A0AA82N816_SCHMA Loading...

CCHC-type domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N816, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 291 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	82.5	Confident	85.5	Confident	99 Å²	99	82.4 Å²	82.4	49%	0.488	41%	0.405	S	S	.	.				0	155.6	0	-170.6	149.1	-80.5	0	0	109	Y16 R19 F20 W23 F42	M1-Y16 HydrophobicContact CG-CE2 4.4Å; M1-R19 HydrophobicContact CE-CB 4.37Å; M1-R19 WeakPolarHBondContact CE-O 3.39Å; M1-F20 HydrophobicContact CE-CB 4.48Å; M1-F20 HydrophobicContact SD-CB 3.98Å; M1-F20 HydrophobicContact SD-CD2 3.87Å; M1-F20 HydrophobicContact SD-CG 4.44Å; M1-W23 HydrophobicContact CE-CB 3.61Å; M1-W23 HydrophobicContact CE-CG 4.04Å; M1-F42 HydrophobicContact CB-CB 4.39Å; M1-F42 HydrophobicContact CB-CD1 3.68Å; M1-F42 HydrophobicContact CB-CE1 4.14Å; M1-F42 HydrophobicContact CB-CG 4.08Å; M1-F42 HydrophobicContact CG-CB 4.49Å; M1-F42 HydrophobicContact SD-CB 4.39Å; M1-F42 HydrophobicContact SD-CG 4.44Å
2	E	87.8	Confident	85.9	Confident	112 Å²	112	78.3 Å²	78.3	52%	0.523	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-69.9	172.4	168.5	-163.3	165.3	-147.4	0	0	110.9	Y16 R19	E2-Y16 WeakPolarHBondContact O-CE2 3.33Å; E2-Y16 PolarHBondContact O-OH 2.61Å; E2-R19 IonicContact OE2-CZ 2.74Å; E2-R19 VanDerWaalsContact OE2-CZ 3.28Å; E2-R19 IonicContact OE2-NH1 3.28Å; E2-R19 PolarHBondContact OE2-NH1 3.48Å; E2-R19 IonicContact OE2-NH2 2.7Å; E2-R19 PolarHBondContact OE2-NH2 3.18Å
3	R	91.7	Very high	86.3	Confident	189 Å²	189	72.5 Å²	72.5	71%	0.713	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-92.7	155.4	168.7	-71	178.8	179.5	160.5	4.4	110	D5 Y16	R3-D5 PolarHBondContact O-N 3.45Å; R3-Y16 VanDerWaalsContact C-CE2 3.42Å
4	L	90.1	Very high	86.7	Confident	11 Å²	11	73.4 Å²	73.4	6%	0.058	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-82.3	116.1	173.8	176.3	59.4	0	0	0	109.6	F13 Y16 I43 A47 L72	L4-F13 HydrophobicContact CD1-CD2 3.97Å; L4-F13 HydrophobicContact CD1-CE2 4.48Å; L4-F13 HydrophobicContact CD2-CD2 4.45Å; L4-F13 HydrophobicContact CD2-CE2 4.2Å; L4-Y16 HydrophobicContact CB-CD1 4.06Å; L4-Y16 HydrophobicContact CB-CD2 4.28Å; L4-Y16 HydrophobicContact CB-CE1 3.85Å; L4-Y16 HydrophobicContact CB-CE2 4.07Å; L4-Y16 HydrophobicContact CB-CG 4.28Å; L4-Y16 HydrophobicContact CD1-CD1 3.9Å; L4-Y16 HydrophobicContact CD1-CD2 4.34Å; L4-Y16 HydrophobicContact CD1-CG 3.8Å; L4-Y16 HydrophobicContact CD2-CD1 4.49Å; L4-Y16 HydrophobicContact CG-CD1 4.36Å; L4-I43 HydrophobicContact CB-CB 4.1Å; L4-I43 HydrophobicContact CB-CG2 4.16Å; L4-I43 HydrophobicContact CD2-CG2 4.25Å; L4-I43 PolarHBondContact N-O 3.25Å; L4-A47 HydrophobicContact CB-CB 4.09Å; L4-A47 HydrophobicContact CD2-CB 4.08Å; L4-A47 HydrophobicContact CG-CB 4.24Å; L4-L72 HydrophobicContact CD2-CD1 3.93Å
5	D	86.9	Confident	87.1	Confident	67 Å²	67	76.3 Å²	76.3	36%	0.358	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-80.2	122.9	161.7	172.9	31.4	0	0	0	109.6	R3 N7 S8	R3-D5 PolarHBondContact O-N 3.45Å; D5-N7 VanDerWaalsContact C-N 3.3Å; D5-N7 WeakPolarHBondContact OD1-CB 3.42Å; D5-N7 PolarHBondContact OD1-N 2.93Å; D5-N7 PolarHBondContact OD1-ND2 3.11Å; D5-S8 WeakPolarHBondContact OD2-CB 3.13Å; D5-S8 PolarHBondContact OD2-N 3.49Å; D5-S8 PolarHBondContact OD2-OG 2.95Å
6	T	79.2	Confident	87.5	Confident	17 Å²	17	71.8 Å²	71.8	10%	0.104	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-5	178.8	54.4	0	0	0	0	113.8	A47 L50	T6-A47 HydrophobicContact CG2-CB 3.82Å; T6-L50 HydrophobicContact CG2-CD2 3.71Å
7	N	78.5	Confident	87.8	Confident	121 Å²	121	67.6 Å²	67.6	65%	0.647	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-6.7	-179.2	-45.4	-85.3	0	0	0	112.5	D5	D5-N7 VanDerWaalsContact C-N 3.3Å; D5-N7 WeakPolarHBondContact OD1-CB 3.42Å; D5-N7 PolarHBondContact OD1-N 2.93Å; D5-N7 PolarHBondContact OD1-ND2 3.11Å
8	S	81.1	Confident	88.2	Confident	39 Å²	39	70.5 Å²	70.5	27%	0.273	35%	0.348	S	S	.	.	S	Bend	trans	-65.9	162.4	175.5	-78.2	0	0	0	0	112.1	D5	D5-S8 WeakPolarHBondContact OD2-CB 3.13Å; D5-S8 PolarHBondContact OD2-N 3.49Å; D5-S8 PolarHBondContact OD2-OG 2.95Å
9	D	85.9	Confident	88.5	Confident	83 Å²	83	72.2 Å²	72.2	44%	0.444	35%	0.35	S	S	.	.			trans	-68.8	173.2	176.9	70.9	52	0	0	0	112.7	N11 A12 F13	D9-N11 VanDerWaalsContact C-N 3.3Å; D9-N11 PolarHBondContact O-N 3.15Å; D9-N11 WeakPolarHBondContact OD1-CA 3.34Å; D9-N11 WeakPolarHBondContact OD1-CB 3.36Å; D9-N11 PolarHBondContact OD1-N 3.45Å; D9-A12 PolarHBondContact OD1-N 3.32Å; D9-F13 PolarHBondContact O-N 3.38Å; D9-F13 VanDerWaalsContact O-N 3.1Å
10	F	88	Confident	88.8	Confident	59 Å²	59	68.6 Å²	68.6	26%	0.259	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-36.6	-178	-174.5	-92.5	0	0	0	113.6	F13 E14 L73 V76 K77	F10-F13 PolarHBondContact O-N 3.37Å; F10-E14 HydrophobicContact CD1-CG 4.42Å; F10-E14 VanDerWaalsContact CE1-CD 3.44Å; F10-E14 HydrophobicContact CE1-CG 3.85Å; F10-E14 WeakPolarHBondContact CE1-OE2 3.45Å; F10-E14 VanDerWaalsContact CZ-CD 3.46Å; F10-E14 HydrophobicContact CZ-CG 3.94Å; F10-E14 WeakPolarHBondContact CZ-OE1 3.39Å; F10-E14 PolarHBondContact O-N 3.43Å; F10-E14 VanDerWaalsContact O-N 3.09Å; F10-L73 HydrophobicContact CE2-CD1 3.45Å; F10-L73 VanDerWaalsContact CE2-CD1 3.45Å; F10-L73 HydrophobicContact CE2-CG 4.33Å; F10-L73 HydrophobicContact CZ-CD1 3.76Å; F10-V76 HydrophobicContact CD2-CG1 4.28Å; F10-K77 HydrophobicContact CD2-CG 4.19Å; F10-K77 HydrophobicContact CE2-CD 4.45Å; F10-K77 HydrophobicContact CE2-CG 3.99Å
11	N	88.7	Confident	89	Confident	109 Å²	109	68.2 Å²	68.2	58%	0.583	33%	0.33	S	S	*	.	H	α-helix	trans	-73.5	-46.2	-176.5	-59.3	-9.1	0	0	0	109.9	D9 F13 E14 E15	D9-N11 VanDerWaalsContact C-N 3.3Å; D9-N11 PolarHBondContact O-N 3.15Å; D9-N11 WeakPolarHBondContact OD1-CA 3.34Å; D9-N11 WeakPolarHBondContact OD1-CB 3.36Å; D9-N11 PolarHBondContact OD1-N 3.45Å; N11-F13 PolarHBondContact O-N 3.18Å; N11-E14 PolarHBondContact O-N 3.14Å; N11-E15 WeakPolarHBondContact O-CG 3.39Å; N11-E15 PolarHBondContact O-N 2.92Å
12	A	90.7	Very high	89.5	Confident	33 Å²	33	68 Å²	68	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-30.2	175.5	0	0	0	0	0	112.6	D9 Y16	D9-A12 PolarHBondContact OD1-N 3.32Å; A12-Y16 PolarHBondContact O-N 3.01Å; A12-Y16 VanDerWaalsContact O-N 3.11Å
13	F	91.1	Very high	89.8	Confident	3 Å²	3	65.7 Å²	65.7	1%	0.013	32%	0.316	C	S	.	.	H	α-helix	trans	-65.8	-49.6	168.5	174.1	-98.7	0	0	0	112.1	L4 D9 F10 N11 Y16 M17 L72 L73 V76	L4-F13 HydrophobicContact CD1-CD2 3.97Å; L4-F13 HydrophobicContact CD1-CE2 4.48Å; L4-F13 HydrophobicContact CD2-CD2 4.45Å; L4-F13 HydrophobicContact CD2-CE2 4.2Å; D9-F13 PolarHBondContact O-N 3.38Å; D9-F13 VanDerWaalsContact O-N 3.1Å; F10-F13 PolarHBondContact O-N 3.37Å; N11-F13 PolarHBondContact O-N 3.18Å; F13-Y16 WeakPolarHBondContact O-CB 3.39Å; F13-Y16 PolarHBondContact O-N 3.1Å; F13-M17 HydrophobicContact CD1-CG 4.37Å; F13-M17 HydrophobicContact CD2-CG 4.43Å; F13-M17 HydrophobicContact CE1-CG 3.85Å; F13-M17 HydrophobicContact CE2-CG 3.91Å; F13-M17 HydrophobicContact CE2-SD 4.09Å; F13-M17 HydrophobicContact CZ-CE 4.35Å; F13-M17 HydrophobicContact CZ-CG 3.59Å; F13-M17 HydrophobicContact CZ-SD 4.03Å; F13-M17 WeakPolarHBondContact O-CG 3.41Å; F13-M17 PolarHBondContact O-N 2.7Å; F13-L72 HydrophobicContact CE2-CB 3.61Å; F13-L72 HydrophobicContact CE2-CD1 4.23Å; F13-L72 HydrophobicContact CZ-CB 3.62Å; F13-L73 HydrophobicContact CD1-CD1 4.05Å; F13-L73 HydrophobicContact CE1-CB 4.05Å; F13-L73 HydrophobicContact CE1-CD1 3.68Å; F13-V76 HydrophobicContact CB-CG1 4.02Å; F13-V76 HydrophobicContact CB-CG2 4.26Å; F13-V76 HydrophobicContact CD2-CG2 3.83Å; F13-V76 HydrophobicContact CE2-CG2 4.39Å; F13-V76 HydrophobicContact CG-CB 4.41Å; F13-V76 HydrophobicContact CG-CG1 4.29Å; F13-V76 HydrophobicContact CG-CG2 3.95Å
14	E	91.4	Very high	89.8	Confident	85 Å²	85	57 Å²	57	40%	0.397	29%	0.285	S	S	.	.	H	α-helix	trans	-67.7	-37.4	-179.8	-64.3	-151.9	140.6	0	0	112.3	F10 N11 Y16 M17 E18	F10-E14 HydrophobicContact CD1-CG 4.42Å; F10-E14 VanDerWaalsContact CE1-CD 3.44Å; F10-E14 HydrophobicContact CE1-CG 3.85Å; F10-E14 WeakPolarHBondContact CE1-OE2 3.45Å; F10-E14 VanDerWaalsContact CZ-CD 3.46Å; F10-E14 HydrophobicContact CZ-CG 3.94Å; F10-E14 WeakPolarHBondContact CZ-OE1 3.39Å; F10-E14 PolarHBondContact O-N 3.43Å; F10-E14 VanDerWaalsContact O-N 3.09Å; N11-E14 PolarHBondContact O-N 3.14Å; E14-Y16 VanDerWaalsContact C-N 3.28Å; E14-Y16 PolarHBondContact O-N 3.02Å; E14-M17 PolarHBondContact O-N 3.29Å; E14-M17 VanDerWaalsContact O-N 3.1Å; E14-E18 WeakPolarHBondContact O-CB 3.46Å; E14-E18 PolarHBondContact O-N 3.46Å
15	E	92.8	Very high	89.9	Confident	117 Å²	117	61.8 Å²	61.8	55%	0.547	31%	0.31	S	S	.	.	H	α-helix	trans	-60.6	-32.7	170	-74.6	-177.6	-157.7	0	0	113	N11 R19	N11-E15 WeakPolarHBondContact O-CG 3.39Å; N11-E15 PolarHBondContact O-N 2.92Å; E15-R19 WeakPolarHBondContact O-CB 3.47Å; E15-R19 WeakPolarHBondContact O-CG 3.48Å; E15-R19 PolarHBondContact O-N 3.17Å; E15-R19 PolarHBondContact O-NE 2.99Å
16	Y	94	Very high	90.1	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-45.7	171.5	-175.2	-86.4	0	0	0	111.1	M1 E2 R3 L4 A12 F13 E14 R19 F20 F39 F42 I43	M1-Y16 HydrophobicContact CG-CE2 4.4Å; E2-Y16 WeakPolarHBondContact O-CE2 3.33Å; E2-Y16 PolarHBondContact O-OH 2.61Å; R3-Y16 VanDerWaalsContact C-CE2 3.42Å; L4-Y16 HydrophobicContact CB-CD1 4.06Å; L4-Y16 HydrophobicContact CB-CD2 4.28Å; L4-Y16 HydrophobicContact CB-CE1 3.85Å; L4-Y16 HydrophobicContact CB-CE2 4.07Å; L4-Y16 HydrophobicContact CB-CG 4.28Å; L4-Y16 HydrophobicContact CD1-CD1 3.9Å; L4-Y16 HydrophobicContact CD1-CD2 4.34Å; L4-Y16 HydrophobicContact CD1-CG 3.8Å; L4-Y16 HydrophobicContact CD2-CD1 4.49Å; L4-Y16 HydrophobicContact CG-CD1 4.36Å; A12-Y16 PolarHBondContact O-N 3.01Å; A12-Y16 VanDerWaalsContact O-N 3.11Å; F13-Y16 WeakPolarHBondContact O-CB 3.39Å; F13-Y16 PolarHBondContact O-N 3.1Å; E14-Y16 VanDerWaalsContact C-N 3.28Å; E14-Y16 PolarHBondContact O-N 3.02Å; Y16-R19 PolarHBondContact O-N 3.24Å; Y16-F20 PolarHBondContact O-N 2.84Å; Y16-F39 HydrophobicContact CE1-CE2 4.19Å; Y16-F42 PolarHBondContact OH-O 2.85Å; Y16-I43 HydrophobicContact CE1-CG2 4.08Å; Y16-I43 WeakPolarHBondContact OH-CA 3.4Å; Y16-I43 PolarHBondContact OH-N 2.74Å
17	M	93	Very high	90.6	Very high	1 Å²	1	65 Å²	65	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-68.3	-40.5	-177	-63.6	-60.1	-79.6	0	0	111.9	F13 E14 F20 E21 F39 Y65 K69	F13-M17 HydrophobicContact CD1-CG 4.37Å; F13-M17 HydrophobicContact CD2-CG 4.43Å; F13-M17 HydrophobicContact CE1-CG 3.85Å; F13-M17 HydrophobicContact CE2-CG 3.91Å; F13-M17 HydrophobicContact CE2-SD 4.09Å; F13-M17 HydrophobicContact CZ-CE 4.35Å; F13-M17 HydrophobicContact CZ-CG 3.59Å; F13-M17 HydrophobicContact CZ-SD 4.03Å; F13-M17 WeakPolarHBondContact O-CG 3.41Å; F13-M17 PolarHBondContact O-N 2.7Å; E14-M17 PolarHBondContact O-N 3.29Å; E14-M17 VanDerWaalsContact O-N 3.1Å; M17-F20 PolarHBondContact O-N 3.03Å; M17-E21 WeakPolarHBondContact O-CB 3.47Å; M17-E21 WeakPolarHBondContact O-CG 3.49Å; M17-E21 PolarHBondContact O-N 3.17Å; M17-F39 HydrophobicContact CE-CE2 3.92Å; M17-F39 HydrophobicContact CE-CZ 3.82Å; M17-F39 HydrophobicContact SD-CE2 3.58Å; M17-F39 VanDerWaalsContact SD-CE2 3.58Å; M17-F39 HydrophobicContact SD-CZ 3.68Å; M17-Y65 HydrophobicContact CE-CE2 4.32Å; M17-Y65 WeakPolarHBondContact CE-OH 3.45Å; M17-K69 HydrophobicContact CE-CB 3.75Å; M17-K69 HydrophobicContact CE-CD 4.05Å; M17-K69 HydrophobicContact CE-CG 3.64Å
18	E	93.8	Very high	90.7	Very high	120 Å²	120	65.9 Å²	65.9	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-62.4	-47.2	173.6	-177.8	179.3	-151.3	0	0	111.2	E14 F20 E21 I22	E14-E18 WeakPolarHBondContact O-CB 3.46Å; E14-E18 PolarHBondContact O-N 3.46Å; E18-F20 PolarHBondContact O-N 3.49Å; E18-E21 PolarHBondContact O-N 2.86Å; E18-E21 VanDerWaalsContact O-N 3.15Å; E18-I22 HydrophobicContact CG-CD1 3.83Å; E18-I22 HydrophobicContact CG-CG1 4.39Å; E18-I22 WeakPolarHBondContact O-CB 3.42Å; E18-I22 WeakPolarHBondContact O-CG1 3.23Å; E18-I22 PolarHBondContact O-N 3.15Å
19	R	94.3	Very high	90.9	Very high	103 Å²	103	71.5 Å²	71.5	39%	0.389	36%	0.355	S	S	.	.	H	α-helix	trans	-58.2	-37.1	174.8	-74.8	-177.9	-62.9	157.9	-0.6	112.1	M1 E2 E15 Y16 W23	M1-R19 HydrophobicContact CE-CB 4.37Å; M1-R19 WeakPolarHBondContact CE-O 3.39Å; E2-R19 IonicContact OE2-CZ 2.74Å; E2-R19 VanDerWaalsContact OE2-CZ 3.28Å; E2-R19 IonicContact OE2-NH1 3.28Å; E2-R19 PolarHBondContact OE2-NH1 3.48Å; E2-R19 IonicContact OE2-NH2 2.7Å; E2-R19 PolarHBondContact OE2-NH2 3.18Å; E15-R19 WeakPolarHBondContact O-CB 3.47Å; E15-R19 WeakPolarHBondContact O-CG 3.48Å; E15-R19 PolarHBondContact O-N 3.17Å; E15-R19 PolarHBondContact O-NE 2.99Å; Y16-R19 PolarHBondContact O-N 3.24Å; R19-W23 WeakPolarHBondContact O-CB 3.18Å; R19-W23 PolarHBondContact O-N 2.83Å
