3.36Å; D244-R246 IonicContact OD1-CZ 3.95Å; D244-R246 PolarHBondContact OD1-N 2.96Å; D244-R246 IonicContact OD1-NE 3.84Å; D244-R246 PolarHBondContact OD1-NE 2.71Å; D244-R246 IonicContact OD1-NH2 2.96Å; D244-R246 IonicContact OD2-CZ 2.79Å; D244-R246 IonicContact OD2-NE 2.72Å; D244-R246 PolarHBondContact OD2-NE 3.11Å; D244-R246 IonicContact OD2-NH2 3.7Å; D244-R246 PolarHBondContact OD2-NH2 3.49Å; R246-H248 PolarHBondContact O-N 3.45Å; R246-M249 WeakPolarHBondContact O-CB 3.33Å; R246-M249 PolarHBondContact O-N 3.39Å; R246-L293 HydrophobicContact CB-CD1 3.79Å; R246-L293 HydrophobicContact CG-CD1 3.99Å
247	Y	96	Very high	91.4	Very high	5 Å²	5	62.5 Å²	62.5	2%	0.02	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-68.1	-35.4	-168.3	-68.1	-2.5	0	0	0	112.7	I210 I241 F242 D244 Q245 M249 L250 Q282 L285 A289	I210-Y247 WeakPolarHBondContact CA-O 3.44Å; I210-Y247 HydrophobicContact CG1-CG 4.36Å; I241-Y247 HydrophobicContact CG2-CD2 4.15Å; I241-Y247 HydrophobicContact CG2-CE2 3.66Å; F242-Y247 VanDerWaalsContact O-CE2 3.25Å; F242-Y247 WeakPolarHBondContact O-CE2 3.19Å; D244-Y247 HydrophobicContact CB-CD1 3.74Å; D244-Y247 HydrophobicContact CB-CD2 3.85Å; D244-Y247 HydrophobicContact CB-CE1 3.58Å; D244-Y247 HydrophobicContact CB-CE2 3.71Å; D244-Y247 HydrophobicContact CB-CG 3.85Å; D244-Y247 WeakPolarHBondContact O-CB 3.31Å; D244-Y247 PolarHBondContact O-N 2.88Å; Q245-Y247 VanDerWaalsContact C-N 3.33Å; Q245-Y247 PolarHBondContact O-N 3.27Å; Y247-M249 PolarHBondContact O-N 2.89Å; Y247-M249 VanDerWaalsContact O-N 3.13Å; Y247-L250 HydrophobicContact CD1-CD1 3.84Å; Y247-L250 WeakPolarHBondContact O-CB 3.48Å; Y247-L250 PolarHBondContact O-N 2.9Å; Y247-Q282 PolarHBondContact OH-NE2 3.08Å; Y247-L285 HydrophobicContact CD2-CD1 4.36Å; Y247-L285 HydrophobicContact CE1-CB 3.98Å; Y247-L285 HydrophobicContact CE1-CD1 4.46Å; Y247-L285 HydrophobicContact CE1-CD2 4.48Å; Y247-L285 HydrophobicContact CE2-CB 4.47Å; Y247-L285 HydrophobicContact CE2-CD1 3.89Å; Y247-L285 WeakPolarHBondContact OH-CB 3.46Å; Y247-A289 HydrophobicContact CD1-CB 4.28Å; Y247-A289 HydrophobicContact CE1-CB 3.89Å
248	H	94.8	Very high	89.9	Confident	129 Å²	129	66.9 Å²	66.9	60%	0.597	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-64	-15.3	173.8	-63.9	84.8	0	0	0	114.1	G209 R246	G209-H248 WeakPolarHBondContact O-CA 3.28Å; R246-H248 PolarHBondContact O-N 3.45Å
249	M	95.8	Very high	88.4	Confident	111 Å²	111	68.6 Å²	68.6	55%	0.547	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-94.8	-12.1	176.1	-58	-178.3	70.9	0	0	113	R246 Y247 L293 Q296	R246-M249 WeakPolarHBondContact O-CB 3.33Å; R246-M249 PolarHBondContact O-N 3.39Å; Y247-M249 PolarHBondContact O-N 2.89Å; Y247-M249 VanDerWaalsContact O-N 3.13Å; M249-L293 HydrophobicContact CB-CD1 4.47Å; M249-L293 HydrophobicContact CB-CD2 3.55Å; M249-Q296 PolarHBondContact O-OE1 2.93Å
250	L	97.3	Very high	87.3	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.354	C	S	.	.			trans	-83.3	143.6	-179.4	-65.9	170.9	0	0	0	110.8	I210 N211 Y247 L270 L285 A289 A292 L293	I210-L250 HydrophobicContact CD1-CD1 4.36Å; I210-L250 HydrophobicContact CG1-CB 4.33Å; I210-L250 HydrophobicContact CG2-CB 4.19Å; N211-L250 WeakPolarHBondContact CB-O 3.26Å; N211-L250 PolarHBondContact N-O 3.46Å; Y247-L250 HydrophobicContact CD1-CD1 3.84Å; Y247-L250 WeakPolarHBondContact O-CB 3.48Å; Y247-L250 PolarHBondContact O-N 2.9Å; L250-L270 HydrophobicContact CB-CD1 4.33Å; L250-L270 HydrophobicContact CD1-CD1 4.22Å; L250-L285 HydrophobicContact CD1-CD2 4.17Å; L250-A289 HydrophobicContact CD1-CB 3.9Å; L250-A292 HydrophobicContact CD2-CB 3.61Å; L250-L293 HydrophobicContact CD2-CD2 3.74Å; L250-L293 HydrophobicContact CD2-CG 3.79Å; L250-L293 HydrophobicContact CG-CD2 4.26Å; L250-L293 HydrophobicContact CG-CG 4.5Å
251	N	96.1	Very high	87	Confident	46 Å²	46	71.6 Å²	71.6	25%	0.246	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	138.8	171.4	-61.1	-82.2	0	0	0	109	N211 L269 L270 Q296	N211-N251 PolarHBondContact ND2-OD1 2.95Å; N211-N251 CarbonylContact O-C 3.55Å; N211-N251 WeakPolarHBondContact O-CA 3.45Å; N251-L269 HydrophobicContact CB-CD1 3.65Å; N251-L270 WeakPolarHBondContact O-CG 3.44Å; N251-L270 PolarHBondContact O-N 3.2Å; N251-Q296 PolarHBondContact ND2-OE1 3.1Å; N251-Q296 VanDerWaalsContact ND2-OE1 3.14Å
252	A	95.6	Very high	86.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.1	176.1	0	0	0	0	0	111.9	I210 N211 T213 L270 V272	I210-A252 HydrophobicContact CG2-CB 3.68Å; N211-A252 PolarHBondContact O-N 2.78Å; T213-A252 PolarHBondContact N-O 2.89Å; T213-A252 PolarHBondContact OG1-O 3.29Å; A252-L270 CarbonylContact C-O 3.49Å; A252-L270 WeakPolarHBondContact CA-O 3.32Å; A252-L270 HydrophobicContact CB-CB 4.07Å; A252-V272 HydrophobicContact CB-CG2 4.1Å
253	L	92.9	Very high	87	Confident	40 Å²	40	67.8 Å²	67.8	21%	0.209	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.8	169.5	177.3	62.6	0	0	0	108.5	T213 P215 L269 L270 M271 V272	T213-L253 WeakPolarHBondContact O-CD1 3.22Å; P215-L253 HydrophobicContact CB-CD1 4.37Å; L253-L269 HydrophobicContact CB-CD2 4.22Å; L253-L269 HydrophobicContact CB-CG 4.46Å; L253-L270 PolarHBondContact N-O 3.4Å; L253-M271 HydrophobicContact CB-CE 3.71Å; L253-M271 HydrophobicContact CD2-CE 3.99Å; L253-M271 HydrophobicContact CD2-SD 4.26Å; L253-M271 HydrophobicContact CG-CE 4.42Å; L253-V272 PolarHBondContact O-N 3Å
254	L	91.5	Very high	87.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	127.5	176.6	-71.8	174.4	0	0	0	111.7	I203 V212 W223 M230 V272	I203-L254 HydrophobicContact CD1-CD1 3.39Å; I203-L254 HydrophobicContact CG2-CD1 4.08Å; V212-L254 HydrophobicContact CG1-CD1 3.57Å; V212-L254 HydrophobicContact CG1-CG 3.83Å; W223-L254 HydrophobicContact CZ2-CB 4.14Å; W223-L254 HydrophobicContact CZ2-CD1 4.07Å; W223-L254 PolarHBondContact NE1-O 3.03Å; M230-L254 HydrophobicContact CE-CD2 4.09Å; M230-L254 HydrophobicContact SD-CD2 3.72Å; L254-V272 WeakPolarHBondContact CA-O 3.43Å; L254-V272 HydrophobicContact CD2-CB 4.05Å; L254-V272 HydrophobicContact CD2-CG1 3.88Å
255	I	88.1	Confident	87.1	Confident	15 Å²	15	63.4 Å²	63.4	8%	0.077	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132	-178.3	-50.3	177.1	0	0	0	109.2	Y260 M271 V272 P273 C274	I255-Y260 HydrophobicContact CD1-CD2 4.14Å; I255-Y260 HydrophobicContact CD1-CG 4.01Å; I255-Y260 HydrophobicContact CG2-CD2 4.21Å; I255-M271 HydrophobicContact CD1-CB 3.95Å; I255-M271 HydrophobicContact CD1-CG 4.38Å; I255-M271 HydrophobicContact CD1-SD 3.93Å; I255-V272 PolarHBondContact N-O 3.49Å; I255-P273 CarbonylContact O-C 3.54Å; I255-P273 WeakPolarHBondContact O-CA 3.47Å; I255-C274 PolarHBondContact O-N 2.9Å; I255-C274 PolarHBondContact O-SG 2.79Å; I255-C274 VanDerWaalsContact O-SG 3.36Å
256	D	80.4	Confident	86.9	Confident	22 Å²	22	59 Å²	59	12%	0.118	31%	0.308	C	S	.	.	S	Bend	trans	-82.3	-12.7	-176.7	58.3	-31	0	0	0	114.4	R218 C226	R218-D256 WeakPolarHBondContact CD-OD1 3.38Å; R218-D256 IonicContact CZ-OD1 3.15Å; R218-D256 IonicContact NE-OD1 2.74Å; R218-D256 IonicContact NH1-OD1 2.81Å; R218-D256 PolarHBondContact NH1-OD1 3.1Å; R218-D256 IonicContact NH1-OD2 3.81Å; C226-D256 HydrophobicContact CB-CB 4.48Å
257	E	64.9	Low	86.8	Confident	67 Å²	67	56.1 Å²	56.1	31%	0.313	30%	0.302	S	S	.	.	S	Bend	trans	-131	155	-170.7	-69.7	-178.1	141.7	0	0	114.9	R218 R222 E259	R218-E257 IonicContact CZ-OE2 3.35Å; R218-E257 IonicContact NH1-OE2 2.71Å; R218-E257 PolarHBondContact NH1-OE2 2.93Å; R218-E257 IonicContact NH2-OE2 3.73Å; R222-E257 IonicContact CZ-OE1 2.71Å; R222-E257 IonicContact NH1-OE1 3.15Å; R222-E257 PolarHBondContact NH1-OE1 3.44Å; R222-E257 IonicContact NH2-OE1 2.79Å; R222-E257 PolarHBondContact NH2-OE1 2.88Å; E257-E259 VanDerWaalsContact C-N 3.35Å; E257-E259 PolarHBondContact O-N 2.75Å
258	S	60.7	Low	86.7	Confident	122 Å²	122	55.9 Å²	55.9	85%	0.853	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	3.2	-164.2	51.9	0	0	0	0	116.8
259	E	61.7	Low	86.6	Confident	156 Å²	156	51.8 Å²	51.8	73%	0.729	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-29.5	-179.4	-65.5	-174.5	159.4	0	0	112.8	E257	E257-E259 VanDerWaalsContact C-N 3.35Å; E257-E259 PolarHBondContact O-N 2.75Å
260	Y	67.4	Low	86.6	Confident	126 Å²	126	46.5 Å²	46.5	49%	0.494	26%	0.257	S	S	.	.	S	Bend	trans	-101.9	120.4	178.9	-63.6	-77.5	0	0	0	109.8	I255 P273	I255-Y260 HydrophobicContact CD1-CD2 4.14Å; I255-Y260 HydrophobicContact CD1-CG 4.01Å; I255-Y260 HydrophobicContact CG2-CD2 4.21Å; Y260-P273 VanDerWaalsContact O-CG 3.23Å; Y260-P273 WeakPolarHBondContact O-CG 3.44Å
261	D	84.1	Confident	86.4	Confident	91 Å²	91	47.6 Å²	47.6	49%	0.487	26%	0.262	S	S	.	.			trans	-80.8	162.3	169.5	-160.5	20.5	0	0	0	111.5	C263 R280	D261-C263 PolarHBondContact O-N 3.21Å; D261-R280 IonicContact OD1-CZ 2.83Å; D261-R280 IonicContact OD1-NH1 3.29Å; D261-R280 PolarHBondContact OD1-NH1 3.46Å; D261-R280 IonicContact OD1-NH2 3.09Å; D261-R280 PolarHBondContact OD1-NH2 2.98Å; D261-R280 IonicContact OD2-CZ 3.26Å; D261-R280 IonicContact OD2-NH2 3.33Å; D261-R280 PolarHBondContact OD2-NH2 3.16Å
262	L	92.1	Very high	86.3	Confident	14 Å²	14	45.4 Å²	45.4	7%	0.073	25%	0.251	C	S	.	.	S	Bend	trans	-58.7	107.3	177.9	177.6	63.7	0	0	0	111.4	M271 V272 I276 R280 M281 F284	L262-M271 WeakPolarHBondContact CA-O 3.42Å; L262-M271 WeakPolarHBondContact CD1-O 3.33Å; L262-V272 HydrophobicContact CD1-CG2 4.07Å; L262-I276 HydrophobicContact CB-CD1 4.47Å; L262-I276 HydrophobicContact CD1-CD1 3.68Å; L262-I276 HydrophobicContact CD2-CD1 3.39Å; L262-I276 HydrophobicContact CD2-CG1 4.45Å; L262-I276 HydrophobicContact CG-CD1 4.02Å; L262-R280 HydrophobicContact CD2-CG 4.13Å; L262-M281 HydrophobicContact CD1-SD 4.09Å; L262-F284 HydrophobicContact CD1-CD1 3.71Å; L262-F284 HydrophobicContact CD1-CD2 4.45Å; L262-F284 HydrophobicContact CD1-CE1 3.76Å; L262-F284 HydrophobicContact CD1-CE2 4.5Å; L262-F284 HydrophobicContact CD1-CG 4.06Å; L262-F284 HydrophobicContact CD1-CZ 4.17Å; L262-F284 HydrophobicContact CD2-CB 3.35Å; L262-F284 HydrophobicContact CD2-CD1 3.89Å; L262-F284 HydrophobicContact CD2-CD2 3.76Å; L262-F284 HydrophobicContact CD2-CG 3.4Å; L262-F284 HydrophobicContact CG-CB 4.1Å; L262-F284 HydrophobicContact CG-CD1 3.74Å; L262-F284 HydrophobicContact CG-CD2 3.61Å; L262-F284 HydrophobicContact CG-CE1 3.98Å; L262-F284 HydrophobicContact CG-CE2 3.87Å; L262-F284 HydrophobicContact CG-CG 3.54Å; L262-F284 HydrophobicContact CG-CZ 4.04Å; L262-F284 WeakPolarHBondContact O-CE2 3.49Å
263	C	93.9	Very high	86.2	Confident	52 Å²	52	46.3 Å²	46.3	35%	0.351	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	168.8	-172.2	79.1	0	0	0	0	113.8	D261 M271	D261-C263 PolarHBondContact O-N 3.21Å; C263-M271 PolarHBondContact N-O 3.23Å; C263-M271 PolarHBondContact O-N 2.87Å
