A0A077Z273_TRITR Loading...

Actin-related protein 10

AlphaFold DB , UniProt , Accession A0A077Z273, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 275 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.6	Very low	72.6	Confident	220 Å²	220	117.3 Å²	117.3	100%	1.084	59%	0.591	S	S	*	*				0	103.1	0	-156.4	-174.1	-63.8	0	0	107.1	L3	M1-L3 VanDerWaalsContact C-N 3.3Å; M1-L3 PolarHBondContact O-N 2.98Å; M1-L3 HydrophobicContact SD-CD1 4.33Å
2	L	56.2	Low	74.3	Confident	182 Å²	182	109.3 Å²	109.3	95%	0.953	55%	0.551	S	S	*	*			trans	-73.5	85.3	178.7	-78.1	158.1	0	0	0	108	S4	L2-S4 PolarHBondContact O-N 3.39Å
3	L	62.6	Low	75.7	Confident	98 Å²	98	104.6 Å²	104.6	51%	0.513	53%	0.531	S	S	.	.			trans	-67.6	126.4	165.8	-84	107.1	0	0	0	107.9	M1	M1-L3 VanDerWaalsContact C-N 3.3Å; M1-L3 PolarHBondContact O-N 2.98Å; M1-L3 HydrophobicContact SD-CD1 4.33Å
4	S	75.2	Confident	76.8	Confident	63 Å²	63	98.1 Å²	98.1	44%	0.441	50%	0.498	S	S	.	.			trans	-59.5	129.7	170	-62.5	0	0	0	0	108.5	L2 K6 D7	L2-S4 PolarHBondContact O-N 3.39Å; S4-K6 PolarHBondContact O-N 2.94Å; S4-D7 WeakPolarHBondContact CB-OD2 3.45Å; S4-D7 PolarHBondContact O-N 2.98Å
5	P	70.9	Confident	77.7	Confident	115 Å²	115	93.3 Å²	93.3	75%	0.747	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-54.5	-24.9	177.3	-27.4	34.1	0	0	0	113.6	D7 R8	P5-D7 VanDerWaalsContact C-N 3.28Å; P5-D7 PolarHBondContact O-N 3.34Å; P5-R8 PolarHBondContact O-N 3.28Å
6	K	68.6	Low	78.4	Confident	141 Å²	141	88.8 Å²	88.8	61%	0.613	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-67.4	-24.7	177.4	-62.4	-179.3	179.9	177.3	0	113.8	S4	S4-K6 PolarHBondContact O-N 2.94Å
7	D	71.5	Confident	79	Confident	103 Å²	103	89.3 Å²	89.3	55%	0.551	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-92.1	-4.3	-179.4	-57.9	-30.3	0	0	0	112	S4 P5	S4-D7 WeakPolarHBondContact CB-OD2 3.45Å; S4-D7 PolarHBondContact O-N 2.98Å; P5-D7 VanDerWaalsContact C-N 3.28Å; P5-D7 PolarHBondContact O-N 3.34Å
8	R	82.8	Confident	79.6	Confident	158 Å²	158	88.1 Å²	88.1	60%	0.596	45%	0.452	S	S	*	.			trans	-75.8	128.9	175.1	-62.9	-72.1	-82.3	-171	-6	108.9	P5	P5-R8 PolarHBondContact O-N 3.28Å
9	R	86.1	Confident	80.2	Confident	119 Å²	119	87.3 Å²	87.3	45%	0.449	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	134.4	172.2	-65.9	173.1	174.6	103.3	-2.7	109.2	S31 L241 S245	R9-S31 WeakPolarHBondContact CA-O 3.45Å; R9-L241 HydrophobicContact CB-CD2 3.97Å; R9-L241 HydrophobicContact CB-CG 4.18Å; R9-S245 WeakPolarHBondContact CD-OG 3.09Å; R9-S245 PolarHBondContact NE-OG 2.94Å
10	V	89.9	Confident	80.5	Confident	61 Å²	61	86 Å²	86	37%	0.37	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.9	-179.5	-178.6	0	0	0	0	109.1	I12 M30 S31 V32 M33	V10-I12 HydrophobicContact CG1-CG1 4.3Å; V10-M30 HydrophobicContact CB-SD 4.41Å; V10-M30 HydrophobicContact CG2-SD 4.48Å; V10-S31 PolarHBondContact N-O 3.24Å; V10-V32 HydrophobicContact CB-CG1 4.41Å; V10-V32 CarbonylContact O-C 3.6Å; V10-V32 VanDerWaalsContact O-CA 3.31Å; V10-V32 WeakPolarHBondContact O-CA 3.43Å; V10-M33 PolarHBondContact O-N 3.26Å
11	V	91.6	Very high	81	Confident	30 Å²	30	87.6 Å²	87.6	18%	0.182	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.7	170	-178.6	0	0	0	0	108.3	V13 M33 A35 I235 L241	V11-V13 HydrophobicContact CG1-CG2 4.4Å; V11-M33 WeakPolarHBondContact CA-O 3.37Å; V11-A35 HydrophobicContact CG1-CB 4.21Å; V11-I235 HydrophobicContact CG1-CB 4.34Å; V11-I235 HydrophobicContact CG1-CG2 4.11Å; V11-I235 HydrophobicContact CG2-CB 4.49Å; V11-I235 HydrophobicContact CG2-CG2 3.96Å; V11-L241 HydrophobicContact CG2-CD1 3.47Å; V11-L241 VanDerWaalsContact CG2-CD1 3.47Å; V11-L241 HydrophobicContact CG2-CD2 4.34Å
12	I	92.2	Very high	83.1	Confident	22 Å²	22	80.4 Å²	80.4	11%	0.113	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112	175.8	-63.8	160.6	0	0	0	107.2	V10 E14 M26 M30 V32 M33 F34 A35	V10-I12 HydrophobicContact CG1-CG1 4.3Å; I12-E14 HydrophobicContact CG2-CB 4.47Å; I12-M26 HydrophobicContact CD1-CB 4.19Å; I12-M26 HydrophobicContact CD1-CE 3.27Å; I12-M26 HydrophobicContact CD1-SD 3.83Å; I12-M26 HydrophobicContact CG1-CE 3.82Å; I12-M26 HydrophobicContact CG2-CE 3.94Å; I12-M26 HydrophobicContact CG2-SD 4.36Å; I12-M30 HydrophobicContact CD1-SD 4.43Å; I12-V32 HydrophobicContact CD1-CB 3.84Å; I12-V32 HydrophobicContact CD1-CG1 3.39Å; I12-V32 HydrophobicContact CG1-CG1 4.34Å; I12-M33 PolarHBondContact N-O 3.44Å; I12-F34 HydrophobicContact CB-CD1 4.06Å; I12-F34 HydrophobicContact CB-CE1 4.36Å; I12-F34 HydrophobicContact CD1-CD1 4.25Å; I12-F34 HydrophobicContact CD1-CE1 3.74Å; I12-F34 HydrophobicContact CD1-CZ 4.37Å; I12-F34 HydrophobicContact CG2-CD1 4.17Å; I12-F34 HydrophobicContact CG2-CE1 4.39Å; I12-A35 PolarHBondContact O-N 3.29Å
13	V	92.6	Very high	84.8	Confident	48 Å²	48	72.8 Å²	72.8	29%	0.291	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	121.3	172.5	-175.8	0	0	0	0	108.2	V11 A35 N37 C40 A228	V11-V13 HydrophobicContact CG1-CG2 4.4Å; V13-A35 WeakPolarHBondContact CA-O 3.39Å; V13-N37 HydrophobicContact CG1-CB 4.39Å; V13-C40 HydrophobicContact CG1-CB 3.98Å; V13-C40 HydrophobicContact CG2-CB 4.39Å; V13-A228 HydrophobicContact CG1-CB 4.37Å
14	E	91.4	Very high	86.1	Confident	14 Å²	14	69.6 Å²	69.6	7%	0.065	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	166.3	-179.4	70.1	176.2	145.7	0	0	113.1	I12 N18 R23 F34 A35 P36 N37 W260	I12-E14 HydrophobicContact CG2-CB 4.47Å; E14-N18 WeakPolarHBondContact CB-ND2 3.35Å; E14-N18 VanDerWaalsContact OE2-CB 3.32Å; E14-N18 WeakPolarHBondContact OE2-CB 3.15Å; E14-N18 PolarHBondContact OE2-ND2 3.28Å; E14-R23 WeakPolarHBondContact OE1-CD 3.13Å; E14-R23 WeakPolarHBondContact OE1-CG 3.12Å; E14-F34 WeakPolarHBondContact OE1-CD1 3.49Å; E14-A35 PolarHBondContact N-O 3.17Å; E14-A35 VanDerWaalsContact N-O 3.13Å; E14-P36 CarbonylContact O-C 3.55Å; E14-N37 WeakPolarHBondContact O-CB 3.31Å; E14-N37 PolarHBondContact O-N 3.28Å; E14-W260 HydrophobicContact CG-CH2 3.54Å; E14-W260 HydrophobicContact CG-CZ2 3.84Å
15	S	90.3	Very high	86.8	Confident	25 Å²	25	70.7 Å²	70.7	18%	0.175	37%	0.374	C	S	.	.			trans	-72.6	143.1	172.5	174.5	0	0	0	0	110.2	L17 N18 Q61	S15-L17 PolarHBondContact O-N 3.12Å; S15-L17 VanDerWaalsContact O-N 3.15Å; S15-L17 PolarHBondContact OG-N 3.42Å; S15-N18 WeakPolarHBondContact O-CB 3.38Å; S15-N18 PolarHBondContact O-N 3.44Å; S15-N18 VanDerWaalsContact O-N 3.13Å; S15-Q61 PolarHBondContact OG-OE1 3.08Å
16	V	89.4	Confident	87.7	Confident	21 Å²	21	67.8 Å²	67.8	13%	0.127	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.8	173.2	175.5	0	0	0	0	112.3	N18 P36 L63 L72 W260	V16-N18 VanDerWaalsContact C-N 3.25Å; V16-N18 PolarHBondContact O-N 3.08Å; V16-P36 HydrophobicContact CG2-CB 4.01Å; V16-L63 HydrophobicContact CG2-CD2 3.72Å; V16-L72 HydrophobicContact CB-CD2 4.47Å; V16-L72 HydrophobicContact CG1-CD1 4.31Å; V16-L72 HydrophobicContact CG1-CD2 3.63Å; V16-L72 HydrophobicContact CG2-CD2 4.07Å; V16-W260 HydrophobicContact CG1-CG 4.15Å; V16-W260 HydrophobicContact CG2-CD2 4.42Å; V16-W260 HydrophobicContact CG2-CG 4.43Å; V16-W260 PolarHBondContact O-NE1 3.23Å
17	L	89	Confident	88.7	Confident	98 Å²	98	61.1 Å²	61.1	51%	0.513	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-4.7	-177.7	-57.8	176.9	0	0	0	113.9	S15 I75 T77	S15-L17 PolarHBondContact O-N 3.12Å; S15-L17 VanDerWaalsContact O-N 3.15Å; S15-L17 PolarHBondContact OG-N 3.42Å; L17-I75 HydrophobicContact CD2-CD1 3.84Å; L17-I75 HydrophobicContact CG-CD1 4.33Å; L17-T77 HydrophobicContact CD1-CG2 3.4Å; L17-T77 VanDerWaalsContact CD1-CG2 3.4Å; L17-T77 HydrophobicContact CD2-CG2 4.17Å; L17-T77 HydrophobicContact CG-CG2 4.24Å
18	N	89.7	Confident	89.5	Confident	67 Å²	67	61.8 Å²	61.8	36%	0.358	32%	0.32	S	S	.	.	S	Bend	trans	-64.9	140.3	-178.4	-84.9	-1.5	0	0	0	111.7	E14 S15 V16	E14-N18 WeakPolarHBondContact CB-ND2 3.35Å; E14-N18 VanDerWaalsContact OE2-CB 3.32Å; E14-N18 WeakPolarHBondContact OE2-CB 3.15Å; E14-N18 PolarHBondContact OE2-ND2 3.28Å; S15-N18 WeakPolarHBondContact O-CB 3.38Å; S15-N18 PolarHBondContact O-N 3.44Å; S15-N18 VanDerWaalsContact O-N 3.13Å; V16-N18 VanDerWaalsContact C-N 3.25Å; V16-N18 PolarHBondContact O-N 3.08Å
19	P	90	Very high	89.7	Confident	74 Å²	74	58.5 Å²	58.5	48%	0.481	32%	0.318	S	S	.	.			trans	-58.4	139.4	176.8	-22.5	32.1	0	0	0	112.7	E21 V22	P19-E21 WeakPolarHBondContact CB-OE2 3.43Å; P19-E21 PolarHBondContact O-N 2.88Å; P19-V22 PolarHBondContact O-N 3.25Å
20	S	87	Confident	89.8	Confident	60 Å²	60	55.9 Å²	55.9	42%	0.42	31%	0.312	S	S	.	.	H	α-helix	trans	-66.2	-20.5	-177.2	71.2	0	0	0	0	114	V22 R23 S24	S20-V22 VanDerWaalsContact C-N 3.31Å; S20-V22 PolarHBondContact O-N 3.18Å; S20-R23 PolarHBondContact O-N 3Å; S20-S24 WeakPolarHBondContact O-CB 3.42Å; S20-S24 PolarHBondContact O-N 3.35Å; S20-S24 PolarHBondContact O-OG 3.27Å
21	E	89.7	Confident	89.8	Confident	120 Å²	120	53.5 Å²	53.5	56%	0.561	30%	0.298	S	S	*	.	H	α-helix	trans	-65.6	-36.5	178.2	-63.2	74.9	-166.9	0	0	111.2	P19 S24 T25	P19-E21 WeakPolarHBondContact CB-OE2 3.43Å; P19-E21 PolarHBondContact O-N 2.88Å; E21-S24 PolarHBondContact O-N 3.42Å; E21-T25 WeakPolarHBondContact O-CB 3.18Å; E21-T25 PolarHBondContact O-N 3.3Å; E21-T25 PolarHBondContact O-OG1 2.8Å