20	F	94.3	Very high	91	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-70.1	-43.3	174.4	177.6	-92.5	0	0	0	112.7	M1 Y16 M17 E18 W23 A24 I35 F39 F42 Y65	M1-F20 HydrophobicContact CE-CB 4.48Å; M1-F20 HydrophobicContact SD-CB 3.98Å; M1-F20 HydrophobicContact SD-CD2 3.87Å; M1-F20 HydrophobicContact SD-CG 4.44Å; Y16-F20 PolarHBondContact O-N 2.84Å; M17-F20 PolarHBondContact O-N 3.03Å; E18-F20 PolarHBondContact O-N 3.49Å; F20-W23 HydrophobicContact CD2-CE3 4.14Å; F20-W23 AromaticContact CE2-CE3 3.76Å; F20-W23 HydrophobicContact CE2-CE3 3.76Å; F20-W23 AromaticContact CE2-CZ3 3.89Å; F20-W23 HydrophobicContact CE2-CZ3 3.89Å; F20-W23 HydrophobicContact CZ-CE3 4.36Å; F20-W23 HydrophobicContact CZ-CZ3 4.3Å; F20-W23 PolarHBondContact O-N 2.82Å; F20-A24 HydrophobicContact CE1-CB 4.32Å; F20-A24 WeakPolarHBondContact O-CB 3.37Å; F20-A24 PolarHBondContact O-N 3.24Å; F20-I35 HydrophobicContact CE1-CD1 4.1Å; F20-I35 HydrophobicContact CE1-CG1 3.68Å; F20-I35 HydrophobicContact CZ-CG1 3.84Å; F20-F39 AromaticContact CD1-CD2 3.75Å; F20-F39 HydrophobicContact CD1-CD2 3.75Å; F20-F39 HydrophobicContact CD1-CE2 4.33Å; F20-F39 AromaticContact CD2-CD2 3.94Å; F20-F39 HydrophobicContact CD2-CD2 3.94Å; F20-F39 HydrophobicContact CE1-CB 4.04Å; F20-F39 AromaticContact CE1-CD2 3.78Å; F20-F39 HydrophobicContact CE1-CD2 3.78Å; F20-F39 HydrophobicContact CE1-CG 4.31Å; F20-F39 HydrophobicContact CE2-CB 3.98Å; F20-F39 AromaticContact CE2-CD2 3.99Å; F20-F39 HydrophobicContact CE2-CD2 3.99Å; F20-F39 AromaticContact CG-CD2 3.83Å; F20-F39 HydrophobicContact CG-CD2 3.83Å; F20-F39 HydrophobicContact CG-CE2 4.35Å; F20-F39 HydrophobicContact CZ-CB 3.58Å; F20-F39 AromaticContact CZ-CD2 3.92Å; F20-F39 HydrophobicContact CZ-CD2 3.92Å; F20-F39 HydrophobicContact CZ-CG 4.24Å; F20-F42 HydrophobicContact CD2-CD2 4.4Å; F20-F42 HydrophobicContact CE2-CD2 4.07Å; F20-Y65 AromaticContact CD1-CE2 3.86Å; F20-Y65 HydrophobicContact CD1-CE2 3.86Å; F20-Y65 AromaticContact CD1-CZ 3.85Å; F20-Y65 WeakPolarHBondContact CD1-OH 3.41Å; F20-Y65 HydrophobicContact CE1-CD2 4.25Å; F20-Y65 AromaticContact CE1-CE2 3.5Å; F20-Y65 HydrophobicContact CE1-CE2 3.5Å; F20-Y65 AromaticContact CE1-CZ 3.84Å; F20-Y65 HydrophobicContact CZ-CE2 4.5Å
21	E	93.3	Very high	90.8	Very high	60 Å²	60	78 Å²	78	28%	0.28	39%	0.386	S	S	.	.	H	α-helix	trans	-66.9	-39.1	179.5	-74	171.1	157.8	0	0	111.4	M17 E18 W23 A24 L25 Y65 K69	M17-E21 WeakPolarHBondContact O-CB 3.47Å; M17-E21 WeakPolarHBondContact O-CG 3.49Å; M17-E21 PolarHBondContact O-N 3.17Å; E18-E21 PolarHBondContact O-N 2.86Å; E18-E21 VanDerWaalsContact O-N 3.15Å; E21-W23 PolarHBondContact O-N 3.45Å; E21-A24 WeakPolarHBondContact O-CB 3.49Å; E21-A24 PolarHBondContact O-N 3.21Å; E21-L25 WeakPolarHBondContact O-CG 3.37Å; E21-L25 PolarHBondContact O-N 3.27Å; E21-Y65 HydrophobicContact CG-CE1 4.18Å; E21-Y65 WeakPolarHBondContact OE1-CE1 3.27Å; E21-K69 WeakPolarHBondContact OE1-CD 3.38Å; E21-K69 IonicContact OE1-NZ 2.61Å; E21-K69 PolarHBondContact OE1-NZ 3.32Å; E21-K69 IonicContact OE2-NZ 2.85Å; E21-K69 PolarHBondContact OE2-NZ 3.08Å
22	I	93.4	Very high	90.5	Very high	96 Å²	96	80.4 Å²	80.4	49%	0.492	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-43.5	170.8	-67.6	168.6	0	0	0	111.2	E18 A24 L25 T26	E18-I22 HydrophobicContact CG-CD1 3.83Å; E18-I22 HydrophobicContact CG-CG1 4.39Å; E18-I22 WeakPolarHBondContact O-CB 3.42Å; E18-I22 WeakPolarHBondContact O-CG1 3.23Å; E18-I22 PolarHBondContact O-N 3.15Å; I22-A24 VanDerWaalsContact C-N 3.33Å; I22-L25 PolarHBondContact O-N 2.96Å; I22-T26 PolarHBondContact O-N 3.01Å
23	W	94	Very high	90.3	Very high	62 Å²	62	80.9 Å²	80.9	24%	0.235	40%	0.395	C	S	.	.	H	α-helix	trans	-66	-35	175.5	174.7	84.1	0	0	0	112.5	M1 R19 F20 E21 T26 K27 F33 H38 F42	M1-W23 HydrophobicContact CE-CB 3.61Å; M1-W23 HydrophobicContact CE-CG 4.04Å; R19-W23 WeakPolarHBondContact O-CB 3.18Å; R19-W23 PolarHBondContact O-N 2.83Å; F20-W23 HydrophobicContact CD2-CE3 4.14Å; F20-W23 AromaticContact CE2-CE3 3.76Å; F20-W23 HydrophobicContact CE2-CE3 3.76Å; F20-W23 AromaticContact CE2-CZ3 3.89Å; F20-W23 HydrophobicContact CE2-CZ3 3.89Å; F20-W23 HydrophobicContact CZ-CE3 4.36Å; F20-W23 HydrophobicContact CZ-CZ3 4.3Å; F20-W23 PolarHBondContact O-N 2.82Å; E21-W23 PolarHBondContact O-N 3.45Å; W23-T26 PolarHBondContact O-N 3.4Å; W23-T26 PolarHBondContact O-OG1 2.95Å; W23-K27 HydrophobicContact CH2-CG 3.92Å; W23-K27 HydrophobicContact CZ2-CD 4.24Å; W23-K27 HydrophobicContact CZ2-CG 3.74Å; W23-F33 AromaticContact CH2-CE2 3.87Å; W23-F33 HydrophobicContact CH2-CE2 3.87Å; W23-F33 AromaticContact CZ3-CE2 3.78Å; W23-F33 HydrophobicContact CZ3-CE2 3.78Å; W23-F33 HydrophobicContact CZ3-CZ 4.1Å; W23-H38 HydrophobicContact CH2-CB 3.71Å; W23-H38 AromaticContact CH2-CG 3.56Å; W23-H38 AromaticContact CH2-ND1 3.65Å; W23-H38 HydrophobicContact CZ3-CB 3.66Å; W23-F42 HydrophobicContact CD2-CE2 4.16Å; W23-F42 AromaticContact CE2-CE2 3.9Å; W23-F42 HydrophobicContact CE3-CE2 4.05Å; W23-F42 AromaticContact CH2-CE2 3.58Å; W23-F42 HydrophobicContact CH2-CE2 3.58Å; W23-F42 HydrophobicContact CH2-CZ 4.3Å; W23-F42 AromaticContact CZ2-CE2 3.61Å; W23-F42 HydrophobicContact CZ2-CE2 3.61Å; W23-F42 AromaticContact CZ2-CZ 3.89Å; W23-F42 HydrophobicContact CZ2-CZ 3.89Å; W23-F42 HydrophobicContact CZ3-CD2 4.37Å; W23-F42 AromaticContact CZ3-CE2 3.78Å; W23-F42 HydrophobicContact CZ3-CE2 3.78Å
24	A	92.4	Very high	90.3	Very high	6 Å²	6	84.2 Å²	84.2	5%	0.05	41%	0.413	C	S	.	.	H	α-helix	trans	-67.5	-37.2	175.9	0	0	0	0	0	111.9	F20 E21 I22 T26 K27 E28 F33 I35	F20-A24 HydrophobicContact CE1-CB 4.32Å; F20-A24 WeakPolarHBondContact O-CB 3.37Å; F20-A24 PolarHBondContact O-N 3.24Å; E21-A24 WeakPolarHBondContact O-CB 3.49Å; E21-A24 PolarHBondContact O-N 3.21Å; I22-A24 VanDerWaalsContact C-N 3.33Å; A24-T26 VanDerWaalsContact C-N 3.31Å; A24-T26 PolarHBondContact O-N 2.9Å; A24-K27 CarbonylContact O-C 3.47Å; A24-K27 WeakPolarHBondContact O-CA 3.32Å; A24-K27 WeakPolarHBondContact O-CB 3.43Å; A24-K27 PolarHBondContact O-N 2.95Å; A24-E28 PolarHBondContact O-N 3.39Å; A24-F33 HydrophobicContact CB-CE1 4.04Å; A24-F33 HydrophobicContact CB-CZ 3.65Å; A24-I35 HydrophobicContact CB-CD1 3.89Å; A24-I35 HydrophobicContact CB-CG1 4.17Å
25	L	91.9	Very high	90.3	Very high	112 Å²	112	82.6 Å²	82.6	59%	0.586	41%	0.406	S	S	*	.	H	α-helix	trans	-64	-32.8	174.7	-70.4	168	0	0	0	112.3	E21 I22 K27 E28	E21-L25 WeakPolarHBondContact O-CG 3.37Å; E21-L25 PolarHBondContact O-N 3.27Å; I22-L25 PolarHBondContact O-N 2.96Å; L25-K27 PolarHBondContact O-N 3.08Å; L25-K27 VanDerWaalsContact O-N 3.15Å; L25-E28 WeakPolarHBondContact CD2-OE2 3.42Å; L25-E28 PolarHBondContact O-N 2.95Å
26	T	90.9	Very high	90.3	Very high	96 Å²	96	77.6 Å²	77.6	59%	0.589	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	5.1	172.6	69.3	0	0	0	0	114.1	I22 W23 A24	I22-T26 PolarHBondContact O-N 3.01Å; W23-T26 PolarHBondContact O-N 3.4Å; W23-T26 PolarHBondContact O-OG1 2.95Å; A24-T26 VanDerWaalsContact C-N 3.31Å; A24-T26 PolarHBondContact O-N 2.9Å
27	K	90	Very high	90.2	Very high	57 Å²	57	78.9 Å²	78.9	25%	0.248	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	1.8	179.2	-70.9	-74.6	93.8	-149.8	0	113.3	W23 A24 L25 D29 D30 F33	W23-K27 HydrophobicContact CH2-CG 3.92Å; W23-K27 HydrophobicContact CZ2-CD 4.24Å; W23-K27 HydrophobicContact CZ2-CG 3.74Å; A24-K27 CarbonylContact O-C 3.47Å; A24-K27 WeakPolarHBondContact O-CA 3.32Å; A24-K27 WeakPolarHBondContact O-CB 3.43Å; A24-K27 PolarHBondContact O-N 2.95Å; L25-K27 PolarHBondContact O-N 3.08Å; L25-K27 VanDerWaalsContact O-N 3.15Å; K27-D29 PolarHBondContact O-N 3.43Å; K27-D30 WeakPolarHBondContact CD-OD2 3.22Å; K27-D30 IonicContact NZ-OD1 3.76Å; K27-D30 PolarHBondContact NZ-OD1 2.75Å; K27-D30 IonicContact NZ-OD2 2.73Å; K27-D30 PolarHBondContact NZ-OD2 3.1Å; K27-D30 PolarHBondContact O-N 3.17Å; K27-D30 VanDerWaalsContact O-N 3.14Å; K27-F33 HydrophobicContact CB-CD1 4.48Å; K27-F33 HydrophobicContact CB-CD2 3.58Å; K27-F33 HydrophobicContact CB-CE1 4.42Å; K27-F33 HydrophobicContact CB-CE2 3.52Å; K27-F33 HydrophobicContact CB-CG 4.1Å; K27-F33 HydrophobicContact CB-CZ 3.97Å; K27-F33 HydrophobicContact CG-CD2 4.44Å; K27-F33 HydrophobicContact CG-CE2 4.22Å; K27-F33 WeakPolarHBondContact O-CB 3.46Å; K27-F33 WeakPolarHBondContact O-CG 3.06Å
28	E	80.6	Confident	90.2	Very high	138 Å²	138	81.9 Å²	81.9	65%	0.645	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.8	-178.2	-167.7	171.6	-177.5	0	0	113.2	A24 L25	A24-E28 PolarHBondContact O-N 3.39Å; L25-E28 WeakPolarHBondContact CD2-OE2 3.42Å; L25-E28 PolarHBondContact O-N 2.95Å
29	D	85	Confident	90.1	Very high	157 Å²	157	76.2 Å²	76.2	84%	0.84	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-11.6	175.2	-65.2	-48.7	0	0	0	114.5	K27 E31	K27-D29 PolarHBondContact O-N 3.43Å; D29-E31 PolarHBondContact O-N 3.3Å
30	D	87.2	Confident	90.1	Very high	76 Å²	76	72.3 Å²	72.3	41%	0.406	37%	0.369	S	S	.	.			trans	-80.5	116.9	177.2	-69	6	0	0	0	109.4	K27 D32 F33	K27-D30 WeakPolarHBondContact CD-OD2 3.22Å; K27-D30 IonicContact NZ-OD1 3.76Å; K27-D30 PolarHBondContact NZ-OD1 2.75Å; K27-D30 IonicContact NZ-OD2 2.73Å; K27-D30 PolarHBondContact NZ-OD2 3.1Å; K27-D30 PolarHBondContact O-N 3.17Å; K27-D30 VanDerWaalsContact O-N 3.14Å; D30-D32 PolarHBondContact O-N 3.43Å; D30-D32 VanDerWaalsContact O-N 3.11Å; D30-F33 HydrophobicContact CB-CB 4.18Å; D30-F33 WeakPolarHBondContact O-CB 3.25Å; D30-F33 PolarHBondContact O-N 2.76Å
31	E	83.3	Confident	89.9	Confident	202 Å²	202	77.1 Å²	77.1	94%	0.944	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-31	-175.4	-64.4	-169.1	165.1	0	0	114.2	D29 F33	D29-E31 PolarHBondContact O-N 3.3Å; E31-F33 VanDerWaalsContact C-N 3.3Å; E31-F33 PolarHBondContact O-N 2.82Å
32	D	83	Confident	89.9	Confident	161 Å²	161	76.8 Å²	76.8	86%	0.861	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	8.5	177.1	-75.4	-48.8	0	0	0	114	D30 N34	D30-D32 PolarHBondContact O-N 3.43Å; D30-D32 VanDerWaalsContact O-N 3.11Å; D32-N34 PolarHBondContact O-N 3.35Å
33	F	87	Confident	89.7	Confident	43 Å²	43	72.3 Å²	72.3	19%	0.189	37%	0.373	C	S	.	.			trans	-67.7	91.6	-170.3	-177.1	-119.3	0	0	0	114.6	W23 A24 K27 D30 E31 I35 H38	W23-F33 AromaticContact CH2-CE2 3.87Å; W23-F33 HydrophobicContact CH2-CE2 3.87Å; W23-F33 AromaticContact CZ3-CE2 3.78Å; W23-F33 HydrophobicContact CZ3-CE2 3.78Å; W23-F33 HydrophobicContact CZ3-CZ 4.1Å; A24-F33 HydrophobicContact CB-CE1 4.04Å; A24-F33 HydrophobicContact CB-CZ 3.65Å; K27-F33 HydrophobicContact CB-CD1 4.48Å; K27-F33 HydrophobicContact CB-CD2 3.58Å; K27-F33 HydrophobicContact CB-CE1 4.42Å; K27-F33 HydrophobicContact CB-CE2 3.52Å; K27-F33 HydrophobicContact CB-CG 4.1Å; K27-F33 HydrophobicContact CB-CZ 3.97Å; K27-F33 HydrophobicContact CG-CD2 4.44Å; K27-F33 HydrophobicContact CG-CE2 4.22Å; K27-F33 WeakPolarHBondContact O-CB 3.46Å; K27-F33 WeakPolarHBondContact O-CG 3.06Å; D30-F33 HydrophobicContact CB-CB 4.18Å; D30-F33 WeakPolarHBondContact O-CB 3.25Å; D30-F33 PolarHBondContact O-N 2.76Å; E31-F33 VanDerWaalsContact C-N 3.3Å; E31-F33 PolarHBondContact O-N 2.82Å; F33-I35 HydrophobicContact CD1-CB 4.43Å; F33-I35 HydrophobicContact CE1-CB 3.67Å; F33-I35 HydrophobicContact CE1-CD1 4.47Å; F33-I35 HydrophobicContact CE1-CG1 4.12Å; F33-I35 HydrophobicContact CZ-CB 3.8Å; F33-I35 HydrophobicContact CZ-CG1 4.01Å; F33-I35 PolarHBondContact O-N 3.01Å; F33-H38 AromaticContact CD2-CD2 3.48Å; F33-H38 VanDerWaalsContact CD2-CD2 3.48Å; F33-H38 WeakPolarHBondContact CD2-CD2 3.46Å; F33-H38 AromaticContact CD2-NE2 3.78Å; F33-H38 HydrophobicContact CE2-CB 4.43Å; F33-H38 AromaticContact CE2-CD2 3.39Å; F33-H38 WeakPolarHBondContact CE2-CD2 3.41Å
34	N	90.2	Very high	89.6	Confident	73 Å²	73	70 Å²	70	39%	0.39	37%	0.369	S	S	.	.			trans	-89.3	88.8	170.8	-169.5	-36.1	0	0	0	111.1	D32 V36 A37 H38	D32-N34 PolarHBondContact O-N 3.35Å; N34-V36 PolarHBondContact O-N 3.1Å; N34-V36 VanDerWaalsContact O-N 3.1Å; N34-V36 WeakPolarHBondContact OD1-CB 3.1Å; N34-V36 PolarHBondContact OD1-N 2.86Å; N34-A37 HydrophobicContact CB-CB 3.87Å; N34-A37 PolarHBondContact O-N 3.18Å; N34-A37 PolarHBondContact OD1-N 3.28Å; N34-H38 PolarHBondContact O-CD2 2.91Å; N34-H38 VanDerWaalsContact O-CD2 3.24Å; N34-H38 PolarHBondContact O-N 2.96Å
35	I	92	Very high	89.5	Confident	51 Å²	51	77.8 Å²	77.8	26%	0.262	40%	0.401	S	S	.	.	H	α-helix	trans	-48.6	-36.6	176.6	-169.9	172.9	0	0	0	113.5	F20 A24 F33 F39 Y65	F20-I35 HydrophobicContact CE1-CD1 4.1Å; F20-I35 HydrophobicContact CE1-CG1 3.68Å; F20-I35 HydrophobicContact CZ-CG1 3.84Å; A24-I35 HydrophobicContact CB-CD1 3.89Å; A24-I35 HydrophobicContact CB-CG1 4.17Å; F33-I35 HydrophobicContact CD1-CB 4.43Å; F33-I35 HydrophobicContact CE1-CB 3.67Å; F33-I35 HydrophobicContact CE1-CD1 4.47Å; F33-I35 HydrophobicContact CE1-CG1 4.12Å; F33-I35 HydrophobicContact CZ-CB 3.8Å; F33-I35 HydrophobicContact CZ-CG1 4.01Å; F33-I35 PolarHBondContact O-N 3.01Å; I35-F39 VanDerWaalsContact O-CB 3.29Å; I35-F39 WeakPolarHBondContact O-CB 3.17Å; I35-F39 PolarHBondContact O-N 2.95Å; I35-Y65 HydrophobicContact CD1-CD1 4.1Å; I35-Y65 HydrophobicContact CD1-CD2 4.37Å; I35-Y65 HydrophobicContact CD1-CE1 4.4Å; I35-Y65 HydrophobicContact CD1-CG 4.09Å; I35-Y65 HydrophobicContact CG1-CD2 4.25Å; I35-Y65 HydrophobicContact CG1-CG 4.35Å
36	V	92.7	Very high	89.3	Confident	11 Å²	11	78.9 Å²	78.9	7%	0.067	40%	0.404	C	S	.	.	H	α-helix	trans	-70.9	-44.4	178.7	171.2	0	0	0	0	111.1	N34 F39 L40 F68	N34-V36 PolarHBondContact O-N 3.1Å; N34-V36 VanDerWaalsContact O-N 3.1Å; N34-V36 WeakPolarHBondContact OD1-CB 3.1Å; N34-V36 PolarHBondContact OD1-N 2.86Å; V36-F39 PolarHBondContact O-N 3.33Å; V36-L40 HydrophobicContact CG1-CD1 3.87Å; V36-L40 HydrophobicContact CG1-CG 4.45Å; V36-L40 WeakPolarHBondContact O-CB 3.5Å; V36-L40 VanDerWaalsContact O-CG 3.22Å; V36-L40 WeakPolarHBondContact O-CG 3.43Å; V36-L40 PolarHBondContact O-N 2.9Å; V36-F68 HydrophobicContact CG1-CD2 4.23Å; V36-F68 HydrophobicContact CG1-CE2 3.7Å
37	A	92.4	Very high	89.2	Confident	32 Å²	32	74.3 Å²	74.3	26%	0.264	38%	0.376	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.4	0	0	0	0	0	111.2	N34 L40 T41	N34-A37 HydrophobicContact CB-CB 3.87Å; N34-A37 PolarHBondContact O-N 3.18Å; N34-A37 PolarHBondContact OD1-N 3.28Å; A37-L40 PolarHBondContact O-N 2.84Å; A37-T41 PolarHBondContact O-N 3.19Å