264	V	95.2	Very high	86	Confident	22 Å²	22	44.6 Å²	44.6	13%	0.133	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.9	172.7	-172.3	0	0	0	0	107.7	L270 F284 N288 A292 F295	V264-L270 HydrophobicContact CG1-CD2 4.42Å; V264-L270 HydrophobicContact CG2-CD2 3.9Å; V264-F284 HydrophobicContact CG2-CE1 4.41Å; V264-F284 HydrophobicContact CG2-CE2 4.39Å; V264-F284 HydrophobicContact CG2-CZ 3.66Å; V264-N288 HydrophobicContact CG2-CB 3.84Å; V264-A292 HydrophobicContact CG1-CB 3.69Å; V264-A292 HydrophobicContact CG2-CB 4.25Å; V264-F295 HydrophobicContact CG1-CD2 3.93Å
265	T	92.4	Very high	86	Confident	37 Å²	37	47.5 Å²	47.5	23%	0.227	28%	0.278	C	S	.	.			trans	-75.4	164.4	174.5	64.3	0	0	0	0	111.8	S267 G268 L269 M271 F295	T265-S267 PolarHBondContact O-N 2.88Å; T265-S267 VanDerWaalsContact O-N 3.1Å; T265-S267 PolarHBondContact OG1-N 2.95Å; T265-S267 PolarHBondContact OG1-OG 3.01Å; T265-G268 PolarHBondContact O-N 3.06Å; T265-L269 PolarHBondContact N-O 3.28Å; T265-L269 WeakPolarHBondContact OG1-CB 3.32Å; T265-L269 PolarHBondContact OG1-N 2.72Å; T265-L269 PolarHBondContact OG1-O 2.83Å; T265-M271 HydrophobicContact CG2-CE 3.83Å; T265-M271 HydrophobicContact CG2-CG 3.77Å; T265-M271 HydrophobicContact CG2-SD 4.06Å; T265-F295 WeakPolarHBondContact O-CD2 3.45Å
266	S	89.8	Confident	86.2	Confident	93 Å²	93	47 Å²	47	65%	0.65	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.2	171.3	50.9	0	0	0	0	113.9	G268	S266-G268 VanDerWaalsContact C-N 3.32Å
267	S	91	Very high	86.8	Confident	30 Å²	30	48.1 Å²	48.1	21%	0.21	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-4.9	174	74.6	0	0	0	0	114.8	T265 L269 Q296	T265-S267 PolarHBondContact O-N 2.88Å; T265-S267 VanDerWaalsContact O-N 3.1Å; T265-S267 PolarHBondContact OG1-N 2.95Å; T265-S267 PolarHBondContact OG1-OG 3.01Å; S267-L269 VanDerWaalsContact C-N 3.27Å; S267-L269 PolarHBondContact O-N 3.48Å; S267-L269 WeakPolarHBondContact OG-CB 3.36Å; S267-L269 PolarHBondContact OG-N 2.92Å; S267-Q296 WeakPolarHBondContact O-CA 3.45Å
268	G	94.1	Very high	88.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	82.2	-7.5	-172.3	0	0	0	0	0	115.2	T265 S266 A292	T265-G268 PolarHBondContact O-N 3.06Å; S266-G268 VanDerWaalsContact C-N 3.32Å; G268-A292 VanDerWaalsContact CA-O 3.31Å; G268-A292 WeakPolarHBondContact CA-O 3.02Å
269	L	94.1	Very high	89.8	Confident	43 Å²	43	41.8 Å²	41.8	23%	0.225	25%	0.248	C	C	.	.			trans	-65.7	131.8	174.8	-175.8	68.6	0	0	0	110.8	N251 L253 T265 S267 M271	N251-L269 HydrophobicContact CB-CD1 3.65Å; L253-L269 HydrophobicContact CB-CD2 4.22Å; L253-L269 HydrophobicContact CB-CG 4.46Å; T265-L269 PolarHBondContact N-O 3.28Å; T265-L269 WeakPolarHBondContact OG1-CB 3.32Å; T265-L269 PolarHBondContact OG1-N 2.72Å; T265-L269 PolarHBondContact OG1-O 2.83Å; S267-L269 VanDerWaalsContact C-N 3.27Å; S267-L269 PolarHBondContact O-N 3.48Å; S267-L269 WeakPolarHBondContact OG-CB 3.36Å; S267-L269 PolarHBondContact OG-N 2.92Å; L269-M271 HydrophobicContact CB-CE 4.26Å; L269-M271 HydrophobicContact CD2-CE 3.44Å; L269-M271 VanDerWaalsContact CD2-CE 3.44Å; L269-M271 HydrophobicContact CG-CE 3.52Å
270	L	95.6	Very high	91.4	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	124.5	175.9	-51.4	-176.8	0	0	0	110.7	I210 L250 N251 A252 L253 V264 V272 F284 L285 A292	I210-L270 HydrophobicContact CD1-CD1 4.36Å; L250-L270 HydrophobicContact CB-CD1 4.33Å; L250-L270 HydrophobicContact CD1-CD1 4.22Å; N251-L270 WeakPolarHBondContact O-CG 3.44Å; N251-L270 PolarHBondContact O-N 3.2Å; A252-L270 CarbonylContact C-O 3.49Å; A252-L270 WeakPolarHBondContact CA-O 3.32Å; A252-L270 HydrophobicContact CB-CB 4.07Å; L253-L270 PolarHBondContact N-O 3.4Å; V264-L270 HydrophobicContact CG1-CD2 4.42Å; V264-L270 HydrophobicContact CG2-CD2 3.9Å; L270-V272 HydrophobicContact CB-CG2 4.05Å; L270-F284 HydrophobicContact CD2-CE1 4.14Å; L270-L285 HydrophobicContact CD1-CD2 3.97Å; L270-A292 HydrophobicContact CD2-CB 3.63Å
271	M	93.5	Very high	92.7	Very high	22 Å²	22	33.8 Å²	33.8	11%	0.108	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	115.7	168.7	-60.3	-65.3	94	0	0	108.4	L253 I255 L262 C263 T265 L269	L253-M271 HydrophobicContact CB-CE 3.71Å; L253-M271 HydrophobicContact CD2-CE 3.99Å; L253-M271 HydrophobicContact CD2-SD 4.26Å; L253-M271 HydrophobicContact CG-CE 4.42Å; I255-M271 HydrophobicContact CD1-CB 3.95Å; I255-M271 HydrophobicContact CD1-CG 4.38Å; I255-M271 HydrophobicContact CD1-SD 3.93Å; L262-M271 WeakPolarHBondContact CA-O 3.42Å; L262-M271 WeakPolarHBondContact CD1-O 3.33Å; C263-M271 PolarHBondContact N-O 3.23Å; C263-M271 PolarHBondContact O-N 2.87Å; T265-M271 HydrophobicContact CG2-CE 3.83Å; T265-M271 HydrophobicContact CG2-CG 3.77Å; T265-M271 HydrophobicContact CG2-SD 4.06Å; L269-M271 HydrophobicContact CB-CE 4.26Å; L269-M271 HydrophobicContact CD2-CE 3.44Å; L269-M271 VanDerWaalsContact CD2-CE 3.44Å; L269-M271 HydrophobicContact CG-CE 3.52Å
272	V	93.4	Very high	93.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.2	-173.6	-178.8	0	0	0	0	110	M230 A252 L253 L254 I255 L262 L270 I276 M281	M230-V272 HydrophobicContact CE-CG1 4.31Å; A252-V272 HydrophobicContact CB-CG2 4.1Å; L253-V272 PolarHBondContact O-N 3Å; L254-V272 WeakPolarHBondContact CA-O 3.43Å; L254-V272 HydrophobicContact CD2-CB 4.05Å; L254-V272 HydrophobicContact CD2-CG1 3.88Å; I255-V272 PolarHBondContact N-O 3.49Å; L262-V272 HydrophobicContact CD1-CG2 4.07Å; L270-V272 HydrophobicContact CB-CG2 4.05Å; V272-I276 HydrophobicContact CG1-CD1 4.29Å; V272-I276 HydrophobicContact CG1-CG2 4.08Å; V272-M281 HydrophobicContact CG1-CE 4.26Å; V272-M281 HydrophobicContact CG1-SD 4.34Å; V272-M281 HydrophobicContact CG2-CE 3.89Å; V272-M281 HydrophobicContact CG2-SD 4.45Å
273	P	92.5	Very high	93.5	Very high	19 Å²	19	33.1 Å²	33.1	12%	0.123	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	134.9	175.3	-22	35.4	0	0	0	111.6	I255 Y260 G275 I276	I255-P273 CarbonylContact O-C 3.54Å; I255-P273 WeakPolarHBondContact O-CA 3.47Å; Y260-P273 VanDerWaalsContact O-CG 3.23Å; Y260-P273 WeakPolarHBondContact O-CG 3.44Å; P273-G275 PolarHBondContact O-N 3.3Å; P273-I276 WeakPolarHBondContact O-CB 3.43Å; P273-I276 WeakPolarHBondContact O-CG2 3.31Å; P273-I276 PolarHBondContact O-N 2.71Å
274	C	90.2	Very high	93.6	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.027	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.8	175.1	-64	0	0	0	0	112.9	C226 R233 I255 I276	C226-C274 HydrophobicContact CB-CB 3.84Å; R233-C274 PolarHBondContact NH1-O 3.03Å; I255-C274 PolarHBondContact O-N 2.9Å; I255-C274 PolarHBondContact O-SG 2.79Å; I255-C274 VanDerWaalsContact O-SG 3.36Å; C274-I276 VanDerWaalsContact C-N 3.27Å; C274-I276 PolarHBondContact O-N 2.71Å
275	G	90	Very high	93.7	Very high	61 Å²	61	30.9 Å²	30.9	63%	0.629	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.4	173.5	0	0	0	0	0	115.5	R233 P273	R233-G275 PolarHBondContact NH1-O 3.49Å; P273-G275 PolarHBondContact O-N 3.3Å
276	I	92.1	Very high	93.7	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.031	20%	0.203	C	C	.	.			trans	-60.3	144.2	-174.2	-166	166.6	0	0	0	113.8	M230 R233 F234 L262 V272 P273 C274 R280 M281	M230-I276 HydrophobicContact CE-CG2 3.78Å; M230-I276 HydrophobicContact SD-CG2 4.35Å; R233-I276 WeakPolarHBondContact CD-O 3.41Å; R233-I276 PolarHBondContact NH1-O 2.79Å; F234-I276 HydrophobicContact CE2-CG2 3.96Å; F234-I276 HydrophobicContact CZ-CG2 3.98Å; L262-I276 HydrophobicContact CB-CD1 4.47Å; L262-I276 HydrophobicContact CD1-CD1 3.68Å; L262-I276 HydrophobicContact CD2-CD1 3.39Å; L262-I276 HydrophobicContact CD2-CG1 4.45Å; L262-I276 HydrophobicContact CG-CD1 4.02Å; V272-I276 HydrophobicContact CG1-CD1 4.29Å; V272-I276 HydrophobicContact CG1-CG2 4.08Å; P273-I276 WeakPolarHBondContact O-CB 3.43Å; P273-I276 WeakPolarHBondContact O-CG2 3.31Å; P273-I276 PolarHBondContact O-N 2.71Å; C274-I276 VanDerWaalsContact C-N 3.27Å; C274-I276 PolarHBondContact O-N 2.71Å; I276-R280 HydrophobicContact CG1-CB 4.35Å; I276-M281 HydrophobicContact CD1-CB 3.63Å; I276-M281 HydrophobicContact CD1-CG 4.11Å; I276-M281 HydrophobicContact CD1-SD 3.63Å; I276-M281 HydrophobicContact CG1-CB 4.09Å
277	S	93.5	Very high	94	Very high	45 Å²	45	34.9 Å²	34.9	32%	0.315	20%	0.204	S	C	.	.			trans	-88.9	146.7	170.2	64.3	0	0	0	0	111.4	S279 R280 M281	S277-S279 VanDerWaalsContact C-N 3.29Å; S277-S279 PolarHBondContact O-N 3.18Å; S277-S279 PolarHBondContact OG-OG 2.92Å; S277-R280 PolarHBondContact O-N 3.35Å; S277-R280 VanDerWaalsContact OG-CB 3.25Å; S277-R280 WeakPolarHBondContact OG-CB 3.49Å; S277-R280 PolarHBondContact OG-N 3.38Å; S277-M281 PolarHBondContact O-N 3.15Å
278	P	94.9	Very high	94.2	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.032	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-34.3	-179.4	-30.4	39.3	0	0	0	114.7	F234 V239 Q282	F234-P278 HydrophobicContact CB-CG 4.43Å; F234-P278 HydrophobicContact CD1-CB 4.29Å; F234-P278 HydrophobicContact CD1-CG 4Å; F234-P278 HydrophobicContact CD2-CG 3.71Å; F234-P278 HydrophobicContact CE1-CB 4.19Å; F234-P278 HydrophobicContact CE1-CG 4.13Å; F234-P278 HydrophobicContact CE2-CG 3.86Å; F234-P278 HydrophobicContact CG-CG 3.79Å; F234-P278 HydrophobicContact CZ-CB 4.37Å; F234-P278 HydrophobicContact CZ-CG 4.07Å; V239-P278 HydrophobicContact CB-CB 4.37Å; V239-P278 HydrophobicContact CG1-CB 4.5Å; V239-P278 WeakPolarHBondContact O-CB 3.47Å; P278-Q282 WeakPolarHBondContact O-CB 3.46Å; P278-Q282 PolarHBondContact O-N 2.83Å
279	S	94.9	Very high	94.3	Very high	51 Å²	51	34.3 Å²	34.3	36%	0.357	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-52.5	173.2	48.6	0	0	0	0	111.9	S277 M281 Q282 D283	S277-S279 VanDerWaalsContact C-N 3.29Å; S277-S279 PolarHBondContact O-N 3.18Å; S277-S279 PolarHBondContact OG-OG 2.92Å; S279-M281 VanDerWaalsContact C-N 3.26Å; S279-M281 PolarHBondContact O-N 3.35Å; S279-Q282 PolarHBondContact O-N 2.81Å; S279-Q282 VanDerWaalsContact O-N 3.09Å; S279-D283 PolarHBondContact O-N 3.41Å
280	R	94.7	Very high	94.5	Very high	114 Å²	114	34 Å²	34	43%	0.43	21%	0.206	S	C	.	.	H	α-helix	trans	-58.8	-38.9	178.7	-169.1	176.8	-167.4	-139.8	-8.6	112	D261 L262 I276 S277 F284	D261-R280 IonicContact OD1-CZ 2.83Å; D261-R280 IonicContact OD1-NH1 3.29Å; D261-R280 PolarHBondContact OD1-NH1 3.46Å; D261-R280 IonicContact OD1-NH2 3.09Å; D261-R280 PolarHBondContact OD1-NH2 2.98Å; D261-R280 IonicContact OD2-CZ 3.26Å; D261-R280 IonicContact OD2-NH2 3.33Å; D261-R280 PolarHBondContact OD2-NH2 3.16Å; L262-R280 HydrophobicContact CD2-CG 4.13Å; I276-R280 HydrophobicContact CG1-CB 4.35Å; S277-R280 PolarHBondContact O-N 3.35Å; S277-R280 VanDerWaalsContact OG-CB 3.25Å; S277-R280 WeakPolarHBondContact OG-CB 3.49Å; S277-R280 PolarHBondContact OG-N 3.38Å; R280-F284 VanDerWaalsContact O-CB 3.24Å; R280-F284 WeakPolarHBondContact O-CB 3.23Å; R280-F284 PolarHBondContact O-N 2.98Å