22	V	89.4	Confident	89.7	Confident	70 Å²	70	52.1 Å²	52.1	42%	0.424	29%	0.289	S	S	.	.	H	α-helix	trans	-65.2	-49.8	176.5	179.6	0	0	0	0	109.2	P19 S20 S24 T25 M26	P19-V22 PolarHBondContact O-N 3.25Å; S20-V22 VanDerWaalsContact C-N 3.31Å; S20-V22 PolarHBondContact O-N 3.18Å; V22-S24 VanDerWaalsContact C-N 3.31Å; V22-S24 PolarHBondContact O-N 3.15Å; V22-T25 PolarHBondContact O-N 3.12Å; V22-T25 VanDerWaalsContact O-N 3.11Å; V22-M26 HydrophobicContact CG1-SD 4.03Å; V22-M26 WeakPolarHBondContact O-CG 3.45Å; V22-M26 PolarHBondContact O-N 2.82Å
23	R	90.2	Very high	89.5	Confident	22 Å²	22	51.9 Å²	51.9	8%	0.083	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-46	176	-61.4	-164.2	-68.5	148.7	-5.6	111.6	E14 S20 T25 M26 A27 F34 I257 T258	E14-R23 WeakPolarHBondContact OE1-CD 3.13Å; E14-R23 WeakPolarHBondContact OE1-CG 3.12Å; S20-R23 PolarHBondContact O-N 3Å; R23-T25 VanDerWaalsContact C-N 3.31Å; R23-T25 PolarHBondContact O-N 2.95Å; R23-M26 PolarHBondContact O-N 3.33Å; R23-A27 WeakPolarHBondContact O-CB 3.33Å; R23-A27 PolarHBondContact O-N 3.41Å; R23-F34 HydrophobicContact CB-CD1 4.42Å; R23-F34 HydrophobicContact CB-CE1 3.82Å; R23-F34 HydrophobicContact CB-CE2 4.09Å; R23-F34 HydrophobicContact CB-CZ 3.63Å; R23-F34 HydrophobicContact CG-CD1 3.97Å; R23-F34 HydrophobicContact CG-CE1 3.76Å; R23-F34 HydrophobicContact CG-CG 4.46Å; R23-F34 HydrophobicContact CG-CZ 4.1Å; R23-F34 WeakPolarHBondContact O-CZ 3.42Å; R23-I257 HydrophobicContact CB-CD1 3.6Å; R23-I257 WeakPolarHBondContact O-CD1 3.44Å; R23-T258 PolarHBondContact NH1-O 3Å; R23-T258 VanDerWaalsContact NH1-O 3.08Å
24	S	90.2	Very high	89.4	Confident	30 Å²	30	49.9 Å²	49.9	21%	0.21	28%	0.275	C	S	.	.	H	α-helix	trans	-59.6	-40.8	177.3	-64	0	0	0	0	112.4	S20 E21 V22 K28 Y251	S20-S24 WeakPolarHBondContact O-CB 3.42Å; S20-S24 PolarHBondContact O-N 3.35Å; S20-S24 PolarHBondContact O-OG 3.27Å; E21-S24 PolarHBondContact O-N 3.42Å; V22-S24 VanDerWaalsContact C-N 3.31Å; V22-S24 PolarHBondContact O-N 3.15Å; S24-K28 WeakPolarHBondContact O-CG 3.28Å; S24-K28 PolarHBondContact O-N 3.12Å; S24-Y251 VanDerWaalsContact CB-OH 3.27Å; S24-Y251 WeakPolarHBondContact CB-OH 3.24Å; S24-Y251 PolarHBondContact OG-OH 2.77Å
25	T	91	Very high	89.3	Confident	86 Å²	86	49.3 Å²	49.3	53%	0.528	27%	0.273	S	S	.	.	H	α-helix	trans	-69.1	-40	178.2	-56	0	0	0	0	111.5	E21 V22 R23 K28	E21-T25 WeakPolarHBondContact O-CB 3.18Å; E21-T25 PolarHBondContact O-N 3.3Å; E21-T25 PolarHBondContact O-OG1 2.8Å; V22-T25 PolarHBondContact O-N 3.12Å; V22-T25 VanDerWaalsContact O-N 3.11Å; R23-T25 VanDerWaalsContact C-N 3.31Å; R23-T25 PolarHBondContact O-N 2.95Å; T25-K28 PolarHBondContact O-N 3.49Å
26	M	89.7	Confident	89.4	Confident	55 Å²	55	48.3 Å²	48.3	27%	0.271	27%	0.266	S	S	.	.	H	α-helix	trans	-65.8	-44.3	176.9	-64.9	174.3	95.9	0	0	111.7	I12 V22 R23 K28 V29 M30 F34	I12-M26 HydrophobicContact CD1-CB 4.19Å; I12-M26 HydrophobicContact CD1-CE 3.27Å; I12-M26 HydrophobicContact CD1-SD 3.83Å; I12-M26 HydrophobicContact CG1-CE 3.82Å; I12-M26 HydrophobicContact CG2-CE 3.94Å; I12-M26 HydrophobicContact CG2-SD 4.36Å; V22-M26 HydrophobicContact CG1-SD 4.03Å; V22-M26 WeakPolarHBondContact O-CG 3.45Å; V22-M26 PolarHBondContact O-N 2.82Å; R23-M26 PolarHBondContact O-N 3.33Å; M26-K28 PolarHBondContact O-N 2.98Å; M26-V29 PolarHBondContact O-N 2.95Å; M26-M30 WeakPolarHBondContact O-CG 3.42Å; M26-M30 PolarHBondContact O-N 2.88Å; M26-M30 VanDerWaalsContact O-N 3.12Å; M26-F34 HydrophobicContact CB-CE1 4.44Å; M26-F34 HydrophobicContact CB-CZ 4.29Å; M26-F34 HydrophobicContact SD-CE1 4.26Å
27	A	88.7	Confident	89.6	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-25.9	179.1	0	0	0	0	0	113.8	R23 V29 V32 Y251 I257	R23-A27 WeakPolarHBondContact O-CB 3.33Å; R23-A27 PolarHBondContact O-N 3.41Å; A27-V29 VanDerWaalsContact C-N 3.3Å; A27-V29 PolarHBondContact O-N 2.85Å; A27-V32 HydrophobicContact CB-CG2 4.05Å; A27-Y251 HydrophobicContact CB-CD1 3.98Å; A27-Y251 HydrophobicContact CB-CD2 3.76Å; A27-Y251 HydrophobicContact CB-CE1 4.28Å; A27-Y251 HydrophobicContact CB-CE2 4.06Å; A27-Y251 HydrophobicContact CB-CG 3.7Å; A27-I257 HydrophobicContact CB-CD1 3.93Å; A27-I257 HydrophobicContact CB-CG1 4.47Å
28	K	89.2	Confident	89.7	Confident	116 Å²	116	44.5 Å²	44.5	50%	0.504	25%	0.246	S	C	.	.	H	α-helix	trans	-68.8	-27.5	172.7	-72.4	173.2	-174.9	177.5	0	113.3	S24 T25 M26 R248 Y251	S24-K28 WeakPolarHBondContact O-CG 3.28Å; S24-K28 PolarHBondContact O-N 3.12Å; T25-K28 PolarHBondContact O-N 3.49Å; M26-K28 PolarHBondContact O-N 2.98Å; K28-R248 WeakPolarHBondContact O-CD 3.41Å; K28-R248 PolarHBondContact O-NE 2.69Å; K28-Y251 HydrophobicContact CD-CE1 4.37Å; K28-Y251 HydrophobicContact CG-CD1 3.96Å; K28-Y251 HydrophobicContact CG-CE1 3.46Å; K28-Y251 VanDerWaalsContact CG-CE1 3.46Å
29	V	87.6	Confident	89.8	Confident	90 Å²	90	41.9 Å²	41.9	55%	0.545	23%	0.232	S	C	.	.	H	α-helix	trans	-98.7	-35	-170.7	-178.8	0	0	0	0	111.5	M26 A27	M26-V29 PolarHBondContact O-N 2.95Å; A27-V29 VanDerWaalsContact C-N 3.3Å; A27-V29 PolarHBondContact O-N 2.85Å
30	M	87.8	Confident	89.9	Confident	64 Å²	64	38.4 Å²	38.4	32%	0.315	21%	0.209	S	C	.	.	S	Bend	trans	-143.9	156.3	-169.3	48.4	171.8	87	0	0	112.1	V10 I12 M26 V32	V10-M30 HydrophobicContact CB-SD 4.41Å; V10-M30 HydrophobicContact CG2-SD 4.48Å; I12-M30 HydrophobicContact CD1-SD 4.43Å; M26-M30 WeakPolarHBondContact O-CG 3.42Å; M26-M30 PolarHBondContact O-N 2.88Å; M26-M30 VanDerWaalsContact O-N 3.12Å; M30-V32 HydrophobicContact CB-CG1 4.18Å; M30-V32 HydrophobicContact CG-CG1 3.41Å; M30-V32 VanDerWaalsContact CG-CG1 3.41Å; M30-V32 HydrophobicContact SD-CG1 3.55Å; M30-V32 VanDerWaalsContact SD-CG1 3.55Å
31	S	88.8	Confident	90.2	Very high	11 Å²	11	35.5 Å²	35.5	8%	0.077	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.7	172.2	-59.3	0	0	0	0	109.5	R9 V10 I246 R248	R9-S31 WeakPolarHBondContact CA-O 3.45Å; V10-S31 PolarHBondContact N-O 3.24Å; S31-I246 CarbonylContact C-O 3.58Å; S31-I246 WeakPolarHBondContact CA-O 3.22Å; S31-R248 PolarHBondContact OG-N 2.93Å
32	V	89.8	Confident	90.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.2	-164.2	-71.7	0	0	0	0	113.5	V10 I12 A27 M30 F34 S245 I246	V10-V32 HydrophobicContact CB-CG1 4.41Å; V10-V32 CarbonylContact O-C 3.6Å; V10-V32 VanDerWaalsContact O-CA 3.31Å; V10-V32 WeakPolarHBondContact O-CA 3.43Å; I12-V32 HydrophobicContact CD1-CB 3.84Å; I12-V32 HydrophobicContact CD1-CG1 3.39Å; I12-V32 HydrophobicContact CG1-CG1 4.34Å; A27-V32 HydrophobicContact CB-CG2 4.05Å; M30-V32 HydrophobicContact CB-CG1 4.18Å; M30-V32 HydrophobicContact CG-CG1 3.41Å; M30-V32 VanDerWaalsContact CG-CG1 3.41Å; M30-V32 HydrophobicContact SD-CG1 3.55Å; M30-V32 VanDerWaalsContact SD-CG1 3.55Å; V32-F34 HydrophobicContact CB-CE2 4.43Å; V32-F34 HydrophobicContact CB-CZ 4.35Å; V32-F34 HydrophobicContact CG2-CD2 4.4Å; V32-F34 HydrophobicContact CG2-CE1 4.49Å; V32-F34 HydrophobicContact CG2-CE2 3.57Å; V32-F34 HydrophobicContact CG2-CZ 3.63Å; V32-S245 WeakPolarHBondContact O-CA 3.22Å; V32-I246 PolarHBondContact N-O 2.9Å; V32-I246 PolarHBondContact O-N 2.8Å
33	M	88.9	Confident	90.5	Very high	17 Å²	17	28.4 Å²	28.4	8%	0.084	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.7	162.8	179.4	179.8	172.5	0	0	107.8	V10 V11 I12 I235 L241 R244	V10-M33 PolarHBondContact O-N 3.26Å; V11-M33 WeakPolarHBondContact CA-O 3.37Å; I12-M33 PolarHBondContact N-O 3.44Å; M33-I235 HydrophobicContact CE-CG2 3.8Å; M33-I235 HydrophobicContact SD-CG2 3.72Å; M33-L241 HydrophobicContact CB-CD1 3.73Å; M33-L241 HydrophobicContact CG-CD1 4.32Å; M33-L241 HydrophobicContact SD-CD1 3.62Å; M33-R244 HydrophobicContact CE-CB 3.84Å; M33-R244 HydrophobicContact CE-CG 4.33Å; M33-R244 HydrophobicContact CG-CB 4.26Å; M33-R244 HydrophobicContact SD-CB 3.71Å
34	F	90.2	Very high	90.6	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.026	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.4	171.4	-60.2	-76.3	0	0	0	108.7	I12 E14 R23 M26 V32 I257 W260 Q263	I12-F34 HydrophobicContact CB-CD1 4.06Å; I12-F34 HydrophobicContact CB-CE1 4.36Å; I12-F34 HydrophobicContact CD1-CD1 4.25Å; I12-F34 HydrophobicContact CD1-CE1 3.74Å; I12-F34 HydrophobicContact CD1-CZ 4.37Å; I12-F34 HydrophobicContact CG2-CD1 4.17Å; I12-F34 HydrophobicContact CG2-CE1 4.39Å; E14-F34 WeakPolarHBondContact OE1-CD1 3.49Å; R23-F34 HydrophobicContact CB-CD1 4.42Å; R23-F34 HydrophobicContact CB-CE1 3.82Å; R23-F34 HydrophobicContact CB-CE2 4.09Å; R23-F34 HydrophobicContact CB-CZ 3.63Å; R23-F34 HydrophobicContact CG-CD1 3.97Å; R23-F34 HydrophobicContact CG-CE1 3.76Å; R23-F34 HydrophobicContact CG-CG 4.46Å; R23-F34 HydrophobicContact CG-CZ 4.1Å; R23-F34 WeakPolarHBondContact O-CZ 3.42Å; M26-F34 HydrophobicContact CB-CE1 4.44Å; M26-F34 HydrophobicContact CB-CZ 4.29Å; M26-F34 HydrophobicContact SD-CE1 4.26Å; V32-F34 HydrophobicContact CB-CE2 4.43Å; V32-F34 HydrophobicContact CB-CZ 4.35Å; V32-F34 HydrophobicContact CG2-CD2 4.4Å; V32-F34 HydrophobicContact CG2-CE1 4.49Å; V32-F34 HydrophobicContact CG2-CE2 3.57Å; V32-F34 HydrophobicContact CG2-CZ 3.63Å; F34-I257 HydrophobicContact CD2-CG2 3.77Å; F34-I257 HydrophobicContact CE2-CD1 3.86Å; F34-I257 HydrophobicContact CE2-CG2 3.85Å; F34-I257 HydrophobicContact CZ-CD1 4.28Å; F34-W260 HydrophobicContact CB-CH2 3.87Å; F34-W260 HydrophobicContact CB-CZ3 3.89Å; F34-Q263 PolarHBondContact O-OE1 3.21Å; F34-Q263 VanDerWaalsContact O-OE1 3.06Å