38	H	92.2	Very high	89.2	Confident	64 Å²	64	76 Å²	76	30%	0.296	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-44.5	175.4	-72.6	-68.6	0	0	0	112.7	W23 F33 N34 L40 T41 F42	W23-H38 HydrophobicContact CH2-CB 3.71Å; W23-H38 AromaticContact CH2-CG 3.56Å; W23-H38 AromaticContact CH2-ND1 3.65Å; W23-H38 HydrophobicContact CZ3-CB 3.66Å; F33-H38 AromaticContact CD2-CD2 3.48Å; F33-H38 VanDerWaalsContact CD2-CD2 3.48Å; F33-H38 WeakPolarHBondContact CD2-CD2 3.46Å; F33-H38 AromaticContact CD2-NE2 3.78Å; F33-H38 HydrophobicContact CE2-CB 4.43Å; F33-H38 AromaticContact CE2-CD2 3.39Å; F33-H38 WeakPolarHBondContact CE2-CD2 3.41Å; N34-H38 PolarHBondContact O-CD2 2.91Å; N34-H38 VanDerWaalsContact O-CD2 3.24Å; N34-H38 PolarHBondContact O-N 2.96Å; H38-L40 VanDerWaalsContact C-N 3.32Å; H38-L40 PolarHBondContact O-N 3.25Å; H38-T41 PolarHBondContact O-N 3.06Å; H38-T41 VanDerWaalsContact O-N 3.1Å; H38-T41 PolarHBondContact O-OG1 3.37Å; H38-F42 HydrophobicContact CB-CD2 4.47Å; H38-F42 HydrophobicContact CB-CE2 4.29Å; H38-F42 WeakPolarHBondContact O-CD2 3.36Å; H38-F42 PolarHBondContact O-N 3.44Å; H38-F42 VanDerWaalsContact O-N 3.09Å
39	F	93.1	Very high	89.6	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-56	-48.5	175.4	-173.6	-113	0	0	0	111.4	Y16 M17 F20 I35 V36 T41 F42 I43 I51 Y65 F68 L72	Y16-F39 HydrophobicContact CE1-CE2 4.19Å; M17-F39 HydrophobicContact CE-CE2 3.92Å; M17-F39 HydrophobicContact CE-CZ 3.82Å; M17-F39 HydrophobicContact SD-CE2 3.58Å; M17-F39 VanDerWaalsContact SD-CE2 3.58Å; M17-F39 HydrophobicContact SD-CZ 3.68Å; F20-F39 AromaticContact CD1-CD2 3.75Å; F20-F39 HydrophobicContact CD1-CD2 3.75Å; F20-F39 HydrophobicContact CD1-CE2 4.33Å; F20-F39 AromaticContact CD2-CD2 3.94Å; F20-F39 HydrophobicContact CD2-CD2 3.94Å; F20-F39 HydrophobicContact CE1-CB 4.04Å; F20-F39 AromaticContact CE1-CD2 3.78Å; F20-F39 HydrophobicContact CE1-CD2 3.78Å; F20-F39 HydrophobicContact CE1-CG 4.31Å; F20-F39 HydrophobicContact CE2-CB 3.98Å; F20-F39 AromaticContact CE2-CD2 3.99Å; F20-F39 HydrophobicContact CE2-CD2 3.99Å; F20-F39 AromaticContact CG-CD2 3.83Å; F20-F39 HydrophobicContact CG-CD2 3.83Å; F20-F39 HydrophobicContact CG-CE2 4.35Å; F20-F39 HydrophobicContact CZ-CB 3.58Å; F20-F39 AromaticContact CZ-CD2 3.92Å; F20-F39 HydrophobicContact CZ-CD2 3.92Å; F20-F39 HydrophobicContact CZ-CG 4.24Å; I35-F39 VanDerWaalsContact O-CB 3.29Å; I35-F39 WeakPolarHBondContact O-CB 3.17Å; I35-F39 PolarHBondContact O-N 2.95Å; V36-F39 PolarHBondContact O-N 3.33Å; F39-T41 PolarHBondContact O-N 2.98Å; F39-F42 PolarHBondContact O-N 3.28Å; F39-I43 HydrophobicContact CD1-CG2 4.05Å; F39-I43 HydrophobicContact CD2-CG2 3.88Å; F39-I43 HydrophobicContact CE1-CD1 4.49Å; F39-I43 HydrophobicContact CE1-CG2 3.73Å; F39-I43 HydrophobicContact CE2-CG2 3.55Å; F39-I43 HydrophobicContact CG-CG2 4.13Å; F39-I43 HydrophobicContact CZ-CG2 3.47Å; F39-I43 VanDerWaalsContact CZ-CG2 3.47Å; F39-I43 WeakPolarHBondContact O-CG1 3.44Å; F39-I43 WeakPolarHBondContact O-CG2 3.4Å; F39-I43 PolarHBondContact O-N 2.97Å; F39-I43 VanDerWaalsContact O-N 3.09Å; F39-I51 HydrophobicContact CE1-CD1 4.03Å; F39-Y65 HydrophobicContact CB-CD2 4.39Å; F39-Y65 HydrophobicContact CB-CE2 4.27Å; F39-Y65 HydrophobicContact CD1-CE2 4.31Å; F39-Y65 AromaticContact CD2-CE2 3.79Å; F39-Y65 HydrophobicContact CD2-CE2 3.79Å; F39-Y65 HydrophobicContact CE2-CE2 4.15Å; F39-Y65 HydrophobicContact CG-CD2 4.3Å; F39-Y65 AromaticContact CG-CE2 3.88Å; F39-Y65 HydrophobicContact CG-CE2 3.88Å; F39-F68 HydrophobicContact CE1-CB 4.19Å; F39-L72 HydrophobicContact CE1-CD1 3.81Å; F39-L72 HydrophobicContact CZ-CD1 3.67Å
40	L	92.4	Very high	89.8	Confident	22 Å²	22	65.8 Å²	65.8	12%	0.115	34%	0.335	C	S	.	.	H	α-helix	trans	-64.5	-20.3	179.6	-66.8	170.3	0	0	0	113.8	V36 A37 H38 I43 Y48 I51 P60	V36-L40 HydrophobicContact CG1-CD1 3.87Å; V36-L40 HydrophobicContact CG1-CG 4.45Å; V36-L40 WeakPolarHBondContact O-CB 3.5Å; V36-L40 VanDerWaalsContact O-CG 3.22Å; V36-L40 WeakPolarHBondContact O-CG 3.43Å; V36-L40 PolarHBondContact O-N 2.9Å; A37-L40 PolarHBondContact O-N 2.84Å; H38-L40 VanDerWaalsContact C-N 3.32Å; H38-L40 PolarHBondContact O-N 3.25Å; L40-I43 HydrophobicContact CD2-CD1 4.06Å; L40-Y48 HydrophobicContact CB-CD2 4.28Å; L40-Y48 HydrophobicContact CB-CE2 4.39Å; L40-Y48 HydrophobicContact CD2-CD2 3.91Å; L40-Y48 HydrophobicContact CD2-CE2 4.15Å; L40-I51 HydrophobicContact CD2-CD1 4.1Å; L40-I51 HydrophobicContact CD2-CG2 4.13Å; L40-P60 HydrophobicContact CD1-CB 3.81Å; L40-P60 HydrophobicContact CD2-CB 3.98Å
41	T	91.3	Very high	89.8	Confident	100 Å²	100	62.3 Å²	62.3	61%	0.613	32%	0.316	S	S	*	.	H	α-helix	trans	-85.9	-34.1	171.9	60.5	0	0	0	0	113.4	A37 H38 F39	A37-T41 PolarHBondContact O-N 3.19Å; H38-T41 PolarHBondContact O-N 3.06Å; H38-T41 VanDerWaalsContact O-N 3.1Å; H38-T41 PolarHBondContact O-OG1 3.37Å; F39-T41 PolarHBondContact O-N 2.98Å
42	F	92.2	Very high	90	Very high	54 Å²	54	58.5 Å²	58.5	24%	0.237	30%	0.297	C	S	.	.	H	α-helix	trans	-81.2	-37.3	-177.9	-71.1	-60.4	0	0	0	114.8	M1 Y16 F20 W23 H38 F39 G44	M1-F42 HydrophobicContact CB-CB 4.39Å; M1-F42 HydrophobicContact CB-CD1 3.68Å; M1-F42 HydrophobicContact CB-CE1 4.14Å; M1-F42 HydrophobicContact CB-CG 4.08Å; M1-F42 HydrophobicContact CG-CB 4.49Å; M1-F42 HydrophobicContact SD-CB 4.39Å; M1-F42 HydrophobicContact SD-CG 4.44Å; Y16-F42 PolarHBondContact OH-O 2.85Å; F20-F42 HydrophobicContact CD2-CD2 4.4Å; F20-F42 HydrophobicContact CE2-CD2 4.07Å; W23-F42 HydrophobicContact CD2-CE2 4.16Å; W23-F42 AromaticContact CE2-CE2 3.9Å; W23-F42 HydrophobicContact CE3-CE2 4.05Å; W23-F42 AromaticContact CH2-CE2 3.58Å; W23-F42 HydrophobicContact CH2-CE2 3.58Å; W23-F42 HydrophobicContact CH2-CZ 4.3Å; W23-F42 AromaticContact CZ2-CE2 3.61Å; W23-F42 HydrophobicContact CZ2-CE2 3.61Å; W23-F42 AromaticContact CZ2-CZ 3.89Å; W23-F42 HydrophobicContact CZ2-CZ 3.89Å; W23-F42 HydrophobicContact CZ3-CD2 4.37Å; W23-F42 AromaticContact CZ3-CE2 3.78Å; W23-F42 HydrophobicContact CZ3-CE2 3.78Å; H38-F42 HydrophobicContact CB-CD2 4.47Å; H38-F42 HydrophobicContact CB-CE2 4.29Å; H38-F42 WeakPolarHBondContact O-CD2 3.36Å; H38-F42 PolarHBondContact O-N 3.44Å; H38-F42 VanDerWaalsContact O-N 3.09Å; F39-F42 PolarHBondContact O-N 3.28Å; F42-G44 PolarHBondContact O-N 3.44Å
43	I	90.8	Very high	90.3	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.281	C	S	.	.	S	Bend	trans	-57.3	-26	-176.3	58.7	178.8	0	0	0	114	L4 Y16 F39 L40 A47 I51	L4-I43 HydrophobicContact CB-CB 4.1Å; L4-I43 HydrophobicContact CB-CG2 4.16Å; L4-I43 HydrophobicContact CD2-CG2 4.25Å; L4-I43 PolarHBondContact N-O 3.25Å; Y16-I43 HydrophobicContact CE1-CG2 4.08Å; Y16-I43 WeakPolarHBondContact OH-CA 3.4Å; Y16-I43 PolarHBondContact OH-N 2.74Å; F39-I43 HydrophobicContact CD1-CG2 4.05Å; F39-I43 HydrophobicContact CD2-CG2 3.88Å; F39-I43 HydrophobicContact CE1-CD1 4.49Å; F39-I43 HydrophobicContact CE1-CG2 3.73Å; F39-I43 HydrophobicContact CE2-CG2 3.55Å; F39-I43 HydrophobicContact CG-CG2 4.13Å; F39-I43 HydrophobicContact CZ-CG2 3.47Å; F39-I43 VanDerWaalsContact CZ-CG2 3.47Å; F39-I43 WeakPolarHBondContact O-CG1 3.44Å; F39-I43 WeakPolarHBondContact O-CG2 3.4Å; F39-I43 PolarHBondContact O-N 2.97Å; F39-I43 VanDerWaalsContact O-N 3.09Å; L40-I43 HydrophobicContact CD2-CD1 4.06Å; I43-A47 HydrophobicContact CB-CB 3.77Å; I43-A47 HydrophobicContact CD1-CB 4.11Å; I43-A47 HydrophobicContact CG1-CB 4.12Å; I43-I51 HydrophobicContact CD1-CD1 3.36Å; I43-I51 HydrophobicContact CD1-CG1 4.48Å
44	G	91.1	Very high	90.2	Very high	13 Å²	13	54.9 Å²	54.9	13%	0.134	28%	0.278	C	S	.	.			trans	83.7	175.2	-178.4	0	0	0	0	0	114.5	F42 E46 Y48	F42-G44 PolarHBondContact O-N 3.44Å; G44-E46 PolarHBondContact O-N 3.32Å; G44-Y48 VanDerWaalsContact O-CB 3.23Å; G44-Y48 WeakPolarHBondContact O-CB 3.5Å; G44-Y48 PolarHBondContact O-N 3.31Å
45	K	90.6	Very high	90	Very high	170 Å²	170	51.5 Å²	51.5	74%	0.739	26%	0.261	S	S	*	.	H	α-helix	trans	-63.9	-37.7	-164	-174.9	-177.3	175	-171.7	0	114.2	S49	K45-S49 WeakPolarHBondContact O-CB 3.46Å; K45-S49 PolarHBondContact O-N 3.14Å; K45-S49 PolarHBondContact O-OG 3.36Å
46	E	86.5	Confident	89.7	Confident	135 Å²	135	53.5 Å²	53.5	63%	0.631	27%	0.271	S	S	*	.	H	α-helix	trans	-75.7	-53.2	-173.7	-75.3	156.7	-144.7	0	0	110.8	G44 Y48 S49 L50	G44-E46 PolarHBondContact O-N 3.32Å; E46-Y48 VanDerWaalsContact C-N 3.32Å; E46-Y48 PolarHBondContact O-N 3.47Å; E46-S49 WeakPolarHBondContact O-CA 3.48Å; E46-S49 WeakPolarHBondContact O-CB 3.29Å; E46-S49 PolarHBondContact O-N 2.97Å; E46-L50 PolarHBondContact O-N 2.98Å
47	A	89.4	Confident	89.3	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-53.7	-44.5	168.9	0	0	0	0	0	112.9	L4 T6 I43 S49 L50 I51	L4-A47 HydrophobicContact CB-CB 4.09Å; L4-A47 HydrophobicContact CD2-CB 4.08Å; L4-A47 HydrophobicContact CG-CB 4.24Å; T6-A47 HydrophobicContact CG2-CB 3.82Å; I43-A47 HydrophobicContact CB-CB 3.77Å; I43-A47 HydrophobicContact CD1-CB 4.11Å; I43-A47 HydrophobicContact CG1-CB 4.12Å; A47-S49 VanDerWaalsContact C-N 3.3Å; A47-S49 PolarHBondContact O-N 2.78Å; A47-L50 PolarHBondContact O-N 2.84Å; A47-I51 WeakPolarHBondContact O-CB 3.41Å; A47-I51 WeakPolarHBondContact O-CG1 3.15Å; A47-I51 PolarHBondContact O-N 3.14Å
48	Y	90.7	Very high	88.9	Confident	92 Å²	92	60.1 Å²	60.1	36%	0.361	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-37.6	174.4	-179.4	-90.3	0	0	0	112.7	L40 G44 E46 I51 K52	L40-Y48 HydrophobicContact CB-CD2 4.28Å; L40-Y48 HydrophobicContact CB-CE2 4.39Å; L40-Y48 HydrophobicContact CD2-CD2 3.91Å; L40-Y48 HydrophobicContact CD2-CE2 4.15Å; G44-Y48 VanDerWaalsContact O-CB 3.23Å; G44-Y48 WeakPolarHBondContact O-CB 3.5Å; G44-Y48 PolarHBondContact O-N 3.31Å; E46-Y48 VanDerWaalsContact C-N 3.32Å; E46-Y48 PolarHBondContact O-N 3.47Å; Y48-I51 PolarHBondContact O-N 3.16Å; Y48-K52 HydrophobicContact CE1-CD 4.39Å; Y48-K52 WeakPolarHBondContact O-CB 2.97Å; Y48-K52 PolarHBondContact O-N 3.2Å
49	S	88.9	Confident	88.6	Confident	55 Å²	55	64.5 Å²	64.5	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-69.6	-39.8	178.2	-59.7	0	0	0	0	111.9	K45 E46 A47 K52 I53	K45-S49 WeakPolarHBondContact O-CB 3.46Å; K45-S49 PolarHBondContact O-N 3.14Å; K45-S49 PolarHBondContact O-OG 3.36Å; E46-S49 WeakPolarHBondContact O-CA 3.48Å; E46-S49 WeakPolarHBondContact O-CB 3.29Å; E46-S49 PolarHBondContact O-N 2.97Å; A47-S49 VanDerWaalsContact C-N 3.3Å; A47-S49 PolarHBondContact O-N 2.78Å; S49-K52 PolarHBondContact O-N 3.1Å; S49-I53 WeakPolarHBondContact O-CG1 3.44Å; S49-I53 PolarHBondContact O-N 3.09Å
50	L	88.5	Confident	88.2	Confident	27 Å²	27	65.1 Å²	65.1	14%	0.141	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-52.1	170.4	172.3	67	0	0	0	110.8	T6 E46 A47 K52 I53 L54 L72 H75	T6-L50 HydrophobicContact CG2-CD2 3.71Å; E46-L50 PolarHBondContact O-N 2.98Å; A47-L50 PolarHBondContact O-N 2.84Å; L50-K52 VanDerWaalsContact C-N 3.27Å; L50-K52 PolarHBondContact O-N 3.37Å; L50-I53 WeakPolarHBondContact O-CA 3.44Å; L50-I53 WeakPolarHBondContact O-CB 3.36Å; L50-I53 PolarHBondContact O-N 2.9Å; L50-L54 HydrophobicContact CD1-CD1 3.94Å; L50-L54 HydrophobicContact CD1-CD2 4.46Å; L50-L54 HydrophobicContact CD1-CG 4.03Å; L50-L54 HydrophobicContact CD2-CD1 4.29Å; L50-L54 HydrophobicContact CG-CD1 3.79Å; L50-L54 HydrophobicContact CG-CG 4.25Å; L50-L54 WeakPolarHBondContact O-CG 3.13Å; L50-L54 PolarHBondContact O-N 3.38Å; L50-L72 HydrophobicContact CD2-CD2 3.88Å; L50-H75 WeakPolarHBondContact CD2-CD2 3.21Å
51	I	87.5	Confident	88.1	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-55.2	-43.8	177.9	-73.8	179.1	0	0	0	111.1	F39 L40 I43 A47 Y48 I53 L54 A55 P60 F68 L72	F39-I51 HydrophobicContact CE1-CD1 4.03Å; L40-I51 HydrophobicContact CD2-CD1 4.1Å; L40-I51 HydrophobicContact CD2-CG2 4.13Å; I43-I51 HydrophobicContact CD1-CD1 3.36Å; I43-I51 HydrophobicContact CD1-CG1 4.48Å; A47-I51 WeakPolarHBondContact O-CB 3.41Å; A47-I51 WeakPolarHBondContact O-CG1 3.15Å; A47-I51 PolarHBondContact O-N 3.14Å; Y48-I51 PolarHBondContact O-N 3.16Å; I51-I53 PolarHBondContact O-N 3.17Å; I51-I53 VanDerWaalsContact O-N 3.16Å; I51-L54 PolarHBondContact O-N 3.09Å; I51-L54 VanDerWaalsContact O-N 3.14Å; I51-A55 WeakPolarHBondContact O-CB 3.33Å; I51-A55 PolarHBondContact O-N 3.41Å; I51-P60 HydrophobicContact CG2-CB 4Å; I51-P60 HydrophobicContact CG2-CG 4.13Å; I51-F68 HydrophobicContact CD1-CD1 4.18Å; I51-F68 HydrophobicContact CG1-CD1 4.39Å; I51-F68 HydrophobicContact CG2-CD1 3.78Å; I51-F68 HydrophobicContact CG2-CE1 3.29Å; I51-F68 HydrophobicContact CG2-CZ 4.07Å; I51-L72 HydrophobicContact CD1-CD1 4.07Å; I51-L72 HydrophobicContact CD1-CD2 4.38Å; I51-L72 HydrophobicContact CD1-CG 4.44Å; I51-L72 HydrophobicContact CG1-CD1 4.45Å; I51-L72 HydrophobicContact CG1-CD2 3.91Å; I51-L72 HydrophobicContact CG1-CG 4.3Å
52	K	88.1	Confident	88	Confident	123 Å²	123	68.1 Å²	68.1	54%	0.535	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-21.7	177.8	-173.6	176.2	176.9	-177.3	0	113.5	Y48 S49 L50 L56 P60	Y48-K52 HydrophobicContact CE1-CD 4.39Å; Y48-K52 WeakPolarHBondContact O-CB 2.97Å; Y48-K52 PolarHBondContact O-N 3.2Å; S49-K52 PolarHBondContact O-N 3.1Å; L50-K52 VanDerWaalsContact C-N 3.27Å; L50-K52 PolarHBondContact O-N 3.37Å; K52-L56 WeakPolarHBondContact O-CD2 3.18Å; K52-L56 WeakPolarHBondContact O-CG 3.48Å; K52-P60 HydrophobicContact CB-CG 4.48Å
53	I	88	Confident	87.7	Confident	102 Å²	102	67 Å²	67	52%	0.523	34%	0.343	S	S	.	.	H	α-helix	trans	-86.9	-42.8	172.7	-63.7	164.4	0	0	0	110.8	S49 L50 I51 L56	S49-I53 WeakPolarHBondContact O-CG1 3.44Å; S49-I53 PolarHBondContact O-N 3.09Å; L50-I53 WeakPolarHBondContact O-CA 3.44Å; L50-I53 WeakPolarHBondContact O-CB 3.36Å; L50-I53 PolarHBondContact O-N 2.9Å; I51-I53 PolarHBondContact O-N 3.17Å; I51-I53 VanDerWaalsContact O-N 3.16Å; I53-L56 WeakPolarHBondContact O-CG 3.37Å