281	M	95.4	Very high	94.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-46	174.8	-171.2	55.5	171.5	0	0	111.8	L207 I210 F234 I241 L262 V272 I276 S277 S279 D283 F284 L285	L207-M281 HydrophobicContact CD1-CE 4.14Å; L207-M281 HydrophobicContact CD2-CE 3.88Å; L207-M281 HydrophobicContact CD2-CG 4.01Å; I210-M281 HydrophobicContact CD1-CE 4.18Å; F234-M281 HydrophobicContact CZ-CB 4.18Å; F234-M281 HydrophobicContact CZ-CG 4.44Å; I241-M281 HydrophobicContact CD1-CB 4.08Å; I241-M281 HydrophobicContact CD1-CG 3.51Å; L262-M281 HydrophobicContact CD1-SD 4.09Å; V272-M281 HydrophobicContact CG1-CE 4.26Å; V272-M281 HydrophobicContact CG1-SD 4.34Å; V272-M281 HydrophobicContact CG2-CE 3.89Å; V272-M281 HydrophobicContact CG2-SD 4.45Å; I276-M281 HydrophobicContact CD1-CB 3.63Å; I276-M281 HydrophobicContact CD1-CG 4.11Å; I276-M281 HydrophobicContact CD1-SD 3.63Å; I276-M281 HydrophobicContact CG1-CB 4.09Å; S277-M281 PolarHBondContact O-N 3.15Å; S279-M281 VanDerWaalsContact C-N 3.26Å; S279-M281 PolarHBondContact O-N 3.35Å; M281-D283 PolarHBondContact O-N 2.71Å; M281-F284 PolarHBondContact O-N 2.9Å; M281-L285 HydrophobicContact CE-CD1 4.09Å; M281-L285 HydrophobicContact CE-CD2 4.05Å; M281-L285 HydrophobicContact CE-CG 4.11Å; M281-L285 HydrophobicContact CG-CD1 4.15Å; M281-L285 HydrophobicContact CG-CG 4.42Å; M281-L285 WeakPolarHBondContact O-CB 3.24Å; M281-L285 VanDerWaalsContact O-CG 3.27Å; M281-L285 WeakPolarHBondContact O-CG 3.44Å; M281-L285 PolarHBondContact O-N 3.36Å; M281-L285 HydrophobicContact SD-CD1 4.49Å; M281-L285 HydrophobicContact SD-CG 4.25Å
282	Q	95.5	Very high	94.7	Very high	5 Å²	5	39.3 Å²	39.3	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-44.8	178.6	177.1	59.6	92	0	0	112.4	I241 F242 Y247 P278 S279 L285 K286	I241-Q282 VanDerWaalsContact CA-OE1 3.3Å; I241-Q282 HydrophobicContact CG1-CB 4.46Å; F242-Q282 VanDerWaalsContact CD2-OE1 3.29Å; Y247-Q282 PolarHBondContact OH-NE2 3.08Å; P278-Q282 WeakPolarHBondContact O-CB 3.46Å; P278-Q282 PolarHBondContact O-N 2.83Å; S279-Q282 PolarHBondContact O-N 2.81Å; S279-Q282 VanDerWaalsContact O-N 3.09Å; Q282-L285 PolarHBondContact O-N 3.46Å; Q282-K286 HydrophobicContact CG-CD 4.49Å; Q282-K286 WeakPolarHBondContact O-CG 3.34Å; Q282-K286 PolarHBondContact O-N 3.33Å
283	D	96	Very high	94.9	Very high	86 Å²	86	40 Å²	40	46%	0.46	23%	0.228	S	C	.	.	H	α-helix	trans	-69.7	-39.5	-179	-63.8	-30.9	0	0	0	111.4	S279 M281 K286 S287	S279-D283 PolarHBondContact O-N 3.41Å; M281-D283 PolarHBondContact O-N 2.71Å; D283-K286 PolarHBondContact O-N 3.12Å; D283-K286 IonicContact OD1-NZ 3.88Å; D283-S287 PolarHBondContact O-N 3.18Å; D283-S287 PolarHBondContact O-OG 3.39Å
284	F	96.6	Very high	95.2	Very high	25 Å²	25	42.6 Å²	42.6	11%	0.11	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-47	172	177.5	-97.5	0	0	0	112	L262 V264 L270 R280 M281 K286 S287 N288	L262-F284 HydrophobicContact CD1-CD1 3.71Å; L262-F284 HydrophobicContact CD1-CD2 4.45Å; L262-F284 HydrophobicContact CD1-CE1 3.76Å; L262-F284 HydrophobicContact CD1-CE2 4.5Å; L262-F284 HydrophobicContact CD1-CG 4.06Å; L262-F284 HydrophobicContact CD1-CZ 4.17Å; L262-F284 HydrophobicContact CD2-CB 3.35Å; L262-F284 HydrophobicContact CD2-CD1 3.89Å; L262-F284 HydrophobicContact CD2-CD2 3.76Å; L262-F284 HydrophobicContact CD2-CG 3.4Å; L262-F284 HydrophobicContact CG-CB 4.1Å; L262-F284 HydrophobicContact CG-CD1 3.74Å; L262-F284 HydrophobicContact CG-CD2 3.61Å; L262-F284 HydrophobicContact CG-CE1 3.98Å; L262-F284 HydrophobicContact CG-CE2 3.87Å; L262-F284 HydrophobicContact CG-CG 3.54Å; L262-F284 HydrophobicContact CG-CZ 4.04Å; L262-F284 WeakPolarHBondContact O-CE2 3.49Å; V264-F284 HydrophobicContact CG2-CE1 4.41Å; V264-F284 HydrophobicContact CG2-CE2 4.39Å; V264-F284 HydrophobicContact CG2-CZ 3.66Å; L270-F284 HydrophobicContact CD2-CE1 4.14Å; R280-F284 VanDerWaalsContact O-CB 3.24Å; R280-F284 WeakPolarHBondContact O-CB 3.23Å; R280-F284 PolarHBondContact O-N 2.98Å; M281-F284 PolarHBondContact O-N 2.9Å; F284-K286 PolarHBondContact O-N 2.84Å; F284-S287 PolarHBondContact O-N 3.07Å; F284-N288 HydrophobicContact CD1-CB 4.39Å; F284-N288 HydrophobicContact CD2-CB 4.36Å; F284-N288 WeakPolarHBondContact CD2-ND2 3.42Å; F284-N288 HydrophobicContact CE1-CB 4.12Å; F284-N288 HydrophobicContact CE2-CB 4.09Å; F284-N288 WeakPolarHBondContact CE2-ND2 3.34Å; F284-N288 HydrophobicContact CZ-CB 3.96Å; F284-N288 WeakPolarHBondContact O-CB 3.28Å; F284-N288 PolarHBondContact O-N 3.22Å; F284-N288 PolarHBondContact O-ND2 3.14Å
285	L	96.9	Very high	95.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-41	178.9	-72.9	175.1	0	0	0	112.4	I210 I241 Y247 L250 L270 M281 Q282 S287 N288 A289	I210-L285 HydrophobicContact CD1-CD1 3.85Å; I210-L285 HydrophobicContact CD1-CD2 3.53Å; I210-L285 HydrophobicContact CD1-CG 4.34Å; I241-L285 HydrophobicContact CD1-CD1 4.04Å; I241-L285 HydrophobicContact CG2-CD1 3.85Å; Y247-L285 HydrophobicContact CD2-CD1 4.36Å; Y247-L285 HydrophobicContact CE1-CB 3.98Å; Y247-L285 HydrophobicContact CE1-CD1 4.46Å; Y247-L285 HydrophobicContact CE1-CD2 4.48Å; Y247-L285 HydrophobicContact CE2-CB 4.47Å; Y247-L285 HydrophobicContact CE2-CD1 3.89Å; Y247-L285 WeakPolarHBondContact OH-CB 3.46Å; L250-L285 HydrophobicContact CD1-CD2 4.17Å; L270-L285 HydrophobicContact CD1-CD2 3.97Å; M281-L285 HydrophobicContact CE-CD1 4.09Å; M281-L285 HydrophobicContact CE-CD2 4.05Å; M281-L285 HydrophobicContact CE-CG 4.11Å; M281-L285 HydrophobicContact CG-CD1 4.15Å; M281-L285 HydrophobicContact CG-CG 4.42Å; M281-L285 WeakPolarHBondContact O-CB 3.24Å; M281-L285 VanDerWaalsContact O-CG 3.27Å; M281-L285 WeakPolarHBondContact O-CG 3.44Å; M281-L285 PolarHBondContact O-N 3.36Å; M281-L285 HydrophobicContact SD-CD1 4.49Å; M281-L285 HydrophobicContact SD-CG 4.25Å; Q282-L285 PolarHBondContact O-N 3.46Å; L285-S287 VanDerWaalsContact C-N 3.33Å; L285-S287 PolarHBondContact O-N 3.29Å; L285-N288 PolarHBondContact O-N 3.41Å; L285-A289 WeakPolarHBondContact O-CB 3.47Å; L285-A289 PolarHBondContact O-N 3.2Å
286	K	93.9	Very high	95.7	Very high	118 Å²	118	44.2 Å²	44.2	51%	0.513	23%	0.229	S	C	.	.	H	α-helix	trans	-56.6	-47.6	174.4	-75.6	168.6	-178.2	169.4	0	111.6	Q282 D283 F284	Q282-K286 HydrophobicContact CG-CD 4.49Å; Q282-K286 WeakPolarHBondContact O-CG 3.34Å; Q282-K286 PolarHBondContact O-N 3.33Å; D283-K286 PolarHBondContact O-N 3.12Å; D283-K286 IonicContact OD1-NZ 3.88Å; F284-K286 PolarHBondContact O-N 2.84Å
287	S	94.9	Very high	95.8	Very high	97 Å²	97	50.8 Å²	50.8	68%	0.678	25%	0.253	S	S	*	.	H	α-helix	trans	-79.7	-23.9	-176.3	-60	0	0	0	0	114.3	D283 F284 L285	D283-S287 PolarHBondContact O-N 3.18Å; D283-S287 PolarHBondContact O-OG 3.39Å; F284-S287 PolarHBondContact O-N 3.07Å; L285-S287 VanDerWaalsContact C-N 3.33Å; L285-S287 PolarHBondContact O-N 3.29Å
288	N	96.4	Very high	95.9	Very high	17 Å²	17	53.4 Å²	53.4	9%	0.091	26%	0.26	C	S	.	.	H	α-helix	trans	-118.5	-18.6	-167.6	-67.7	-88.8	0	0	0	115.7	V264 F284 L285 G290 R291 A292	V264-N288 HydrophobicContact CG2-CB 3.84Å; F284-N288 HydrophobicContact CD1-CB 4.39Å; F284-N288 HydrophobicContact CD2-CB 4.36Å; F284-N288 WeakPolarHBondContact CD2-ND2 3.42Å; F284-N288 HydrophobicContact CE1-CB 4.12Å; F284-N288 HydrophobicContact CE2-CB 4.09Å; F284-N288 WeakPolarHBondContact CE2-ND2 3.34Å; F284-N288 HydrophobicContact CZ-CB 3.96Å; F284-N288 WeakPolarHBondContact O-CB 3.28Å; F284-N288 PolarHBondContact O-N 3.22Å; F284-N288 PolarHBondContact O-ND2 3.14Å; L285-N288 PolarHBondContact O-N 3.41Å; N288-G290 VanDerWaalsContact C-N 3.3Å; N288-G290 PolarHBondContact O-N 2.97Å; N288-R291 PolarHBondContact O-N 2.96Å; N288-R291 PolarHBondContact OD1-NE 3.46Å; N288-R291 PolarHBondContact OD1-NH2 3.36Å; N288-A292 WeakPolarHBondContact O-CB 3.43Å; N288-A292 PolarHBondContact O-N 2.9Å
289	A	96.4	Very high	95.8	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-56.4	-41.5	-175.4	0	0	0	0	0	113.1	Y247 L250 L285 L293	Y247-A289 HydrophobicContact CD1-CB 4.28Å; Y247-A289 HydrophobicContact CE1-CB 3.89Å; L250-A289 HydrophobicContact CD1-CB 3.9Å; L285-A289 WeakPolarHBondContact O-CB 3.47Å; L285-A289 PolarHBondContact O-N 3.2Å; A289-L293 WeakPolarHBondContact O-CG 3.44Å; A289-L293 PolarHBondContact O-N 2.97Å; A289-L293 VanDerWaalsContact O-N 3.17Å
290	G	96.9	Very high	95.7	Very high	37 Å²	37	58.3 Å²	58.3	38%	0.381	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-45.3	175.1	0	0	0	0	0	112.9	N288 L293 E294	N288-G290 VanDerWaalsContact C-N 3.3Å; N288-G290 PolarHBondContact O-N 2.97Å; G290-L293 PolarHBondContact O-N 3.46Å; G290-E294 WeakPolarHBondContact O-CB 3.19Å; G290-E294 PolarHBondContact O-N 3.22Å
291	R	96.9	Very high	95.6	Very high	134 Å²	134	55.6 Å²	55.6	51%	0.506	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-40.6	179	-177.5	166.7	68.3	163.9	3.3	112.3	N288 E294 F295	N288-R291 PolarHBondContact O-N 2.96Å; N288-R291 PolarHBondContact OD1-NE 3.46Å; N288-R291 PolarHBondContact OD1-NH2 3.36Å; R291-E294 PolarHBondContact O-N 2.88Å; R291-F295 HydrophobicContact CG-CD1 4.48Å; R291-F295 HydrophobicContact CG-CD2 4.23Å; R291-F295 HydrophobicContact CG-CE1 4.12Å; R291-F295 HydrophobicContact CG-CE2 3.85Å; R291-F295 HydrophobicContact CG-CZ 3.79Å; R291-F295 WeakPolarHBondContact O-CG 3.49Å; R291-F295 PolarHBondContact O-N 2.88Å
292	A	97.4	Very high	95.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-44.4	177.5	0	0	0	0	0	112.5	L250 V264 G268 L270 N288 E294 F295 Q296	L250-A292 HydrophobicContact CD2-CB 3.61Å; V264-A292 HydrophobicContact CG1-CB 3.69Å; V264-A292 HydrophobicContact CG2-CB 4.25Å; G268-A292 VanDerWaalsContact CA-O 3.31Å; G268-A292 WeakPolarHBondContact CA-O 3.02Å; L270-A292 HydrophobicContact CD2-CB 3.63Å; N288-A292 WeakPolarHBondContact O-CB 3.43Å; N288-A292 PolarHBondContact O-N 2.9Å; A292-E294 VanDerWaalsContact C-N 3.31Å; A292-E294 PolarHBondContact O-N 3.24Å; A292-F295 PolarHBondContact O-N 3.47Å; A292-Q296 WeakPolarHBondContact O-CB 3.23Å; A292-Q296 PolarHBondContact O-N 3.33Å
293	L	97.9	Very high	95.3	Very high	15 Å²	15	59.5 Å²	59.5	8%	0.079	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-35.7	174.7	-68.7	178.8	0	0	0	112.6	R246 M249 L250 A289 G290 Q296 R297	R246-L293 HydrophobicContact CB-CD1 3.79Å; R246-L293 HydrophobicContact CG-CD1 3.99Å; M249-L293 HydrophobicContact CB-CD1 4.47Å; M249-L293 HydrophobicContact CB-CD2 3.55Å; L250-L293 HydrophobicContact CD2-CD2 3.74Å; L250-L293 HydrophobicContact CD2-CG 3.79Å; L250-L293 HydrophobicContact CG-CD2 4.26Å; L250-L293 HydrophobicContact CG-CG 4.5Å; A289-L293 WeakPolarHBondContact O-CG 3.44Å; A289-L293 PolarHBondContact O-N 2.97Å; A289-L293 VanDerWaalsContact O-N 3.17Å; G290-L293 PolarHBondContact O-N 3.46Å; L293-Q296 PolarHBondContact O-N 2.8Å; L293-R297 VanDerWaalsContact O-CG 3.3Å; L293-R297 WeakPolarHBondContact O-CG 3.42Å; L293-R297 PolarHBondContact O-N 3.4Å