35	A	90	Very high	90.7	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.017	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	129.3	178.6	0	0	0	0	0	110.1	V11 I12 V13 E14 N37 C40 I235	V11-A35 HydrophobicContact CG1-CB 4.21Å; I12-A35 PolarHBondContact O-N 3.29Å; V13-A35 WeakPolarHBondContact CA-O 3.39Å; E14-A35 PolarHBondContact N-O 3.17Å; E14-A35 VanDerWaalsContact N-O 3.13Å; A35-N37 PolarHBondContact O-N 3.44Å; A35-C40 WeakPolarHBondContact CB-SG 3.44Å; A35-I235 HydrophobicContact CB-CD1 3.87Å
36	P	91.7	Very high	90.8	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.026	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	138.4	176.9	-19.7	28.2	0	0	0	111.6	E14 V16 S38 L39 C40 W260	E14-P36 CarbonylContact O-C 3.55Å; V16-P36 HydrophobicContact CG2-CB 4.01Å; P36-S38 VanDerWaalsContact C-N 3.29Å; P36-S38 PolarHBondContact O-N 3.03Å; P36-L39 HydrophobicContact CB-CB 4.07Å; P36-L39 HydrophobicContact CG-CB 4.26Å; P36-L39 HydrophobicContact CG-CD2 4.49Å; P36-L39 PolarHBondContact O-N 3.27Å; P36-C40 PolarHBondContact O-N 3.21Å; P36-C40 PolarHBondContact O-SG 3.14Å; P36-W260 HydrophobicContact CB-CE3 4.41Å; P36-W260 HydrophobicContact CB-CZ3 4.48Å; P36-W260 HydrophobicContact CG-CD2 4.34Å; P36-W260 HydrophobicContact CG-CE3 3.51Å; P36-W260 HydrophobicContact CG-CZ3 3.81Å
37	N	92.8	Very high	90.9	Very high	31 Å²	31	26.4 Å²	26.4	17%	0.166	16%	0.155	C	C	.	.	H	α-helix	trans	-54.7	-45.4	176.8	-165.1	6.7	0	0	0	112.2	V13 E14 A35 L39 C40 S41 D54 A228	V13-N37 HydrophobicContact CG1-CB 4.39Å; E14-N37 WeakPolarHBondContact O-CB 3.31Å; E14-N37 PolarHBondContact O-N 3.28Å; A35-N37 PolarHBondContact O-N 3.44Å; N37-L39 PolarHBondContact O-N 2.77Å; N37-C40 PolarHBondContact O-N 3.04Å; N37-S41 WeakPolarHBondContact O-CB 3.39Å; N37-S41 PolarHBondContact O-N 3.29Å; N37-D54 PolarHBondContact ND2-OD2 2.95Å; N37-A228 WeakPolarHBondContact OD1-CB 3.47Å
38	S	92.2	Very high	91.1	Very high	8 Å²	8	32.4 Å²	32.4	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-50.7	177.8	52.3	0	0	0	0	112	P36 C40 S41 C42 L63 S70	P36-S38 VanDerWaalsContact C-N 3.29Å; P36-S38 PolarHBondContact O-N 3.03Å; S38-C40 PolarHBondContact O-N 2.92Å; S38-S41 PolarHBondContact O-N 3.48Å; S38-S41 PolarHBondContact O-OG 3.21Å; S38-C42 PolarHBondContact O-N 2.9Å; S38-C42 PolarHBondContact O-SG 2.84Å; S38-L63 WeakPolarHBondContact OG-CD2 3.44Å; S38-S70 PolarHBondContact OG-OG 3.22Å
39	L	91.3	Very high	91.3	Very high	13 Å²	13	28.6 Å²	28.6	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-43.6	-178.4	-174.5	59.7	0	0	0	111.6	P36 N37 S41 C42 V65 G68 M265	P36-L39 HydrophobicContact CB-CB 4.07Å; P36-L39 HydrophobicContact CG-CB 4.26Å; P36-L39 HydrophobicContact CG-CD2 4.49Å; P36-L39 PolarHBondContact O-N 3.27Å; N37-L39 PolarHBondContact O-N 2.77Å; L39-S41 VanDerWaalsContact C-N 3.28Å; L39-S41 PolarHBondContact O-N 3.3Å; L39-C42 PolarHBondContact O-N 2.89Å; L39-V65 HydrophobicContact CD1-CG1 3.89Å; L39-G68 WeakPolarHBondContact CD1-O 3.34Å; L39-M265 HydrophobicContact CD1-CE 3.77Å; L39-M265 HydrophobicContact CD2-CE 3.37Å; L39-M265 HydrophobicContact CG-CE 3.38Å
40	C	92.5	Very high	91.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-41.4	176.2	-65.1	0	0	0	0	111.3	V13 A35 P36 N37 S38 C42 L43 P44 A228 G231 I235	V13-C40 HydrophobicContact CG1-CB 3.98Å; V13-C40 HydrophobicContact CG2-CB 4.39Å; A35-C40 WeakPolarHBondContact CB-SG 3.44Å; P36-C40 PolarHBondContact O-N 3.21Å; P36-C40 PolarHBondContact O-SG 3.14Å; N37-C40 PolarHBondContact O-N 3.04Å; S38-C40 PolarHBondContact O-N 2.92Å; C40-C42 PolarHBondContact O-N 3.28Å; C40-L43 PolarHBondContact O-N 2.91Å; C40-P44 VanDerWaalsContact O-CD 3.28Å; C40-P44 WeakPolarHBondContact O-CD 3.4Å; C40-A228 WeakPolarHBondContact CB-O 3.38Å; C40-G231 WeakPolarHBondContact O-CA 3.24Å; C40-I235 VanDerWaalsContact SG-CD1 3.56Å
41	S	93.5	Very high	92.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-24.7	-178.1	80.6	0	0	0	0	114.3	N37 S38 L39 P44 V52 M227	N37-S41 WeakPolarHBondContact O-CB 3.39Å; N37-S41 PolarHBondContact O-N 3.29Å; S38-S41 PolarHBondContact O-N 3.48Å; S38-S41 PolarHBondContact O-OG 3.21Å; L39-S41 VanDerWaalsContact C-N 3.28Å; L39-S41 PolarHBondContact O-N 3.3Å; S41-P44 WeakPolarHBondContact O-CD 3.45Å; S41-V52 VanDerWaalsContact OG-CG1 3.31Å; S41-V52 WeakPolarHBondContact OG-CG1 3.44Å; S41-M227 VanDerWaalsContact O-CE 3.22Å; S41-M227 WeakPolarHBondContact O-CE 3.4Å
42	C	93.3	Very high	92.5	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.007	12%	0.124	C	C	.	.	H	α-helix	trans	-77.2	-28.7	178.2	-67.1	0	0	0	0	113.4	S38 L39 C40 L45 G46 L47 V52	S38-C42 PolarHBondContact O-N 2.9Å; S38-C42 PolarHBondContact O-SG 2.84Å; L39-C42 PolarHBondContact O-N 2.89Å; C40-C42 PolarHBondContact O-N 3.28Å; C42-L45 PolarHBondContact O-N 3.09Å; C42-G46 PolarHBondContact O-N 3.24Å; C42-L47 HydrophobicContact CB-CB 4.04Å; C42-L47 WeakPolarHBondContact CB-O 3.44Å; C42-L47 PolarHBondContact O-N 3.39Å; C42-L47 VanDerWaalsContact O-N 3.08Å; C42-V52 WeakPolarHBondContact SG-CG2 3.27Å
43	L	92.1	Very high	92.8	Very high	40 Å²	40	20.8 Å²	20.8	21%	0.209	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-62.8	-41.8	-171.4	-68.3	176.1	0	0	0	115.1	C40 L45 G46 I234 I235 M265	C40-L43 PolarHBondContact O-N 2.91Å; L43-L45 PolarHBondContact O-N 2.96Å; L43-L45 VanDerWaalsContact O-N 3.1Å; L43-G46 PolarHBondContact O-N 2.93Å; L43-I234 HydrophobicContact CB-CD1 4.33Å; L43-I235 HydrophobicContact CD1-CD1 3.59Å; L43-I235 HydrophobicContact CD1-CG1 3.27Å; L43-M265 HydrophobicContact CD1-CE 4.17Å; L43-M265 HydrophobicContact CD2-CE 4.02Å; L43-M265 HydrophobicContact CD2-SD 4.43Å; L43-M265 HydrophobicContact CG-CE 4.41Å
44	P	92.3	Very high	93.1	Very high	25 Å²	25	21.1 Å²	21.1	16%	0.162	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-59.8	-24	178	-25.1	34.6	0	0	0	114.1	C40 S41 M227 L230 I234	C40-P44 VanDerWaalsContact O-CD 3.28Å; C40-P44 WeakPolarHBondContact O-CD 3.4Å; S41-P44 WeakPolarHBondContact O-CD 3.45Å; P44-M227 HydrophobicContact CB-CE 4.26Å; P44-M227 HydrophobicContact CB-SD 4.34Å; P44-M227 HydrophobicContact CG-CE 4.38Å; P44-M227 WeakPolarHBondContact CG-O 3.36Å; P44-M227 HydrophobicContact CG-SD 4.45Å; P44-L230 HydrophobicContact CB-CD2 3.71Å; P44-L230 HydrophobicContact CB-CG 4.15Å; P44-L230 HydrophobicContact CG-CB 3.97Å; P44-L230 HydrophobicContact CG-CD2 3.87Å; P44-L230 HydrophobicContact CG-CG 3.82Å; P44-I234 HydrophobicContact CB-CD1 4.44Å; P44-I234 HydrophobicContact CG-CD1 4.23Å
45	L	92.1	Very high	93.3	Very high	31 Å²	31	20.9 Å²	20.9	16%	0.162	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-97.5	-3.9	177.3	-64.9	178.3	0	0	0	112.7	C42 L43 L47 L177 F218 R221 M227	C42-L45 PolarHBondContact O-N 3.09Å; L43-L45 PolarHBondContact O-N 2.96Å; L43-L45 VanDerWaalsContact O-N 3.1Å; L45-L47 VanDerWaalsContact C-N 3.26Å; L45-L47 HydrophobicContact CB-CD1 3.78Å; L45-L47 HydrophobicContact CB-CD2 4.5Å; L45-L47 HydrophobicContact CB-CG 3.65Å; L45-L47 HydrophobicContact CD1-CD1 3.79Å; L45-L47 HydrophobicContact CG-CD1 4.45Å; L45-L47 PolarHBondContact O-N 2.92Å; L45-L177 HydrophobicContact CD1-CD1 3.65Å; L45-F218 HydrophobicContact CD1-CB 4.15Å; L45-R221 HydrophobicContact CD2-CB 4.19Å; L45-R221 HydrophobicContact CD2-CG 3.69Å; L45-M227 HydrophobicContact CD1-CE 3.72Å; L45-M227 HydrophobicContact CG-CE 3.73Å
46	G	91.8	Very high	93.5	Very high	63 Å²	63	21.6 Å²	21.6	65%	0.649	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.7	27.9	-175.1	0	0	0	0	0	113.2	C42 L43	C42-G46 PolarHBondContact O-N 3.24Å; L43-G46 PolarHBondContact O-N 2.93Å
47	L	92.3	Very high	93.6	Very high	31 Å²	31	27.8 Å²	27.8	16%	0.162	16%	0.157	C	C	.	.			trans	-86.1	127.3	-177.3	-59.5	173.7	0	0	0	110.2	C42 L45 A50 L177 F218	C42-L47 HydrophobicContact CB-CB 4.04Å; C42-L47 WeakPolarHBondContact CB-O 3.44Å; C42-L47 PolarHBondContact O-N 3.39Å; C42-L47 VanDerWaalsContact O-N 3.08Å; L45-L47 VanDerWaalsContact C-N 3.26Å; L45-L47 HydrophobicContact CB-CD1 3.78Å; L45-L47 HydrophobicContact CB-CD2 4.5Å; L45-L47 HydrophobicContact CB-CG 3.65Å; L45-L47 HydrophobicContact CD1-CD1 3.79Å; L45-L47 HydrophobicContact CG-CD1 4.45Å; L45-L47 PolarHBondContact O-N 2.92Å; L47-A50 HydrophobicContact CD1-CB 4.21Å; L47-L177 HydrophobicContact CD1-CD2 4.36Å; L47-F218 HydrophobicContact CD1-CB 4.28Å; L47-F218 HydrophobicContact CD1-CD1 3.94Å; L47-F218 HydrophobicContact CD1-CD2 3.57Å; L47-F218 HydrophobicContact CD1-CE1 4.13Å; L47-F218 HydrophobicContact CD1-CE2 3.73Å; L47-F218 HydrophobicContact CD1-CG 3.66Å; L47-F218 HydrophobicContact CD1-CZ 4.02Å; L47-F218 HydrophobicContact CD2-CD1 4Å; L47-F218 HydrophobicContact CD2-CE1 3.52Å; L47-F218 HydrophobicContact CD2-CE2 4.21Å; L47-F218 HydrophobicContact CD2-CZ 3.64Å; L47-F218 HydrophobicContact CG-CE1 4.49Å; L47-F218 HydrophobicContact CG-CZ 4.45Å