54	L	86.7	Confident	87.7	Confident	25 Å²	25	70.7 Å²	70.7	13%	0.131	37%	0.367	C	S	.	.	H	α-helix	trans	-68.3	-34.2	-179.2	-64.6	177.6	0	0	0	113.1	L50 I51 L56 L71 H75 F141	L50-L54 HydrophobicContact CD1-CD1 3.94Å; L50-L54 HydrophobicContact CD1-CD2 4.46Å; L50-L54 HydrophobicContact CD1-CG 4.03Å; L50-L54 HydrophobicContact CD2-CD1 4.29Å; L50-L54 HydrophobicContact CG-CD1 3.79Å; L50-L54 HydrophobicContact CG-CG 4.25Å; L50-L54 WeakPolarHBondContact O-CG 3.13Å; L50-L54 PolarHBondContact O-N 3.38Å; I51-L54 PolarHBondContact O-N 3.09Å; I51-L54 VanDerWaalsContact O-N 3.14Å; L54-L56 VanDerWaalsContact C-N 3.29Å; L54-L56 PolarHBondContact O-N 3.06Å; L54-L71 HydrophobicContact CB-CD1 4.34Å; L54-L71 HydrophobicContact CB-CD2 4.46Å; L54-L71 HydrophobicContact CD1-CB 4.3Å; L54-H75 HydrophobicContact CD1-CB 4.36Å; L54-F141 HydrophobicContact CD2-CD2 3.96Å; L54-F141 HydrophobicContact CD2-CE2 3.69Å
55	A	85.8	Confident	87.7	Confident	3 Å²	3	71.3 Å²	71.3	3%	0.025	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-12.6	-177	0	0	0	0	0	114.7	I51 D58 P60 L63	I51-A55 WeakPolarHBondContact O-CB 3.33Å; I51-A55 PolarHBondContact O-N 3.41Å; A55-D58 WeakPolarHBondContact O-CB 3.23Å; A55-D58 PolarHBondContact O-N 3.08Å; A55-P60 HydrophobicContact CB-CG 4.41Å; A55-L63 HydrophobicContact CB-CD1 3.58Å
56	L	84	Confident	87.7	Confident	92 Å²	92	66.7 Å²	66.7	48%	0.482	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	141	-169.6	-64.4	176	0	0	0	112.7	K52 I53 L54 D58 K140	K52-L56 WeakPolarHBondContact O-CD2 3.18Å; K52-L56 WeakPolarHBondContact O-CG 3.48Å; I53-L56 WeakPolarHBondContact O-CG 3.37Å; L54-L56 VanDerWaalsContact C-N 3.29Å; L54-L56 PolarHBondContact O-N 3.06Å; L56-D58 VanDerWaalsContact C-N 3.35Å; L56-K140 WeakPolarHBondContact O-CE 3.49Å; L56-K140 PolarHBondContact O-NZ 3.43Å
57	P	84.2	Confident	87.8	Confident	105 Å²	105	63 Å²	63	68%	0.682	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	cis	-81.5	-5.7	8.7	36	-37.9	0	0	0	114.8
58	D	84.3	Confident	87.6	Confident	78 Å²	78	63 Å²	63	42%	0.417	35%	0.346	S	S	.	.	S	Bend	trans	-77.9	158.7	-168.1	-53	-65.8	0	0	0	112.4	A55 L56 L63	A55-D58 WeakPolarHBondContact O-CB 3.23Å; A55-D58 PolarHBondContact O-N 3.08Å; L56-D58 VanDerWaalsContact C-N 3.35Å; D58-L63 HydrophobicContact CB-CD2 4.11Å; D58-L63 HydrophobicContact CB-CG 4.48Å
59	K	86.2	Confident	87.5	Confident	155 Å²	155	61.4 Å²	61.4	67%	0.674	34%	0.341	S	S	*	.			trans	-77	145.1	172.2	-63.4	177.7	-177.8	173.6	0	108.8	I61 S62	K59-I61 VanDerWaalsContact C-N 3.32Å; K59-I61 HydrophobicContact CB-CG2 4.41Å; K59-I61 PolarHBondContact O-N 3.41Å; K59-S62 PolarHBondContact N-OG 2.75Å; K59-S62 PolarHBondContact O-N 3.15Å; K59-S62 VanDerWaalsContact O-N 3.1Å; K59-S62 PolarHBondContact O-OG 3.14Å
60	P	85.4	Confident	87.6	Confident	13 Å²	13	63.1 Å²	63.1	8%	0.084	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-54.7	-45.9	176.1	-30.3	36.9	0	0	0	113.2	L40 I51 K52 A55 S62 L63 F68	L40-P60 HydrophobicContact CD1-CB 3.81Å; L40-P60 HydrophobicContact CD2-CB 3.98Å; I51-P60 HydrophobicContact CG2-CB 4Å; I51-P60 HydrophobicContact CG2-CG 4.13Å; K52-P60 HydrophobicContact CB-CG 4.48Å; A55-P60 HydrophobicContact CB-CG 4.41Å; P60-S62 PolarHBondContact O-N 3Å; P60-L63 PolarHBondContact O-N 2.89Å; P60-L63 VanDerWaalsContact O-N 3.08Å; P60-F68 HydrophobicContact CB-CZ 4.01Å; P60-F68 VanDerWaalsContact O-CE2 3.25Å; P60-F68 WeakPolarHBondContact O-CE2 3.31Å; P60-F68 WeakPolarHBondContact O-CZ 3.32Å
61	I	89.4	Confident	87.5	Confident	109 Å²	109	64.1 Å²	64.1	56%	0.559	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-63.6	-10.4	-178.3	-160.3	165.1	0	0	0	115	K59	K59-I61 VanDerWaalsContact C-N 3.32Å; K59-I61 HydrophobicContact CB-CG2 4.41Å; K59-I61 PolarHBondContact O-N 3.41Å
62	S	88.9	Confident	87.5	Confident	77 Å²	77	64.1 Å²	64.1	54%	0.538	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-99.6	-1.2	176.3	44.9	0	0	0	0	115	K59 P60	K59-S62 PolarHBondContact N-OG 2.75Å; K59-S62 PolarHBondContact O-N 3.15Å; K59-S62 VanDerWaalsContact O-N 3.1Å; K59-S62 PolarHBondContact O-OG 3.14Å; P60-S62 PolarHBondContact O-N 3Å
63	L	87.8	Confident	87.6	Confident	29 Å²	29	59.2 Å²	59.2	15%	0.152	33%	0.328	C	S	.	.	S	Bend	trans	-95.8	141.5	174.1	-61.4	178	0	0	0	110.7	A55 D58 P60 T67 F68 L71	A55-L63 HydrophobicContact CB-CD1 3.58Å; D58-L63 HydrophobicContact CB-CD2 4.11Å; D58-L63 HydrophobicContact CB-CG 4.48Å; P60-L63 PolarHBondContact O-N 2.89Å; P60-L63 VanDerWaalsContact O-N 3.08Å; L63-T67 HydrophobicContact CD1-CG2 4.41Å; L63-F68 HydrophobicContact CB-CE1 4.22Å; L63-F68 HydrophobicContact CB-CE2 3.76Å; L63-F68 HydrophobicContact CB-CZ 3.57Å; L63-F68 HydrophobicContact CD1-CE1 3.84Å; L63-F68 HydrophobicContact CD1-CZ 3.9Å; L63-F68 HydrophobicContact CG-CZ 4.17Å; L63-F68 WeakPolarHBondContact O-CE2 3.47Å; L63-L71 HydrophobicContact CD1-CD1 4.33Å
64	P	90.2	Very high	87.5	Confident	79 Å²	79	57.1 Å²	57.1	51%	0.513	32%	0.318	S	S	.	.			trans	-72.1	151.4	177.1	30.8	-34.7	0	0	0	111.3	A66 T67 F68	P64-A66 VanDerWaalsContact C-N 3.29Å; P64-A66 PolarHBondContact O-N 3.46Å; P64-T67 WeakPolarHBondContact O-CB 3.47Å; P64-T67 PolarHBondContact O-N 3.07Å; P64-F68 PolarHBondContact O-N 3.03Å
65	Y	90.9	Very high	87.4	Confident	26 Å²	26	57.6 Å²	57.6	10%	0.102	32%	0.319	C	S	.	.	H	α-helix	trans	-53.9	-39.8	-174.5	178.2	-102.7	0	0	0	114.2	M17 F20 E21 I35 F39 T67 F68 K69	M17-Y65 HydrophobicContact CE-CE2 4.32Å; M17-Y65 WeakPolarHBondContact CE-OH 3.45Å; F20-Y65 AromaticContact CD1-CE2 3.86Å; F20-Y65 HydrophobicContact CD1-CE2 3.86Å; F20-Y65 AromaticContact CD1-CZ 3.85Å; F20-Y65 WeakPolarHBondContact CD1-OH 3.41Å; F20-Y65 HydrophobicContact CE1-CD2 4.25Å; F20-Y65 AromaticContact CE1-CE2 3.5Å; F20-Y65 HydrophobicContact CE1-CE2 3.5Å; F20-Y65 AromaticContact CE1-CZ 3.84Å; F20-Y65 HydrophobicContact CZ-CE2 4.5Å; E21-Y65 HydrophobicContact CG-CE1 4.18Å; E21-Y65 WeakPolarHBondContact OE1-CE1 3.27Å; I35-Y65 HydrophobicContact CD1-CD1 4.1Å; I35-Y65 HydrophobicContact CD1-CD2 4.37Å; I35-Y65 HydrophobicContact CD1-CE1 4.4Å; I35-Y65 HydrophobicContact CD1-CG 4.09Å; I35-Y65 HydrophobicContact CG1-CD2 4.25Å; I35-Y65 HydrophobicContact CG1-CG 4.35Å; F39-Y65 HydrophobicContact CB-CD2 4.39Å; F39-Y65 HydrophobicContact CB-CE2 4.27Å; F39-Y65 HydrophobicContact CD1-CE2 4.31Å; F39-Y65 AromaticContact CD2-CE2 3.79Å; F39-Y65 HydrophobicContact CD2-CE2 3.79Å; F39-Y65 HydrophobicContact CE2-CE2 4.15Å; F39-Y65 HydrophobicContact CG-CD2 4.3Å; F39-Y65 AromaticContact CG-CE2 3.88Å; F39-Y65 HydrophobicContact CG-CE2 3.88Å; Y65-T67 VanDerWaalsContact C-N 3.26Å; Y65-T67 PolarHBondContact O-N 3.29Å; Y65-F68 WeakPolarHBondContact O-CA 3.36Å; Y65-F68 WeakPolarHBondContact O-CB 3.46Å; Y65-F68 PolarHBondContact O-N 3.22Å; Y65-K69 PolarHBondContact O-N 3.45Å
66	A	90	Very high	87.4	Confident	74 Å²	74	57.7 Å²	57.7	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-57.8	-37.1	176.5	0	0	0	0	0	113	P64 F68 K69 Q70	P64-A66 VanDerWaalsContact C-N 3.29Å; P64-A66 PolarHBondContact O-N 3.46Å; A66-F68 VanDerWaalsContact C-N 3.32Å; A66-F68 PolarHBondContact O-N 3.45Å; A66-K69 PolarHBondContact O-N 3.09Å; A66-Q70 PolarHBondContact O-N 2.83Å
67	T	88.6	Confident	87.4	Confident	56 Å²	56	57.9 Å²	57.9	34%	0.344	32%	0.316	S	S	.	.	H	α-helix	trans	-67.3	-32.8	174.9	-58.5	0	0	0	0	111.4	L63 P64 Y65 L71	L63-T67 HydrophobicContact CD1-CG2 4.41Å; P64-T67 WeakPolarHBondContact O-CB 3.47Å; P64-T67 PolarHBondContact O-N 3.07Å; Y65-T67 VanDerWaalsContact C-N 3.26Å; Y65-T67 PolarHBondContact O-N 3.29Å; T67-L71 HydrophobicContact CG2-CD1 3.93Å; T67-L71 HydrophobicContact CG2-CG 4.26Å; T67-L71 VanDerWaalsContact O-CB 3.32Å; T67-L71 WeakPolarHBondContact O-CB 3.42Å; T67-L71 VanDerWaalsContact O-CG 3.23Å; T67-L71 WeakPolarHBondContact O-CG 3.47Å; T67-L71 PolarHBondContact O-N 3.18Å
68	F	86	Confident	87.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-71.1	-44.7	173.5	-74.4	-51.9	0	0	0	113.5	V36 F39 I51 P60 L63 P64 Y65 A66 Q70 L71 L72	V36-F68 HydrophobicContact CG1-CD2 4.23Å; V36-F68 HydrophobicContact CG1-CE2 3.7Å; F39-F68 HydrophobicContact CE1-CB 4.19Å; I51-F68 HydrophobicContact CD1-CD1 4.18Å; I51-F68 HydrophobicContact CG1-CD1 4.39Å; I51-F68 HydrophobicContact CG2-CD1 3.78Å; I51-F68 HydrophobicContact CG2-CE1 3.29Å; I51-F68 HydrophobicContact CG2-CZ 4.07Å; P60-F68 HydrophobicContact CB-CZ 4.01Å; P60-F68 VanDerWaalsContact O-CE2 3.25Å; P60-F68 WeakPolarHBondContact O-CE2 3.31Å; P60-F68 WeakPolarHBondContact O-CZ 3.32Å; L63-F68 HydrophobicContact CB-CE1 4.22Å; L63-F68 HydrophobicContact CB-CE2 3.76Å; L63-F68 HydrophobicContact CB-CZ 3.57Å; L63-F68 HydrophobicContact CD1-CE1 3.84Å; L63-F68 HydrophobicContact CD1-CZ 3.9Å; L63-F68 HydrophobicContact CG-CZ 4.17Å; L63-F68 WeakPolarHBondContact O-CE2 3.47Å; P64-F68 PolarHBondContact O-N 3.03Å; Y65-F68 WeakPolarHBondContact O-CA 3.36Å; Y65-F68 WeakPolarHBondContact O-CB 3.46Å; Y65-F68 PolarHBondContact O-N 3.22Å; A66-F68 VanDerWaalsContact C-N 3.32Å; A66-F68 PolarHBondContact O-N 3.45Å; F68-Q70 PolarHBondContact O-N 3.3Å; F68-L71 PolarHBondContact O-N 3.11Å; F68-L72 WeakPolarHBondContact O-CB 3.4Å; F68-L72 WeakPolarHBondContact O-CG 3.18Å; F68-L72 PolarHBondContact O-N 2.87Å
69	K	89	Confident	86.9	Confident	59 Å²	59	54.9 Å²	54.9	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-55.2	-46.5	174.7	-171.2	163.6	-168.9	178.7	0	109.7	M17 E21 Y65 A66 L73	M17-K69 HydrophobicContact CE-CB 3.75Å; M17-K69 HydrophobicContact CE-CD 4.05Å; M17-K69 HydrophobicContact CE-CG 3.64Å; E21-K69 WeakPolarHBondContact OE1-CD 3.38Å; E21-K69 IonicContact OE1-NZ 2.61Å; E21-K69 PolarHBondContact OE1-NZ 3.32Å; E21-K69 IonicContact OE2-NZ 2.85Å; E21-K69 PolarHBondContact OE2-NZ 3.08Å; Y65-K69 PolarHBondContact O-N 3.45Å; A66-K69 PolarHBondContact O-N 3.09Å; K69-L73 WeakPolarHBondContact O-CB 3.29Å; K69-L73 PolarHBondContact O-N 3.3Å
70	Q	89.1	Confident	86.3	Confident	92 Å²	92	50.5 Å²	50.5	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-65.2	-50	176.4	-165.3	65.3	48.3	0	0	113.8	A66 F68 L72 L73 D74	A66-Q70 PolarHBondContact O-N 2.83Å; F68-Q70 PolarHBondContact O-N 3.3Å; Q70-L72 VanDerWaalsContact C-N 3.28Å; Q70-L72 PolarHBondContact O-N 2.73Å; Q70-L73 PolarHBondContact O-N 2.84Å; Q70-D74 PolarHBondContact NE2-OD1 3.48Å; Q70-D74 WeakPolarHBondContact O-CB 3.46Å; Q70-D74 PolarHBondContact O-N 3.37Å
71	L	87.9	Confident	85.6	Confident	48 Å²	48	52.7 Å²	52.7	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-36.1	-178.2	-78.2	173.1	0	0	0	113	L54 L63 T67 F68 H75	L54-L71 HydrophobicContact CB-CD1 4.34Å; L54-L71 HydrophobicContact CB-CD2 4.46Å; L54-L71 HydrophobicContact CD1-CB 4.3Å; L63-L71 HydrophobicContact CD1-CD1 4.33Å; T67-L71 HydrophobicContact CG2-CD1 3.93Å; T67-L71 HydrophobicContact CG2-CG 4.26Å; T67-L71 VanDerWaalsContact O-CB 3.32Å; T67-L71 WeakPolarHBondContact O-CB 3.42Å; T67-L71 VanDerWaalsContact O-CG 3.23Å; T67-L71 WeakPolarHBondContact O-CG 3.47Å; T67-L71 PolarHBondContact O-N 3.18Å; F68-L71 PolarHBondContact O-N 3.11Å; L71-H75 PolarHBondContact O-N 3.05Å
72	L	87.9	Confident	84.1	Confident	2 Å²	2	51 Å²	51	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-75.3	-44.1	174.5	-70.2	172.1	0	0	0	111.8	L4 F13 F39 L50 I51 F68 Q70 D74 H75 V76	L4-L72 HydrophobicContact CD2-CD1 3.93Å; F13-L72 HydrophobicContact CE2-CB 3.61Å; F13-L72 HydrophobicContact CE2-CD1 4.23Å; F13-L72 HydrophobicContact CZ-CB 3.62Å; F39-L72 HydrophobicContact CE1-CD1 3.81Å; F39-L72 HydrophobicContact CZ-CD1 3.67Å; L50-L72 HydrophobicContact CD2-CD2 3.88Å; I51-L72 HydrophobicContact CD1-CD1 4.07Å; I51-L72 HydrophobicContact CD1-CD2 4.38Å; I51-L72 HydrophobicContact CD1-CG 4.44Å; I51-L72 HydrophobicContact CG1-CD1 4.45Å; I51-L72 HydrophobicContact CG1-CD2 3.91Å; I51-L72 HydrophobicContact CG1-CG 4.3Å; F68-L72 WeakPolarHBondContact O-CB 3.4Å; F68-L72 WeakPolarHBondContact O-CG 3.18Å; F68-L72 PolarHBondContact O-N 2.87Å; Q70-L72 VanDerWaalsContact C-N 3.28Å; Q70-L72 PolarHBondContact O-N 2.73Å; L72-D74 VanDerWaalsContact C-N 3.29Å; L72-D74 PolarHBondContact O-N 2.84Å; L72-H75 WeakPolarHBondContact O-CB 3.2Å; L72-H75 PolarHBondContact O-N 3.09Å; L72-H75 VanDerWaalsContact O-N 3.08Å; L72-V76 WeakPolarHBondContact O-CG2 3.34Å; L72-V76 PolarHBondContact O-N 3.37Å
73	L	88.3	Confident	82.2	Confident	19 Å²	19	51.9 Å²	51.9	10%	0.099	29%	0.286	C	S	.	.	H	α-helix	trans	-57.3	-42.3	176.4	-171.8	78.9	0	0	0	111.7	F10 F13 K69 Q70 V76 K77	F10-L73 HydrophobicContact CE2-CD1 3.45Å; F10-L73 VanDerWaalsContact CE2-CD1 3.45Å; F10-L73 HydrophobicContact CE2-CG 4.33Å; F10-L73 HydrophobicContact CZ-CD1 3.76Å; F13-L73 HydrophobicContact CD1-CD1 4.05Å; F13-L73 HydrophobicContact CE1-CB 4.05Å; F13-L73 HydrophobicContact CE1-CD1 3.68Å; K69-L73 WeakPolarHBondContact O-CB 3.29Å; K69-L73 PolarHBondContact O-N 3.3Å; Q70-L73 PolarHBondContact O-N 2.84Å; L73-V76 PolarHBondContact O-N 3.5Å; L73-K77 HydrophobicContact CG-CD 4.25Å; L73-K77 WeakPolarHBondContact O-CB 3.45Å; L73-K77 VanDerWaalsContact O-CG 3.23Å; L73-K77 WeakPolarHBondContact O-CG 3.46Å; L73-K77 PolarHBondContact O-N 2.86Å
74	D	86.3	Confident	80.1	Confident	59 Å²	59	53 Å²	53	32%	0.316	30%	0.304	S	S	.	.	H	α-helix	trans	-66.5	-37.3	176.3	-67.5	-18.3	0	0	0	111.5	Q70 L72 Y78	Q70-D74 PolarHBondContact NE2-OD1 3.48Å; Q70-D74 WeakPolarHBondContact O-CB 3.46Å; Q70-D74 PolarHBondContact O-N 3.37Å; L72-D74 VanDerWaalsContact C-N 3.29Å; L72-D74 PolarHBondContact O-N 2.84Å; D74-Y78 VanDerWaalsContact O-CB 3.27Å; D74-Y78 WeakPolarHBondContact O-CB 3.13Å; D74-Y78 PolarHBondContact O-N 2.96Å
75	H	85.6	Confident	77.9	Confident	35 Å²	35	55 Å²	55	16%	0.162	31%	0.305	C	S	.	.	H	α-helix	trans	-67.7	-45.1	174.4	-174.9	67.1	0	0	0	112.4	L50 L54 L71 L72 Y78 T79	L50-H75 WeakPolarHBondContact CD2-CD2 3.21Å; L54-H75 HydrophobicContact CD1-CB 4.36Å; L71-H75 PolarHBondContact O-N 3.05Å; L72-H75 WeakPolarHBondContact O-CB 3.2Å; L72-H75 PolarHBondContact O-N 3.09Å; L72-H75 VanDerWaalsContact O-N 3.08Å; H75-Y78 WeakPolarHBondContact O-CB 3.42Å; H75-Y78 PolarHBondContact O-N 2.94Å; H75-T79 PolarHBondContact O-N 2.92Å; H75-T79 PolarHBondContact O-OG1 3.43Å