294	E	97.1	Very high	95.2	Very high	73 Å²	73	62.3 Å²	62.3	34%	0.341	31%	0.309	S	S	.	.	H	α-helix	trans	-69.9	-45	177.7	-171.8	50.7	-146	0	0	111.9	G290 R291 A292 Q296 R297 Q298	G290-E294 WeakPolarHBondContact O-CB 3.19Å; G290-E294 PolarHBondContact O-N 3.22Å; R291-E294 PolarHBondContact O-N 2.88Å; A292-E294 VanDerWaalsContact C-N 3.31Å; A292-E294 PolarHBondContact O-N 3.24Å; E294-Q296 VanDerWaalsContact C-N 3.31Å; E294-Q296 PolarHBondContact O-N 3Å; E294-R297 WeakPolarHBondContact O-CB 3.36Å; E294-R297 PolarHBondContact O-N 2.86Å; E294-R297 VanDerWaalsContact O-N 3.15Å; E294-R297 IonicContact OE2-NH1 3.36Å; E294-R297 PolarHBondContact OE2-NH1 2.83Å; E294-Q298 WeakPolarHBondContact O-CG 3.48Å; E294-Q298 PolarHBondContact O-N 2.9Å; E294-Q298 PolarHBondContact OE1-NE2 3.44Å
295	F	95.5	Very high	95.1	Very high	65 Å²	65	63.9 Å²	63.9	29%	0.285	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-39.9	171.4	-70.7	-6.3	0	0	0	112.1	V264 T265 R291 A292 R297 Q298 F299	V264-F295 HydrophobicContact CG1-CD2 3.93Å; T265-F295 WeakPolarHBondContact O-CD2 3.45Å; R291-F295 HydrophobicContact CG-CD1 4.48Å; R291-F295 HydrophobicContact CG-CD2 4.23Å; R291-F295 HydrophobicContact CG-CE1 4.12Å; R291-F295 HydrophobicContact CG-CE2 3.85Å; R291-F295 HydrophobicContact CG-CZ 3.79Å; R291-F295 WeakPolarHBondContact O-CG 3.49Å; R291-F295 PolarHBondContact O-N 2.88Å; A292-F295 PolarHBondContact O-N 3.47Å; F295-R297 VanDerWaalsContact C-N 3.34Å; F295-R297 PolarHBondContact O-N 2.88Å; F295-Q298 PolarHBondContact O-N 3.02Å; F295-F299 WeakPolarHBondContact O-CB 3.48Å; F295-F299 PolarHBondContact O-N 2.92Å
296	Q	95.2	Very high	94.9	Very high	33 Å²	33	64.1 Å²	64.1	15%	0.154	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-39.8	174.8	-174.7	176.1	-40	0	0	112.2	M249 N251 S267 A292 L293 E294 Q300	M249-Q296 PolarHBondContact O-OE1 2.93Å; N251-Q296 PolarHBondContact ND2-OE1 3.1Å; N251-Q296 VanDerWaalsContact ND2-OE1 3.14Å; S267-Q296 WeakPolarHBondContact O-CA 3.45Å; A292-Q296 WeakPolarHBondContact O-CB 3.23Å; A292-Q296 PolarHBondContact O-N 3.33Å; L293-Q296 PolarHBondContact O-N 2.8Å; E294-Q296 VanDerWaalsContact C-N 3.31Å; E294-Q296 PolarHBondContact O-N 3Å; Q296-Q300 WeakPolarHBondContact O-CB 3.24Å; Q296-Q300 VanDerWaalsContact O-CG 3.23Å; Q296-Q300 WeakPolarHBondContact O-CG 3.32Å; Q296-Q300 PolarHBondContact O-N 3.06Å
297	R	95.7	Very high	94.9	Very high	145 Å²	145	62.4 Å²	62.4	55%	0.547	32%	0.317	S	S	.	.	H	α-helix	trans	-66	-47.3	175.3	-72.6	165.5	179	172.3	-2.6	111.9	L293 E294 F295 Q300 A301	L293-R297 VanDerWaalsContact O-CG 3.3Å; L293-R297 WeakPolarHBondContact O-CG 3.42Å; L293-R297 PolarHBondContact O-N 3.4Å; E294-R297 WeakPolarHBondContact O-CB 3.36Å; E294-R297 PolarHBondContact O-N 2.86Å; E294-R297 VanDerWaalsContact O-N 3.15Å; E294-R297 IonicContact OE2-NH1 3.36Å; E294-R297 PolarHBondContact OE2-NH1 2.83Å; F295-R297 VanDerWaalsContact C-N 3.34Å; F295-R297 PolarHBondContact O-N 2.88Å; R297-Q300 PolarHBondContact O-N 2.74Å; R297-A301 WeakPolarHBondContact O-CB 3.31Å; R297-A301 PolarHBondContact O-N 2.95Å
298	Q	93.9	Very high	95	Very high	100 Å²	100	63.5 Å²	63.5	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-47.1	179.6	-69.6	172.8	6.9	0	0	110.9	E294 F295 Q300 A301 A302	E294-Q298 WeakPolarHBondContact O-CG 3.48Å; E294-Q298 PolarHBondContact O-N 2.9Å; E294-Q298 PolarHBondContact OE1-NE2 3.44Å; F295-Q298 PolarHBondContact O-N 3.02Å; Q298-Q300 PolarHBondContact O-N 3.06Å; Q298-A301 PolarHBondContact O-N 3.29Å; Q298-A302 WeakPolarHBondContact O-CB 3.43Å; Q298-A302 PolarHBondContact O-N 2.97Å
299	F	92.8	Very high	94.9	Very high	66 Å²	66	63.4 Å²	63.4	29%	0.289	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-43.6	175.3	-174.9	-109.7	0	0	0	112.6	F295 A302 I303 L330	F295-F299 WeakPolarHBondContact O-CB 3.48Å; F295-F299 PolarHBondContact O-N 2.92Å; F299-A302 PolarHBondContact O-N 3.1Å; F299-I303 HydrophobicContact CD1-CD1 3.82Å; F299-I303 HydrophobicContact CE1-CD1 3.36Å; F299-I303 HydrophobicContact CE1-CG1 4.46Å; F299-I303 HydrophobicContact CE2-CD1 4.22Å; F299-I303 HydrophobicContact CG-CD1 4.43Å; F299-I303 HydrophobicContact CZ-CD1 3.59Å; F299-I303 HydrophobicContact CZ-CG1 4.45Å; F299-I303 WeakPolarHBondContact O-CG1 3.48Å; F299-I303 PolarHBondContact O-N 3.48Å; F299-L330 HydrophobicContact CD2-CD2 3.73Å; F299-L330 HydrophobicContact CE2-CD2 3.94Å
300	Q	93.1	Very high	94.8	Very high	92 Å²	92	67.9 Å²	67.9	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-38.4	174.6	-77	-177.1	9.4	0	0	113	Q296 R297 Q298 K304	Q296-Q300 WeakPolarHBondContact O-CB 3.24Å; Q296-Q300 VanDerWaalsContact O-CG 3.23Å; Q296-Q300 WeakPolarHBondContact O-CG 3.32Å; Q296-Q300 PolarHBondContact O-N 3.06Å; R297-Q300 PolarHBondContact O-N 2.74Å; Q298-Q300 PolarHBondContact O-N 3.06Å; Q300-K304 WeakPolarHBondContact O-CB 3.42Å; Q300-K304 VanDerWaalsContact O-CG 3.28Å; Q300-K304 WeakPolarHBondContact O-CG 3.33Å; Q300-K304 PolarHBondContact O-N 3.49Å
301	A	94.1	Very high	94.7	Very high	57 Å²	57	73 Å²	73	47%	0.471	33%	0.334	S	S	.	.	H	α-helix	trans	-64.8	-45.1	175.4	0	0	0	0	0	110.9	R297 Q298 K304 E305	R297-A301 WeakPolarHBondContact O-CB 3.31Å; R297-A301 PolarHBondContact O-N 2.95Å; Q298-A301 PolarHBondContact O-N 3.29Å; A301-K304 WeakPolarHBondContact O-CB 3.37Å; A301-K304 PolarHBondContact O-N 2.92Å; A301-E305 PolarHBondContact O-N 3.49Å
302	A	92.3	Very high	94.6	Very high	15 Å²	15	70.3 Å²	70.3	12%	0.124	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-42.2	177.2	0	0	0	0	0	112.6	Q298 F299 K304 E305 V306 L330 I334	Q298-A302 WeakPolarHBondContact O-CB 3.43Å; Q298-A302 PolarHBondContact O-N 2.97Å; F299-A302 PolarHBondContact O-N 3.1Å; A302-K304 PolarHBondContact O-N 3.43Å; A302-E305 PolarHBondContact O-N 3.03Å; A302-V306 WeakPolarHBondContact O-CG2 3.46Å; A302-V306 PolarHBondContact O-N 3.49Å; A302-L330 HydrophobicContact CB-CD2 3.36Å; A302-L330 HydrophobicContact CB-CG 3.9Å; A302-I334 HydrophobicContact CB-CD1 3.73Å
303	I	91.7	Very high	94.4	Very high	73 Å²	73	70.3 Å²	70.3	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-62.2	-40.7	172.2	-74.3	175.2	0	0	0	111.9	F299 E305 T307 L330	F299-I303 HydrophobicContact CD1-CD1 3.82Å; F299-I303 HydrophobicContact CE1-CD1 3.36Å; F299-I303 HydrophobicContact CE1-CG1 4.46Å; F299-I303 HydrophobicContact CE2-CD1 4.22Å; F299-I303 HydrophobicContact CG-CD1 4.43Å; F299-I303 HydrophobicContact CZ-CD1 3.59Å; F299-I303 HydrophobicContact CZ-CG1 4.45Å; F299-I303 WeakPolarHBondContact O-CG1 3.48Å; F299-I303 PolarHBondContact O-N 3.48Å; I303-E305 VanDerWaalsContact C-N 3.33Å; I303-T307 WeakPolarHBondContact O-CB 3.38Å; I303-T307 PolarHBondContact O-N 3.41Å; I303-T307 PolarHBondContact O-OG1 2.88Å; I303-L330 HydrophobicContact CG1-CD2 4.43Å
304	K	93.6	Very high	94.2	Very high	145 Å²	145	71.8 Å²	71.8	63%	0.63	33%	0.334	S	S	*	.	H	α-helix	trans	-63.9	-40.6	175.2	-74.9	170.6	-177.2	175.9	0	110.9	Q300 A301 A302 T307 K308	Q300-K304 WeakPolarHBondContact O-CB 3.42Å; Q300-K304 VanDerWaalsContact O-CG 3.28Å; Q300-K304 WeakPolarHBondContact O-CG 3.33Å; Q300-K304 PolarHBondContact O-N 3.49Å; A301-K304 WeakPolarHBondContact O-CB 3.37Å; A301-K304 PolarHBondContact O-N 2.92Å; A302-K304 PolarHBondContact O-N 3.43Å; K304-T307 PolarHBondContact O-N 3.04Å; K304-K308 WeakPolarHBondContact O-CB 3.48Å; K304-K308 PolarHBondContact O-N 2.93Å
305	E	94.6	Very high	93.9	Very high	57 Å²	57	73.2 Å²	73.2	27%	0.266	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-51.7	174.8	-175.8	174.3	173.9	0	0	111.8	A301 A302 I303 T307 K308 L309 R338	A301-E305 PolarHBondContact O-N 3.49Å; A302-E305 PolarHBondContact O-N 3.03Å; I303-E305 VanDerWaalsContact C-N 3.33Å; E305-T307 VanDerWaalsContact C-N 3.25Å; E305-T307 PolarHBondContact O-N 3.05Å; E305-K308 CarbonylContact O-C 3.51Å; E305-K308 WeakPolarHBondContact O-CA 3.47Å; E305-K308 WeakPolarHBondContact O-CB 3.15Å; E305-K308 PolarHBondContact O-N 2.94Å; E305-L309 HydrophobicContact CG-CD1 3.82Å; E305-L309 HydrophobicContact CG-CG 4.06Å; E305-L309 WeakPolarHBondContact O-CG 3.37Å; E305-L309 PolarHBondContact O-N 3.36Å; E305-R338 VanDerWaalsContact CD-NH2 3.26Å; E305-R338 IonicContact OE1-CZ 2.62Å; E305-R338 IonicContact OE1-NE 3.47Å; E305-R338 PolarHBondContact OE1-NE 2.98Å; E305-R338 IonicContact OE1-NH2 2.8Å; E305-R338 PolarHBondContact OE1-NH2 2.83Å; E305-R338 IonicContact OE2-NH2 2.68Å; E305-R338 PolarHBondContact OE2-NH2 3.2Å
306	V	93.3	Very high	93.7	Very high	6 Å²	6	74.2 Å²	74.2	4%	0.036	35%	0.348	C	S	.	.	H	α-helix	trans	-54.1	-44.5	175.7	166.5	0	0	0	0	110.9	A302 K308 L309 R310 F324 L330 L333 I334 L337	A302-V306 WeakPolarHBondContact O-CG2 3.46Å; A302-V306 PolarHBondContact O-N 3.49Å; V306-K308 VanDerWaalsContact C-N 3.34Å; V306-K308 PolarHBondContact O-N 2.83Å; V306-L309 PolarHBondContact O-N 2.84Å; V306-R310 WeakPolarHBondContact O-CB 3.21Å; V306-R310 PolarHBondContact O-N 3.14Å; V306-F324 HydrophobicContact CG1-CE1 3.61Å; V306-F324 HydrophobicContact CG1-CE2 4.22Å; V306-F324 HydrophobicContact CG1-CZ 3.38Å; V306-L330 HydrophobicContact CG2-CD1 3.73Å; V306-L333 HydrophobicContact CG1-CD2 4.11Å; V306-L333 HydrophobicContact CG2-CD2 4.21Å; V306-L333 HydrophobicContact CG2-CG 4.42Å; V306-I334 HydrophobicContact CG2-CD1 4.1Å; V306-I334 HydrophobicContact CG2-CG1 3.45Å; V306-I334 VanDerWaalsContact CG2-CG1 3.45Å; V306-L337 HydrophobicContact CB-CD1 4.29Å; V306-L337 HydrophobicContact CG1-CD1 3.9Å; V306-L337 HydrophobicContact CG2-CD1 4.09Å
307	T	94.2	Very high	93.4	Very high	82 Å²	82	72.7 Å²	72.7	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-39.7	177.1	-55.7	0	0	0	0	112.1	I303 K304 E305 R311	I303-T307 WeakPolarHBondContact O-CB 3.38Å; I303-T307 PolarHBondContact O-N 3.41Å; I303-T307 PolarHBondContact O-OG1 2.88Å; K304-T307 PolarHBondContact O-N 3.04Å; E305-T307 VanDerWaalsContact C-N 3.25Å; E305-T307 PolarHBondContact O-N 3.05Å; T307-R311 PolarHBondContact O-N 3.46Å
308	K	95.7	Very high	93.1	Very high	120 Å²	120	68.8 Å²	68.8	52%	0.522	34%	0.336	S	S	.	.	H	α-helix	trans	-65.4	-54.1	174.8	-175.1	-175.6	176.9	-172.7	0	110.7	K304 E305 V306 R310 R311 H312	K304-K308 WeakPolarHBondContact O-CB 3.48Å; K304-K308 PolarHBondContact O-N 2.93Å; E305-K308 CarbonylContact O-C 3.51Å; E305-K308 WeakPolarHBondContact O-CA 3.47Å; E305-K308 WeakPolarHBondContact O-CB 3.15Å; E305-K308 PolarHBondContact O-N 2.94Å; V306-K308 VanDerWaalsContact C-N 3.34Å; V306-K308 PolarHBondContact O-N 2.83Å; K308-R310 PolarHBondContact O-N 3.15Å; K308-R311 PolarHBondContact O-N 3.43Å; K308-H312 VanDerWaalsContact CG-CE1 3.48Å; K308-H312 WeakPolarHBondContact CG-CE1 3.48Å; K308-H312 PolarHBondContact O-N 3.34Å; K308-H312 VanDerWaalsContact O-N 3.1Å; K308-H312 PolarHBondContact O-ND1 3.06Å