48	Q	92.1	Very high	93.6	Very high	128 Å²	128	30.6 Å²	30.6	60%	0.598	18%	0.179	S	C	*	.	S	Bend	trans	-94.4	-25.1	168.3	-67.1	-176.8	-47.8	0	0	112	F66 D67 G68	Q48-F66 CarbonylContact O-C 3.55Å; Q48-D67 PolarHBondContact O-N 3.11Å; Q48-D67 VanDerWaalsContact O-N 3.08Å; Q48-G68 PolarHBondContact O-N 3.46Å
49	T	93.8	Very high	93.6	Very high	35 Å²	35	31 Å²	31	22%	0.215	18%	0.184	C	C	.	.	S	Bend	trans	-131.1	116.7	-177.9	-61.7	0	0	0	0	110.1	V65 F66 D67 S171 M172	T49-V65 CarbonylContact C-O 3.6Å; T49-V65 VanDerWaalsContact CA-O 3.24Å; T49-V65 WeakPolarHBondContact CA-O 3.42Å; T49-F66 HydrophobicContact CG2-CD2 3.67Å; T49-F66 HydrophobicContact CG2-CE2 4.26Å; T49-D67 PolarHBondContact OG1-N 3.38Å; T49-S171 VanDerWaalsContact CG2-OG 3.28Å; T49-S171 WeakPolarHBondContact CG2-OG 3.42Å; T49-M172 HydrophobicContact CG2-CE 3.66Å
50	A	95.7	Very high	93.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	150	176.7	0	0	0	0	0	110.8	L47 V52 V65 G175 L177 F218	L47-A50 HydrophobicContact CD1-CB 4.21Å; A50-V52 PolarHBondContact O-N 3.29Å; A50-V65 PolarHBondContact N-O 2.93Å; A50-V65 PolarHBondContact O-N 3.29Å; A50-G175 CarbonylContact C-O 3.59Å; A50-G175 VanDerWaalsContact CA-O 3.25Å; A50-G175 WeakPolarHBondContact CA-O 3.47Å; A50-G175 WeakPolarHBondContact CB-O 3.36Å; A50-L177 HydrophobicContact CB-CB 4.25Å; A50-F218 HydrophobicContact CB-CD2 4.23Å; A50-F218 HydrophobicContact CB-CE2 3.8Å
51	L	96.9	Very high	93.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	104.1	166.1	-175.7	65.5	0	0	0	109.1	V62 P64 I157 A160 V161 M172 G175 I176 L177	L51-V62 HydrophobicContact CD1-CG1 3.56Å; L51-V62 HydrophobicContact CD2-CG1 4.25Å; L51-V62 HydrophobicContact CG-CG1 3.89Å; L51-P64 HydrophobicContact CD1-CB 3.91Å; L51-P64 HydrophobicContact CD1-CG 3.61Å; L51-I157 HydrophobicContact CD2-CG2 3.74Å; L51-A160 HydrophobicContact CD1-CB 4.3Å; L51-V161 HydrophobicContact CD2-CG2 3.66Å; L51-M172 HydrophobicContact CB-CB 4.14Å; L51-M172 HydrophobicContact CB-SD 4.21Å; L51-G175 PolarHBondContact N-O 3.14Å; L51-I176 HydrophobicContact CB-CG1 4.48Å; L51-I176 HydrophobicContact CD2-CG1 4.32Å; L51-I176 WeakPolarHBondContact O-CA 3.21Å; L51-L177 PolarHBondContact O-N 3.22Å
52	V	96.4	Very high	94.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.1	-178.9	-173.4	0	0	0	0	109.9	S41 C42 A50 V62 L63 V65 L177 V179	S41-V52 VanDerWaalsContact OG-CG1 3.31Å; S41-V52 WeakPolarHBondContact OG-CG1 3.44Å; C42-V52 WeakPolarHBondContact SG-CG2 3.27Å; A50-V52 PolarHBondContact O-N 3.29Å; V52-V62 CarbonylContact O-C 3.56Å; V52-V62 VanDerWaalsContact O-CA 3.31Å; V52-V62 WeakPolarHBondContact O-CA 3.45Å; V52-L63 PolarHBondContact N-O 2.95Å; V52-L63 VanDerWaalsContact N-O 3.13Å; V52-L63 PolarHBondContact O-N 3.21Å; V52-V65 HydrophobicContact CG2-CG2 4.02Å; V52-L177 CarbonylContact C-O 3.57Å; V52-L177 WeakPolarHBondContact CA-O 3.46Å; V52-L177 HydrophobicContact CG2-CD2 4.38Å; V52-V179 HydrophobicContact CG1-CG2 3.71Å
53	V	96.4	Very high	94.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	99.5	175.4	-177.9	0	0	0	0	107.5	V55 T60 V62 I153 I157 I176 L177 V178 V179	V53-V55 HydrophobicContact CG1-CG2 4.16Å; V53-T60 HydrophobicContact CG1-CG2 4.45Å; V53-V62 HydrophobicContact CB-CG2 4.43Å; V53-V62 HydrophobicContact CG1-CG2 4.11Å; V53-V62 HydrophobicContact CG2-CG1 4.29Å; V53-V62 HydrophobicContact CG2-CG2 4.15Å; V53-I153 HydrophobicContact CG1-CG2 4.12Å; V53-I157 HydrophobicContact CG1-CD1 4.22Å; V53-I157 HydrophobicContact CG1-CG1 4.38Å; V53-I157 HydrophobicContact CG2-CD1 3.76Å; V53-I157 HydrophobicContact CG2-CG1 3.68Å; V53-I176 HydrophobicContact CG2-CG2 3.75Å; V53-L177 PolarHBondContact N-O 2.7Å; V53-V178 HydrophobicContact CB-CG2 4.29Å; V53-V178 CarbonylContact O-C 3.57Å; V53-V178 WeakPolarHBondContact O-CA 3.38Å; V53-V179 PolarHBondContact O-N 3.13Å
54	D	95.6	Very high	94.4	Very high	25 Å²	25	29.5 Å²	29.5	13%	0.134	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	105.8	178.1	-176.5	12.6	0	0	0	110.4	N37 G56 T60 Q61 V179	N37-D54 PolarHBondContact ND2-OD2 2.95Å; D54-G56 PolarHBondContact O-N 2.94Å; D54-T60 CarbonylContact O-C 3.53Å; D54-T60 VanDerWaalsContact O-CA 3.29Å; D54-T60 WeakPolarHBondContact O-CA 3.04Å; D54-T60 WeakPolarHBondContact O-CG2 3.01Å; D54-Q61 PolarHBondContact N-O 3.41Å; D54-Q61 PolarHBondContact O-N 2.62Å; D54-V179 CarbonylContact C-O 3.57Å; D54-V179 WeakPolarHBondContact CA-O 3.33Å; D54-V179 HydrophobicContact CB-CG2 3.93Å
55	V	95.2	Very high	94.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	86.4	176.1	-168.7	0	0	0	0	108.7	V53 T60 I153 V178 V179 G180 G181 G182 C183 F188	V53-V55 HydrophobicContact CG1-CG2 4.16Å; V55-T60 HydrophobicContact CG2-CG2 4.15Å; V55-I153 HydrophobicContact CG1-CD1 4.1Å; V55-I153 HydrophobicContact CG2-CD1 4.11Å; V55-V178 HydrophobicContact CG2-CG1 4.42Å; V55-V179 PolarHBondContact N-O 3.23Å; V55-G180 CarbonylContact O-C 3.56Å; V55-G181 PolarHBondContact O-N 3.3Å; V55-G181 VanDerWaalsContact O-N 3.12Å; V55-G182 PolarHBondContact O-N 2.84Å; V55-C183 HydrophobicContact CB-CB 4.48Å; V55-C183 HydrophobicContact CG2-CB 4.38Å; V55-F188 HydrophobicContact CG2-CE1 4.33Å; V55-F188 HydrophobicContact CG2-CZ 3.96Å
56	G	93.8	Very high	94.5	Very high	17 Å²	17	30.9 Å²	30.9	18%	0.175	18%	0.178	C	C	.	.			trans	-79.6	-171.7	-178.4	0	0	0	0	0	114.2	D54 G59 S82	D54-G56 PolarHBondContact O-N 2.94Å; G56-G59 CarbonylContact C-O 3.51Å; G56-G59 VanDerWaalsContact CA-O 3.27Å; G56-G59 WeakPolarHBondContact CA-O 3.38Å; G56-G59 PolarHBondContact N-O 3.12Å; G56-S82 PolarHBondContact O-N 3.17Å; G56-S82 PolarHBondContact O-OG 3.49Å
57	Y	94.2	Very high	94.5	Very high	135 Å²	135	31.7 Å²	31.7	53%	0.529	17%	0.168	S	C	.	.	S	Bend	trans	-78.8	-56.7	172.4	-178.9	-106.1	0	0	0	111.3	G59 G81 S82 Q83	Y57-G59 VanDerWaalsContact C-N 3.35Å; Y57-G59 PolarHBondContact O-N 3.42Å; Y57-G81 CarbonylContact O-C 3.6Å; Y57-S82 PolarHBondContact O-N 3.17Å; Y57-S82 VanDerWaalsContact O-N 3.13Å; Y57-Q83 HydrophobicContact CD1-CB 4.2Å; Y57-Q83 HydrophobicContact CD2-CB 4.32Å; Y57-Q83 HydrophobicContact CE1-CB 3.94Å; Y57-Q83 HydrophobicContact CE1-CG 4.08Å; Y57-Q83 HydrophobicContact CE2-CB 4.05Å; Y57-Q83 HydrophobicContact CG-CB 4.39Å; Y57-Q83 WeakPolarHBondContact O-CB 3.49Å; Y57-Q83 PolarHBondContact O-N 3.07Å
58	S	92.3	Very high	94.3	Very high	90 Å²	90	30.7 Å²	30.7	63%	0.629	17%	0.165	S	C	*	.	S	Bend	trans	-75.9	-19.2	-176.2	52.6	0	0	0	0	114.6
59	G	92.8	Very high	94.1	Very high	16 Å²	16	27.7 Å²	27.7	17%	0.165	15%	0.153	C	C	.	.			trans	-179.3	176.6	-177.4	0	0	0	0	0	111.7	G56 Y57 S78	G56-G59 CarbonylContact C-O 3.51Å; G56-G59 VanDerWaalsContact CA-O 3.27Å; G56-G59 WeakPolarHBondContact CA-O 3.38Å; G56-G59 PolarHBondContact N-O 3.12Å; Y57-G59 VanDerWaalsContact C-N 3.35Å; Y57-G59 PolarHBondContact O-N 3.42Å; G59-S78 CarbonylContact C-O 3.45Å; G59-S78 VanDerWaalsContact CA-O 3.32Å; G59-S78 WeakPolarHBondContact CA-O 3.14Å
60	T	94.6	Very high	94	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.2	176.4	-58.6	0	0	0	0	109.6	V53 D54 V55 T77 S78 V80 I153 L156	V53-T60 HydrophobicContact CG1-CG2 4.45Å; D54-T60 CarbonylContact O-C 3.53Å; D54-T60 VanDerWaalsContact O-CA 3.29Å; D54-T60 WeakPolarHBondContact O-CA 3.04Å; D54-T60 WeakPolarHBondContact O-CG2 3.01Å; V55-T60 HydrophobicContact CG2-CG2 4.15Å; T60-T77 CarbonylContact O-C 3.58Å; T60-T77 WeakPolarHBondContact O-CA 3.42Å; T60-S78 PolarHBondContact N-O 3.38Å; T60-S78 PolarHBondContact O-N 3.25Å; T60-V80 WeakPolarHBondContact CB-O 2.82Å; T60-V80 PolarHBondContact N-O 3.22Å; T60-V80 PolarHBondContact OG1-O 3.22Å; T60-I153 HydrophobicContact CG2-CD1 4.41Å; T60-I153 HydrophobicContact CG2-CG1 4.19Å; T60-L156 HydrophobicContact CG2-CD2 3.97Å
61	Q	95.1	Very high	93.9	Very high	19 Å²	19	27.8 Å²	27.8	9%	0.089	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.8	177.6	179.4	178.2	-7.1	0	0	109.9	S15 D54 I75 T77	S15-Q61 PolarHBondContact OG-OE1 3.08Å; D54-Q61 PolarHBondContact N-O 3.41Å; D54-Q61 PolarHBondContact O-N 2.62Å; Q61-I75 HydrophobicContact CG-CD1 4.19Å; Q61-I75 HydrophobicContact CG-CG1 4.24Å; Q61-T77 HydrophobicContact CB-CG2 4.43Å; Q61-T77 HydrophobicContact CG-CG2 4.09Å
62	V	96.7	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.3	171.6	-178	0	0	0	0	108.1	L51 V52 V53 Q76 L156 I157 A160	L51-V62 HydrophobicContact CD1-CG1 3.56Å; L51-V62 HydrophobicContact CD2-CG1 4.25Å; L51-V62 HydrophobicContact CG-CG1 3.89Å; V52-V62 CarbonylContact O-C 3.56Å; V52-V62 VanDerWaalsContact O-CA 3.31Å; V52-V62 WeakPolarHBondContact O-CA 3.45Å; V53-V62 HydrophobicContact CB-CG2 4.43Å; V53-V62 HydrophobicContact CG1-CG2 4.11Å; V53-V62 HydrophobicContact CG2-CG1 4.29Å; V53-V62 HydrophobicContact CG2-CG2 4.15Å; V62-Q76 HydrophobicContact CB-CB 4.33Å; V62-Q76 PolarHBondContact N-O 2.91Å; V62-Q76 PolarHBondContact O-N 3.45Å; V62-L156 HydrophobicContact CB-CG 4.43Å; V62-L156 HydrophobicContact CG2-CB 4.25Å; V62-L156 HydrophobicContact CG2-CD2 3.72Å; V62-L156 HydrophobicContact CG2-CG 3.83Å; V62-I157 HydrophobicContact CG2-CG1 4.06Å; V62-A160 HydrophobicContact CB-CB 4.19Å; V62-A160 HydrophobicContact CG1-CB 3.52Å