76	V	85.4	Confident	75.5	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.024	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-38.4	178.3	172.2	0	0	0	0	111	F10 F13 L72 L73 T79 N80	F10-V76 HydrophobicContact CD2-CG1 4.28Å; F13-V76 HydrophobicContact CB-CG1 4.02Å; F13-V76 HydrophobicContact CB-CG2 4.26Å; F13-V76 HydrophobicContact CD2-CG2 3.83Å; F13-V76 HydrophobicContact CE2-CG2 4.39Å; F13-V76 HydrophobicContact CG-CB 4.41Å; F13-V76 HydrophobicContact CG-CG1 4.29Å; F13-V76 HydrophobicContact CG-CG2 3.95Å; L72-V76 WeakPolarHBondContact O-CG2 3.34Å; L72-V76 PolarHBondContact O-N 3.37Å; L73-V76 PolarHBondContact O-N 3.5Å; V76-T79 PolarHBondContact O-OG1 3.22Å; V76-T79 VanDerWaalsContact O-OG1 3.14Å; V76-N80 WeakPolarHBondContact CG1-ND2 3.35Å; V76-N80 WeakPolarHBondContact O-CB 3.46Å; V76-N80 PolarHBondContact O-N 2.96Å; V76-N80 VanDerWaalsContact O-N 3.13Å; V76-N80 PolarHBondContact O-ND2 3.48Å
77	K	84.4	Confident	73.1	Confident	96 Å²	96	65.7 Å²	65.7	42%	0.417	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-45.1	170.2	-75.4	169.7	179.1	173.6	0	111.3	F10 L73 S81	F10-K77 HydrophobicContact CD2-CG 4.19Å; F10-K77 HydrophobicContact CE2-CD 4.45Å; F10-K77 HydrophobicContact CE2-CG 3.99Å; L73-K77 HydrophobicContact CG-CD 4.25Å; L73-K77 WeakPolarHBondContact O-CB 3.45Å; L73-K77 VanDerWaalsContact O-CG 3.23Å; L73-K77 WeakPolarHBondContact O-CG 3.46Å; L73-K77 PolarHBondContact O-N 2.86Å; K77-S81 VanDerWaalsContact O-CB 3.22Å; K77-S81 WeakPolarHBondContact O-CB 3.23Å; K77-S81 PolarHBondContact O-N 3.06Å; K77-S81 PolarHBondContact O-OG 2.92Å
78	Y	78.8	Confident	70.8	Confident	74 Å²	74	72.4 Å²	72.4	29%	0.29	36%	0.361	S	S	.	.	H	α-helix	trans	-58.6	-53.8	177.1	177.6	-82.2	0	0	0	111.6	D74 H75 N80 S81 E82 F141	D74-Y78 VanDerWaalsContact O-CB 3.27Å; D74-Y78 WeakPolarHBondContact O-CB 3.13Å; D74-Y78 PolarHBondContact O-N 2.96Å; H75-Y78 WeakPolarHBondContact O-CB 3.42Å; H75-Y78 PolarHBondContact O-N 2.94Å; Y78-N80 PolarHBondContact O-N 3.36Å; Y78-S81 PolarHBondContact O-N 3.3Å; Y78-S81 PolarHBondContact O-OG 3.31Å; Y78-E82 HydrophobicContact CE1-CB 4.43Å; Y78-E82 WeakPolarHBondContact CE1-OE2 3.46Å; Y78-E82 PolarHBondContact O-N 3.46Å; Y78-E82 PolarHBondContact OH-OE2 3.37Å; Y78-F141 HydrophobicContact CD1-CE1 4.36Å; Y78-F141 HydrophobicContact CD2-CD1 4.28Å; Y78-F141 AromaticContact CD2-CE1 3.83Å; Y78-F141 HydrophobicContact CD2-CE1 3.83Å; Y78-F141 HydrophobicContact CE2-CE1 4.08Å; Y78-F141 HydrophobicContact CG-CE1 4.01Å
79	T	77.9	Confident	68.5	Low	46 Å²	46	75.4 Å²	75.4	28%	0.282	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-44.7	-176.6	51.8	0	0	0	0	112.4	H75 V76 S81 E82 C83	H75-T79 PolarHBondContact O-N 2.92Å; H75-T79 PolarHBondContact O-OG1 3.43Å; V76-T79 PolarHBondContact O-OG1 3.22Å; V76-T79 VanDerWaalsContact O-OG1 3.14Å; T79-S81 VanDerWaalsContact C-N 3.35Å; T79-S81 PolarHBondContact O-N 2.87Å; T79-E82 PolarHBondContact O-N 3Å; T79-C83 WeakPolarHBondContact O-CB 3.33Å; T79-C83 PolarHBondContact O-N 2.97Å; T79-C83 VanDerWaalsContact O-N 3.07Å
80	N	73.8	Confident	66.1	Low	64 Å²	64	78.8 Å²	78.8	34%	0.342	40%	0.403	S	S	.	.	H	α-helix	trans	-63.9	-39	175.8	-76.9	-76.5	0	0	0	111.8	V76 Y78 G84	V76-N80 WeakPolarHBondContact CG1-ND2 3.35Å; V76-N80 WeakPolarHBondContact O-CB 3.46Å; V76-N80 PolarHBondContact O-N 2.96Å; V76-N80 VanDerWaalsContact O-N 3.13Å; V76-N80 PolarHBondContact O-ND2 3.48Å; Y78-N80 PolarHBondContact O-N 3.36Å; N80-G84 PolarHBondContact O-N 3.36Å
81	S	70.7	Confident	63.7	Low	59 Å²	59	84.4 Å²	84.4	41%	0.413	43%	0.426	S	S	.	.	H	α-helix	trans	-69.4	-37.4	177.7	77	0	0	0	0	113.8	K77 Y78 T79 K85	K77-S81 VanDerWaalsContact O-CB 3.22Å; K77-S81 WeakPolarHBondContact O-CB 3.23Å; K77-S81 PolarHBondContact O-N 3.06Å; K77-S81 PolarHBondContact O-OG 2.92Å; Y78-S81 PolarHBondContact O-N 3.3Å; Y78-S81 PolarHBondContact O-OG 3.31Å; T79-S81 VanDerWaalsContact C-N 3.35Å; T79-S81 PolarHBondContact O-N 2.87Å; S81-K85 WeakPolarHBondContact O-CG 3.38Å; S81-K85 PolarHBondContact O-N 3.36Å
82	E	58.2	Low	61.1	Low	74 Å²	74	89.5 Å²	89.5	35%	0.346	45%	0.45	S	S	.	.	H	α-helix	trans	-73.1	-33.1	178.1	-161	-177.4	164.7	0	0	111.3	Y78 T79 R86	Y78-E82 HydrophobicContact CE1-CB 4.43Å; Y78-E82 WeakPolarHBondContact CE1-OE2 3.46Å; Y78-E82 PolarHBondContact O-N 3.46Å; Y78-E82 PolarHBondContact OH-OE2 3.37Å; T79-E82 PolarHBondContact O-N 3Å; E82-R86 IonicContact OE1-CZ 3.62Å; E82-R86 IonicContact OE1-NE 3.83Å; E82-R86 IonicContact OE1-NH2 2.67Å; E82-R86 PolarHBondContact OE1-NH2 2.98Å
83	C	50	Low	58.7	Low	94 Å²	94	93.8 Å²	93.8	64%	0.635	48%	0.477	S	S	*	.	H	α-helix	trans	-64.3	-53.5	172.3	-162	0	0	0	0	111.2	T79 K85 R86	T79-C83 WeakPolarHBondContact O-CB 3.33Å; T79-C83 PolarHBondContact O-N 2.97Å; T79-C83 VanDerWaalsContact O-N 3.07Å; C83-K85 PolarHBondContact O-N 3.03Å; C83-K85 VanDerWaalsContact O-N 3.15Å; C83-R86 PolarHBondContact O-N 2.86Å
84	G	44.1	Very low	56.3	Low	52 Å²	52	105 Å²	105	54%	0.536	52%	0.517	S	S	.	.	H	α-helix	trans	-65.2	-17.6	-176.4	0	0	0	0	0	115.8	N80	N80-G84 PolarHBondContact O-N 3.36Å
85	K	43.4	Very low	54	Low	122 Å²	122	109.6 Å²	109.6	53%	0.53	54%	0.537	S	S	.	.	H	α-helix	trans	-85	-20	177.1	-76.1	-179	177.9	-178.1	0	113.9	S81 C83 E131	S81-K85 WeakPolarHBondContact O-CG 3.38Å; S81-K85 PolarHBondContact O-N 3.36Å; C83-K85 PolarHBondContact O-N 3.03Å; C83-K85 VanDerWaalsContact O-N 3.15Å; K85-E131 IonicContact NZ-OE1 2.87Å
86	R	40.4	Very low	51.6	Low	150 Å²	150	112.7 Å²	112.7	57%	0.566	56%	0.555	S	S	*	*	H	α-helix	trans	-80.1	-37	-172.9	-70.5	-179.2	-176.2	-160.5	3.4	114.9	E82 C83 K88 S89	E82-R86 IonicContact OE1-CZ 3.62Å; E82-R86 IonicContact OE1-NE 3.83Å; E82-R86 IonicContact OE1-NH2 2.67Å; E82-R86 PolarHBondContact OE1-NH2 2.98Å; C83-R86 PolarHBondContact O-N 2.86Å; R86-K88 PolarHBondContact O-N 3.06Å; R86-S89 PolarHBondContact O-N 3.13Å; R86-S89 VanDerWaalsContact O-N 3.11Å; R86-S89 PolarHBondContact O-OG 3.08Å
87	E	39.7	Very low	49.3	Very low	175 Å²	175	122 Å²	122	82%	0.818	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-19.3	-178.1	-77.5	-164.3	127.8	0	0	114.9
88	K	39.8	Very low	47	Very low	196 Å²	196	127.9 Å²	127.9	85%	0.852	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-8	-179.2	-69.7	172	-176.2	165.9	0	113.9	R86	R86-K88 PolarHBondContact O-N 3.06Å
89	S	37.6	Very low	44.9	Very low	64 Å²	64	129.3 Å²	129.3	45%	0.448	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.3	-18.1	178.1	35.5	0	0	0	0	115.3	R86 K91	R86-S89 PolarHBondContact O-N 3.13Å; R86-S89 VanDerWaalsContact O-N 3.11Å; R86-S89 PolarHBondContact O-OG 3.08Å; S89-K91 PolarHBondContact O-N 3.34Å
90	D	38.7	Very low	42.7	Very low	129 Å²	129	132.3 Å²	132.3	69%	0.69	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	17.3	-165.7	-88.8	-29	0	0	0	117.2
91	K	39.8	Very low	40.8	Very low	211 Å²	211	135.1 Å²	135.1	92%	0.917	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	-0.6	176.4	-74.4	-176.7	178	173.9	0	115.9	S89	S89-K91 PolarHBondContact O-N 3.34Å
92	M	33.2	Very low	39	Very low	154 Å²	154	139.3 Å²	139.3	76%	0.759	69%	0.687	S	S	*	*	S	Bend	trans	-109.4	-15.6	-177.4	-166	56.6	78.7	0	0	115.2
93	T	36.4	Very low	37.8	Very low	92 Å²	92	144 Å²	144	56%	0.564	71%	0.713	S	S	*	*			trans	-101.1	-8.2	-161.8	-29.7	0	0	0	0	115.8	Q95	T93-Q95 VanDerWaalsContact C-N 3.25Å; T93-Q95 PolarHBondContact O-N 2.8Å; T93-Q95 VanDerWaalsContact O-N 3.17Å
94	R	38.8	Very low	36.8	Very low	254 Å²	254	144.3 Å²	144.3	96%	0.958	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-4.2	-176.2	-76.7	-165.4	-178.9	-155.6	0.9	116
95	Q	37.2	Very low	36.1	Very low	157 Å²	157	153.1 Å²	153.1	73%	0.734	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-23.5	178.2	-124.7	171.2	-2.8	0	0	114.2	T93 F97 R98	T93-Q95 VanDerWaalsContact C-N 3.25Å; T93-Q95 PolarHBondContact O-N 2.8Å; T93-Q95 VanDerWaalsContact O-N 3.17Å; Q95-F97 PolarHBondContact O-N 3.44Å; Q95-R98 PolarHBondContact O-N 3.01Å
96	N	35.5	Very low	35.4	Very low	99 Å²	99	159.1 Å²	159.1	53%	0.529	75%	0.752	S	S	.	*	G	3₁₀ helix	trans	-76.8	-22.7	-169.5	-66	-20.1	0	0	0	113.8	R98	N96-R98 PolarHBondContact O-N 3.35Å
97	F	37.5	Very low	34.9	Very low	200 Å²	200	158.1 Å²	158.1	88%	0.877	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-74	-2.9	178.5	-145.4	-93	0	0	0	114.3	Q95	Q95-F97 PolarHBondContact O-N 3.44Å
98	R	36.2	Very low	34.7	Very low	220 Å²	220	154.7 Å²	154.7	83%	0.83	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-103	-9.7	-178.6	-123.6	179.8	-174.5	-172.1	1.7	115.2	Q95 N96	Q95-R98 PolarHBondContact O-N 3.01Å; N96-R98 PolarHBondContact O-N 3.35Å
99	N	33.9	Very low	34.4	Very low	104 Å²	104	152.2 Å²	152.2	56%	0.556	76%	0.757	S	S	*	*	S	Bend	trans	-105.7	-12.5	-169.3	-68.8	-10.1	0	0	0	114.7	T101 L102	N99-T101 PolarHBondContact O-N 3.41Å; N99-L102 PolarHBondContact O-N 3.02Å
100	S	32.5	Very low	34.2	Very low	108 Å²	108	159 Å²	159	76%	0.755	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-14	179.8	-50.9	0	0	0	0	114.4	L102	S100-L102 PolarHBondContact O-N 2.98Å
101	T	33.5	Very low	33.7	Very low	123 Å²	123	159.6 Å²	159.6	76%	0.755	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-0.5	-176.9	-31.2	0	0	0	0	114.1	N99	N99-T101 PolarHBondContact O-N 3.41Å
102	L	32.6	Very low	33.4	Very low	147 Å²	147	158.5 Å²	158.5	77%	0.77	77%	0.774	S	S	*	*	S	Bend	trans	-118.4	-11.8	-171.2	-77.9	174.2	0	0	0	117.2	N99 S100 S104	N99-L102 PolarHBondContact O-N 3.02Å; S100-L102 PolarHBondContact O-N 2.98Å; L102-S104 PolarHBondContact O-N 3.25Å; L102-S104 VanDerWaalsContact O-N 3.09Å
103	I	33.1	Very low	33.5	Very low	173 Å²	173	156.5 Å²	156.5	89%	0.887	78%	0.775	S	S	*	*			trans	-90	56.4	174.6	-46.1	-174.4	0	0	0	110.4
104	S	29.3	Very low	33.2	Very low	100 Å²	100	162.7 Å²	162.7	70%	0.699	79%	0.789	S	S	*	*			trans	-131.8	68.5	174.5	-169.7	0	0	0	0	110.6	L102	L102-S104 PolarHBondContact O-N 3.25Å; L102-S104 VanDerWaalsContact O-N 3.09Å
105	R	28	Very low	32.8	Very low	237 Å²	237	154.1 Å²	154.1	89%	0.894	77%	0.769	S	S	*	*			trans	170.1	103.4	160.8	-96.9	153.3	-178.8	-170.7	1	110.8
106	R	30.2	Very low	32.8	Very low	249 Å²	249	154.3 Å²	154.3	94%	0.94	77%	0.774	S	S	*	*			trans	174.3	40.4	143.8	-97.8	170	-173.3	-163	2.7	114.2	S108	R106-S108 PolarHBondContact O-N 3.11Å
107	S	29.3	Very low	32.7	Very low	129 Å²	129	156 Å²	156	90%	0.902	78%	0.783	S	S	*	*			trans	-79.2	105.6	158.7	39	0	0	0	0	109.1
108	S	36.2	Very low	32.5	Very low	102 Å²	102	152.9 Å²	152.9	71%	0.713	78%	0.781	S	S	*	*			trans	-149.9	140.3	176.2	-170.8	0	0	0	0	111.5	R106	R106-S108 PolarHBondContact O-N 3.11Å
109	M	33.5	Very low	32.2	Very low	144 Å²	144	147.1 Å²	147.1	71%	0.709	77%	0.774	S	S	*	*	S	Bend	trans	66.4	102.4	174.1	-69.6	-72.1	104.8	0	0	118.6
110	R	32.7	Very low	32.3	Very low	208 Å²	208	149.6 Å²	149.6	79%	0.785	79%	0.787	S	S	*	*				95.4	86.9	119	-161.6	176.6	-61.8	-123.6	-2.3	119
111	N	29.3	Very low	32.1	Very low	141 Å²	141	148.4 Å²	148.4	75%	0.754	78%	0.779	S	S	*	*			trans	-9.3	126.3	147.7	-37.5	-6.8	0	0	0	117.1
112	Q	33.3	Very low	32	Very low	188 Å²	188	147.9 Å²	147.9	88%	0.879	78%	0.778	S	S	*	*				178.1	142.2	106.1	-97.4	162.2	91.3	0	0	113.9
113	S	33.5	Very low	31.7	Very low	111 Å²	111	149 Å²	149	78%	0.776	78%	0.78	S	S	*	*			trans	64	112.7	152	-152.3	0	0	0	0	121.2
114	Y	31.4	Very low	31.5	Very low	222 Å²	222	146.4 Å²	146.4	87%	0.871	77%	0.772	S	S	*	*			trans	80.9	128.2	140.6	-146.4	-102.1	0	0	0	120.8
115	S	30.8	Very low	31.7	Very low	75 Å²	75	148 Å²	148	52%	0.524	78%	0.778	S	S	.	*			trans	67.6	58.1	157.2	-173	0	0	0	0	119.7	N117	S115-N117 PolarHBondContact O-N 2.81Å; S115-N117 VanDerWaalsContact O-N 3.15Å; S115-N117 PolarHBondContact OG-ND2 3.21Å
116	D	36.9	Very low	32.1	Very low	160 Å²	160	143.7 Å²	143.7	86%	0.856	77%	0.767	S	S	*	*			trans	-79.8	89.5	158	-80.9	-43.8	0	0	0	111.5	T118	D116-T118 PolarHBondContact O-N 3.19Å; D116-T118 VanDerWaalsContact O-N 3.16Å
117	N	33.5	Very low	32.3	Very low	134 Å²	134	139.1 Å²	139.1	72%	0.717	76%	0.761	S	S	*	*			trans	-75.4	93.9	163.2	-60.5	-70.5	0	0	0	108	S115 S119	S115-N117 PolarHBondContact O-N 2.81Å; S115-N117 VanDerWaalsContact O-N 3.15Å; S115-N117 PolarHBondContact OG-ND2 3.21Å; N117-S119 PolarHBondContact O-N 2.92Å
118	T	33.5	Very low	32.5	Very low	136 Å²	136	141.1 Å²	141.1	83%	0.834	76%	0.762	S	S	*	*			trans	-71.3	63.6	168.8	-46.9	0	0	0	0	110.3	D116 L120	D116-T118 PolarHBondContact O-N 3.19Å; D116-T118 VanDerWaalsContact O-N 3.16Å; T118-L120 PolarHBondContact O-N 3.47Å
119	S	30.1	Very low	32.5	Very low	98 Å²	98	144 Å²	144	69%	0.685	76%	0.764	S	S	*	*			trans	-67.3	96.7	165.5	-175.2	0	0	0	0	106.9	N117 S121	N117-S119 PolarHBondContact O-N 2.92Å; S119-S121 PolarHBondContact O-N 3.2Å
120	L	34.7	Very low	32.9	Very low	157 Å²	157	143.7 Å²	143.7	82%	0.822	76%	0.761	S	S	*	*			trans	-64.1	91.3	161.9	-172	71.9	0	0	0	106.7	T118 C122	T118-L120 PolarHBondContact O-N 3.47Å; L120-C122 PolarHBondContact O-N 2.93Å; L120-C122 VanDerWaalsContact O-N 3.11Å
121	S	29.9	Very low	33.5	Very low	83 Å²	83	139.8 Å²	139.8	58%	0.58	75%	0.751	S	S	*	*			trans	-62.7	110.4	-177.8	-177.7	0	0	0	0	109	S119 E123	S119-S121 PolarHBondContact O-N 3.2Å; S121-E123 VanDerWaalsContact C-N 3.28Å; S121-E123 PolarHBondContact O-N 2.81Å
122	C	29.4	Very low	34.3	Very low	111 Å²	111	137.8 Å²	137.8	75%	0.75	74%	0.736	S	S	*	*			trans	-70.1	92.8	162.7	-58.5	0	0	0	0	106.9	L120 T124	L120-C122 PolarHBondContact O-N 2.93Å; L120-C122 VanDerWaalsContact O-N 3.11Å; C122-T124 PolarHBondContact O-N 2.96Å