309	L	94.9	Very high	93	Very high	15 Å²	15	64.5 Å²	64.5	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-48.2	-179.3	-70	174.6	0	0	0	111.4	E305 V306 R311 H312 I313 I334 L337 R338 L341	E305-L309 HydrophobicContact CG-CD1 3.82Å; E305-L309 HydrophobicContact CG-CG 4.06Å; E305-L309 WeakPolarHBondContact O-CG 3.37Å; E305-L309 PolarHBondContact O-N 3.36Å; V306-L309 PolarHBondContact O-N 2.84Å; L309-R311 VanDerWaalsContact C-N 3.27Å; L309-R311 PolarHBondContact O-N 2.77Å; L309-H312 PolarHBondContact O-N 2.84Å; L309-H312 VanDerWaalsContact O-N 3.13Å; L309-I313 HydrophobicContact CB-CD1 4.38Å; L309-I313 WeakPolarHBondContact O-CB 3.31Å; L309-I313 WeakPolarHBondContact O-CD1 3.34Å; L309-I313 VanDerWaalsContact O-CG1 3.28Å; L309-I313 WeakPolarHBondContact O-CG1 3.4Å; L309-I313 PolarHBondContact O-N 2.97Å; L309-I334 HydrophobicContact CD1-CG2 4.31Å; L309-L337 HydrophobicContact CB-CB 4.05Å; L309-L337 HydrophobicContact CB-CD1 4.35Å; L309-L337 HydrophobicContact CD1-CB 3.87Å; L309-R338 HydrophobicContact CD1-CG 3.88Å; L309-R338 HydrophobicContact CD2-CG 4.34Å; L309-L341 HydrophobicContact CD2-CD2 3.87Å
310	R	95	Very high	92.8	Very high	95 Å²	95	70.1 Å²	70.1	36%	0.358	34%	0.336	S	S	.	.	H	α-helix	trans	-51.5	-45.5	177	-177.8	-170.7	-175.4	-160.9	-0.8	112	V306 K308 I314 L322	V306-R310 WeakPolarHBondContact O-CB 3.21Å; V306-R310 PolarHBondContact O-N 3.14Å; K308-R310 PolarHBondContact O-N 3.15Å; R310-I314 HydrophobicContact CG-CD1 4.02Å; R310-I314 WeakPolarHBondContact O-CB 3.44Å; R310-I314 VanDerWaalsContact O-CG1 3.25Å; R310-I314 WeakPolarHBondContact O-CG1 3.46Å; R310-I314 PolarHBondContact O-N 2.92Å; R310-L322 HydrophobicContact CB-CD2 4.4Å; R310-L322 HydrophobicContact CG-CB 4.27Å; R310-L322 HydrophobicContact CG-CD2 3.95Å; R310-L322 HydrophobicContact CG-CG 4.11Å; R310-L322 VanDerWaalsContact CZ-O 3.22Å; R310-L322 PolarHBondContact NE-O 3.26Å; R310-L322 PolarHBondContact NH2-O 3.01Å
311	R	94.7	Very high	92.7	Very high	146 Å²	146	67.7 Å²	67.7	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-51	176.9	176.5	160.4	50.8	102.9	-4.5	111.7	T307 K308 L309 I313 I314 D315	T307-R311 PolarHBondContact O-N 3.46Å; K308-R311 PolarHBondContact O-N 3.43Å; L309-R311 VanDerWaalsContact C-N 3.27Å; L309-R311 PolarHBondContact O-N 2.77Å; R311-I313 PolarHBondContact O-N 3.41Å; R311-I314 PolarHBondContact O-N 3.39Å; R311-I314 VanDerWaalsContact O-N 3.13Å; R311-D315 WeakPolarHBondContact CG-OD2 3.46Å; R311-D315 PolarHBondContact O-N 3.48Å; R311-D315 VanDerWaalsContact O-OD2 3.14Å
312	H	94.6	Very high	92.6	Very high	77 Å²	77	65 Å²	65	36%	0.356	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-34	178.7	-68.8	66.2	0	0	0	112.6	K308 L309 K316 L341	K308-H312 VanDerWaalsContact CG-CE1 3.48Å; K308-H312 WeakPolarHBondContact CG-CE1 3.48Å; K308-H312 PolarHBondContact O-N 3.34Å; K308-H312 VanDerWaalsContact O-N 3.1Å; K308-H312 PolarHBondContact O-ND1 3.06Å; L309-H312 PolarHBondContact O-N 2.84Å; L309-H312 VanDerWaalsContact O-N 3.13Å; H312-K316 WeakPolarHBondContact O-CB 3.45Å; H312-K316 PolarHBondContact O-N 3.45Å; H312-L341 HydrophobicContact CB-CD1 3.89Å
313	I	92.2	Very high	92.6	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-71.3	-45.2	176.1	-71	159.3	0	0	0	111.4	L309 R311 D315 H317 L319 L322 L337 F340 L341	L309-I313 HydrophobicContact CB-CD1 4.38Å; L309-I313 WeakPolarHBondContact O-CB 3.31Å; L309-I313 WeakPolarHBondContact O-CD1 3.34Å; L309-I313 VanDerWaalsContact O-CG1 3.28Å; L309-I313 WeakPolarHBondContact O-CG1 3.4Å; L309-I313 PolarHBondContact O-N 2.97Å; R311-I313 PolarHBondContact O-N 3.41Å; I313-D315 VanDerWaalsContact C-N 3.28Å; I313-D315 PolarHBondContact O-N 2.93Å; I313-H317 WeakPolarHBondContact O-CB 3.16Å; I313-H317 PolarHBondContact O-CD2 3.3Å; I313-H317 PolarHBondContact O-N 3.48Å; I313-L319 HydrophobicContact CG2-CD1 3.82Å; I313-L322 HydrophobicContact CB-CD2 4.09Å; I313-L322 HydrophobicContact CD1-CD2 4.41Å; I313-L322 HydrophobicContact CG2-CD2 3.63Å; I313-L337 HydrophobicContact CD1-CB 3.81Å; I313-L337 HydrophobicContact CD1-CD2 3.53Å; I313-L337 HydrophobicContact CD1-CG 4.27Å; I313-L337 WeakPolarHBondContact CD1-O 3.39Å; I313-F340 HydrophobicContact CD1-CB 4.18Å; I313-F340 HydrophobicContact CG1-CD1 4.42Å; I313-F340 HydrophobicContact CG2-CD1 3.48Å; I313-F340 VanDerWaalsContact CG2-CD1 3.48Å; I313-F340 HydrophobicContact CG2-CE1 3.83Å; I313-F340 HydrophobicContact CG2-CG 4.43Å; I313-L341 HydrophobicContact CG1-CB 4.21Å; I313-L341 HydrophobicContact CG1-CD1 4.27Å
314	I	93.6	Very high	92.4	Very high	46 Å²	46	65.6 Å²	65.6	24%	0.236	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-46.2	174.2	-74.6	166.6	0	0	0	110.2	R310 R311 S318 L319 L322	R310-I314 HydrophobicContact CG-CD1 4.02Å; R310-I314 WeakPolarHBondContact O-CB 3.44Å; R310-I314 VanDerWaalsContact O-CG1 3.25Å; R310-I314 WeakPolarHBondContact O-CG1 3.46Å; R310-I314 PolarHBondContact O-N 2.92Å; R311-I314 PolarHBondContact O-N 3.39Å; R311-I314 VanDerWaalsContact O-N 3.13Å; I314-S318 CarbonylContact O-C 3.59Å; I314-S318 WeakPolarHBondContact O-CA 3.37Å; I314-S318 PolarHBondContact O-N 3.33Å; I314-L319 HydrophobicContact CG1-CB 4.29Å; I314-L319 PolarHBondContact O-N 3.31Å; I314-L322 HydrophobicContact CD1-CB 4.05Å; I314-L322 HydrophobicContact CG1-CB 3.84Å
315	D	92	Very high	91.9	Very high	103 Å²	103	62.6 Å²	62.6	55%	0.551	30%	0.296	S	S	*	.	H	α-helix	trans	-68.1	-51.2	-178.8	-58	-26.8	0	0	0	111.2	R311 I313 H317 S318	R311-D315 WeakPolarHBondContact CG-OD2 3.46Å; R311-D315 PolarHBondContact O-N 3.48Å; R311-D315 VanDerWaalsContact O-OD2 3.14Å; I313-D315 VanDerWaalsContact C-N 3.28Å; I313-D315 PolarHBondContact O-N 2.93Å; D315-H317 PolarHBondContact O-N 2.81Å; D315-S318 PolarHBondContact O-N 3.39Å
316	K	90.2	Very high	90.8	Very high	85 Å²	85	67.8 Å²	67.8	37%	0.37	33%	0.326	S	S	.	.	H	α-helix	trans	-59.2	-47.5	-179.5	-175.3	-170.2	-179.7	-164.7	0	112.3	H312 L341 A343	H312-K316 WeakPolarHBondContact O-CB 3.45Å; H312-K316 PolarHBondContact O-N 3.45Å; K316-L341 HydrophobicContact CD-CD1 4.31Å; K316-L341 PolarHBondContact NZ-O 3.33Å; K316-A343 PolarHBondContact NZ-O 2.89Å
317	H	89.3	Confident	89.4	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.009	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	5	-173.5	-65	-81.2	0	0	0	113.1	I313 D315 L319 F340 S348	I313-H317 WeakPolarHBondContact O-CB 3.16Å; I313-H317 PolarHBondContact O-CD2 3.3Å; I313-H317 PolarHBondContact O-N 3.48Å; D315-H317 PolarHBondContact O-N 2.81Å; H317-L319 HydrophobicContact CB-CD2 4.14Å; H317-L319 HydrophobicContact CB-CG 3.97Å; H317-L319 PolarHBondContact O-N 3.48Å; H317-F340 AromaticContact CD2-CD1 3.75Å; H317-F340 AromaticContact CD2-CE1 3.76Å; H317-F340 AromaticContact NE2-CD1 3.66Å; H317-F340 AromaticContact NE2-CE1 3.89Å; H317-F340 PolarHBondContact NE2-O 2.98Å; H317-S348 VanDerWaalsContact ND1-CA 3.28Å; H317-S348 WeakPolarHBondContact ND1-CA 3.4Å; H317-S348 PolarHBondContact ND1-OG 2.68Å
318	S	89.6	Confident	88.2	Confident	63 Å²	63	70 Å²	70	44%	0.441	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	40.5	-176.7	-64.4	0	0	0	0	113.2	I314 D315 G353	I314-S318 CarbonylContact O-C 3.59Å; I314-S318 WeakPolarHBondContact O-CA 3.37Å; I314-S318 PolarHBondContact O-N 3.33Å; D315-S318 PolarHBondContact O-N 3.39Å; S318-G353 PolarHBondContact O-N 3.27Å
319	L	90.7	Very high	87.6	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.052	35%	0.35	C	S	.	.			trans	-70.3	143.1	-178.9	-60.9	179.2	0	0	0	110.5	I313 I314 H317 L322 L351 L356	I313-L319 HydrophobicContact CG2-CD1 3.82Å; I314-L319 HydrophobicContact CG1-CB 4.29Å; I314-L319 PolarHBondContact O-N 3.31Å; H317-L319 HydrophobicContact CB-CD2 4.14Å; H317-L319 HydrophobicContact CB-CG 3.97Å; H317-L319 PolarHBondContact O-N 3.48Å; L319-L322 HydrophobicContact CD1-CB 4.06Å; L319-L322 HydrophobicContact CD1-CD2 4.43Å; L319-L351 HydrophobicContact CD2-CB 3.8Å; L319-L351 HydrophobicContact CD2-CD1 4.49Å; L319-L351 WeakPolarHBondContact CD2-O 3.49Å; L319-L356 HydrophobicContact CD1-CB 4.39Å; L319-L356 HydrophobicContact CD1-CD2 4.27Å
320	R	89.6	Confident	87.2	Confident	183 Å²	183	69.1 Å²	69.1	69%	0.691	35%	0.354	S	S	*	.	S	Bend	trans	-74.5	-38.5	172.7	-173.8	177.4	-179.8	-179.4	2.4	111.8	G353 Q354 R355	R320-G353 VanDerWaalsContact CB-O 3.26Å; R320-G353 WeakPolarHBondContact CB-O 3.36Å; R320-Q354 PolarHBondContact N-O 3.48Å; R320-R355 HydrophobicContact CB-CG 4.44Å
321	V	91.1	Very high	86.8	Confident	41 Å²	41	70.7 Å²	70.7	25%	0.248	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	135.6	177.8	175.7	0	0	0	0	108.9	T323 R355 L356	V321-T323 HydrophobicContact CG1-CG2 3.72Å; V321-R355 HydrophobicContact CB-CB 4.41Å; V321-R355 HydrophobicContact CB-CG 4.34Å; V321-R355 HydrophobicContact CG2-CG 4.46Å; V321-L356 PolarHBondContact O-N 2.62Å
322	L	91.5	Very high	86.5	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.7	161.3	174.5	55.8	0	0	0	109.1	R310 I313 I314 L319 L337 L356 L358	R310-L322 HydrophobicContact CB-CD2 4.4Å; R310-L322 HydrophobicContact CG-CB 4.27Å; R310-L322 HydrophobicContact CG-CD2 3.95Å; R310-L322 HydrophobicContact CG-CG 4.11Å; R310-L322 VanDerWaalsContact CZ-O 3.22Å; R310-L322 PolarHBondContact NE-O 3.26Å; R310-L322 PolarHBondContact NH2-O 3.01Å; I313-L322 HydrophobicContact CB-CD2 4.09Å; I313-L322 HydrophobicContact CD1-CD2 4.41Å; I313-L322 HydrophobicContact CG2-CD2 3.63Å; I314-L322 HydrophobicContact CD1-CB 4.05Å; I314-L322 HydrophobicContact CG1-CB 3.84Å; L319-L322 HydrophobicContact CD1-CB 4.06Å; L319-L322 HydrophobicContact CD1-CD2 4.43Å; L322-L337 HydrophobicContact CD2-CD2 3.92Å; L322-L356 WeakPolarHBondContact CA-O 3.19Å; L322-L356 HydrophobicContact CD1-CB 4.02Å; L322-L356 HydrophobicContact CD1-CD2 3.96Å; L322-L356 HydrophobicContact CD1-CG 4.01Å; L322-L358 HydrophobicContact CD1-CD1 4.3Å; L322-L358 HydrophobicContact CD1-CG 4.05Å
323	T	91.8	Very high	86.3	Confident	33 Å²	33	61.3 Å²	61.3	20%	0.202	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	167.7	177.8	47.6	0	0	0	0	110.5	V321 L356 H357 L358	V321-T323 HydrophobicContact CG1-CG2 3.72Å; T323-L356 PolarHBondContact N-O 3.4Å; T323-L356 PolarHBondContact OG1-O 3.21Å; T323-L356 VanDerWaalsContact OG1-O 3.05Å; T323-H357 CarbonylContact O-C 3.34Å; T323-H357 VanDerWaalsContact O-CA 3.29Å; T323-H357 WeakPolarHBondContact O-CA 3.23Å; T323-H357 PolarHBondContact OG1-ND1 2.99Å; T323-L358 PolarHBondContact O-N 2.99Å
324	F	89.4	Confident	86.2	Confident	67 Å²	67	62 Å²	62	29%	0.294	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	161.9	177.5	44	-102.9	0	0	0	109.4	V306 L333 L358	V306-F324 HydrophobicContact CG1-CE1 3.61Å; V306-F324 HydrophobicContact CG1-CE2 4.22Å; V306-F324 HydrophobicContact CG1-CZ 3.38Å; F324-L333 HydrophobicContact CB-CD1 3.79Å; F324-L333 HydrophobicContact CB-CD2 4.21Å; F324-L333 HydrophobicContact CD1-CD1 4.07Å; F324-L333 HydrophobicContact CD1-CD2 4.05Å; F324-L333 HydrophobicContact CD2-CD2 3.54Å; F324-L333 HydrophobicContact CE1-CD2 4.31Å; F324-L333 HydrophobicContact CE2-CD2 3.84Å; F324-L333 HydrophobicContact CG-CD1 3.92Å; F324-L333 HydrophobicContact CG-CD2 3.66Å; F324-L333 HydrophobicContact CG-CG 4.46Å; F324-L333 HydrophobicContact CZ-CD2 4.22Å; F324-L358 VanDerWaalsContact CA-O 3.26Å; F324-L358 WeakPolarHBondContact CA-O 3.5Å; F324-L358 HydrophobicContact CB-CB 4.08Å; F324-L358 WeakPolarHBondContact CB-O 3.2Å