63	L	95.6	Very high	93.4	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	111.7	-177.3	-177.3	50.2	0	0	0	109.7	V16 S38 V52 L72 I75	V16-L63 HydrophobicContact CG2-CD2 3.72Å; S38-L63 WeakPolarHBondContact OG-CD2 3.44Å; V52-L63 PolarHBondContact N-O 2.95Å; V52-L63 VanDerWaalsContact N-O 3.13Å; V52-L63 PolarHBondContact O-N 3.21Å; L63-L72 HydrophobicContact CD1-CD2 4.13Å; L63-L72 HydrophobicContact CD2-CD2 4.22Å; L63-I75 HydrophobicContact CD1-CB 4.04Å; L63-I75 HydrophobicContact CD1-CG1 4.21Å
64	P	96.2	Very high	93.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.6	174.1	-14.3	26.4	0	0	0	110.8	L51 L71 C164 M172	L51-P64 HydrophobicContact CD1-CB 3.91Å; L51-P64 HydrophobicContact CD1-CG 3.61Å; P64-L71 HydrophobicContact CB-CB 4.24Å; P64-L71 HydrophobicContact CB-CD1 4.21Å; P64-L71 HydrophobicContact CB-CG 4.49Å; P64-L71 PolarHBondContact O-N 3.06Å; P64-C164 WeakPolarHBondContact CG-SG 3.46Å; P64-M172 HydrophobicContact CB-CE 4.41Å; P64-M172 HydrophobicContact CB-CG 4.46Å; P64-M172 HydrophobicContact CB-SD 3.86Å
65	V	94	Very high	93.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.5	169.6	-177.7	0	0	0	0	107.2	L39 T49 A50 V52 I69 M172	L39-V65 HydrophobicContact CD1-CG1 3.89Å; T49-V65 CarbonylContact C-O 3.6Å; T49-V65 VanDerWaalsContact CA-O 3.24Å; T49-V65 WeakPolarHBondContact CA-O 3.42Å; A50-V65 PolarHBondContact N-O 2.93Å; A50-V65 PolarHBondContact O-N 3.29Å; V52-V65 HydrophobicContact CG2-CG2 4.02Å; V65-I69 CarbonylContact C-O 3.59Å; V65-I69 WeakPolarHBondContact CA-O 3.44Å; V65-M172 WeakPolarHBondContact O-CE 3.47Å
66	F	93.6	Very high	93.2	Very high	84 Å²	84	36.2 Å²	36.2	37%	0.368	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	125.7	178.7	-176.2	-98.1	0	0	0	109.1	Q48 T49 G68 I69 L71 I168 M172	Q48-F66 CarbonylContact O-C 3.55Å; T49-F66 HydrophobicContact CG2-CD2 3.67Å; T49-F66 HydrophobicContact CG2-CE2 4.26Å; F66-G68 PolarHBondContact O-N 3.2Å; F66-I69 PolarHBondContact N-O 3.22Å; F66-I69 WeakPolarHBondContact O-CB 3.28Å; F66-I69 PolarHBondContact O-N 2.91Å; F66-L71 HydrophobicContact CB-CD1 3.96Å; F66-L71 HydrophobicContact CB-CD2 4.47Å; F66-L71 HydrophobicContact CB-CG 4.24Å; F66-I168 HydrophobicContact CD1-CG2 4.48Å; F66-I168 HydrophobicContact CD2-CB 4.08Å; F66-I168 HydrophobicContact CD2-CG2 3.67Å; F66-I168 HydrophobicContact CE1-CG2 4.27Å; F66-I168 HydrophobicContact CE2-CB 4.15Å; F66-I168 HydrophobicContact CE2-CG2 3.43Å; F66-I168 VanDerWaalsContact CE2-CG2 3.43Å; F66-I168 HydrophobicContact CG-CG2 4.2Å; F66-I168 HydrophobicContact CZ-CG2 3.76Å; F66-M172 HydrophobicContact CB-CE 3.88Å; F66-M172 HydrophobicContact CD2-CE 3.83Å; F66-M172 HydrophobicContact CG-CE 4.33Å
67	D	91.2	Very high	93.3	Very high	80 Å²	80	38.4 Å²	38.4	43%	0.428	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	40.8	-178.6	-160.5	22.1	0	0	0	113.7	Q48 T49 I69	Q48-D67 PolarHBondContact O-N 3.11Å; Q48-D67 VanDerWaalsContact O-N 3.08Å; T49-D67 PolarHBondContact OG1-N 3.38Å; D67-I69 PolarHBondContact O-N 2.91Å
68	G	88.5	Confident	93.2	Very high	10 Å²	10	32.5 Å²	32.5	10%	0.103	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	6.7	-178.4	0	0	0	0	0	115.3	L39 Q48 F66	L39-G68 WeakPolarHBondContact CD1-O 3.34Å; Q48-G68 PolarHBondContact O-N 3.46Å; F66-G68 PolarHBondContact O-N 3.2Å
69	I	88.7	Confident	93.1	Very high	66 Å²	66	32.4 Å²	32.4	34%	0.338	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.6	176.7	-57.5	174	0	0	0	109.5	V65 F66 D67	V65-I69 CarbonylContact C-O 3.59Å; V65-I69 WeakPolarHBondContact CA-O 3.44Å; F66-I69 PolarHBondContact N-O 3.22Å; F66-I69 WeakPolarHBondContact O-CB 3.28Å; F66-I69 PolarHBondContact O-N 2.91Å; D67-I69 PolarHBondContact O-N 2.91Å
70	S	91.3	Very high	93.1	Very high	10 Å²	10	32 Å²	32	7%	0.07	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	120.5	173.7	-65.9	0	0	0	0	110.6	S38 L72	S38-S70 PolarHBondContact OG-OG 3.22Å; S70-L72 PolarHBondContact O-N 2.89Å
71	L	92.5	Very high	93	Very high	26 Å²	26	31.9 Å²	31.9	14%	0.136	17%	0.174	C	C	.	.			trans	-81.6	79.2	-176.6	-59.6	-175	0	0	0	111.2	P64 F66 H73 S74 I168	P64-L71 HydrophobicContact CB-CB 4.24Å; P64-L71 HydrophobicContact CB-CD1 4.21Å; P64-L71 HydrophobicContact CB-CG 4.49Å; P64-L71 PolarHBondContact O-N 3.06Å; F66-L71 HydrophobicContact CB-CD1 3.96Å; F66-L71 HydrophobicContact CB-CD2 4.47Å; F66-L71 HydrophobicContact CB-CG 4.24Å; L71-H73 PolarHBondContact O-N 3.08Å; L71-S74 PolarHBondContact O-N 3.37Å; L71-I168 HydrophobicContact CD1-CD1 3.2Å
72	L	91.8	Very high	92.9	Very high	35 Å²	35	32.2 Å²	32.2	18%	0.183	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-60.5	-29.4	-174	-54.1	-174.1	0	0	0	114.1	V16 L63 S70 S74 I75 W260 T261	V16-L72 HydrophobicContact CB-CD2 4.47Å; V16-L72 HydrophobicContact CG1-CD1 4.31Å; V16-L72 HydrophobicContact CG1-CD2 3.63Å; V16-L72 HydrophobicContact CG2-CD2 4.07Å; L63-L72 HydrophobicContact CD1-CD2 4.13Å; L63-L72 HydrophobicContact CD2-CD2 4.22Å; S70-L72 PolarHBondContact O-N 2.89Å; L72-S74 PolarHBondContact O-N 3.45Å; L72-I75 WeakPolarHBondContact O-CB 3.48Å; L72-I75 WeakPolarHBondContact O-CG2 3.38Å; L72-I75 PolarHBondContact O-N 3.5Å; L72-W260 HydrophobicContact CD1-CB 3.62Å; L72-W260 HydrophobicContact CD1-CG 4.42Å; L72-T261 HydrophobicContact CD1-CG2 3.64Å; L72-T261 HydrophobicContact CG-CG2 4.17Å
73	H	92.1	Very high	92.8	Very high	117 Å²	117	36.8 Å²	36.8	54%	0.542	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-65.5	-22.7	176.5	67.9	-90.5	0	0	0	112.9	L71	L71-H73 PolarHBondContact O-N 3.08Å
74	S	93.4	Very high	92.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-103	9.8	179.3	-66.9	0	0	0	0	112.9	L71 L72 Q76 K163 C164	L71-S74 PolarHBondContact O-N 3.37Å; L72-S74 PolarHBondContact O-N 3.45Å; S74-Q76 PolarHBondContact O-N 2.92Å; S74-K163 PolarHBondContact OG-O 3.37Å; S74-C164 WeakPolarHBondContact OG-CA 3.48Å; S74-C164 PolarHBondContact OG-N 3.07Å
75	I	95.1	Very high	92.5	Very high	34 Å²	34	38.1 Å²	38.1	17%	0.174	21%	0.209	C	C	.	.			trans	-61	136.6	175.2	-166.7	174.7	0	0	0	110.2	L17 Q61 L63 L72 T77	L17-I75 HydrophobicContact CD2-CD1 3.84Å; L17-I75 HydrophobicContact CG-CD1 4.33Å; Q61-I75 HydrophobicContact CG-CD1 4.19Å; Q61-I75 HydrophobicContact CG-CG1 4.24Å; L63-I75 HydrophobicContact CD1-CB 4.04Å; L63-I75 HydrophobicContact CD1-CG1 4.21Å; L72-I75 WeakPolarHBondContact O-CB 3.48Å; L72-I75 WeakPolarHBondContact O-CG2 3.38Å; L72-I75 PolarHBondContact O-N 3.5Å; I75-T77 HydrophobicContact CD1-CG2 4.16Å; I75-T77 HydrophobicContact CG1-CG2 4.11Å
76	Q	94.9	Very high	92.5	Very high	17 Å²	17	43.4 Å²	43.4	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.4	170.7	-68.7	-66.9	91.9	0	0	109.1	V62 S74 L156 E159 A160	V62-Q76 HydrophobicContact CB-CB 4.33Å; V62-Q76 PolarHBondContact N-O 2.91Å; V62-Q76 PolarHBondContact O-N 3.45Å; S74-Q76 PolarHBondContact O-N 2.92Å; Q76-L156 HydrophobicContact CB-CD1 3.61Å; Q76-L156 HydrophobicContact CB-CG 3.78Å; Q76-E159 HydrophobicContact CG-CB 4.21Å; Q76-E159 VanDerWaalsContact NE2-CB 3.26Å; Q76-A160 HydrophobicContact CB-CB 4.11Å; Q76-A160 HydrophobicContact CG-CB 3.65Å
77	T	94.2	Very high	92.5	Very high	64 Å²	64	46.8 Å²	46.8	39%	0.393	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.5	-176.8	58.5	0	0	0	0	109.7	L17 T60 Q61 I75	L17-T77 HydrophobicContact CD1-CG2 3.4Å; L17-T77 VanDerWaalsContact CD1-CG2 3.4Å; L17-T77 HydrophobicContact CD2-CG2 4.17Å; L17-T77 HydrophobicContact CG-CG2 4.24Å; T60-T77 CarbonylContact O-C 3.58Å; T60-T77 WeakPolarHBondContact O-CA 3.42Å; Q61-T77 HydrophobicContact CB-CG2 4.43Å; Q61-T77 HydrophobicContact CG-CG2 4.09Å; I75-T77 HydrophobicContact CD1-CG2 4.16Å; I75-T77 HydrophobicContact CG1-CG2 4.11Å
78	S	92.9	Very high	92.5	Very high	10 Å²	10	45.9 Å²	45.9	7%	0.07	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	141.6	172.7	179.8	0	0	0	0	109.2	G59 T60 V80 M151	G59-S78 CarbonylContact C-O 3.45Å; G59-S78 VanDerWaalsContact CA-O 3.32Å; G59-S78 WeakPolarHBondContact CA-O 3.14Å; T60-S78 PolarHBondContact N-O 3.38Å; T60-S78 PolarHBondContact O-N 3.25Å; S78-V80 PolarHBondContact O-N 2.79Å; S78-V80 WeakPolarHBondContact OG-CB 3.45Å; S78-V80 PolarHBondContact OG-N 3.22Å; S78-M151 PolarHBondContact OG-O 2.91Å; S78-M151 VanDerWaalsContact OG-O 3.13Å
79	S	91.1	Very high	92.6	Very high	89 Å²	89	47.8 Å²	47.8	62%	0.622	24%	0.241	S	C	*	.	S	Bend	trans	-69.5	-13.7	173.1	-52.9	0	0	0	0	111.5	G81	S79-G81 PolarHBondContact O-N 3.1Å