123	E	28.3	Very low	35.3	Very low	172 Å²	172	130.5 Å²	130.5	80%	0.804	71%	0.706	S	S	*	*			trans	-55.1	126.2	177	-70.6	-177.4	119.4	0	0	109.6	S121 V125	S121-E123 VanDerWaalsContact C-N 3.28Å; S121-E123 PolarHBondContact O-N 2.81Å; E123-V125 PolarHBondContact O-N 3.13Å
124	T	27.1	Very low	36.5	Very low	118 Å²	118	129.8 Å²	129.8	72%	0.724	69%	0.689	S	S	*	*			trans	-83.8	86.7	-167.6	-50.2	0	0	0	0	109.9	C122	C122-T124 PolarHBondContact O-N 2.96Å
125	V	35.1	Very low	38	Very low	134 Å²	134	119.6 Å²	119.6	81%	0.812	65%	0.65	S	S	*	*			trans	-82.6	116.3	162.3	-175.3	0	0	0	0	107.3	E123	E123-V125 PolarHBondContact O-N 3.13Å
126	H	34.7	Very low	39.4	Very low	146 Å²	146	123 Å²	123	68%	0.676	66%	0.661	S	S	*	*			trans	-76.3	131.1	169.7	-70.3	-100.3	0	0	0	109.2
127	D	36.2	Very low	39.9	Very low	152 Å²	152	119.4 Å²	119.4	81%	0.813	64%	0.638	S	S	*	*				-178.7	160.2	116.5	-83.2	-14.9	0	0	0	110.1	E129	D127-E129 PolarHBondContact O-N 3.14Å; D127-E129 VanDerWaalsContact O-N 3.08Å
128	D	31.6	Very low	41.2	Very low	171 Å²	171	115.3 Å²	115.3	91%	0.914	62%	0.619	S	S	*	*			trans	-80.6	85.3	-156.8	-66	-57.7	0	0	0	116
129	E	36.9	Very low	42.2	Very low	162 Å²	162	110.7 Å²	110.7	76%	0.757	60%	0.599	S	S	*	*			trans	-124	125.3	157	-72.4	-166.3	170.7	0	0	112	D127 E131	D127-E129 PolarHBondContact O-N 3.14Å; D127-E129 VanDerWaalsContact O-N 3.08Å; E129-E131 PolarHBondContact O-N 2.84Å
130	H	42.8	Very low	43.3	Very low	139 Å²	139	110.8 Å²	110.8	64%	0.644	59%	0.587	S	S	*	*			trans	-78.7	87.5	174.7	-91.6	-2.7	0	0	0	111.3	F132	H130-F132 HydrophobicContact CB-CE2 4.26Å; H130-F132 WeakPolarHBondContact O-CD2 3.48Å; H130-F132 PolarHBondContact O-N 2.98Å; H130-F132 VanDerWaalsContact O-N 3.14Å
131	E	45.5	Very low	44.4	Very low	125 Å²	125	106.1 Å²	106.1	58%	0.584	56%	0.56	S	S	*	*			trans	-69	108.7	176.4	-165.8	165.9	-118.4	0	0	111.7	K85 E129 S133 C144	K85-E131 IonicContact NZ-OE1 2.87Å; E129-E131 PolarHBondContact O-N 2.84Å; E131-S133 PolarHBondContact O-N 3.37Å; E131-S133 VanDerWaalsContact O-N 3.15Å; E131-C144 PolarHBondContact O-N 3Å
132	F	46	Very low	45.7	Very low	100 Å²	100	104.2 Å²	104.2	44%	0.439	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	83.3	176.2	-75.8	-98.4	0	0	0	110.8	H130 P143	H130-F132 HydrophobicContact CB-CE2 4.26Å; H130-F132 WeakPolarHBondContact O-CD2 3.48Å; H130-F132 PolarHBondContact O-N 2.98Å; H130-F132 VanDerWaalsContact O-N 3.14Å; F132-P143 HydrophobicContact CD1-CG 4.1Å; F132-P143 HydrophobicContact CE1-CG 3.68Å; F132-P143 HydrophobicContact CE2-CG 4.38Å; F132-P143 HydrophobicContact CZ-CG 3.84Å
133	S	52.8	Low	46.5	Very low	34 Å²	34	100.9 Å²	100.9	24%	0.238	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	148.2	171.4	67.9	0	0	0	0	111.4	E131 C135 H142 C144	E131-S133 PolarHBondContact O-N 3.37Å; E131-S133 VanDerWaalsContact O-N 3.15Å; S133-C135 PolarHBondContact O-N 3.1Å; S133-H142 PolarHBondContact N-O 3.37Å; S133-H142 PolarHBondContact O-N 3.32Å; S133-C144 WeakPolarHBondContact OG-CB 3.49Å; S133-C144 PolarHBondContact OG-SG 2.66Å
134	K	59.2	Low	46.9	Very low	97 Å²	97	96.3 Å²	96.3	42%	0.422	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	118.3	165.7	-172.1	175	-177.8	173.8	0	108.7	L136 G139 F141	K134-L136 PolarHBondContact O-N 3.06Å; K134-G139 VanDerWaalsContact CE-O 3.26Å; K134-G139 WeakPolarHBondContact CE-O 3.42Å; K134-F141 HydrophobicContact CB-CD1 3.99Å; K134-F141 HydrophobicContact CB-CE1 3.69Å; K134-F141 HydrophobicContact CB-CZ 4Å; K134-F141 HydrophobicContact CD-CE2 4.24Å; K134-F141 HydrophobicContact CD-CZ 4Å; K134-F141 HydrophobicContact CG-CE1 4.29Å; K134-F141 HydrophobicContact CG-CE2 4.26Å; K134-F141 HydrophobicContact CG-CZ 4.12Å
135	C	63.5	Low	47.3	Very low	8 Å²	8	96.2 Å²	96.2	5%	0.054	50%	0.501	C	S	.	.			trans	-66.6	110.6	-179.7	-171.4	0	0	0	0	110.8	S133 F137 C138 G139 K140 H142	S133-C135 PolarHBondContact O-N 3.1Å; C135-F137 PolarHBondContact O-N 3.03Å; C135-C138 WeakPolarHBondContact CB-SG 3.33Å; C135-C138 PolarHBondContact O-N 3.12Å; C135-C138 PolarHBondContact SG-N 3.22Å; C135-G139 VanDerWaalsContact O-CA 3.31Å; C135-G139 WeakPolarHBondContact O-CA 3.45Å; C135-G139 PolarHBondContact O-N 2.88Å; C135-K140 WeakPolarHBondContact CB-O 3.33Å; C135-K140 PolarHBondContact N-O 3.27Å; C135-H142 VanDerWaalsContact CB-CE1 3.46Å; C135-H142 WeakPolarHBondContact CB-CE1 3.36Å; C135-H142 WeakPolarHBondContact CB-NE2 3.22Å; C135-H142 PolarHBondContact SG-NE2 3.37Å
136	L	59.4	Low	47.6	Very low	145 Å²	145	91.9 Å²	91.9	76%	0.759	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-12.8	176.2	-61.5	179.9	0	0	0	113.3	K134	K134-L136 PolarHBondContact O-N 3.06Å
137	F	47.3	Very low	48.5	Very low	85 Å²	85	95.3 Å²	95.3	37%	0.373	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-51.8	177.1	-53.2	-59.7	0	0	0	112.9	C135 F149 G161 H162 I163	C135-F137 PolarHBondContact O-N 3.03Å; F137-F149 HydrophobicContact CB-CB 4.23Å; F137-F149 HydrophobicContact CB-CD2 3.66Å; F137-F149 HydrophobicContact CB-CE2 4.24Å; F137-F149 HydrophobicContact CB-CG 3.97Å; F137-F149 HydrophobicContact CD2-CB 4.32Å; F137-F149 HydrophobicContact CD2-CD2 4.35Å; F137-F149 HydrophobicContact CG-CB 4.19Å; F137-F149 HydrophobicContact CG-CD2 4.3Å; F137-F149 HydrophobicContact CG-CG 4.45Å; F137-G161 WeakPolarHBondContact CD1-O 3.4Å; F137-G161 WeakPolarHBondContact CE1-O 3.47Å; F137-H162 HydrophobicContact CD1-CB 4.17Å; F137-H162 HydrophobicContact CE1-CB 4.37Å; F137-I163 WeakPolarHBondContact O-CD1 3.44Å; F137-I163 WeakPolarHBondContact O-CG1 3.35Å
138	C	61	Low	49.2	Very low	48 Å²	48	93.6 Å²	93.6	32%	0.324	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-3.2	-176	73.5	0	0	0	0	115.1	C135 K140 F149	C135-C138 WeakPolarHBondContact CB-SG 3.33Å; C135-C138 PolarHBondContact O-N 3.12Å; C135-C138 PolarHBondContact SG-N 3.22Å; C138-K140 PolarHBondContact O-N 3.49Å; C138-K140 VanDerWaalsContact O-N 3.09Å; C138-F149 HydrophobicContact CB-CE2 4.02Å; C138-F149 HydrophobicContact CB-CZ 4.08Å
139	G	54.2	Low	50.2	Low	40 Å²	40	87.6 Å²	87.6	41%	0.412	44%	0.439	S	S	.	.	S	Bend	trans	76.7	-18.7	178.7	0	0	0	0	0	115.7	K134 C135	K134-G139 VanDerWaalsContact CE-O 3.26Å; K134-G139 WeakPolarHBondContact CE-O 3.42Å; C135-G139 VanDerWaalsContact O-CA 3.31Å; C135-G139 WeakPolarHBondContact O-CA 3.45Å; C135-G139 PolarHBondContact O-N 2.88Å
140	K	53.2	Low	51.1	Low	99 Å²	99	89.7 Å²	89.7	43%	0.43	44%	0.44	S	S	.	.	S	Bend	trans	-76.9	153.5	177.8	-55.2	-162.8	177.2	-141.5	0	111.7	L56 C135 C138	L56-K140 WeakPolarHBondContact O-CE 3.49Å; L56-K140 PolarHBondContact O-NZ 3.43Å; C135-K140 WeakPolarHBondContact CB-O 3.33Å; C135-K140 PolarHBondContact N-O 3.27Å; C138-K140 PolarHBondContact O-N 3.49Å; C138-K140 VanDerWaalsContact O-N 3.09Å
141	F	58.4	Low	51.9	Low	59 Å²	59	90.1 Å²	90.1	26%	0.259	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.7	166.8	-67.5	-97	0	0	0	109.3	L54 Y78 K134	L54-F141 HydrophobicContact CD2-CD2 3.96Å; L54-F141 HydrophobicContact CD2-CE2 3.69Å; Y78-F141 HydrophobicContact CD1-CE1 4.36Å; Y78-F141 HydrophobicContact CD2-CD1 4.28Å; Y78-F141 AromaticContact CD2-CE1 3.83Å; Y78-F141 HydrophobicContact CD2-CE1 3.83Å; Y78-F141 HydrophobicContact CE2-CE1 4.08Å; Y78-F141 HydrophobicContact CG-CE1 4.01Å; K134-F141 HydrophobicContact CB-CD1 3.99Å; K134-F141 HydrophobicContact CB-CE1 3.69Å; K134-F141 HydrophobicContact CB-CZ 4Å; K134-F141 HydrophobicContact CD-CE2 4.24Å; K134-F141 HydrophobicContact CD-CZ 4Å; K134-F141 HydrophobicContact CG-CE1 4.29Å; K134-F141 HydrophobicContact CG-CE2 4.26Å; K134-F141 HydrophobicContact CG-CZ 4.12Å
142	H	56.4	Low	52.9	Low	43 Å²	43	85.9 Å²	85.9	20%	0.199	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	157.7	173.1	58.8	34.2	0	0	0	109.8	S133 C135 C144 S146	S133-H142 PolarHBondContact N-O 3.37Å; S133-H142 PolarHBondContact O-N 3.32Å; C135-H142 VanDerWaalsContact CB-CE1 3.46Å; C135-H142 WeakPolarHBondContact CB-CE1 3.36Å; C135-H142 WeakPolarHBondContact CB-NE2 3.22Å; C135-H142 PolarHBondContact SG-NE2 3.37Å; H142-C144 PolarHBondContact O-N 3.4Å; H142-S146 PolarHBondContact CE1-OG 2.95Å; H142-S146 PolarHBondContact NE2-OG 2.91Å
143	P	45.9	Very low	54.4	Low	41 Å²	41	88.3 Å²	88.3	27%	0.266	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	138.2	175.9	-24.5	35.1	0	0	0	111.1	F132 N145	F132-P143 HydrophobicContact CD1-CG 4.1Å; F132-P143 HydrophobicContact CE1-CG 3.68Å; F132-P143 HydrophobicContact CE2-CG 4.38Å; F132-P143 HydrophobicContact CZ-CG 3.84Å; P143-N145 PolarHBondContact O-N 3.33Å
144	C	37.8	Very low	55.7	Low	77 Å²	77	86.8 Å²	86.8	52%	0.52	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	49.1	-168.4	-156.5	0	0	0	0	114.7	E131 S133 H142	E131-C144 PolarHBondContact O-N 3Å; S133-C144 WeakPolarHBondContact OG-CB 3.49Å; S133-C144 PolarHBondContact OG-SG 2.66Å; H142-C144 PolarHBondContact O-N 3.4Å
145	N	34.8	Very low	56.4	Low	115 Å²	115	91.1 Å²	91.1	62%	0.615	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-3.5	-175	-86.2	-57.6	0	0	0	114.5	P143 R147	P143-N145 PolarHBondContact O-N 3.33Å; N145-R147 PolarHBondContact O-N 3.08Å
146	S	41.7	Very low	57.1	Low	44 Å²	44	96.1 Å²	96.1	31%	0.308	47%	0.471	S	S	.	.			trans	-80.1	98.7	-173.6	65.4	0	0	0	0	112.7	H142 I148	H142-S146 PolarHBondContact CE1-OG 2.95Å; H142-S146 PolarHBondContact NE2-OG 2.91Å; S146-I148 PolarHBondContact O-N 3Å
147	R	53.7	Low	58.3	Low	217 Å²	217	91.1 Å²	91.1	82%	0.819	45%	0.448	S	S	*	.			trans	-72.1	18.7	-177.3	-52.6	-178.8	-170.4	-159	-1.2	114.6	N145 F149	N145-R147 PolarHBondContact O-N 3.08Å; R147-F149 PolarHBondContact O-N 3.25Å
148	I	52.1	Low	59.8	Low	117 Å²	117	89.2 Å²	89.2	60%	0.6	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-38	-155.3	-64.7	176.3	0	0	0	113.4	S146	S146-I148 PolarHBondContact O-N 3Å
149	F	51.9	Low	60.5	Low	45 Å²	45	90.5 Å²	90.5	20%	0.197	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-1.2	-169.9	-61.8	-73.7	0	0	0	115.6	F137 C138 R147 N151 S152 G161 I163	F137-F149 HydrophobicContact CB-CB 4.23Å; F137-F149 HydrophobicContact CB-CD2 3.66Å; F137-F149 HydrophobicContact CB-CE2 4.24Å; F137-F149 HydrophobicContact CB-CG 3.97Å; F137-F149 HydrophobicContact CD2-CB 4.32Å; F137-F149 HydrophobicContact CD2-CD2 4.35Å; F137-F149 HydrophobicContact CG-CB 4.19Å; F137-F149 HydrophobicContact CG-CD2 4.3Å; F137-F149 HydrophobicContact CG-CG 4.45Å; C138-F149 HydrophobicContact CB-CE2 4.02Å; C138-F149 HydrophobicContact CB-CZ 4.08Å; R147-F149 PolarHBondContact O-N 3.25Å; F149-N151 PolarHBondContact O-N 2.81Å; F149-N151 VanDerWaalsContact O-N 3.14Å; F149-S152 WeakPolarHBondContact CA-OG 3.38Å; F149-S152 PolarHBondContact O-N 3.07Å; F149-S152 PolarHBondContact O-OG 3.44Å; F149-G161 VanDerWaalsContact O-CA 3.29Å; F149-G161 WeakPolarHBondContact O-CA 3.38Å; F149-I163 HydrophobicContact CD1-CG2 3.69Å; F149-I163 HydrophobicContact CE1-CG2 3.85Å
150	R	56	Low	61.4	Low	205 Å²	205	92.2 Å²	92.2	77%	0.774	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-33.8	179.3	-88.8	-167.3	175.2	-162.9	0.4	113.2
151	N	59.8	Low	62.3	Low	149 Å²	149	88.6 Å²	88.6	80%	0.797	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-7.3	-174.4	-61.5	-5.8	0	0	0	113.7	F149 K153	F149-N151 PolarHBondContact O-N 2.81Å; F149-N151 VanDerWaalsContact O-N 3.14Å; N151-K153 PolarHBondContact O-N 3.04Å
152	S	64.9	Low	63.2	Low	36 Å²	36	86.8 Å²	86.8	25%	0.252	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-76.3	123.9	178.8	57.9	0	0	0	0	110.6	F149 T160 G161	F149-S152 WeakPolarHBondContact CA-OG 3.38Å; F149-S152 PolarHBondContact O-N 3.07Å; F149-S152 PolarHBondContact O-OG 3.44Å; S152-T160 WeakPolarHBondContact O-CA 2.95Å; S152-G161 PolarHBondContact O-N 2.99Å
153	K	78.1	Confident	63.9	Low	151 Å²	151	86.9 Å²	86.9	66%	0.657	44%	0.442	S	S	*	.	B	Isolated β-bridge	trans	-74.5	133.8	169.9	-68.1	-177.4	179.5	-178.9	0	110.1	N151 F155 G158 T160	N151-K153 PolarHBondContact O-N 3.04Å; K153-F155 PolarHBondContact O-N 3.48Å; K153-G158 WeakPolarHBondContact CG-O 3.42Å; K153-T160 HydrophobicContact CG-CG2 3.66Å
154	C	79.9	Confident	65.3	Low	1 Å²	1	90.2 Å²	90.2	1%	0.007	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-68.7	121.9	172.4	176.2	0	0	0	0	110.6	K156 C157 G158 I159 H162 C167	C154-K156 PolarHBondContact O-N 3.15Å; C154-K156 PolarHBondContact SG-N 3.16Å; C154-K156 VanDerWaalsContact SG-N 3.44Å; C154-C157 PolarHBondContact O-N 2.72Å; C154-G158 WeakPolarHBondContact O-CA 3.15Å; C154-G158 PolarHBondContact O-N 3.03Å; C154-I159 WeakPolarHBondContact CB-O 3.46Å; C154-I159 PolarHBondContact N-O 2.67Å; C154-H162 WeakPolarHBondContact CB-NE2 3.43Å; C154-H162 WeakPolarHBondContact CB-O 3.43Å; C154-H162 PolarHBondContact SG-NE2 2.64Å; C154-C167 VanDerWaalsContact SG-CB 3.51Å
155	F	74.8	Confident	66.7	Low	189 Å²	189	91.2 Å²	91.2	83%	0.829	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-15	177.6	-67.6	-79.4	0	0	0	114.8	K153 Q164	K153-F155 PolarHBondContact O-N 3.48Å; F155-Q164 HydrophobicContact CB-CB 4.47Å
156	K	78	Confident	68.5	Low	112 Å²	112	88.7 Å²	88.7	49%	0.487	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-23.2	-176.3	-163.2	-172.9	179.2	-158.1	0	114.5	C154 Q164 C167 T169	C154-K156 PolarHBondContact O-N 3.15Å; C154-K156 PolarHBondContact SG-N 3.16Å; C154-K156 VanDerWaalsContact SG-N 3.44Å; K156-Q164 HydrophobicContact CB-CB 4.44Å; K156-Q164 HydrophobicContact CB-CG 4.11Å; K156-C167 HydrophobicContact CB-CB 4.13Å; K156-C167 HydrophobicContact CD-CB 3.83Å; K156-C167 PolarHBondContact NZ-O 2.99Å; K156-T169 WeakPolarHBondContact CE-OG1 3.36Å; K156-T169 PolarHBondContact NZ-OG1 3.15Å
157	C	84.3	Confident	70.2	Confident	41 Å²	41	86.7 Å²	86.7	28%	0.277	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.1	-1	-178.5	68.4	0	0	0	0	114.6	C154 I159 H162 C167	C154-C157 PolarHBondContact O-N 2.72Å; C157-I159 PolarHBondContact O-N 2.63Å; C157-H162 PolarHBondContact SG-CE1 2.93Å; C157-H162 PolarHBondContact SG-NE2 2.77Å; C157-H162 VanDerWaalsContact SG-NE2 3.43Å; C157-C167 VanDerWaalsContact SG-SG 3.65Å