325	D	82.7	Confident	86.1	Confident	81 Å²	81	61.8 Å²	61.8	43%	0.433	35%	0.346	S	S	.	.			trans	-84.5	149.8	177.1	-80.8	-18.2	0	0	0	113.1	S327 H357 L358 A359	D325-S327 PolarHBondContact O-N 3.43Å; D325-H357 IonicContact OD1-CE1 2.92Å; D325-H357 PolarHBondContact OD1-CE1 3.48Å; D325-H357 IonicContact OD1-NE2 3.83Å; D325-H357 PolarHBondContact OD1-NE2 2.82Å; D325-L358 PolarHBondContact N-O 2.73Å; D325-A359 HydrophobicContact CB-CB 4.37Å; D325-A359 VanDerWaalsContact OD2-CB 3.31Å; D325-A359 WeakPolarHBondContact OD2-CB 3.44Å
326	D	70.6	Confident	86	Confident	167 Å²	167	56.9 Å²	56.9	89%	0.893	32%	0.32	S	S	*	.			trans	-80.3	54.1	172.7	-164.4	12.7	0	0	0	111.2	G328	D326-G328 PolarHBondContact O-N 3.03Å
327	S	64.3	Low	86.1	Confident	76 Å²	76	52.8 Å²	52.8	53%	0.531	30%	0.302	S	S	.	.			trans	-79	4.3	-174	61.5	0	0	0	0	114.3	D325 N329	D325-S327 PolarHBondContact O-N 3.43Å; S327-N329 PolarHBondContact O-N 3.38Å
328	G	69.6	Low	86.3	Confident	57 Å²	57	58.9 Å²	58.9	59%	0.588	33%	0.325	S	S	*	.	S	Bend	trans	71.8	-17.7	-175.2	0	0	0	0	0	115.6	D326 L330	D326-G328 PolarHBondContact O-N 3.03Å; G328-L330 VanDerWaalsContact C-N 3.26Å; G328-L330 PolarHBondContact O-N 3.41Å
329	N	82.2	Confident	86.3	Confident	86 Å²	86	59.9 Å²	59.9	46%	0.46	32%	0.319	S	S	.	.			trans	-81.2	68.4	177.9	-170.8	-0.8	0	0	0	112	S327 D331 G332 L333	S327-N329 PolarHBondContact O-N 3.38Å; N329-D331 VanDerWaalsContact C-N 3.35Å; N329-G332 WeakPolarHBondContact OD1-CA 3.35Å; N329-G332 PolarHBondContact OD1-N 2.85Å; N329-L333 PolarHBondContact O-N 2.71Å; N329-L333 VanDerWaalsContact O-N 3.11Å
330	L	85.9	Confident	86.1	Confident	32 Å²	32	60 Å²	60	17%	0.168	32%	0.319	C	S	.	.	H	α-helix	trans	-67.8	-34.1	-176.4	-167.8	56.3	0	0	0	112.5	F299 A302 I303 V306 G328 L333 I334	F299-L330 HydrophobicContact CD2-CD2 3.73Å; F299-L330 HydrophobicContact CE2-CD2 3.94Å; A302-L330 HydrophobicContact CB-CD2 3.36Å; A302-L330 HydrophobicContact CB-CG 3.9Å; I303-L330 HydrophobicContact CG1-CD2 4.43Å; V306-L330 HydrophobicContact CG2-CD1 3.73Å; G328-L330 VanDerWaalsContact C-N 3.26Å; G328-L330 PolarHBondContact O-N 3.41Å; L330-L333 HydrophobicContact CD1-CD2 4.33Å; L330-L333 PolarHBondContact O-N 2.78Å; L330-I334 HydrophobicContact CG-CD1 4.35Å; L330-I334 WeakPolarHBondContact O-CG1 3.4Å; L330-I334 PolarHBondContact O-N 3.47Å
331	D	86.8	Confident	86	Confident	128 Å²	128	53.9 Å²	53.9	68%	0.684	30%	0.3	S	S	*	.	H	α-helix	trans	-68.1	-44.2	177.4	-60.6	-52.8	0	0	0	111.9	N329 L333 I334 A335	N329-D331 VanDerWaalsContact C-N 3.35Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.03Å; D331-I334 PolarHBondContact O-N 3.06Å; D331-A335 WeakPolarHBondContact O-CB 3.39Å; D331-A335 PolarHBondContact O-N 3.13Å
332	G	87.9	Confident	85.9	Confident	18 Å²	18	57.1 Å²	57.1	19%	0.186	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-40.5	173	0	0	0	0	0	112.1	N329 A335 S336	N329-G332 WeakPolarHBondContact OD1-CA 3.35Å; N329-G332 PolarHBondContact OD1-N 2.85Å; G332-A335 PolarHBondContact O-N 2.8Å; G332-S336 VanDerWaalsContact O-CB 3.26Å; G332-S336 WeakPolarHBondContact O-CB 3.49Å; G332-S336 PolarHBondContact O-N 3.27Å
333	L	90.8	Very high	85.5	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-45.5	173.6	178.8	62.7	0	0	0	112.3	V306 F324 N329 L330 D331 A335 S336 L337 L358 L375	V306-L333 HydrophobicContact CG1-CD2 4.11Å; V306-L333 HydrophobicContact CG2-CD2 4.21Å; V306-L333 HydrophobicContact CG2-CG 4.42Å; F324-L333 HydrophobicContact CB-CD1 3.79Å; F324-L333 HydrophobicContact CB-CD2 4.21Å; F324-L333 HydrophobicContact CD1-CD1 4.07Å; F324-L333 HydrophobicContact CD1-CD2 4.05Å; F324-L333 HydrophobicContact CD2-CD2 3.54Å; F324-L333 HydrophobicContact CE1-CD2 4.31Å; F324-L333 HydrophobicContact CE2-CD2 3.84Å; F324-L333 HydrophobicContact CG-CD1 3.92Å; F324-L333 HydrophobicContact CG-CD2 3.66Å; F324-L333 HydrophobicContact CG-CG 4.46Å; F324-L333 HydrophobicContact CZ-CD2 4.22Å; N329-L333 PolarHBondContact O-N 2.71Å; N329-L333 VanDerWaalsContact O-N 3.11Å; L330-L333 HydrophobicContact CD1-CD2 4.33Å; L330-L333 PolarHBondContact O-N 2.78Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.03Å; L333-A335 PolarHBondContact O-N 3.01Å; L333-S336 WeakPolarHBondContact O-CB 3.37Å; L333-S336 PolarHBondContact O-N 3.43Å; L333-L337 HydrophobicContact CD1-CD1 3.99Å; L333-L337 HydrophobicContact CD1-CG 4.09Å; L333-L337 HydrophobicContact CG-CD1 3.89Å; L333-L337 HydrophobicContact CG-CG 4.41Å; L333-L337 WeakPolarHBondContact O-CB 3.48Å; L333-L337 VanDerWaalsContact O-CG 3.23Å; L333-L337 WeakPolarHBondContact O-CG 3.43Å; L333-L337 PolarHBondContact O-N 2.98Å; L333-L358 HydrophobicContact CD1-CB 4.27Å; L333-L358 HydrophobicContact CD1-CD1 3.88Å; L333-L375 HydrophobicContact CB-CD2 4.29Å; L333-L375 HydrophobicContact CD1-CD2 3.87Å
334	I	91.5	Very high	85.1	Confident	13 Å²	13	60.4 Å²	60.4	7%	0.067	34%	0.341	C	S	.	.	H	α-helix	trans	-61.7	-45	176.6	-72.9	169.2	0	0	0	110.7	A302 V306 L309 L330 D331 S336 L337 R338	A302-I334 HydrophobicContact CB-CD1 3.73Å; V306-I334 HydrophobicContact CG2-CD1 4.1Å; V306-I334 HydrophobicContact CG2-CG1 3.45Å; V306-I334 VanDerWaalsContact CG2-CG1 3.45Å; L309-I334 HydrophobicContact CD1-CG2 4.31Å; L330-I334 HydrophobicContact CG-CD1 4.35Å; L330-I334 WeakPolarHBondContact O-CG1 3.4Å; L330-I334 PolarHBondContact O-N 3.47Å; D331-I334 PolarHBondContact O-N 3.06Å; I334-S336 VanDerWaalsContact C-N 3.34Å; I334-S336 PolarHBondContact O-N 3.47Å; I334-L337 PolarHBondContact O-N 3.39Å; I334-R338 HydrophobicContact CG2-CG 4.38Å; I334-R338 WeakPolarHBondContact O-CB 3.39Å; I334-R338 VanDerWaalsContact O-CG 3.31Å; I334-R338 WeakPolarHBondContact O-CG 3.48Å; I334-R338 PolarHBondContact O-N 3.4Å
335	A	90.7	Very high	84.7	Confident	42 Å²	42	62.1 Å²	62.1	35%	0.347	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-44.4	175.7	0	0	0	0	0	111.8	D331 G332 L333 R338 R339	D331-A335 WeakPolarHBondContact O-CB 3.39Å; D331-A335 PolarHBondContact O-N 3.13Å; G332-A335 PolarHBondContact O-N 2.8Å; L333-A335 PolarHBondContact O-N 3.01Å; A335-R338 PolarHBondContact O-N 2.85Å; A335-R339 WeakPolarHBondContact O-CG 3.46Å; A335-R339 PolarHBondContact O-N 3.17Å; A335-R339 PolarHBondContact O-NH1 3.18Å
336	S	89.8	Confident	84.7	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-48.7	176.3	-163.9	0	0	0	0	112.1	G332 L333 I334 R339 F340 L375 W377	G332-S336 VanDerWaalsContact O-CB 3.26Å; G332-S336 WeakPolarHBondContact O-CB 3.49Å; G332-S336 PolarHBondContact O-N 3.27Å; L333-S336 WeakPolarHBondContact O-CB 3.37Å; L333-S336 PolarHBondContact O-N 3.43Å; I334-S336 VanDerWaalsContact C-N 3.34Å; I334-S336 PolarHBondContact O-N 3.47Å; S336-R339 PolarHBondContact O-N 3.4Å; S336-F340 PolarHBondContact O-N 3.46Å; S336-L375 VanDerWaalsContact CB-O 3.22Å; S336-L375 WeakPolarHBondContact CB-O 3.38Å; S336-L375 PolarHBondContact OG-O 2.79Å; S336-W377 PolarHBondContact OG-NE1 2.96Å
337	L	92.4	Very high	85.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-39.9	177.7	-68.2	168.1	0	0	0	111.9	V306 L309 I313 L322 L333 I334 F340 L341 L358	V306-L337 HydrophobicContact CB-CD1 4.29Å; V306-L337 HydrophobicContact CG1-CD1 3.9Å; V306-L337 HydrophobicContact CG2-CD1 4.09Å; L309-L337 HydrophobicContact CB-CB 4.05Å; L309-L337 HydrophobicContact CB-CD1 4.35Å; L309-L337 HydrophobicContact CD1-CB 3.87Å; I313-L337 HydrophobicContact CD1-CB 3.81Å; I313-L337 HydrophobicContact CD1-CD2 3.53Å; I313-L337 HydrophobicContact CD1-CG 4.27Å; I313-L337 WeakPolarHBondContact CD1-O 3.39Å; L322-L337 HydrophobicContact CD2-CD2 3.92Å; L333-L337 HydrophobicContact CD1-CD1 3.99Å; L333-L337 HydrophobicContact CD1-CG 4.09Å; L333-L337 HydrophobicContact CG-CD1 3.89Å; L333-L337 HydrophobicContact CG-CG 4.41Å; L333-L337 WeakPolarHBondContact O-CB 3.48Å; L333-L337 VanDerWaalsContact O-CG 3.23Å; L333-L337 WeakPolarHBondContact O-CG 3.43Å; L333-L337 PolarHBondContact O-N 2.98Å; I334-L337 PolarHBondContact O-N 3.39Å; L337-F340 WeakPolarHBondContact O-CB 3.19Å; L337-F340 PolarHBondContact O-N 3.26Å; L337-L341 PolarHBondContact O-N 3.24Å; L337-L358 HydrophobicContact CD2-CD1 3.6Å; L337-L358 HydrophobicContact CG-CD1 4.12Å
338	R	92.9	Very high	86.1	Confident	130 Å²	130	59.3 Å²	59.3	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-44.6	175.1	-73.8	177.3	-178.1	-179.6	5	111.8	E305 L309 I334 A335 F340 L341 C342	E305-R338 VanDerWaalsContact CD-NH2 3.26Å; E305-R338 IonicContact OE1-CZ 2.62Å; E305-R338 IonicContact OE1-NE 3.47Å; E305-R338 PolarHBondContact OE1-NE 2.98Å; E305-R338 IonicContact OE1-NH2 2.8Å; E305-R338 PolarHBondContact OE1-NH2 2.83Å; E305-R338 IonicContact OE2-NH2 2.68Å; E305-R338 PolarHBondContact OE2-NH2 3.2Å; L309-R338 HydrophobicContact CD1-CG 3.88Å; L309-R338 HydrophobicContact CD2-CG 4.34Å; I334-R338 HydrophobicContact CG2-CG 4.38Å; I334-R338 WeakPolarHBondContact O-CB 3.39Å; I334-R338 VanDerWaalsContact O-CG 3.31Å; I334-R338 WeakPolarHBondContact O-CG 3.48Å; I334-R338 PolarHBondContact O-N 3.4Å; A335-R338 PolarHBondContact O-N 2.85Å; R338-F340 PolarHBondContact O-N 3.06Å; R338-L341 PolarHBondContact O-N 3.17Å; R338-C342 PolarHBondContact O-N 3.06Å; R338-C342 PolarHBondContact O-SG 3.44Å
339	R	89.4	Confident	86.6	Confident	84 Å²	84	61.5 Å²	61.5	32%	0.317	31%	0.313	S	S	.	.	H	α-helix	trans	-57.2	-40.6	172.3	-69	-163	-55.2	-73.3	4.1	111.2	A335 S336 L341 C342 A343 L375 W377	A335-R339 WeakPolarHBondContact O-CG 3.46Å; A335-R339 PolarHBondContact O-N 3.17Å; A335-R339 PolarHBondContact O-NH1 3.18Å; S336-R339 PolarHBondContact O-N 3.4Å; R339-L341 PolarHBondContact O-N 2.97Å; R339-C342 CarbonylContact O-C 3.37Å; R339-C342 PolarHBondContact O-N 2.88Å; R339-C342 VanDerWaalsContact O-N 3.14Å; R339-A343 PolarHBondContact O-N 3.47Å; R339-A343 VanDerWaalsContact O-N 3.08Å; R339-L375 PolarHBondContact NH2-O 2.76Å; R339-W377 HydrophobicContact CB-CH2 3.84Å; R339-W377 HydrophobicContact CB-CZ2 3.53Å; R339-W377 VanDerWaalsContact CZ-O 3.25Å; R339-W377 PolarHBondContact NE-O 2.96Å; R339-W377 PolarHBondContact NH2-O 3.04Å