80	V	91.1	Very high	92.7	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.048	25%	0.251	C	S	.	.			trans	-75.5	107.3	175.9	179.3	0	0	0	0	109.6	T60 S78 A84 I142 L143 D150	T60-V80 WeakPolarHBondContact CB-O 2.82Å; T60-V80 PolarHBondContact N-O 3.22Å; T60-V80 PolarHBondContact OG1-O 3.22Å; S78-V80 PolarHBondContact O-N 2.79Å; S78-V80 WeakPolarHBondContact OG-CB 3.45Å; S78-V80 PolarHBondContact OG-N 3.22Å; V80-A84 HydrophobicContact CG1-CB 4.45Å; V80-I142 WeakPolarHBondContact CG1-O 3.11Å; V80-L143 HydrophobicContact CG1-CD2 3.68Å; V80-D150 HydrophobicContact CG2-CB 3.68Å
81	G	92.5	Very high	92.8	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	-133.2	-165.7	171.1	0	0	0	0	0	111.7	Y57 S79 Q83 A84	Y57-G81 CarbonylContact O-C 3.6Å; S79-G81 PolarHBondContact O-N 3.1Å; G81-Q83 PolarHBondContact O-N 2.93Å; G81-Q83 VanDerWaalsContact O-N 3.14Å; G81-A84 WeakPolarHBondContact O-CB 3.46Å; G81-A84 PolarHBondContact O-N 3.25Å
82	S	93.4	Very high	92.6	Very high	25 Å²	25	52.5 Å²	52.5	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-21.8	-179.7	-47	0	0	0	0	113.3	G56 Y57 A84 V85 H86 G182	G56-S82 PolarHBondContact O-N 3.17Å; G56-S82 PolarHBondContact O-OG 3.49Å; Y57-S82 PolarHBondContact O-N 3.17Å; Y57-S82 VanDerWaalsContact O-N 3.13Å; S82-A84 VanDerWaalsContact C-N 3.3Å; S82-A84 PolarHBondContact O-N 3.18Å; S82-V85 WeakPolarHBondContact O-CB 3.32Å; S82-V85 PolarHBondContact O-N 3.26Å; S82-H86 WeakPolarHBondContact O-CB 3.13Å; S82-H86 PolarHBondContact O-N 3.38Å; S82-G182 WeakPolarHBondContact OG-CA 3.29Å; S82-G182 PolarHBondContact OG-N 2.85Å
83	Q	94.7	Very high	92.3	Very high	97 Å²	97	53.9 Å²	53.9	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-38	172.4	-178	178.8	12.1	0	0	111.6	Y57 G81 H86 R87	Y57-Q83 HydrophobicContact CD1-CB 4.2Å; Y57-Q83 HydrophobicContact CD2-CB 4.32Å; Y57-Q83 HydrophobicContact CE1-CB 3.94Å; Y57-Q83 HydrophobicContact CE1-CG 4.08Å; Y57-Q83 HydrophobicContact CE2-CB 4.05Å; Y57-Q83 HydrophobicContact CG-CB 4.39Å; Y57-Q83 WeakPolarHBondContact O-CB 3.49Å; Y57-Q83 PolarHBondContact O-N 3.07Å; G81-Q83 PolarHBondContact O-N 2.93Å; G81-Q83 VanDerWaalsContact O-N 3.14Å; Q83-H86 PolarHBondContact O-N 3.23Å; Q83-R87 WeakPolarHBondContact O-CB 3.5Å; Q83-R87 PolarHBondContact O-N 3.09Å
84	A	92.8	Very high	91.9	Very high	9 Å²	9	54.8 Å²	54.8	7%	0.074	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-43	177.1	0	0	0	0	0	110.6	V80 G81 S82 H86 R87 R88 I142	V80-A84 HydrophobicContact CG1-CB 4.45Å; G81-A84 WeakPolarHBondContact O-CB 3.46Å; G81-A84 PolarHBondContact O-N 3.25Å; S82-A84 VanDerWaalsContact C-N 3.3Å; S82-A84 PolarHBondContact O-N 3.18Å; A84-H86 PolarHBondContact O-N 3.25Å; A84-R87 PolarHBondContact O-N 3.49Å; A84-R88 VanDerWaalsContact O-CB 3.29Å; A84-R88 WeakPolarHBondContact O-CB 3.4Å; A84-R88 PolarHBondContact O-N 3.24Å; A84-I142 HydrophobicContact CB-CD1 3.9Å; A84-I142 HydrophobicContact CB-CG1 4.42Å; A84-I142 HydrophobicContact CB-CG2 4.34Å
85	V	93.5	Very high	91.4	Very high	20 Å²	20	60.8 Å²	60.8	12%	0.121	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-46.2	172.2	178.7	0	0	0	0	110.9	S82 R87 R88 L89 A139 I142 L143	S82-V85 WeakPolarHBondContact O-CB 3.32Å; S82-V85 PolarHBondContact O-N 3.26Å; V85-R87 PolarHBondContact O-N 3.4Å; V85-R88 PolarHBondContact O-N 2.98Å; V85-L89 WeakPolarHBondContact O-CB 3.28Å; V85-L89 PolarHBondContact O-N 3.49Å; V85-A139 HydrophobicContact CG1-CB 4.27Å; V85-I142 HydrophobicContact CB-CG2 4.45Å; V85-I142 HydrophobicContact CG2-CG2 3.69Å; V85-L143 HydrophobicContact CG2-CD1 3.88Å; V85-L143 HydrophobicContact CG2-CD2 3.75Å; V85-L143 HydrophobicContact CG2-CG 3.64Å
86	H	93.6	Very high	90.1	Very high	111 Å²	111	69.8 Å²	69.8	51%	0.514	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-45.6	178.8	-176.1	87.2	0	0	0	112.1	S82 Q83 A84 L89 K90	S82-H86 WeakPolarHBondContact O-CB 3.13Å; S82-H86 PolarHBondContact O-N 3.38Å; Q83-H86 PolarHBondContact O-N 3.23Å; A84-H86 PolarHBondContact O-N 3.25Å; H86-L89 PolarHBondContact O-N 3Å; H86-K90 PolarHBondContact O-N 3.46Å
87	R	93.3	Very high	88.1	Confident	154 Å²	154	72.5 Å²	72.5	58%	0.581	35%	0.349	S	S	*	.	H	α-helix	trans	-60.7	-47.3	175.9	179.6	175.1	63.9	-167.4	-0.3	110.9	Q83 A84 V85 L89 K90 E91	Q83-R87 WeakPolarHBondContact O-CB 3.5Å; Q83-R87 PolarHBondContact O-N 3.09Å; A84-R87 PolarHBondContact O-N 3.49Å; V85-R87 PolarHBondContact O-N 3.4Å; R87-L89 PolarHBondContact O-N 3.45Å; R87-K90 WeakPolarHBondContact O-CB 3.22Å; R87-K90 PolarHBondContact O-N 3.5Å; R87-E91 WeakPolarHBondContact O-CG 3.34Å; R87-E91 PolarHBondContact O-N 3.36Å
88	R	91.3	Very high	86.3	Confident	62 Å²	62	77.3 Å²	77.3	23%	0.234	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-43.8	178.8	-173.8	63	170.8	143.3	-1.2	111.9	A84 V85 K90 E91 L92 A139 I142	A84-R88 VanDerWaalsContact O-CB 3.29Å; A84-R88 WeakPolarHBondContact O-CB 3.4Å; A84-R88 PolarHBondContact O-N 3.24Å; V85-R88 PolarHBondContact O-N 2.98Å; R88-K90 VanDerWaalsContact C-N 3.34Å; R88-K90 PolarHBondContact O-N 3.15Å; R88-E91 IonicContact NH1-OE2 3.49Å; R88-E91 PolarHBondContact O-N 2.83Å; R88-L92 HydrophobicContact CG-CD1 4.19Å; R88-L92 WeakPolarHBondContact O-CG 3.48Å; R88-L92 PolarHBondContact O-N 2.86Å; R88-A139 HydrophobicContact CG-CB 4.4Å; R88-I142 HydrophobicContact CB-CD1 4.46Å
89	L	91.2	Very high	84.4	Confident	50 Å²	50	79.7 Å²	79.7	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-45	175.9	-178.9	60.9	0	0	0	111.4	V85 H86 R87 E91 L92 I93 V131 V135 A139	V85-L89 WeakPolarHBondContact O-CB 3.28Å; V85-L89 PolarHBondContact O-N 3.49Å; H86-L89 PolarHBondContact O-N 3Å; R87-L89 PolarHBondContact O-N 3.45Å; L89-E91 VanDerWaalsContact C-N 3.34Å; L89-E91 PolarHBondContact O-N 3.22Å; L89-L92 PolarHBondContact O-N 3.33Å; L89-I93 HydrophobicContact CD1-CD1 3.9Å; L89-I93 HydrophobicContact CD1-CG1 4.27Å; L89-I93 HydrophobicContact CG-CD1 3.82Å; L89-I93 WeakPolarHBondContact O-CB 3.31Å; L89-I93 VanDerWaalsContact O-CG1 3.26Å; L89-I93 WeakPolarHBondContact O-CG1 3.19Å; L89-I93 PolarHBondContact O-N 3.47Å; L89-V131 HydrophobicContact CD1-CG1 4.3Å; L89-V135 HydrophobicContact CD1-CG1 3.82Å; L89-A139 HydrophobicContact CB-CB 3.87Å; L89-A139 HydrophobicContact CD1-CB 4.17Å
90	K	91.2	Very high	82.2	Confident	123 Å²	123	82.3 Å²	82.3	54%	0.535	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-44.5	176.9	-175.4	179.2	177.8	-179.5	0	111.7	H86 R87 R88 I93 Q94	H86-K90 PolarHBondContact O-N 3.46Å; R87-K90 WeakPolarHBondContact O-CB 3.22Å; R87-K90 PolarHBondContact O-N 3.5Å; R88-K90 VanDerWaalsContact C-N 3.34Å; R88-K90 PolarHBondContact O-N 3.15Å; K90-I93 PolarHBondContact O-N 3.13Å; K90-Q94 WeakPolarHBondContact O-CB 3.46Å; K90-Q94 VanDerWaalsContact O-CG 3.27Å; K90-Q94 WeakPolarHBondContact O-CG 3.33Å; K90-Q94 PolarHBondContact O-N 3.49Å
91	E	91.8	Very high	80	Confident	63 Å²	63	86.4 Å²	86.4	29%	0.294	41%	0.407	S	S	.	.	H	α-helix	trans	-63.2	-44.2	177.6	-70.7	171.2	-163.3	0	0	112.5	R87 R88 L89 Q94 K95	R87-E91 WeakPolarHBondContact O-CG 3.34Å; R87-E91 PolarHBondContact O-N 3.36Å; R88-E91 IonicContact NH1-OE2 3.49Å; R88-E91 PolarHBondContact O-N 2.83Å; L89-E91 VanDerWaalsContact C-N 3.34Å; L89-E91 PolarHBondContact O-N 3.22Å; E91-Q94 PolarHBondContact O-N 2.91Å; E91-K95 VanDerWaalsContact O-CB 3.25Å; E91-K95 WeakPolarHBondContact O-CB 3.5Å; E91-K95 VanDerWaalsContact O-CG 3.27Å; E91-K95 WeakPolarHBondContact O-CG 3.25Å; E91-K95 PolarHBondContact O-N 3.27Å
92	L	88.1	Confident	77.5	Confident	14 Å²	14	89.6 Å²	89.6	7%	0.073	44%	0.44	C	S	.	.	H	α-helix	trans	-64.6	-41.2	179.4	-69.8	171.9	0	0	0	111.6	R88 L89 R96 P99 V135 A138 A139	R88-L92 HydrophobicContact CG-CD1 4.19Å; R88-L92 WeakPolarHBondContact O-CG 3.48Å; R88-L92 PolarHBondContact O-N 2.86Å; L89-L92 PolarHBondContact O-N 3.33Å; L92-R96 PolarHBondContact O-N 3.13Å; L92-P99 HydrophobicContact CD2-CG 4.42Å; L92-V135 HydrophobicContact CB-CG1 3.85Å; L92-V135 HydrophobicContact CD1-CG1 4.24Å; L92-A138 HydrophobicContact CD1-CB 3.91Å; L92-A139 HydrophobicContact CD1-CB 4.22Å
93	I	85.3	Confident	74.9	Confident	64 Å²	64	95 Å²	95	33%	0.328	47%	0.467	S	S	.	.	H	α-helix	trans	-64.4	-44.4	175.6	-68.2	166.5	0	0	0	110.8	L89 K90 V131	L89-I93 HydrophobicContact CD1-CD1 3.9Å; L89-I93 HydrophobicContact CD1-CG1 4.27Å; L89-I93 HydrophobicContact CG-CD1 3.82Å; L89-I93 WeakPolarHBondContact O-CB 3.31Å; L89-I93 VanDerWaalsContact O-CG1 3.26Å; L89-I93 WeakPolarHBondContact O-CG1 3.19Å; L89-I93 PolarHBondContact O-N 3.47Å; K90-I93 PolarHBondContact O-N 3.13Å; I93-V131 HydrophobicContact CD1-CG2 4.49Å
94	Q	85.5	Confident	72.3	Confident	137 Å²	137	92.6 Å²	92.6	64%	0.64	46%	0.46	S	S	*	.	H	α-helix	trans	-66.7	-41.2	-179.8	-77.5	-179.6	-18	0	0	112.6	K90 E91 R96	K90-Q94 WeakPolarHBondContact O-CB 3.46Å; K90-Q94 VanDerWaalsContact O-CG 3.27Å; K90-Q94 WeakPolarHBondContact O-CG 3.33Å; K90-Q94 PolarHBondContact O-N 3.49Å; E91-Q94 PolarHBondContact O-N 2.91Å; Q94-R96 PolarHBondContact O-N 3.15Å
95	K	82.3	Confident	69.6	Low	126 Å²	126	103.8 Å²	103.8	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-69.3	-20.8	-174.8	-78.7	177.3	177.3	173.1	0	112.6	E91 S97	E91-K95 VanDerWaalsContact O-CB 3.25Å; E91-K95 WeakPolarHBondContact O-CB 3.5Å; E91-K95 VanDerWaalsContact O-CG 3.27Å; E91-K95 WeakPolarHBondContact O-CG 3.25Å; E91-K95 PolarHBondContact O-N 3.27Å; K95-S97 WeakPolarHBondContact CB-OG 3.47Å; K95-S97 PolarHBondContact O-N 3.28Å; K95-S97 PolarHBondContact O-OG 3.47Å