158	G	78.7	Confident	70.8	Confident	45 Å²	45	82.4 Å²	82.4	46%	0.464	43%	0.43	S	S	.	.			trans	75.3	-18.3	179.6	0	0	0	0	0	115.9	K153 C154	K153-G158 WeakPolarHBondContact CG-O 3.42Å; C154-G158 WeakPolarHBondContact O-CA 3.15Å; C154-G158 PolarHBondContact O-N 3.03Å
159	I	75.7	Confident	71.2	Confident	74 Å²	74	79 Å²	79	38%	0.379	41%	0.414	S	S	.	.			trans	-69.2	137.6	-176.4	-63.6	165.9	0	0	0	110.7	C154 C157 H172	C154-I159 WeakPolarHBondContact CB-O 3.46Å; C154-I159 PolarHBondContact N-O 2.67Å; C157-I159 PolarHBondContact O-N 2.63Å; I159-H172 HydrophobicContact CD1-CB 3.94Å; I159-H172 WeakPolarHBondContact CD1-ND1 3.26Å
160	T	74.4	Confident	71.1	Confident	77 Å²	77	85.1 Å²	85.1	47%	0.472	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-75.8	152.4	176.7	44.9	0	0	0	0	112.5	S152 K153	S152-T160 WeakPolarHBondContact O-CA 2.95Å; K153-T160 HydrophobicContact CG-CG2 3.66Å
161	G	71.6	Confident	70.9	Confident	22 Å²	22	79.5 Å²	79.5	23%	0.227	43%	0.434	C	S	.	.	S	Bend	trans	99.6	4.6	171.5	0	0	0	0	0	115.3	F137 F149 S152	F137-G161 WeakPolarHBondContact CD1-O 3.4Å; F137-G161 WeakPolarHBondContact CE1-O 3.47Å; F149-G161 VanDerWaalsContact O-CA 3.29Å; F149-G161 WeakPolarHBondContact O-CA 3.38Å; S152-G161 PolarHBondContact O-N 2.99Å
162	H	77.4	Confident	70.5	Confident	22 Å²	22	74.3 Å²	74.3	10%	0.102	41%	0.405	C	S	.	.			trans	-154.5	170	169.5	72.2	-84.1	0	0	0	111.6	F137 C154 C157 V166 C167 H172	F137-H162 HydrophobicContact CD1-CB 4.17Å; F137-H162 HydrophobicContact CE1-CB 4.37Å; C154-H162 WeakPolarHBondContact CB-NE2 3.43Å; C154-H162 WeakPolarHBondContact CB-O 3.43Å; C154-H162 PolarHBondContact SG-NE2 2.64Å; C157-H162 PolarHBondContact SG-CE1 2.93Å; C157-H162 PolarHBondContact SG-NE2 2.77Å; C157-H162 VanDerWaalsContact SG-NE2 3.43Å; H162-V166 HydrophobicContact CB-CG2 4.04Å; H162-C167 WeakPolarHBondContact NE2-CB 3.46Å; H162-H172 AromaticContact CE1-CE1 3.89Å; H162-H172 AromaticContact CE1-NE2 3.27Å; H162-H172 PolarHBondContact CE1-NE2 3.48Å; H162-H172 VanDerWaalsContact CE1-NE2 3.27Å; H162-H172 AromaticContact NE2-NE2 3.67Å
163	I	71.4	Confident	69.4	Low	45 Å²	45	79.3 Å²	79.3	23%	0.231	42%	0.422	C	S	.	.			trans	-113.1	163.3	179.7	66.3	168.5	0	0	0	112.5	F137 F149 S165 V166 C167	F137-I163 WeakPolarHBondContact O-CD1 3.44Å; F137-I163 WeakPolarHBondContact O-CG1 3.35Å; F149-I163 HydrophobicContact CD1-CG2 3.69Å; F149-I163 HydrophobicContact CE1-CG2 3.85Å; I163-S165 VanDerWaalsContact C-N 3.27Å; I163-S165 WeakPolarHBondContact CD1-OG 3.43Å; I163-S165 WeakPolarHBondContact CG1-OG 3.11Å; I163-S165 PolarHBondContact O-N 3.34Å; I163-S165 VanDerWaalsContact O-N 3.13Å; I163-V166 HydrophobicContact CG1-CG2 4.21Å; I163-V166 WeakPolarHBondContact O-CG2 3.34Å; I163-V166 PolarHBondContact O-N 3.36Å; I163-V166 VanDerWaalsContact O-N 3.08Å; I163-C167 PolarHBondContact O-N 3.22Å
164	Q	75.1	Confident	67.9	Low	110 Å²	110	75.5 Å²	75.5	51%	0.514	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-54.4	-34.1	-172.7	171.4	167.8	4.9	0	0	115	F155 K156 V166 C167	F155-Q164 HydrophobicContact CB-CB 4.47Å; K156-Q164 HydrophobicContact CB-CB 4.44Å; K156-Q164 HydrophobicContact CB-CG 4.11Å; Q164-V166 VanDerWaalsContact C-N 3.29Å; Q164-V166 PolarHBondContact O-N 3.27Å; Q164-C167 WeakPolarHBondContact O-CB 3.42Å; Q164-C167 PolarHBondContact O-N 3.41Å
165	S	67.3	Low	66.4	Low	99 Å²	99	82 Å²	82	69%	0.692	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-68.1	-24	-179.6	50.9	0	0	0	0	114.1	I163	I163-S165 VanDerWaalsContact C-N 3.27Å; I163-S165 WeakPolarHBondContact CD1-OG 3.43Å; I163-S165 WeakPolarHBondContact CG1-OG 3.11Å; I163-S165 PolarHBondContact O-N 3.34Å; I163-S165 VanDerWaalsContact O-N 3.13Å
166	V	70.7	Confident	65	Low	61 Å²	61	75.8 Å²	75.8	37%	0.37	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-109.2	7.5	178.2	-60.1	0	0	0	0	112.8	H162 I163 Q164 N168	H162-V166 HydrophobicContact CB-CG2 4.04Å; I163-V166 HydrophobicContact CG1-CG2 4.21Å; I163-V166 WeakPolarHBondContact O-CG2 3.34Å; I163-V166 PolarHBondContact O-N 3.36Å; I163-V166 VanDerWaalsContact O-N 3.08Å; Q164-V166 VanDerWaalsContact C-N 3.29Å; Q164-V166 PolarHBondContact O-N 3.27Å; V166-N168 PolarHBondContact O-N 2.93Å
167	C	77.6	Confident	63.2	Low	3 Å²	3	75.1 Å²	75.1	2%	0.02	43%	0.431	C	S	.	.			trans	-77.1	88	-178.8	179.8	0	0	0	0	112.4	C154 K156 C157 H162 I163 Q164 T169	C154-C167 VanDerWaalsContact SG-CB 3.51Å; K156-C167 HydrophobicContact CB-CB 4.13Å; K156-C167 HydrophobicContact CD-CB 3.83Å; K156-C167 PolarHBondContact NZ-O 2.99Å; C157-C167 VanDerWaalsContact SG-SG 3.65Å; H162-C167 WeakPolarHBondContact NE2-CB 3.46Å; I163-C167 PolarHBondContact O-N 3.22Å; Q164-C167 WeakPolarHBondContact O-CB 3.42Å; Q164-C167 PolarHBondContact O-N 3.41Å; C167-T169 VanDerWaalsContact C-N 3.26Å; C167-T169 PolarHBondContact O-N 3.21Å; C167-T169 PolarHBondContact O-OG1 3.3Å
168	N	67.3	Low	61.3	Low	126 Å²	126	77.2 Å²	77.2	67%	0.674	45%	0.451	S	S	*	.			trans	-72.2	79.3	167.7	-81.8	-14.7	0	0	0	111.1	V166 M170 V171	V166-N168 PolarHBondContact O-N 2.93Å; N168-M170 PolarHBondContact O-N 3.21Å; N168-V171 HydrophobicContact CB-CG2 4.34Å; N168-V171 PolarHBondContact O-N 3.05Å
169	T	59.5	Low	59.6	Low	45 Å²	45	84.1 Å²	84.1	28%	0.276	47%	0.468	S	S	.	.	H	α-helix	trans	-49.9	-24.7	-176.8	-53.5	0	0	0	0	114.7	K156 C167 V171 F173	K156-T169 WeakPolarHBondContact CE-OG1 3.36Å; K156-T169 PolarHBondContact NZ-OG1 3.15Å; C167-T169 VanDerWaalsContact C-N 3.26Å; C167-T169 PolarHBondContact O-N 3.21Å; C167-T169 PolarHBondContact O-OG1 3.3Å; T169-V171 VanDerWaalsContact C-N 3.3Å; T169-V171 PolarHBondContact O-N 3.4Å; T169-F173 HydrophobicContact CG2-CE2 4.05Å; T169-F173 WeakPolarHBondContact O-CD2 3.42Å
170	M	49.7	Very low	57.8	Low	174 Å²	174	88.4 Å²	88.4	86%	0.857	49%	0.489	S	S	*	.	H	α-helix	trans	-70.8	-19.3	178.7	-167.2	152	62	0	0	114.2	N168	N168-M170 PolarHBondContact O-N 3.21Å
171	V	53.2	Low	56	Low	87 Å²	87	92.4 Å²	92.4	53%	0.527	51%	0.507	S	S	.	.	H	α-helix	trans	-79.5	-40.7	178.4	-178.2	0	0	0	0	111.7	N168 T169 F173 A174	N168-V171 HydrophobicContact CB-CG2 4.34Å; N168-V171 PolarHBondContact O-N 3.05Å; T169-V171 VanDerWaalsContact C-N 3.3Å; T169-V171 PolarHBondContact O-N 3.4Å; V171-F173 VanDerWaalsContact C-N 3.29Å; V171-F173 PolarHBondContact O-N 3.39Å; V171-A174 WeakPolarHBondContact O-CB 3.37Å; V171-A174 PolarHBondContact O-N 3.26Å; V171-A174 VanDerWaalsContact O-N 3.09Å
172	H	50.4	Low	54.4	Low	41 Å²	41	96 Å²	96	19%	0.19	53%	0.534	C	S	.	.	H	α-helix	trans	-69.5	-20.3	-169.3	-65.2	-50.6	0	0	0	115.2	I159 H162 A174 E175 S176	I159-H172 HydrophobicContact CD1-CB 3.94Å; I159-H172 WeakPolarHBondContact CD1-ND1 3.26Å; H162-H172 AromaticContact CE1-CE1 3.89Å; H162-H172 AromaticContact CE1-NE2 3.27Å; H162-H172 PolarHBondContact CE1-NE2 3.48Å; H162-H172 VanDerWaalsContact CE1-NE2 3.27Å; H162-H172 AromaticContact NE2-NE2 3.67Å; H172-A174 PolarHBondContact O-N 3.06Å; H172-E175 PolarHBondContact O-N 3.36Å; H172-S176 PolarHBondContact O-N 2.82Å
173	F	43.3	Very low	52.6	Low	141 Å²	141	100.3 Å²	100.3	62%	0.618	57%	0.567	S	S	*	*	H	α-helix	trans	-68.8	-16.5	173.1	-71.1	-69.7	0	0	0	113.7	T169 V171 S176 N177	T169-F173 HydrophobicContact CG2-CE2 4.05Å; T169-F173 WeakPolarHBondContact O-CD2 3.42Å; V171-F173 VanDerWaalsContact C-N 3.29Å; V171-F173 PolarHBondContact O-N 3.39Å; F173-S176 PolarHBondContact O-OG 3.48Å; F173-N177 PolarHBondContact O-ND2 3.42Å
174	A	46.1	Very low	50.9	Low	71 Å²	71	104.9 Å²	104.9	59%	0.587	59%	0.592	S	S	*	*	H	α-helix	trans	-76.9	-40	174.7	0	0	0	0	0	112.1	V171 H172	V171-A174 WeakPolarHBondContact O-CB 3.37Å; V171-A174 PolarHBondContact O-N 3.26Å; V171-A174 VanDerWaalsContact O-N 3.09Å; H172-A174 PolarHBondContact O-N 3.06Å
175	E	47.7	Very low	49	Very low	138 Å²	138	107 Å²	107	65%	0.645	61%	0.607	S	S	*	*	H	α-helix	trans	-82.8	-29.3	-176.6	-70.9	-175.7	115.1	0	0	113.7	H172 N177 A178	H172-E175 PolarHBondContact O-N 3.36Å; E175-N177 VanDerWaalsContact C-N 3.27Å; E175-N177 PolarHBondContact O-N 3.19Å; E175-A178 PolarHBondContact O-N 2.99Å
176	S	45.9	Very low	47.6	Very low	58 Å²	58	110.1 Å²	110.1	41%	0.406	61%	0.611	S	S	.	*	H	α-helix	trans	-60.4	-39.4	175.3	56.5	0	0	0	0	112.2	H172 F173 K179	H172-S176 PolarHBondContact O-N 2.82Å; F173-S176 PolarHBondContact O-OG 3.48Å; S176-K179 PolarHBondContact O-N 3.09Å
177	N	39.5	Very low	45.9	Very low	98 Å²	98	114.8 Å²	114.8	52%	0.524	63%	0.633	S	S	.	*	H	α-helix	trans	-79	-27.8	-172.2	-60.2	-0.8	0	0	0	111.2	F173 E175 K179 M180	F173-N177 PolarHBondContact O-ND2 3.42Å; E175-N177 VanDerWaalsContact C-N 3.27Å; E175-N177 PolarHBondContact O-N 3.19Å; N177-K179 PolarHBondContact O-N 3.25Å; N177-M180 PolarHBondContact O-N 2.78Å
178	A	44.5	Very low	43.8	Very low	84 Å²	84	119.5 Å²	119.5	69%	0.694	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-0.1	174.7	0	0	0	0	0	114.9	E175	E175-A178 PolarHBondContact O-N 2.99Å
179	K	42.4	Very low	42.2	Very low	191 Å²	191	121.5 Å²	121.5	83%	0.83	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	8.8	175.3	-87.8	-179	175.3	172.8	0	114.9	S176 N177	S176-K179 PolarHBondContact O-N 3.09Å; N177-K179 PolarHBondContact O-N 3.25Å
180	M	39.6	Very low	40.9	Very low	164 Å²	164	125.2 Å²	125.2	81%	0.808	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-1.9	176.3	-82.3	-171.8	155.7	0	0	115.2	N177 A182	N177-M180 PolarHBondContact O-N 2.78Å; M180-A182 PolarHBondContact O-N 2.89Å
181	D	35.7	Very low	40.1	Very low	161 Å²	161	128 Å²	128	86%	0.861	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	67.1	173	-74.7	-48	0	0	0	112.2
182	A	37.5	Very low	39.1	Very low	96 Å²	96	135.7 Å²	135.7	79%	0.793	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.4	-8.1	177.5	0	0	0	0	0	115.8	M180	M180-A182 PolarHBondContact O-N 2.89Å
183	S	39.5	Very low	38.2	Very low	114 Å²	114	137 Å²	137	80%	0.797	75%	0.749	S	S	*	*	S	Bend	trans	-158.1	70.4	-178.5	64.8	0	0	0	0	113.7
184	N	36.9	Very low	37.7	Very low	140 Å²	140	138.6 Å²	138.6	75%	0.749	76%	0.762	S	S	*	*			trans	-151.9	70.1	158.3	-165	79.2	0	0	0	111.8	Q186	N184-Q186 PolarHBondContact ND2-O 3.11Å
185	D	35.6	Very low	37.1	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	77%	0.773	S	S	*	*			trans	-63	151.4	151	-74.4	-47.5	0	0	0	109
186	Q	36.5	Very low	36.3	Very low	164 Å²	164	142.9 Å²	142.9	77%	0.766	78%	0.783	S	S	*	*	S	Bend	trans	85.1	139.2	-170.4	-49	-71	-8.4	0	0	115.9	N184	N184-Q186 PolarHBondContact ND2-O 3.11Å
187	L	35.4	Very low	35.7	Very low	159 Å²	159	150.1 Å²	150.1	83%	0.832	80%	0.803	S	S	*	*			trans	72.9	64.6	167.7	-61.5	171.5	0	0	0	119.2
188	S	33.8	Very low	35.3	Very low	102 Å²	102	152.3 Å²	152.3	71%	0.713	82%	0.815	S	S	*	*				16.6	129	121	-55.2	0	0	0	0	120.9
189	L	32.8	Very low	34.8	Very low	168 Å²	168	153.7 Å²	153.7	88%	0.88	82%	0.82	S	S	*	*			trans	53.7	114.6	157	-72.7	80.6	0	0	0	116.6
190	S	33.1	Very low	34.5	Very low	122 Å²	122	150.2 Å²	150.2	85%	0.853	82%	0.816	S	S	*	*				-169.2	138.5	67.8	-175.9	0	0	0	0	112.5
191	R	32	Very low	34.3	Very low	233 Å²	233	151.9 Å²	151.9	88%	0.879	82%	0.822	S	S	*	*			trans	-109.6	98.4	179.9	177.9	-166.5	64.5	177.6	-5.2	111.2
192	R	33	Very low	34.2	Very low	248 Å²	248	152.3 Å²	152.3	94%	0.936	82%	0.824	S	S	*	*			trans	-173.9	134.1	152.1	-112.7	166.8	178	-151	-3.3	114.8
193	G	30.8	Very low	34.2	Very low	70 Å²	70	155.3 Å²	155.3	72%	0.722	83%	0.827	S	S	*	*			trans	88.5	86.3	147.3	0	0	0	0	0	117.7
194	I	34.2	Very low	33.8	Very low	174 Å²	174	158.4 Å²	158.4	89%	0.892	83%	0.828	S	S	*	*			trans	-117.3	110.7	152	-61.7	178.7	0	0	0	107.3
195	T	32.6	Very low	33.7	Very low	134 Å²	134	158.7 Å²	158.7	82%	0.822	84%	0.835	S	S	*	*			trans	-98.9	132.5	170	-32	0	0	0	0	107.5	Y197	T195-Y197 PolarHBondContact O-N 3.03Å
196	L	30	Very low	33.5	Very low	164 Å²	164	160.3 Å²	160.3	86%	0.859	84%	0.838	S	S	*	*			trans	-63.6	129.5	175.1	-81.1	112.8	0	0	0	111
197	Y	34.4	Very low	33.5	Very low	210 Å²	210	158.2 Å²	158.2	82%	0.824	84%	0.841	S	S	*	*			trans	-159.7	128.3	145.5	-106.8	-72.5	0	0	0	110.9	T195	T195-Y197 PolarHBondContact O-N 3.03Å
198	N	32	Very low	33.1	Very low	145 Å²	145	158.6 Å²	158.6	78%	0.775	84%	0.839	S	S	*	*			trans	43.5	120.8	157.3	-58.6	-3.4	0	0	0	121.9
199	S	32	Very low	33.4	Very low	113 Å²	113	163.9 Å²	163.9	79%	0.79	84%	0.843	S	S	*	*			trans	-73.9	178.3	145.8	-42	0	0	0	0	110.5
200	P	37.9	Very low	33.3	Very low	117 Å²	117	164.2 Å²	164.2	76%	0.76	84%	0.84	S	S	*	*			cis	-133.6	170.2	-0.3	42	-26.6	0	0	0	115.5
201	E	35.5	Very low	33.4	Very low	199 Å²	199	163.8 Å²	163.8	93%	0.93	83%	0.833	S	S	*	*			trans	-134.9	152.4	149.7	-77.7	-162.4	131.8	0	0	110.4
202	L	32.6	Very low	33.7	Very low	171 Å²	171	162.4 Å²	162.4	90%	0.895	83%	0.833	S	S	*	*			trans	-104.5	143.7	-178.5	-76.3	159	0	0	0	110.4
203	N	37.7	Very low	33.6	Very low	159 Å²	159	158 Å²	158	85%	0.85	83%	0.827	S	S	*	*			trans	-138.2	148.9	143.6	60.6	8.8	0	0	0	110.7
204	E	31.3	Very low	33.8	Very low	179 Å²	179	160.2 Å²	160.2	84%	0.836	83%	0.828	S	S	*	*			trans	-99.2	148.3	-164.9	-56.8	172	118.9	0	0	111.6
205	T	34.5	Very low	34	Very low	145 Å²	145	159.2 Å²	159.2	89%	0.89	82%	0.824	S	S	*	*			trans	-148.2	138	149.4	-62.6	0	0	0	0	108.7
206	Q	32.1	Very low	33.8	Very low	190 Å²	190	160.2 Å²	160.2	89%	0.888	82%	0.82	S	S	*	*			trans	-81.7	138.1	-164.3	-61	159.6	-35.5	0	0	112.9
207	S	36.5	Very low	34.1	Very low	120 Å²	120	157.3 Å²	157.3	84%	0.839	81%	0.811	S	S	*	*			trans	-149.7	127	142.8	60.2	0	0	0	0	109
208	H	26.9	Very low	33.9	Very low	168 Å²	168	153 Å²	153	78%	0.778	81%	0.806	S	S	*	*			trans	-93.8	139	-168.8	121.3	-45.7	0	0	0	111.9
209	W	38.7	Very low	34	Very low	212 Å²	212	155.5 Å²	155.5	80%	0.803	81%	0.806	S	S	*	*			trans	-157.4	129	139.1	55.5	-83.6	0	0	0	108.3