340	F	87.2	Confident	86.8	Confident	11 Å²	11	62.2 Å²	62.2	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-70	-34.4	-177.3	-148.2	-83.3	0	0	0	112.7	I313 H317 S336 L337 R338 C342 A343 L351 L356 W377	I313-F340 HydrophobicContact CD1-CB 4.18Å; I313-F340 HydrophobicContact CG1-CD1 4.42Å; I313-F340 HydrophobicContact CG2-CD1 3.48Å; I313-F340 VanDerWaalsContact CG2-CD1 3.48Å; I313-F340 HydrophobicContact CG2-CE1 3.83Å; I313-F340 HydrophobicContact CG2-CG 4.43Å; H317-F340 AromaticContact CD2-CD1 3.75Å; H317-F340 AromaticContact CD2-CE1 3.76Å; H317-F340 AromaticContact NE2-CD1 3.66Å; H317-F340 AromaticContact NE2-CE1 3.89Å; H317-F340 PolarHBondContact NE2-O 2.98Å; S336-F340 PolarHBondContact O-N 3.46Å; L337-F340 WeakPolarHBondContact O-CB 3.19Å; L337-F340 PolarHBondContact O-N 3.26Å; R338-F340 PolarHBondContact O-N 3.06Å; F340-C342 VanDerWaalsContact C-N 3.28Å; F340-C342 PolarHBondContact O-N 3.06Å; F340-A343 VanDerWaalsContact O-CB 3.29Å; F340-A343 WeakPolarHBondContact O-CB 3.46Å; F340-A343 PolarHBondContact O-N 3.19Å; F340-L351 HydrophobicContact CE1-CD1 3.76Å; F340-L351 HydrophobicContact CE2-CD1 4.36Å; F340-L351 HydrophobicContact CZ-CD1 3.32Å; F340-L356 HydrophobicContact CD2-CD2 4.49Å; F340-L356 HydrophobicContact CE1-CD2 4Å; F340-L356 HydrophobicContact CE2-CD2 3.57Å; F340-L356 HydrophobicContact CZ-CD2 3.25Å; F340-W377 HydrophobicContact CB-CZ2 3.81Å; F340-W377 AromaticContact CD2-CE2 3.95Å; F340-W377 HydrophobicContact CD2-CH2 4.14Å; F340-W377 AromaticContact CD2-CZ2 3.52Å; F340-W377 HydrophobicContact CD2-CZ2 3.52Å; F340-W377 HydrophobicContact CG-CZ2 4.09Å
341	L	88.1	Confident	86.7	Confident	55 Å²	55	61.8 Å²	61.8	29%	0.288	32%	0.321	S	S	.	.	H	α-helix	trans	-66.6	-32.6	173	-172.1	62.6	0	0	0	111.6	L309 H312 I313 K316 L337 R338 R339	L309-L341 HydrophobicContact CD2-CD2 3.87Å; H312-L341 HydrophobicContact CB-CD1 3.89Å; I313-L341 HydrophobicContact CG1-CB 4.21Å; I313-L341 HydrophobicContact CG1-CD1 4.27Å; K316-L341 HydrophobicContact CD-CD1 4.31Å; K316-L341 PolarHBondContact NZ-O 3.33Å; L337-L341 PolarHBondContact O-N 3.24Å; R338-L341 PolarHBondContact O-N 3.17Å; R339-L341 PolarHBondContact O-N 2.97Å
342	C	87.5	Confident	86.7	Confident	109 Å²	109	62.8 Å²	62.8	74%	0.736	32%	0.319	S	S	*	.	H	α-helix	trans	-82.2	-7.2	175	-64.1	0	0	0	0	114.7	R338 R339 F340	R338-C342 PolarHBondContact O-N 3.06Å; R338-C342 PolarHBondContact O-SG 3.44Å; R339-C342 CarbonylContact O-C 3.37Å; R339-C342 PolarHBondContact O-N 2.88Å; R339-C342 VanDerWaalsContact O-N 3.14Å; F340-C342 VanDerWaalsContact C-N 3.28Å; F340-C342 PolarHBondContact O-N 3.06Å
343	A	83.3	Confident	86.6	Confident	10 Å²	10	64 Å²	64	8%	0.083	33%	0.332	C	S	.	.			trans	-59	144.7	-177.6	0	0	0	0	0	113.3	K316 R339 F340 I347	K316-A343 PolarHBondContact NZ-O 2.89Å; R339-A343 PolarHBondContact O-N 3.47Å; R339-A343 VanDerWaalsContact O-N 3.08Å; F340-A343 VanDerWaalsContact O-CB 3.29Å; F340-A343 WeakPolarHBondContact O-CB 3.46Å; F340-A343 PolarHBondContact O-N 3.19Å; A343-I347 HydrophobicContact CB-CB 4.31Å; A343-I347 HydrophobicContact CB-CD1 3.94Å; A343-I347 HydrophobicContact CB-CG2 4.18Å
344	D	83.2	Confident	86.6	Confident	95 Å²	95	67.6 Å²	67.6	51%	0.508	35%	0.348	S	S	.	.			trans	-65.2	156.9	-178	-176.2	29.7	0	0	0	112.9	R346 I347	D344-R346 PolarHBondContact O-N 3.46Å; D344-R346 IonicContact OD2-NE 3.03Å; D344-I347 WeakPolarHBondContact O-CB 3.3Å; D344-I347 PolarHBondContact O-N 2.89Å
345	Q	81.9	Confident	86.6	Confident	103 Å²	103	70.5 Å²	70.5	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-59.6	-30.8	-175	-176	56.4	32	0	0	113.2	I347 S348 D349	Q345-I347 PolarHBondContact O-N 3.43Å; Q345-S348 WeakPolarHBondContact O-CA 3.38Å; Q345-S348 WeakPolarHBondContact O-CB 3.41Å; Q345-S348 PolarHBondContact O-N 3.27Å; Q345-S348 PolarHBondContact O-OG 3.01Å; Q345-S348 PolarHBondContact OE1-OG 3.28Å; Q345-D349 PolarHBondContact NE2-OD1 3.4Å; Q345-D349 PolarHBondContact O-N 3.06Å
346	R	83	Confident	86.6	Confident	193 Å²	193	68.6 Å²	68.6	73%	0.728	34%	0.342	S	S	*	.	H	α-helix	trans	-56.7	-33.7	174.5	-59.7	176.9	-174	-172.8	2.3	112.5	D344 C350	D344-R346 PolarHBondContact O-N 3.46Å; D344-R346 IonicContact OD2-NE 3.03Å; R346-C350 PolarHBondContact O-N 3.45Å; R346-C350 PolarHBondContact O-SG 2.83Å; R346-C350 VanDerWaalsContact O-SG 3.38Å
347	I	81	Confident	86.6	Confident	66 Å²	66	69.1 Å²	69.1	34%	0.338	35%	0.345	S	S	.	.	H	α-helix	trans	-74.3	-40.2	177.4	-67.6	167.2	0	0	0	109.7	A343 D344 Q345 D349 C350 L351	A343-I347 HydrophobicContact CB-CB 4.31Å; A343-I347 HydrophobicContact CB-CD1 3.94Å; A343-I347 HydrophobicContact CB-CG2 4.18Å; D344-I347 WeakPolarHBondContact O-CB 3.3Å; D344-I347 PolarHBondContact O-N 2.89Å; Q345-I347 PolarHBondContact O-N 3.43Å; I347-D349 VanDerWaalsContact C-N 3.29Å; I347-D349 PolarHBondContact O-N 3.42Å; I347-C350 PolarHBondContact O-N 3.24Å; I347-L351 HydrophobicContact CG2-CD1 3.45Å; I347-L351 VanDerWaalsContact CG2-CD1 3.45Å; I347-L351 HydrophobicContact CG2-CG 4.23Å; I347-L351 WeakPolarHBondContact O-CB 3.27Å; I347-L351 WeakPolarHBondContact O-CD1 3.48Å; I347-L351 WeakPolarHBondContact O-CG 3.25Å; I347-L351 PolarHBondContact O-N 2.72Å; I347-L351 VanDerWaalsContact O-N 3.08Å
348	S	82	Confident	86.4	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-55	-44.4	172.7	-42.7	0	0	0	0	112.1	H317 Q345 L351 K352	H317-S348 VanDerWaalsContact ND1-CA 3.28Å; H317-S348 WeakPolarHBondContact ND1-CA 3.4Å; H317-S348 PolarHBondContact ND1-OG 2.68Å; Q345-S348 WeakPolarHBondContact O-CA 3.38Å; Q345-S348 WeakPolarHBondContact O-CB 3.41Å; Q345-S348 PolarHBondContact O-N 3.27Å; Q345-S348 PolarHBondContact O-OG 3.01Å; Q345-S348 PolarHBondContact OE1-OG 3.28Å; S348-L351 PolarHBondContact O-N 3.46Å; S348-K352 PolarHBondContact O-N 2.86Å; S348-K352 VanDerWaalsContact O-N 3.14Å
349	D	82	Confident	86.1	Confident	103 Å²	103	63.2 Å²	63.2	55%	0.551	32%	0.323	S	S	*	.	H	α-helix	trans	-68.2	-42.3	-176.5	-60.5	-24.6	0	0	0	111.7	Q345 I347 L351	Q345-D349 PolarHBondContact NE2-OD1 3.4Å; Q345-D349 PolarHBondContact O-N 3.06Å; I347-D349 VanDerWaalsContact C-N 3.29Å; I347-D349 PolarHBondContact O-N 3.42Å; D349-L351 VanDerWaalsContact C-N 3.31Å; D349-L351 PolarHBondContact O-N 2.88Å
350	C	84.8	Confident	85.4	Confident	101 Å²	101	61.8 Å²	61.8	68%	0.682	34%	0.335	S	S	*	.	H	α-helix	trans	-66.1	-29.3	175.5	-71.5	0	0	0	0	113.8	R346 I347	R346-C350 PolarHBondContact O-N 3.45Å; R346-C350 PolarHBondContact O-SG 2.83Å; R346-C350 VanDerWaalsContact O-SG 3.38Å; I347-C350 PolarHBondContact O-N 3.24Å
351	L	83.9	Confident	85	Confident	22 Å²	22	66.5 Å²	66.5	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-97.1	-7.4	-173.4	-68.8	175.5	0	0	0	114.8	L319 F340 I347 S348 D349 G353 Q354	L319-L351 HydrophobicContact CD2-CB 3.8Å; L319-L351 HydrophobicContact CD2-CD1 4.49Å; L319-L351 WeakPolarHBondContact CD2-O 3.49Å; F340-L351 HydrophobicContact CE1-CD1 3.76Å; F340-L351 HydrophobicContact CE2-CD1 4.36Å; F340-L351 HydrophobicContact CZ-CD1 3.32Å; I347-L351 HydrophobicContact CG2-CD1 3.45Å; I347-L351 VanDerWaalsContact CG2-CD1 3.45Å; I347-L351 HydrophobicContact CG2-CG 4.23Å; I347-L351 WeakPolarHBondContact O-CB 3.27Å; I347-L351 WeakPolarHBondContact O-CD1 3.48Å; I347-L351 WeakPolarHBondContact O-CG 3.25Å; I347-L351 PolarHBondContact O-N 2.72Å; I347-L351 VanDerWaalsContact O-N 3.08Å; S348-L351 PolarHBondContact O-N 3.46Å; D349-L351 VanDerWaalsContact C-N 3.31Å; D349-L351 PolarHBondContact O-N 2.88Å; L351-G353 PolarHBondContact O-N 3.1Å; L351-G353 VanDerWaalsContact O-N 3.15Å; L351-Q354 VanDerWaalsContact O-CB 3.23Å; L351-Q354 WeakPolarHBondContact O-CB 3.24Å; L351-Q354 WeakPolarHBondContact O-CG 3.19Å; L351-Q354 PolarHBondContact O-N 3.3Å
352	K	87.4	Confident	84.6	Confident	150 Å²	150	66.5 Å²	66.5	65%	0.652	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	120.9	-179.6	-174.7	169.5	-175.1	175.4	0	111.5	S348 Q354	S348-K352 PolarHBondContact O-N 2.86Å; S348-K352 VanDerWaalsContact O-N 3.14Å; K352-Q354 VanDerWaalsContact C-N 3.27Å; K352-Q354 PolarHBondContact O-N 3.23Å
353	G	86.7	Confident	84.5	Confident	44 Å²	44	68.3 Å²	68.3	45%	0.454	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	-1.1	-178.6	0	0	0	0	0	115.9	S318 R320 L351	S318-G353 PolarHBondContact O-N 3.27Å; R320-G353 VanDerWaalsContact CB-O 3.26Å; R320-G353 WeakPolarHBondContact CB-O 3.36Å; L351-G353 PolarHBondContact O-N 3.1Å; L351-G353 VanDerWaalsContact O-N 3.15Å
354	Q	89.9	Confident	84.6	Confident	82 Å²	82	70.2 Å²	70.2	38%	0.383	38%	0.382	S	S	.	.			trans	-74.9	162.9	-179.2	-60.1	-61.3	-13.2	0	0	112.9	R320 L351 K352 I371	R320-Q354 PolarHBondContact N-O 3.48Å; L351-Q354 VanDerWaalsContact O-CB 3.23Å; L351-Q354 WeakPolarHBondContact O-CB 3.24Å; L351-Q354 WeakPolarHBondContact O-CG 3.19Å; L351-Q354 PolarHBondContact O-N 3.3Å; K352-Q354 VanDerWaalsContact C-N 3.27Å; K352-Q354 PolarHBondContact O-N 3.23Å; Q354-I371 HydrophobicContact CB-CD1 4.17Å; Q354-I371 HydrophobicContact CG-CD1 4.23Å
355	R	91.6	Very high	84.7	Confident	74 Å²	74	72 Å²	72	28%	0.279	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.6	173.6	-61.4	162.4	61.6	101.1	-5.7	108.3	R320 V321 D368 R370 I371	R320-R355 HydrophobicContact CB-CG 4.44Å; V321-R355 HydrophobicContact CB-CB 4.41Å; V321-R355 HydrophobicContact CB-CG 4.34Å; V321-R355 HydrophobicContact CG2-CG 4.46Å; R355-D368 IonicContact CZ-OD2 2.71Å; R355-D368 PolarHBondContact NE-O 3.31Å; R355-D368 IonicContact NE-OD2 3.55Å; R355-D368 IonicContact NH2-OD2 3.91Å; R355-D368 PolarHBondContact NH2-OD2 3.17Å; R355-R370 HydrophobicContact CB-CG 3.62Å; R355-R370 CarbonylContact O-C 3.58Å; R355-R370 WeakPolarHBondContact O-CA 3.36Å; R355-I371 PolarHBondContact O-N 3.42Å
356	L	90.2	Very high	84.5	Confident	2 Å²	2	69 Å²	69	1%	0.01	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.2	-175.2	-169.3	62.6	0	0	0	111.9	L319 V321 L322 T323 F340 L358 I371 V373	L319-L356 HydrophobicContact CD1-CB 4.39Å; L319-L356 HydrophobicContact CD1-CD2 4.27Å; V321-L356 PolarHBondContact O-N 2.62Å; L322-L356 WeakPolarHBondContact CA-O 3.19Å; L322-L356 HydrophobicContact CD1-CB 4.02Å; L322-L356 HydrophobicContact CD1-CD2 3.96Å; L322-L356 HydrophobicContact CD1-CG 4.01Å; T323-L356 PolarHBondContact N-O 3.4Å; T323-L356 PolarHBondContact OG1-O 3.21Å; T323-L356 VanDerWaalsContact OG1-O 3.05Å; F340-L356 HydrophobicContact CD2-CD2 4.49Å; F340-L356 HydrophobicContact CE1-CD2 4Å; F340-L356 HydrophobicContact CE2-CD2 3.57Å; F340-L356 HydrophobicContact CZ-CD2 3.25Å; L356-L358 HydrophobicContact CD2-CD2 4.23Å; L356-L358 HydrophobicContact CG-CD2 4.26Å; L356-I371 HydrophobicContact CD1-CB 4.16Å; L356-I371 HydrophobicContact CD1-CG2 4.31Å; L356-V373 HydrophobicContact CD1-CB 4.28Å; L356-V373 HydrophobicContact CD1-CG2 3.63Å
357	H	90.5	Very high	84.2	Confident	12 Å²	12	71.4 Å²	71.4	6%	0.056	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	118.2	176.9	-168.7	46.3	0	0	0	110.1	T323 D325 R370 I371 M372 V373	T323-H357 CarbonylContact O-C 3.34Å; T323-H357 VanDerWaalsContact O-CA 3.29Å; T323-H357 WeakPolarHBondContact O-CA 3.23Å; T323-H357 PolarHBondContact OG1-ND1 2.99Å; D325-H357 IonicContact OD1-CE1 2.92Å; D325-H357 PolarHBondContact OD1-CE1 3.48Å; D325-H357 IonicContact OD1-NE2 3.83Å; D325-H357 PolarHBondContact OD1-NE2 2.82Å; H357-R370 HydrophobicContact CB-CB 4.32Å; H357-I371 PolarHBondContact N-O 3.49Å; H357-M372 CarbonylContact O-C 3.57Å; H357-M372 VanDerWaalsContact O-CA 3.32Å; H357-M372 WeakPolarHBondContact O-CA 3.44Å; H357-V373 PolarHBondContact O-N 3.3Å