96	R	66.9	Low	67.2	Low	223 Å²	223	105.7 Å²	105.7	84%	0.842	51%	0.512	S	S	*	.			trans	46	4.9	-172.4	-94.2	-171	178.5	176.9	-0.4	115	L92 Q94	L92-R96 PolarHBondContact O-N 3.13Å; Q94-R96 PolarHBondContact O-N 3.15Å
97	S	53.7	Low	64.4	Low	74 Å²	74	103.7 Å²	103.7	52%	0.517	50%	0.504	S	S	.	.			trans	-104.2	103.8	-177.5	24.9	0	0	0	0	104.8	K95	K95-S97 WeakPolarHBondContact CB-OG 3.47Å; K95-S97 PolarHBondContact O-N 3.28Å; K95-S97 PolarHBondContact O-OG 3.47Å
98	W	56.6	Low	61.8	Low	164 Å²	164	106.2 Å²	106.2	62%	0.621	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-54.3	129.1	168.7	-58.9	-86.2	0	0	0	107.8	N100 E132	W98-N100 PolarHBondContact O-N 3.08Å; W98-E132 PolarHBondContact NE1-OE2 2.83Å
99	P	52.1	Low	59.6	Low	60 Å²	60	111.9 Å²	111.9	39%	0.39	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-55	117.2	167.3	21.2	-28.1	0	0	0	106.5	L92 T101	L92-P99 HydrophobicContact CD2-CG 4.42Å; P99-T101 PolarHBondContact O-N 3.46Å
100	N	46	Very low	57.2	Low	144 Å²	144	115 Å²	115	77%	0.77	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-46.5	117.3	178	-86.7	-35.5	0	0	0	107.8	W98 G102 N103	W98-N100 PolarHBondContact O-N 3.08Å; N100-G102 PolarHBondContact O-N 2.9Å; N100-N103 PolarHBondContact O-N 3.08Å
101	T	45.4	Very low	54.6	Low	95 Å²	95	119.3 Å²	119.3	58%	0.583	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.9	-14.4	-177.8	-42.7	0	0	0	0	113.5	P99 M107	P99-T101 PolarHBondContact O-N 3.46Å; T101-M107 HydrophobicContact CG2-CE 3.41Å; T101-M107 VanDerWaalsContact CG2-CE 3.41Å; T101-M107 HydrophobicContact CG2-SD 3.24Å; T101-M107 WeakPolarHBondContact CG2-SD 3.36Å
102	G	38.9	Very low	52.3	Low	66 Å²	66	119.1 Å²	119.1	68%	0.68	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-28.1	179.6	0	0	0	0	0	116.3	N100	N100-G102 PolarHBondContact O-N 2.9Å
103	N	38.5	Very low	50.1	Low	139 Å²	139	124.5 Å²	124.5	74%	0.743	61%	0.607	S	S	*	*	S	Bend	trans	-112.1	-2.3	-172.8	-62.8	7.1	0	0	0	114	N100 W105	N100-N103 PolarHBondContact O-N 3.08Å; N103-W105 PolarHBondContact O-N 3.28Å; N103-W105 VanDerWaalsContact O-N 3.16Å
104	C	41.4	Very low	48.2	Very low	46 Å²	46	128 Å²	128	31%	0.311	63%	0.625	S	S	.	*			trans	-80.8	89.2	166.8	178.1	0	0	0	0	107.3	T106 M107	C104-T106 PolarHBondContact O-N 3.19Å; C104-T106 PolarHBondContact SG-OG1 3.19Å; C104-M107 HydrophobicContact CB-CB 4.43Å; C104-M107 HydrophobicContact CB-CE 3.93Å; C104-M107 PolarHBondContact O-N 3.46Å; C104-M107 VanDerWaalsContact O-N 3.08Å
105	W	34.8	Very low	46.4	Very low	244 Å²	244	125.9 Å²	125.9	92%	0.924	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-17.4	178.4	-73.6	86.4	0	0	0	113	N103	N103-W105 PolarHBondContact O-N 3.28Å; N103-W105 VanDerWaalsContact O-N 3.16Å
106	T	42.6	Very low	45.2	Very low	60 Å²	60	122.2 Å²	122.2	37%	0.368	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.1	-17.2	177.6	31	0	0	0	0	115.2	C104 K108	C104-T106 PolarHBondContact O-N 3.19Å; C104-T106 PolarHBondContact SG-OG1 3.19Å; T106-K108 VanDerWaalsContact C-N 3.25Å; T106-K108 PolarHBondContact O-N 3.44Å
107	M	35	Very low	44.9	Very low	70 Å²	70	119.7 Å²	119.7	35%	0.345	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	-13.6	-176.9	-135.8	-174.5	-53.9	0	0	114.1	T101 C104 R109	T101-M107 HydrophobicContact CG2-CE 3.41Å; T101-M107 VanDerWaalsContact CG2-CE 3.41Å; T101-M107 HydrophobicContact CG2-SD 3.24Å; T101-M107 WeakPolarHBondContact CG2-SD 3.36Å; C104-M107 HydrophobicContact CB-CB 4.43Å; C104-M107 HydrophobicContact CB-CE 3.93Å; C104-M107 PolarHBondContact O-N 3.46Å; C104-M107 VanDerWaalsContact O-N 3.08Å; M107-R109 VanDerWaalsContact C-N 3.35Å; M107-R109 PolarHBondContact O-N 3.44Å
108	K	39.7	Very low	45.4	Very low	207 Å²	207	123.7 Å²	123.7	90%	0.9	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-12.1	-177.5	-93.1	-173.5	177.9	177	0	114.9	T106	T106-K108 VanDerWaalsContact C-N 3.25Å; T106-K108 PolarHBondContact O-N 3.44Å
109	R	45.6	Very low	46.3	Very low	181 Å²	181	119.4 Å²	119.4	68%	0.683	61%	0.607	S	S	*	*	S	Bend	trans	-104	-18.4	-171.5	-163.5	158.7	166.6	110.3	-8.4	114.9	M107 E194	M107-R109 VanDerWaalsContact C-N 3.35Å; M107-R109 PolarHBondContact O-N 3.44Å; R109-E194 IonicContact CZ-OE1 3.77Å; R109-E194 IonicContact NE-OE1 3.08Å; R109-E194 PolarHBondContact NE-OE1 3.28Å; R109-E194 VanDerWaalsContact NE-OE1 3.08Å; R109-E194 IonicContact NH2-OE1 3.53Å
110	W	40.8	Very low	47.6	Very low	115 Å²	115	122 Å²	122	44%	0.436	61%	0.614	S	S	.	*			trans	-110.4	84.8	-176.3	-93	60.3	0	0	0	111	I112 E194	W110-I112 HydrophobicContact CB-CD1 3.53Å; W110-I112 HydrophobicContact CD2-CD1 3.27Å; W110-I112 HydrophobicContact CD2-CG1 3.91Å; W110-I112 HydrophobicContact CE3-CD1 2.78Å; W110-I112 HydrophobicContact CE3-CG1 3.45Å; W110-I112 VanDerWaalsContact CE3-CG1 3.45Å; W110-I112 HydrophobicContact CG-CD1 3.68Å; W110-I112 HydrophobicContact CH2-CD1 4.3Å; W110-I112 HydrophobicContact CH2-CG1 4.08Å; W110-I112 HydrophobicContact CZ3-CD1 3.31Å; W110-I112 HydrophobicContact CZ3-CG1 3.43Å; W110-I112 VanDerWaalsContact CZ3-CG1 3.43Å; W110-I112 PolarHBondContact O-N 2.91Å; W110-E194 PolarHBondContact NE1-OE2 2.86Å
111	K	35.8	Very low	49.2	Very low	214 Å²	214	120.1 Å²	120.1	93%	0.93	60%	0.596	S	S	*	*			trans	-90.2	46.2	165.6	-126.3	-166.3	-165.7	-178	0	110.3	S113	K111-S113 PolarHBondContact O-N 3.42Å
112	I	43.9	Very low	50.9	Low	59 Å²	59	121.3 Å²	121.3	30%	0.303	61%	0.606	S	S	.	*			trans	-79.3	124.4	168.5	-29.3	84.5	0	0	0	106.2	W110 L114 V115	W110-I112 HydrophobicContact CB-CD1 3.53Å; W110-I112 HydrophobicContact CD2-CD1 3.27Å; W110-I112 HydrophobicContact CD2-CG1 3.91Å; W110-I112 HydrophobicContact CE3-CD1 2.78Å; W110-I112 HydrophobicContact CE3-CG1 3.45Å; W110-I112 VanDerWaalsContact CE3-CG1 3.45Å; W110-I112 HydrophobicContact CG-CD1 3.68Å; W110-I112 HydrophobicContact CH2-CD1 4.3Å; W110-I112 HydrophobicContact CH2-CG1 4.08Å; W110-I112 HydrophobicContact CZ3-CD1 3.31Å; W110-I112 HydrophobicContact CZ3-CG1 3.43Å; W110-I112 VanDerWaalsContact CZ3-CG1 3.43Å; W110-I112 PolarHBondContact O-N 2.91Å; I112-L114 HydrophobicContact CB-CB 4.03Å; I112-L114 HydrophobicContact CG2-CB 3.66Å; I112-L114 HydrophobicContact CG2-CD1 3.82Å; I112-L114 HydrophobicContact CG2-CG 3.71Å; I112-L114 PolarHBondContact O-N 3.16Å; I112-V115 PolarHBondContact O-N 3.23Å
113	S	42	Very low	52.8	Low	126 Å²	126	123.1 Å²	123.1	88%	0.881	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	21	158.8	-50	0	0	0	0	113.7	K111	K111-S113 PolarHBondContact O-N 3.42Å
114	L	44.1	Very low	54.5	Low	137 Å²	137	124.6 Å²	124.6	72%	0.717	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	15.5	170.6	-76.2	176.5	0	0	0	112.8	I112 S116	I112-L114 HydrophobicContact CB-CB 4.03Å; I112-L114 HydrophobicContact CG2-CB 3.66Å; I112-L114 HydrophobicContact CG2-CD1 3.82Å; I112-L114 HydrophobicContact CG2-CG 3.71Å; I112-L114 PolarHBondContact O-N 3.16Å; L114-S116 WeakPolarHBondContact O-CA 3.31Å; L114-S116 WeakPolarHBondContact O-CB 3.28Å; L114-S116 PolarHBondContact O-N 2.66Å
115	V	48.6	Very low	55.9	Low	94 Å²	94	131.4 Å²	131.4	57%	0.57	63%	0.626	S	S	*	*	S	Bend	trans	-67.2	56.7	147	-177.1	0	0	0	0	107	I112	I112-V115 PolarHBondContact O-N 3.23Å
116	S	57	Low	57.9	Low	48 Å²	48	128 Å²	128	34%	0.336	63%	0.626	S	S	.	*				56.1	98.3	100.7	-162.5	0	0	0	0	108.3	L114 R136	L114-S116 WeakPolarHBondContact O-CA 3.31Å; L114-S116 WeakPolarHBondContact O-CB 3.28Å; L114-S116 PolarHBondContact O-N 2.66Å; S116-R136 PolarHBondContact OG-NH1 2.82Å; S116-R136 PolarHBondContact OG-NH2 3.34Å
117	E	61.1	Low	59.6	Low	170 Å²	170	131.8 Å²	131.8	79%	0.794	64%	0.637	S	S	*	*			trans	-27.4	141.1	165.6	-64.9	170.4	159.5	0	0	111.6	L119	E117-L119 PolarHBondContact O-N 2.99Å
118	K	64.1	Low	61.8	Low	158 Å²	158	132.9 Å²	132.9	69%	0.687	64%	0.643	S	S	*	*			trans	-52.5	107.3	169	-72.4	-178.8	178.5	-179.8	0	107.5	I130	K118-I130 HydrophobicContact CB-CG2 3.99Å; K118-I130 HydrophobicContact CD-CG2 4.37Å; K118-I130 HydrophobicContact CG-CG2 4.21Å
119	L	75.2	Confident	63.8	Low	74 Å²	74	126.1 Å²	126.1	39%	0.387	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.1	119.8	177.5	-91.1	152.9	0	0	0	107.9	E117 Y121 V131	E117-L119 PolarHBondContact O-N 2.99Å; L119-Y121 HydrophobicContact CB-CE2 4.16Å; L119-V131 PolarHBondContact O-N 3.12Å
120	E	78.2	Confident	65.5	Low	115 Å²	115	121.3 Å²	121.3	54%	0.537	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.5	113.9	-177.9	-68.6	-166.3	173.9	0	0	109.3	I128 I130	E120-I128 HydrophobicContact CB-CG2 3.48Å; E120-I128 VanDerWaalsContact CB-CG2 3.48Å; E120-I128 HydrophobicContact CG-CG2 3.79Å; E120-I130 HydrophobicContact CG-CG1 4.26Å
121	Y	80.2	Confident	67.5	Low	104 Å²	104	116.3 Å²	116.3	41%	0.408	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	115.7	175.3	-63	-88.6	0	0	0	109.3	L119 L123 L129 V131	L119-Y121 HydrophobicContact CB-CE2 4.16Å; Y121-L123 PolarHBondContact O-N 2.73Å; Y121-L129 WeakPolarHBondContact CB-O 3.24Å; Y121-L129 WeakPolarHBondContact CD2-O 3.48Å; Y121-L129 PolarHBondContact N-O 2.73Å; Y121-L129 PolarHBondContact O-N 2.74Å; Y121-V131 HydrophobicContact CD2-CB 4.35Å; Y121-V131 HydrophobicContact CD2-CG2 3.83Å; Y121-V131 HydrophobicContact CE2-CB 3.93Å; Y121-V131 HydrophobicContact CE2-CG2 3.8Å