210	E	31.7	Very low	34	Very low	175 Å²	175	159.1 Å²	159.1	82%	0.818	81%	0.811	S	S	*	*			trans	-88.7	137	-178.7	-61.8	-172.3	143.6	0	0	111.3
211	T	34.5	Very low	33.8	Very low	114 Å²	114	161.1 Å²	161.1	70%	0.699	81%	0.813	S	S	*	*			trans	-150.5	134.8	154.7	-67.2	0	0	0	0	108.8
212	K	38.4	Very low	33.7	Very low	204 Å²	204	156.4 Å²	156.4	89%	0.887	80%	0.803	S	S	*	*			trans	-73.2	136.9	-167	-63.7	174	-179.8	175.3	0	112.6
213	I	31.5	Very low	33.7	Very low	156 Å²	156	156.9 Å²	156.9	80%	0.8	80%	0.8	S	S	*	*			trans	-113	126.6	167.2	-60.3	175.2	0	0	0	109.1
214	P	35.3	Very low	33.4	Very low	116 Å²	116	155.3 Å²	155.3	75%	0.753	80%	0.795	S	S	*	*			trans	-95.9	106	161.4	32.4	-24.9	0	0	0	111
215	N	38.5	Very low	33.6	Very low	152 Å²	152	153.8 Å²	153.8	81%	0.813	79%	0.791	S	S	*	*			trans	31.1	126.4	152.9	-55.9	-19	0	0	0	121
216	Q	28.9	Very low	33.7	Very low	156 Å²	156	152.1 Å²	152.1	73%	0.729	78%	0.781	S	S	*	*			trans	-68.5	166.6	168.7	-68.1	-166.4	-11.3	0	0	113.8	T218	Q216-T218 PolarHBondContact OE1-OG1 3.17Å
217	P	35	Very low	33.9	Very low	103 Å²	103	148.1 Å²	148.1	67%	0.669	77%	0.771	S	S	*	*				-112.8	131.6	124.7	33.1	-32.4	0	0	0	112.4	Y219	P217-Y219 HydrophobicContact CB-CE2 4.35Å; P217-Y219 HydrophobicContact CG-CE2 4.16Å; P217-Y219 PolarHBondContact O-N 3.12Å
218	T	30.2	Very low	33.6	Very low	119 Å²	119	149.3 Å²	149.3	73%	0.73	77%	0.768	S	S	*	*			trans	-81.8	110.4	-176.5	-32.1	0	0	0	0	111.3	Q216	Q216-T218 PolarHBondContact OE1-OG1 3.17Å
219	Y	33.5	Very low	33.9	Very low	198 Å²	198	149.6 Å²	149.6	78%	0.776	77%	0.772	S	S	*	*			trans	-98.3	116.4	171.3	-77.8	-80.6	0	0	0	111.4	P217 I221	P217-Y219 HydrophobicContact CB-CE2 4.35Å; P217-Y219 HydrophobicContact CG-CE2 4.16Å; P217-Y219 PolarHBondContact O-N 3.12Å; Y219-I221 PolarHBondContact O-N 3.26Å
220	Q	33.2	Very low	33.5	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.883	77%	0.769	S	S	*	*			trans	-71.1	121.1	171.7	-67.5	-174.9	-6.7	0	0	110	S222	Q220-S222 PolarHBondContact O-N 3.01Å
221	I	32.9	Very low	33.6	Very low	158 Å²	158	141.3 Å²	141.3	81%	0.81	76%	0.76	S	S	*	*			trans	-79.9	102.9	173.8	-60.4	174.4	0	0	0	107.9	Y219	Y219-I221 PolarHBondContact O-N 3.26Å
222	S	34.5	Very low	33.6	Very low	101 Å²	101	146.3 Å²	146.3	71%	0.706	77%	0.766	S	S	*	*			trans	-68.1	150.8	169.4	52.4	0	0	0	0	110.9	Q220 V224	Q220-S222 PolarHBondContact O-N 3.01Å; S222-V224 PolarHBondContact O-N 3.2Å; S222-V224 VanDerWaalsContact O-N 3.08Å
223	H	32.6	Very low	33.3	Very low	181 Å²	181	143.1 Å²	143.1	84%	0.838	76%	0.758	S	S	*	*			trans	-62.9	111.4	-169.4	-66.7	-87.4	0	0	0	112.8	I225	H223-I225 PolarHBondContact O-N 3.39Å
224	V	31.7	Very low	33.2	Very low	125 Å²	125	142.6 Å²	142.6	76%	0.758	76%	0.757	S	S	*	*			trans	-72.9	95.3	163.6	179.6	0	0	0	0	108.2	S222 V226	S222-V224 PolarHBondContact O-N 3.2Å; S222-V224 VanDerWaalsContact O-N 3.08Å; V224-V226 PolarHBondContact O-N 3.17Å
225	I	35	Very low	33.2	Very low	147 Å²	147	141.6 Å²	141.6	75%	0.754	75%	0.753	S	S	*	*			trans	-70.7	108.6	167	-60.4	175	0	0	0	107	H223 P227	H223-I225 PolarHBondContact O-N 3.39Å; I225-P227 WeakPolarHBondContact O-CD 3.42Å
226	V	35.9	Very low	33.3	Very low	110 Å²	110	143.2 Å²	143.2	67%	0.667	76%	0.755	S	S	*	*			trans	-67.4	122.1	168.7	176.9	0	0	0	0	107.8	V224 N228	V224-V226 PolarHBondContact O-N 3.17Å; V226-N228 PolarHBondContact O-N 2.86Å
227	P	35.5	Very low	33.5	Very low	106 Å²	106	142 Å²	142	69%	0.688	76%	0.759	S	S	*	*			trans	-65.3	122	169	-15.9	30.6	0	0	0	108.4	I225 M229	I225-P227 WeakPolarHBondContact O-CD 3.42Å; P227-M229 PolarHBondContact O-N 3.47Å
228	N	31.1	Very low	33.4	Very low	145 Å²	145	142.6 Å²	142.6	78%	0.775	77%	0.765	S	S	*	*			trans	-61.4	113.1	163.7	-85.3	-23.6	0	0	0	107.5	V226 V230	V226-N228 PolarHBondContact O-N 2.86Å; N228-V230 HydrophobicContact CB-CG2 4.31Å; N228-V230 PolarHBondContact O-N 2.76Å
229	M	33.1	Very low	33.8	Very low	175 Å²	175	144.7 Å²	144.7	86%	0.862	77%	0.772	S	S	*	*			trans	-70.2	78.8	165.6	-71.9	-179	71.8	0	0	108.6	P227 C231	P227-M229 PolarHBondContact O-N 3.47Å; M229-C231 PolarHBondContact O-N 3.42Å; M229-C231 VanDerWaalsContact O-N 3.12Å
230	V	31.4	Very low	33.7	Very low	121 Å²	121	138.6 Å²	138.6	73%	0.733	77%	0.77	S	S	*	*			trans	-65	107.7	163.9	178	0	0	0	0	106.2	N228 R232	N228-V230 HydrophobicContact CB-CG2 4.31Å; N228-V230 PolarHBondContact O-N 2.76Å; V230-R232 PolarHBondContact O-N 3.13Å
231	C	33.1	Very low	33.7	Very low	92 Å²	92	138.1 Å²	138.1	62%	0.622	77%	0.771	S	S	*	*			trans	-56.3	126.3	168.1	-64.7	0	0	0	0	107.7	M229 D233	M229-C231 PolarHBondContact O-N 3.42Å; M229-C231 VanDerWaalsContact O-N 3.12Å; C231-D233 PolarHBondContact O-N 3.05Å; C231-D233 VanDerWaalsContact O-N 3.17Å
232	R	33.2	Very low	33.7	Very low	219 Å²	219	135.6 Å²	135.6	83%	0.826	77%	0.767	S	S	*	*			trans	-77.1	100.9	168.5	-86.1	-173.6	168.9	-178.9	-4.1	107.4	V230 N234	V230-R232 PolarHBondContact O-N 3.13Å; R232-N234 PolarHBondContact O-N 3.09Å
233	D	33.1	Very low	33.5	Very low	137 Å²	137	139.1 Å²	139.1	73%	0.733	77%	0.767	S	S	*	*			trans	-68.2	71.3	173.7	-63.8	-27.3	0	0	0	110.4	C231 S235	C231-D233 PolarHBondContact O-N 3.05Å; C231-D233 VanDerWaalsContact O-N 3.17Å; D233-S235 PolarHBondContact O-N 3.5Å
234	N	29.2	Very low	33.8	Very low	144 Å²	144	137.8 Å²	137.8	77%	0.77	77%	0.765	S	S	*	*			trans	-75.5	50.6	176.2	-80.4	5.1	0	0	0	111	R232	R232-N234 PolarHBondContact O-N 3.09Å
235	S	36.1	Very low	33.9	Very low	96 Å²	96	135.4 Å²	135.4	67%	0.671	76%	0.755	S	S	*	*			trans	-113	56.8	178.1	67	0	0	0	0	111.2	D233 T237	D233-S235 PolarHBondContact O-N 3.5Å; S235-T237 PolarHBondContact O-N 3.03Å
236	H	40.2	Very low	34	Very low	186 Å²	186	137.8 Å²	137.8	86%	0.861	76%	0.763	S	S	*	*			trans	-70.5	96	164.8	-86	-67.3	0	0	0	109.3	S238	H236-S238 PolarHBondContact O-N 3.35Å; H236-S238 VanDerWaalsContact O-N 3.13Å
237	T	33.5	Very low	34	Very low	131 Å²	131	139.9 Å²	139.9	80%	0.804	77%	0.77	S	S	*	*			trans	-60	110.8	168.5	45.9	0	0	0	0	109.9	S235 D239	S235-T237 PolarHBondContact O-N 3.03Å; T237-D239 PolarHBondContact O-N 3.28Å
238	S	32.2	Very low	34.1	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	78%	0.777	S	S	*	*			trans	-88	82.6	180	59.7	0	0	0	0	111.7	H236	H236-S238 PolarHBondContact O-N 3.35Å; H236-S238 VanDerWaalsContact O-N 3.13Å
239	D	39.5	Very low	34.3	Very low	163 Å²	163	143.9 Å²	143.9	87%	0.872	77%	0.773	S	S	*	*			trans	-79.4	118	157.2	-77.1	-44.5	0	0	0	108.2	T237	T237-D239 PolarHBondContact O-N 3.28Å
240	G	30	Very low	34.4	Very low	71 Å²	71	142 Å²	142	73%	0.732	77%	0.766	S	S	*	*			trans	-96.8	159.2	-158.6	0	0	0	0	0	116.5
241	I	33.5	Very low	34.6	Very low	178 Å²	178	142.9 Å²	142.9	91%	0.913	77%	0.767	S	S	*	*			trans	-132.1	146.6	158.4	-48.2	-178.8	0	0	0	107.7
242	S	33.6	Very low	34.6	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	78%	0.775	S	S	*	*			trans	-86.4	143.7	-163.8	56.9	0	0	0	0	116.1
243	Y	31	Very low	34.8	Very low	176 Å²	176	141.7 Å²	141.7	69%	0.69	78%	0.775	S	S	*	*			trans	45.7	114.2	134.4	-166.3	-90.1	0	0	0	119.4
244	N	37.9	Very low	34.9	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	77%	0.773	S	S	*	*				-158.3	141.6	121.3	-104.6	-45.4	0	0	0	111.1
245	S	33.6	Very low	35.4	Very low	76 Å²	76	143 Å²	143	53%	0.531	78%	0.776	S	S	.	*			trans	-112.5	143.5	177.2	57	0	0	0	0	110.3
246	E	38	Very low	35.5	Very low	197 Å²	197	145 Å²	145	92%	0.921	78%	0.779	S	S	*	*			trans	-157.3	173.6	149.7	-121.5	165.6	-150.4	0	0	113.5
247	N	34.8	Very low	35.2	Very low	153 Å²	153	145.5 Å²	145.5	82%	0.818	78%	0.782	S	S	*	*			trans	-113.3	-175.3	-152	-85	-63.7	0	0	0	114.9
248	K	37.3	Very low	35.4	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	78%	0.784	S	S	*	*			trans	81.8	142	162.4	-79.2	-179.1	176.9	178.9	0	116.5
249	M	37.2	Very low	36	Very low	144 Å²	144	147.9 Å²	147.9	71%	0.709	78%	0.777	S	S	*	*			cis	-132.3	144.1	2.3	-67.5	-162.8	69.1	0	0	109.3
250	L	34.1	Very low	35.9	Very low	136 Å²	136	147.1 Å²	147.1	71%	0.712	77%	0.772	S	S	*	*				52.3	123.1	72.9	-65.6	178.8	0	0	0	112.4
251	N	36.7	Very low	36.2	Very low	140 Å²	140	148.3 Å²	148.3	75%	0.749	77%	0.77	S	S	*	*			cis	-154.5	174	41.7	-93	-26.8	0	0	0	114.7
252	E	31.9	Very low	36.4	Very low	167 Å²	167	146.3 Å²	146.3	78%	0.78	77%	0.765	S	S	*	*			trans	-86.1	167.8	175.2	-54.1	162.3	97.1	0	0	114.5
253	S	38.3	Very low	36.5	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	77%	0.767	S	S	*	*				-169.4	152.4	123	24.3	0	0	0	0	111.8
254	N	35.1	Very low	36.7	Very low	130 Å²	130	145.5 Å²	145.5	70%	0.695	77%	0.773	S	S	*	*			trans	-99.4	164.5	-177.9	-61.5	-75.1	0	0	0	111.5
255	H	40.2	Very low	36.4	Very low	178 Å²	178	145.2 Å²	145.2	82%	0.824	77%	0.772	S	S	*	*				-171.5	154.4	116.4	-96.9	-59.6	0	0	0	114
256	D	36.8	Very low	36.3	Very low	137 Å²	137	145.9 Å²	145.9	73%	0.733	78%	0.782	S	S	*	*			trans	-44.3	160.3	-179.3	-49.9	-90.4	0	0	0	115.9
257	Q	35.3	Very low	36.2	Very low	198 Å²	198	139.9 Å²	139.9	93%	0.925	77%	0.774	S	S	*	*				-162.7	167.8	67.3	-164.7	164.4	-10.4	0	0	114
258	K	37.4	Very low	36.4	Very low	197 Å²	197	142.4 Å²	142.4	86%	0.857	78%	0.778	S	S	*	*			trans	-108.4	-167.2	-165.8	-128.7	-155.4	139.3	-169.4	0	112.9
259	P	44	Very low	36.7	Very low	98 Å²	98	138.1 Å²	138.1	64%	0.636	77%	0.769	S	S	*	*			trans	-126.5	-169.5	-141.9	43.5	-22.9	0	0	0	115
260	D	37.8	Very low	36.9	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	77%	0.771	S	S	*	*			trans	-151.3	128.1	162	-107.6	-52.4	0	0	0	109.3
261	S	35.6	Very low	37	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	78%	0.776	S	S	*	*				65.4	138.7	94.5	76.8	0	0	0	0	114.2
262	V	38.1	Very low	37.1	Very low	135 Å²	135	137.1 Å²	137.1	82%	0.818	77%	0.773	S	S	*	*				-147.5	173.5	54	162.9	0	0	0	0	112.2
263	V	34.6	Very low	37.3	Very low	128 Å²	128	136.3 Å²	136.3	78%	0.776	77%	0.774	S	S	*	*			trans	-116.2	179.8	-171.5	180	0	0	0	0	111.4
264	V	36.4	Very low	37.1	Very low	136 Å²	136	139 Å²	139	82%	0.824	77%	0.77	S	S	*	*			trans	100.5	138.9	163.4	179.7	0	0	0	0	115.8
265	D	32.1	Very low	37.1	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	77%	0.768	S	S	*	*			cis	-170.8	166.2	-27.6	-171.8	25.7	0	0	0	110.1
266	A	30.8	Very low	36.8	Very low	90 Å²	90	135.1 Å²	135.1	74%	0.744	76%	0.763	S	S	*	*			trans	54.3	135	155.1	0	0	0	0	0	122.3
267	G	35.9	Very low	36.6	Very low	72 Å²	72	137.7 Å²	137.7	74%	0.742	77%	0.771	S	S	*	*			trans	161.6	67	165.3	0	0	0	0	0	118.6
268	F	39.1	Very low	36.4	Very low	206 Å²	206	134.2 Å²	134.2	90%	0.904	76%	0.763	S	S	*	*			trans	-155.2	171	168.3	-86.9	-59.6	0	0	0	108.7
269	P	44.3	Very low	36.2	Very low	101 Å²	101	136.4 Å²	136.4	66%	0.656	77%	0.768	S	S	*	*			cis	-106.9	-130.3	0.8	13.8	12.8	0	0	0	111.8
270	D	40.3	Very low	35.5	Very low	139 Å²	139	137.1 Å²	137.1	74%	0.743	78%	0.776	S	S	*	*			cis	-157.4	167.9	11.8	-103.2	-45.8	0	0	0	113.6
271	D	36.6	Very low	35.5	Very low	153 Å²	153	138 Å²	138	82%	0.818	78%	0.779	S	S	*	*			trans	120.9	120.2	132.9	-126.1	7.3	0	0	0	118.9
272	P	38.1	Very low	35.3	Very low	107 Å²	107	144.6 Å²	144.6	70%	0.695	79%	0.789	S	S	*	*			trans	-116.9	165.5	-175	42.3	-33.3	0	0	0	115.4
273	L	35.7	Very low	35	Very low	150 Å²	150	141.2 Å²	141.2	79%	0.785	78%	0.781	S	S	*	*			trans	-150.2	153.8	165.8	-75.4	-179.1	0	0	0	114.8
274	F	34.9	Very low	35.1	Very low	174 Å²	174	144.2 Å²	144.2	76%	0.763	78%	0.783	S	S	*	*			trans	82.3	84.3	163.7	-53.3	-63.1	0	0	0	120.2
275	S	35.1	Very low	35.2	Very low	93 Å²	93	147.7 Å²	147.7	65%	0.65	78%	0.783	S	S	*	*				13.2	158.6	115.9	63.8	0	0	0	0	120.3
276	N	33.7	Very low	35.3	Very low	135 Å²	135	149.8 Å²	149.8	72%	0.722	79%	0.786	S	S	*	*			cis	-159.2	174	30.3	-0.7	-93.2	0	0	0	114.9
277	E	33.8	Very low	35.7	Very low	191 Å²	191	155.4 Å²	155.4	89%	0.893	79%	0.788	S	S	*	*			trans	85.2	135.3	154.7	-79.4	177.6	164.3	0	0	121.3
278	T	29.3	Very low	35.6	Very low	125 Å²	125	159.2 Å²	159.2	77%	0.767	79%	0.786	S	S	*	*			trans	-110.9	148.2	-167.8	42.6	0	0	0	0	112.8
279	Y	35	Very low	35.6	Very low	242 Å²	242	157.2 Å²	157.2	95%	0.949	78%	0.783	S	S	*	*			trans	-148.7	132.7	147.3	-90.2	-70.7	0	0	0	111
280	S	28.6	Very low	35.3	Very low	114 Å²	114	160.2 Å²	160.2	80%	0.797	79%	0.788	S	S	*	*			trans	-101.4	134.2	-174.8	-176.9	0	0	0	0	112.3
281	I	38.1	Very low	35.2	Very low	165 Å²	165	166.6 Å²	166.6	85%	0.846	81%	0.81	S	S	*	*			trans	-132.7	102.7	169.8	-57.8	-177.3	0	0	0	110
282	R	30.2	Very low	35.2	Very low	235 Å²	235	167.3 Å²	167.3	89%	0.887	81%	0.809	S	S	*	*			trans	-92.1	109.2	179.8	179.7	-176.7	-179.3	-168	3.5	110.4
283	G	32.9	Very low	35	Very low	63 Å²	63	170.4 Å²	170.4	65%	0.649	82%	0.815	S	S	*	*			trans	-133.1	49.8	-159.9	0	0	0	0	0	118.1
284	K	35.8	Very low	35	Very low	191 Å²	191	171.6 Å²	171.6	83%	0.83	82%	0.817	S	S	*	*			trans	-1.3	117.8	168.1	-62.7	-179.5	177.2	-174.3	0	118.2
285	Y	38.5	Very low	35	Very low	209 Å²	209	171.4 Å²	171.4	82%	0.82	82%	0.82	S	S	*	*			trans	-138.3	71.4	150.2	-88.8	-76.9	0	0	0	111.8
286	F	34.9	Very low	35	Very low	191 Å²	191	176.3 Å²	176.3	84%	0.838	83%	0.831	S	S	*	*			trans	-94	136.1	150	-86.5	-92.1	0	0	0	108
287	R	38.4	Very low	35.1	Very low	208 Å²	208	179.1 Å²	179.1	79%	0.785	84%	0.838	S	S	*	*			trans	-140.8	103.8	158.2	-131.2	-164.5	-57.2	-100.5	4	106.6
288	E	34.6	Very low	35.2	Very low	151 Å²	151	178.2 Å²	178.2	71%	0.706	83%	0.834	S	S	*	*			trans	-61.1	148	169.7	-60.3	101.5	157.7	0	0	110.2
289	I	39.2	Very low	35.6	Very low	165 Å²	165	182.3 Å²	182.3	85%	0.846	84%	0.839	S	S	*	*			trans	-123.6	102.4	155.5	-61.1	-179.7	0	0	0	104.8
290	E	37.6	Very low	35.7	Very low	163 Å²	163	177.3 Å²	177.3	76%	0.762	83%	0.83	S	S	*	*			trans	-88.1	147.6	170.5	-64	-172.8	118.7	0	0	110.1
291	F	39.1	Very low	36.3	Very low	273 Å²	273	183.1 Å²	183.1	100%	1.197	83%	0.833	S	S	*	*			trans	71	0	177.5	-75	-85.7	0	0	0	117.9

Retrieved 291 of 291 residues in 187 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).