358	L	88.8	Confident	84.3	Confident	2 Å²	2	70 Å²	70	1%	0.01	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	102.4	177	-52.3	-179.4	0	0	0	109.3	L322 T323 F324 D325 L333 L337 L356 V373 L375	L322-L358 HydrophobicContact CD1-CD1 4.3Å; L322-L358 HydrophobicContact CD1-CG 4.05Å; T323-L358 PolarHBondContact O-N 2.99Å; F324-L358 VanDerWaalsContact CA-O 3.26Å; F324-L358 WeakPolarHBondContact CA-O 3.5Å; F324-L358 HydrophobicContact CB-CB 4.08Å; F324-L358 WeakPolarHBondContact CB-O 3.2Å; D325-L358 PolarHBondContact N-O 2.73Å; L333-L358 HydrophobicContact CD1-CB 4.27Å; L333-L358 HydrophobicContact CD1-CD1 3.88Å; L337-L358 HydrophobicContact CD2-CD1 3.6Å; L337-L358 HydrophobicContact CG-CD1 4.12Å; L356-L358 HydrophobicContact CD2-CD2 4.23Å; L356-L358 HydrophobicContact CG-CD2 4.26Å; L358-V373 WeakPolarHBondContact CA-O 3.36Å; L358-V373 HydrophobicContact CD2-CB 3.96Å; L358-V373 HydrophobicContact CD2-CG1 4.16Å; L358-L375 HydrophobicContact CB-CD2 3.93Å
359	A	85.2	Confident	84.3	Confident	3 Å²	3	71.7 Å²	71.7	3%	0.025	40%	0.398	C	S	.	.			trans	-164.8	159.2	-169.7	0	0	0	0	0	111.8	D325 M372 V373	D325-A359 HydrophobicContact CB-CB 4.37Å; D325-A359 VanDerWaalsContact OD2-CB 3.31Å; D325-A359 WeakPolarHBondContact OD2-CB 3.44Å; A359-M372 HydrophobicContact CB-SD 4.07Å; A359-V373 PolarHBondContact N-O 3.47Å
360	G	76.2	Confident	84.6	Confident	54 Å²	54	69.2 Å²	69.2	56%	0.557	38%	0.381	S	S	*	.	S	Bend	trans	65.1	-162.2	173.4	0	0	0	0	0	115
361	S	77.9	Confident	84.7	Confident	110 Å²	110	66.8 Å²	66.8	77%	0.769	36%	0.36	S	S	*	.	S	Bend	trans	-124.3	4.2	-175.6	57.5	0	0	0	0	114
362	A	79.3	Confident	84.8	Confident	56 Å²	56	67.3 Å²	67.3	46%	0.463	36%	0.363	S	S	.	.	S	Bend	trans	-142.4	143.9	178.5	0	0	0	0	0	112.6	S364	A362-S364 PolarHBondContact O-N 3.03Å
363	Y	85.8	Confident	84.8	Confident	147 Å²	147	60.9 Å²	60.9	58%	0.576	34%	0.336	S	S	*	.			trans	-64.5	127.5	169.6	-59.3	-85.3	0	0	0	110.2	M372 V373 P374 W377	Y363-M372 WeakPolarHBondContact CA-O 3.12Å; Y363-V373 HydrophobicContact CD1-CB 4.5Å; Y363-V373 HydrophobicContact CD1-CG2 4.07Å; Y363-V373 HydrophobicContact CE1-CB 4.41Å; Y363-V373 HydrophobicContact CE1-CG1 3.96Å; Y363-V373 HydrophobicContact CE1-CG2 4.15Å; Y363-P374 HydrophobicContact CD2-CG 4.44Å; Y363-P374 HydrophobicContact CE2-CG 4.41Å; Y363-W377 HydrophobicContact CE1-CB 4.4Å; Y363-W377 VanDerWaalsContact OH-CB 3.3Å; Y363-W377 WeakPolarHBondContact OH-CB 3.28Å
364	S	84.9	Confident	84.8	Confident	50 Å²	50	59 Å²	59	35%	0.35	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	171.9	-179.5	53.3	0	0	0	0	111.1	A362 M372	A362-S364 PolarHBondContact O-N 3.03Å; S364-M372 PolarHBondContact N-O 3.05Å; S364-M372 PolarHBondContact O-N 3.11Å; S364-M372 WeakPolarHBondContact OG-CB 3.25Å; S364-M372 VanDerWaalsContact OG-CE 3.25Å; S364-M372 WeakPolarHBondContact OG-CE 3.37Å
365	I	86.2	Confident	84.5	Confident	131 Å²	131	56.5 Å²	56.5	67%	0.672	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	124	174.6	-59.7	174.3	0	0	0	107.9	R370	I365-R370 WeakPolarHBondContact CA-O 3.45Å
366	L	76.6	Confident	84	Confident	42 Å²	42	58.7 Å²	58.7	22%	0.22	32%	0.322	C	S	.	.			trans	-72.1	154.6	173.3	-66	-178.8	0	0	0	110.9	D368 G369 R370 M372	L366-D368 WeakPolarHBondContact CB-OD1 3.31Å; L366-D368 PolarHBondContact O-N 3.03Å; L366-G369 PolarHBondContact O-N 2.94Å; L366-R370 HydrophobicContact CB-CB 4.19Å; L366-R370 HydrophobicContact CD1-CB 4.01Å; L366-R370 HydrophobicContact CG-CB 4.39Å; L366-R370 PolarHBondContact N-O 2.87Å; L366-M372 HydrophobicContact CD1-CG 4.05Å; L366-M372 HydrophobicContact CD1-SD 4.14Å; L366-M372 HydrophobicContact CD2-CE 4.31Å; L366-M372 HydrophobicContact CD2-CG 3.85Å; L366-M372 HydrophobicContact CD2-SD 3.71Å; L366-M372 HydrophobicContact CG-CG 3.6Å; L366-M372 HydrophobicContact CG-SD 4Å
367	W	76.5	Confident	83.5	Confident	243 Å²	243	60 Å²	60	92%	0.92	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-21.5	177.8	66.3	-94.1	0	0	0	114.2
368	D	82.8	Confident	82.4	Confident	37 Å²	37	70.3 Å²	70.3	20%	0.198	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	14.4	175.7	82.6	-61.1	0	0	0	114	R355 L366 R370	R355-D368 IonicContact CZ-OD2 2.71Å; R355-D368 PolarHBondContact NE-O 3.31Å; R355-D368 IonicContact NE-OD2 3.55Å; R355-D368 IonicContact NH2-OD2 3.91Å; R355-D368 PolarHBondContact NH2-OD2 3.17Å; L366-D368 WeakPolarHBondContact CB-OD1 3.31Å; L366-D368 PolarHBondContact O-N 3.03Å; D368-R370 VanDerWaalsContact C-N 3.31Å; D368-R370 VanDerWaalsContact CG-NE 3.31Å; D368-R370 PolarHBondContact O-N 3.45Å; D368-R370 IonicContact OD1-CZ 3.47Å; D368-R370 IonicContact OD1-NE 2.71Å; D368-R370 PolarHBondContact OD1-NE 2.67Å; D368-R370 IonicContact OD1-NH2 2.67Å; D368-R370 PolarHBondContact OD1-NH2 3.09Å; D368-R370 IonicContact OD2-CZ 2.76Å; D368-R370 IonicContact OD2-NE 3.7Å; D368-R370 PolarHBondContact OD2-NE 3.13Å; D368-R370 IonicContact OD2-NH2 3.92Å; D368-R370 PolarHBondContact OD2-NH2 2.93Å
369	G	82.9	Confident	82.1	Confident	40 Å²	40	73.8 Å²	73.8	41%	0.412	39%	0.394	S	S	.	.	S	Bend	trans	73.1	16.6	178.5	0	0	0	0	0	114.6	L366	L366-G369 PolarHBondContact O-N 2.94Å
370	R	87.8	Confident	81.9	Confident	52 Å²	52	77.5 Å²	77.5	20%	0.196	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-79.5	130.5	169.3	-90.2	178.1	-64.3	149.8	7.1	110.4	R355 H357 I365 L366 D368	R355-R370 HydrophobicContact CB-CG 3.62Å; R355-R370 CarbonylContact O-C 3.58Å; R355-R370 WeakPolarHBondContact O-CA 3.36Å; H357-R370 HydrophobicContact CB-CB 4.32Å; I365-R370 WeakPolarHBondContact CA-O 3.45Å; L366-R370 HydrophobicContact CB-CB 4.19Å; L366-R370 HydrophobicContact CD1-CB 4.01Å; L366-R370 HydrophobicContact CG-CB 4.39Å; L366-R370 PolarHBondContact N-O 2.87Å; D368-R370 VanDerWaalsContact C-N 3.31Å; D368-R370 VanDerWaalsContact CG-NE 3.31Å; D368-R370 PolarHBondContact O-N 3.45Å; D368-R370 IonicContact OD1-CZ 3.47Å; D368-R370 IonicContact OD1-NE 2.71Å; D368-R370 PolarHBondContact OD1-NE 2.67Å; D368-R370 IonicContact OD1-NH2 2.67Å; D368-R370 PolarHBondContact OD1-NH2 3.09Å; D368-R370 IonicContact OD2-CZ 2.76Å; D368-R370 IonicContact OD2-NE 3.7Å; D368-R370 PolarHBondContact OD2-NE 3.13Å; D368-R370 IonicContact OD2-NH2 3.92Å; D368-R370 PolarHBondContact OD2-NH2 2.93Å
371	I	88.3	Confident	82.3	Confident	49 Å²	49	78.8 Å²	78.8	25%	0.251	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	121.7	168	-53.6	173.6	0	0	0	107.1	Q354 R355 L356 H357 V373	Q354-I371 HydrophobicContact CB-CD1 4.17Å; Q354-I371 HydrophobicContact CG-CD1 4.23Å; R355-I371 PolarHBondContact O-N 3.42Å; L356-I371 HydrophobicContact CD1-CB 4.16Å; L356-I371 HydrophobicContact CD1-CG2 4.31Å; H357-I371 PolarHBondContact N-O 3.49Å; I371-V373 HydrophobicContact CG2-CG2 4.25Å
372	M	85.6	Confident	82.5	Confident	34 Å²	34	76.9 Å²	76.9	17%	0.167	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134.3	168.1	-63.9	-132.3	-63.1	0	0	110.2	H357 A359 Y363 S364 L366	H357-M372 CarbonylContact O-C 3.57Å; H357-M372 VanDerWaalsContact O-CA 3.32Å; H357-M372 WeakPolarHBondContact O-CA 3.44Å; A359-M372 HydrophobicContact CB-SD 4.07Å; Y363-M372 WeakPolarHBondContact CA-O 3.12Å; S364-M372 PolarHBondContact N-O 3.05Å; S364-M372 PolarHBondContact O-N 3.11Å; S364-M372 WeakPolarHBondContact OG-CB 3.25Å; S364-M372 VanDerWaalsContact OG-CE 3.25Å; S364-M372 WeakPolarHBondContact OG-CE 3.37Å; L366-M372 HydrophobicContact CD1-CG 4.05Å; L366-M372 HydrophobicContact CD1-SD 4.14Å; L366-M372 HydrophobicContact CD2-CE 4.31Å; L366-M372 HydrophobicContact CD2-CG 3.85Å; L366-M372 HydrophobicContact CD2-SD 3.71Å; L366-M372 HydrophobicContact CG-CG 3.6Å; L366-M372 HydrophobicContact CG-SD 4Å
373	V	87.2	Confident	82.7	Confident	15 Å²	15	78.3 Å²	78.3	9%	0.091	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.1	173.4	170.4	0	0	0	0	108.6	L356 H357 L358 A359 Y363 I371 W377	L356-V373 HydrophobicContact CD1-CB 4.28Å; L356-V373 HydrophobicContact CD1-CG2 3.63Å; H357-V373 PolarHBondContact O-N 3.3Å; L358-V373 WeakPolarHBondContact CA-O 3.36Å; L358-V373 HydrophobicContact CD2-CB 3.96Å; L358-V373 HydrophobicContact CD2-CG1 4.16Å; A359-V373 PolarHBondContact N-O 3.47Å; Y363-V373 HydrophobicContact CD1-CB 4.5Å; Y363-V373 HydrophobicContact CD1-CG2 4.07Å; Y363-V373 HydrophobicContact CE1-CB 4.41Å; Y363-V373 HydrophobicContact CE1-CG1 3.96Å; Y363-V373 HydrophobicContact CE1-CG2 4.15Å; I371-V373 HydrophobicContact CG2-CG2 4.25Å; V373-W377 HydrophobicContact CG1-CB 3.74Å; V373-W377 HydrophobicContact CG1-CD2 4.5Å; V373-W377 HydrophobicContact CG1-CG 3.69Å
374	P	86.3	Confident	82.5	Confident	5 Å²	5	73.7 Å²	73.7	3%	0.032	37%	0.366	C	S	.	.			trans	-59.1	152.9	176	-23.6	34.9	0	0	0	112.2	Y363 D376 W377	Y363-P374 HydrophobicContact CD2-CG 4.44Å; Y363-P374 HydrophobicContact CE2-CG 4.41Å; P374-D376 WeakPolarHBondContact CB-OD1 3.41Å; P374-D376 PolarHBondContact O-N 3.17Å; P374-W377 PolarHBondContact O-N 3.44Å
375	L	84.3	Confident	82.3	Confident	28 Å²	28	75.4 Å²	75.4	15%	0.147	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-28.6	179.1	-67.1	175.2	0	0	0	113	L333 S336 R339 L358	L333-L375 HydrophobicContact CB-CD2 4.29Å; L333-L375 HydrophobicContact CD1-CD2 3.87Å; S336-L375 VanDerWaalsContact CB-O 3.22Å; S336-L375 WeakPolarHBondContact CB-O 3.38Å; S336-L375 PolarHBondContact OG-O 2.79Å; R339-L375 PolarHBondContact NH2-O 2.76Å; L358-L375 HydrophobicContact CB-CD2 3.93Å
376	D	81.1	Confident	82	Confident	121 Å²	121	71.1 Å²	71.1	65%	0.647	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	13.4	-177	63.6	-36	0	0	0	114.1	P374 Q378	P374-D376 WeakPolarHBondContact CB-OD1 3.41Å; P374-D376 PolarHBondContact O-N 3.17Å; D376-Q378 PolarHBondContact O-N 3.49Å
377	W	78.9	Confident	82.5	Confident	29 Å²	29	73.5 Å²	73.5	11%	0.11	35%	0.354	C	S	.	.			trans	-48.4	138.7	175.1	73	-86.4	0	0	0	112.9	S336 R339 F340 Y363 V373 P374	S336-W377 PolarHBondContact OG-NE1 2.96Å; R339-W377 HydrophobicContact CB-CH2 3.84Å; R339-W377 HydrophobicContact CB-CZ2 3.53Å; R339-W377 VanDerWaalsContact CZ-O 3.25Å; R339-W377 PolarHBondContact NE-O 2.96Å; R339-W377 PolarHBondContact NH2-O 3.04Å; F340-W377 HydrophobicContact CB-CZ2 3.81Å; F340-W377 AromaticContact CD2-CE2 3.95Å; F340-W377 HydrophobicContact CD2-CH2 4.14Å; F340-W377 AromaticContact CD2-CZ2 3.52Å; F340-W377 HydrophobicContact CD2-CZ2 3.52Å; F340-W377 HydrophobicContact CG-CZ2 4.09Å; Y363-W377 HydrophobicContact CE1-CB 4.4Å; Y363-W377 VanDerWaalsContact OH-CB 3.3Å; Y363-W377 WeakPolarHBondContact OH-CB 3.28Å; V373-W377 HydrophobicContact CG1-CB 3.74Å; V373-W377 HydrophobicContact CG1-CD2 4.5Å; V373-W377 HydrophobicContact CG1-CG 3.69Å; P374-W377 PolarHBondContact O-N 3.44Å
378	Q	68.1	Low	83	Confident	229 Å²	229	58.1 Å²	58.1	100%	1.07	30%	0.302	S	S	*	.			trans	-94.9	0	-178.3	-64.6	-175.4	-6.3	0	0	111.3	D376	D376-Q378 PolarHBondContact O-N 3.49Å

Retrieved 378 of 378 residues in 154.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).