122	P	80.5	Confident	69.8	Low	120 Å²	120	110.2 Å²	110.2	78%	0.779	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.4	123.1	175.8	27.7	-33	0	0	0	109.7
123	L	78.9	Confident	71.7	Confident	105 Å²	105	108 Å²	108	55%	0.55	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-96.6	167.1	169.9	-158.7	73	0	0	0	109	Y121 K125 K127	Y121-L123 PolarHBondContact O-N 2.73Å; L123-K125 PolarHBondContact O-N 3.23Å; L123-K127 WeakPolarHBondContact CA-O 3.25Å; L123-K127 HydrophobicContact CB-CB 4.01Å; L123-K127 WeakPolarHBondContact CB-O 3.49Å; L123-K127 HydrophobicContact CD2-CB 4.23Å; L123-K127 PolarHBondContact N-O 3.39Å
124	Q	75.9	Confident	73.7	Confident	169 Å²	169	104.1 Å²	104.1	79%	0.79	53%	0.528	S	S	*	.	S	Bend	trans	-60.1	138.5	175	-63.3	179.8	-3.3	0	0	111.2
125	K	69.3	Low	75.7	Confident	190 Å²	190	98.7 Å²	98.7	83%	0.826	50%	0.501	S	S	*	.	S	Bend	trans	66.9	60.7	175.2	-51.9	178.5	178.7	-177.5	0	114.5	L123 K127	L123-K125 PolarHBondContact O-N 3.23Å; K125-K127 PolarHBondContact O-N 3.47Å
126	D	77.3	Confident	77.5	Confident	171 Å²	171	97 Å²	97	91%	0.914	48%	0.484	S	S	*	.	S	Bend	trans	58	16.4	172.4	-57.9	-26.1	0	0	0	116.4
127	K	78.6	Confident	79	Confident	141 Å²	141	98.4 Å²	98.4	61%	0.613	49%	0.485	S	S	*	.			trans	-92.3	134.3	174.8	-71.1	-179.2	-177.1	-177.3	0	109.3	L123 K125	L123-K127 WeakPolarHBondContact CA-O 3.25Å; L123-K127 HydrophobicContact CB-CB 4.01Å; L123-K127 WeakPolarHBondContact CB-O 3.49Å; L123-K127 HydrophobicContact CD2-CB 4.23Å; L123-K127 PolarHBondContact N-O 3.39Å; K125-K127 PolarHBondContact O-N 3.47Å
128	I	81.7	Confident	80.3	Confident	92 Å²	92	91.4 Å²	91.4	47%	0.472	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.5	173.8	-61.7	172.6	0	0	0	107.8	E120 I130	E120-I128 HydrophobicContact CB-CG2 3.48Å; E120-I128 VanDerWaalsContact CB-CG2 3.48Å; E120-I128 HydrophobicContact CG-CG2 3.79Å; I128-I130 HydrophobicContact CG2-CG1 4.04Å
129	L	81	Confident	81.6	Confident	65 Å²	65	84 Å²	84	34%	0.34	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.7	168.9	175.7	67.3	0	0	0	108	Y121 V131	Y121-L129 WeakPolarHBondContact CB-O 3.24Å; Y121-L129 WeakPolarHBondContact CD2-O 3.48Å; Y121-L129 PolarHBondContact N-O 2.73Å; Y121-L129 PolarHBondContact O-N 2.74Å; L129-V131 HydrophobicContact CD2-CG2 4.03Å; L129-V131 HydrophobicContact CG-CG2 3.91Å
130	I	81.2	Confident	82.4	Confident	80 Å²	80	81.5 Å²	81.5	41%	0.41	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.4	174.1	-54.8	-178.6	0	0	0	107.6	K118 E120 I128	K118-I130 HydrophobicContact CB-CG2 3.99Å; K118-I130 HydrophobicContact CD-CG2 4.37Å; K118-I130 HydrophobicContact CG-CG2 4.21Å; E120-I130 HydrophobicContact CG-CG1 4.26Å; I128-I130 HydrophobicContact CG2-CG1 4.04Å
131	V	83.1	Confident	83	Confident	10 Å²	10	76.5 Å²	76.5	6%	0.061	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	116.4	175.5	-170.9	0	0	0	0	109	L89 I93 L119 Y121 L129 V135 R136	L89-V131 HydrophobicContact CD1-CG1 4.3Å; I93-V131 HydrophobicContact CD1-CG2 4.49Å; L119-V131 PolarHBondContact O-N 3.12Å; Y121-V131 HydrophobicContact CD2-CB 4.35Å; Y121-V131 HydrophobicContact CD2-CG2 3.83Å; Y121-V131 HydrophobicContact CE2-CB 3.93Å; Y121-V131 HydrophobicContact CE2-CG2 3.8Å; L129-V131 HydrophobicContact CD2-CG2 4.03Å; L129-V131 HydrophobicContact CG-CG2 3.91Å; V131-V135 HydrophobicContact CG1-CB 4.04Å; V131-V135 HydrophobicContact CG1-CG1 3.97Å; V131-R136 HydrophobicContact CG1-CG 3.74Å
132	E	83.7	Confident	83.5	Confident	86 Å²	86	72.5 Å²	72.5	40%	0.402	38%	0.377	S	S	.	.			trans	-62.3	149.4	177	-66.3	-175.9	166.2	0	0	111.7	W98 A134 V135 R136	W98-E132 PolarHBondContact NE1-OE2 2.83Å; E132-A134 VanDerWaalsContact C-N 3.28Å; E132-A134 PolarHBondContact O-N 2.88Å; E132-V135 HydrophobicContact CB-CG2 4.36Å; E132-V135 PolarHBondContact O-N 3.47Å; E132-R136 PolarHBondContact O-N 2.84Å
133	G	83.9	Confident	84.1	Confident	12 Å²	12	66.8 Å²	66.8	12%	0.124	34%	0.34	C	S	.	.	H	α-helix	trans	-55.2	-43.5	176.5	0	0	0	0	0	112.7	V135 R136 E137	G133-V135 VanDerWaalsContact C-N 3.26Å; G133-V135 PolarHBondContact O-N 2.83Å; G133-R136 WeakPolarHBondContact O-CB 3.36Å; G133-R136 PolarHBondContact O-N 3.1Å; G133-E137 PolarHBondContact O-N 2.8Å
134	A	83.7	Confident	84.7	Confident	45 Å²	45	62.4 Å²	62.4	37%	0.372	32%	0.316	S	S	.	.	H	α-helix	trans	-59.3	-34.2	179.5	0	0	0	0	0	113.3	E132 A138	E132-A134 VanDerWaalsContact C-N 3.28Å; E132-A134 PolarHBondContact O-N 2.88Å; A134-A138 VanDerWaalsContact O-CB 3.22Å; A134-A138 WeakPolarHBondContact O-CB 3.5Å; A134-A138 PolarHBondContact O-N 2.89Å
135	V	86.1	Confident	85.2	Confident	23 Å²	23	57.5 Å²	57.5	14%	0.139	29%	0.293	C	S	.	.	H	α-helix	trans	-71.4	-38.2	177.2	175.2	0	0	0	0	111.1	L89 L92 V131 E132 G133 A139	L89-V135 HydrophobicContact CD1-CG1 3.82Å; L92-V135 HydrophobicContact CB-CG1 3.85Å; L92-V135 HydrophobicContact CD1-CG1 4.24Å; V131-V135 HydrophobicContact CG1-CB 4.04Å; V131-V135 HydrophobicContact CG1-CG1 3.97Å; E132-V135 HydrophobicContact CB-CG2 4.36Å; E132-V135 PolarHBondContact O-N 3.47Å; G133-V135 VanDerWaalsContact C-N 3.26Å; G133-V135 PolarHBondContact O-N 2.83Å; V135-A139 WeakPolarHBondContact O-CB 3.41Å; V135-A139 PolarHBondContact O-N 3.47Å
136	R	86.9	Confident	85.6	Confident	60 Å²	60	53.9 Å²	53.9	23%	0.226	28%	0.279	C	S	.	.	H	α-helix	trans	-67.5	-41.9	177.2	-67.5	-178.8	-78.7	150.1	-4.6	111.3	S116 V131 E132 G133 A139 A140	S116-R136 PolarHBondContact OG-NH1 2.82Å; S116-R136 PolarHBondContact OG-NH2 3.34Å; V131-R136 HydrophobicContact CG1-CG 3.74Å; E132-R136 PolarHBondContact O-N 2.84Å; G133-R136 WeakPolarHBondContact O-CB 3.36Å; G133-R136 PolarHBondContact O-N 3.1Å; R136-A139 PolarHBondContact O-N 3.31Å; R136-A140 PolarHBondContact O-N 2.97Å; R136-A140 VanDerWaalsContact O-N 3.14Å
137	E	88.3	Confident	85.4	Confident	76 Å²	76	49.2 Å²	49.2	36%	0.355	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-52.2	175.6	-173.9	176.7	170	0	0	111.3	G133 A139 A140 E141	G133-E137 PolarHBondContact O-N 2.8Å; E137-A139 PolarHBondContact O-N 2.88Å; E137-A139 VanDerWaalsContact O-N 3.16Å; E137-A140 PolarHBondContact O-N 3.26Å; E137-E141 PolarHBondContact O-N 3.13Å
138	A	88.8	Confident	85	Confident	24 Å²	24	52.2 Å²	52.2	20%	0.198	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-26.6	177.8	0	0	0	0	0	113.5	L92 A134	L92-A138 HydrophobicContact CD1-CB 3.91Å; A134-A138 VanDerWaalsContact O-CB 3.22Å; A134-A138 WeakPolarHBondContact O-CB 3.5Å; A134-A138 PolarHBondContact O-N 2.89Å
139	A	90.7	Very high	84.8	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.008	29%	0.288	C	S	.	.	H	α-helix	trans	-74	-37.5	172.7	0	0	0	0	0	112.6	V85 R88 L89 L92 V135 R136 E137 E141 I142	V85-A139 HydrophobicContact CG1-CB 4.27Å; R88-A139 HydrophobicContact CG-CB 4.4Å; L89-A139 HydrophobicContact CB-CB 3.87Å; L89-A139 HydrophobicContact CD1-CB 4.17Å; L92-A139 HydrophobicContact CD1-CB 4.22Å; V135-A139 WeakPolarHBondContact O-CB 3.41Å; V135-A139 PolarHBondContact O-N 3.47Å; R136-A139 PolarHBondContact O-N 3.31Å; E137-A139 PolarHBondContact O-N 2.88Å; E137-A139 VanDerWaalsContact O-N 3.16Å; A139-E141 VanDerWaalsContact C-N 3.35Å; A139-I142 VanDerWaalsContact O-CG2 3.24Å; A139-I142 WeakPolarHBondContact O-CG2 3.31Å
140	A	92.3	Very high	84.8	Confident	22 Å²	22	54.5 Å²	54.5	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-76	-23.5	178.4	0	0	0	0	0	113	R136 E137 I142 L143 L185	R136-A140 PolarHBondContact O-N 2.97Å; R136-A140 VanDerWaalsContact O-N 3.14Å; E137-A140 PolarHBondContact O-N 3.26Å; A140-I142 PolarHBondContact O-N 2.83Å; A140-I142 VanDerWaalsContact O-N 3.14Å; A140-L143 WeakPolarHBondContact O-CB 3.41Å; A140-L143 PolarHBondContact O-N 3.22Å; A140-L185 HydrophobicContact CB-CD1 4.03Å
141	E	91.4	Very high	85.1	Confident	11 Å²	11	53.8 Å²	53.8	5%	0.051	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-56.9	-30.1	-178.3	-162.6	51.5	-151.7	0	0	113	E137 A139 L143 F144 E145 R191	E137-E141 PolarHBondContact O-N 3.13Å; A139-E141 VanDerWaalsContact C-N 3.35Å; E141-L143 PolarHBondContact O-N 3.38Å; E141-F144 CarbonylContact O-C 3.55Å; E141-F144 PolarHBondContact O-N 3.35Å; E141-E145 HydrophobicContact CG-CG 3.87Å; E141-E145 WeakPolarHBondContact CG-OE1 3.41Å; E141-E145 WeakPolarHBondContact O-CG 3.29Å; E141-E145 PolarHBondContact O-N 3.19Å; E141-R191 IonicContact OE1-CZ 2.8Å; E141-R191 IonicContact OE1-NH1 2.8Å; E141-R191 IonicContact OE1-NH2 3.96Å; E141-R191 PolarHBondContact OE1-NH2 3.17Å; E141-R191 IonicContact OE2-CZ 2.88Å; E141-R191 IonicContact OE2-NH1 3.18Å; E141-R191 PolarHBondContact OE2-NH1 3.03Å; E141-R191 IonicContact OE2-NH2 2.78Å; E141-R191 PolarHBondContact OE2-NH2 3.08Å
142	I	91.4	Very high	85.5	Confident	20 Å²	20	53.4 Å²	53.4	10%	0.103	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-55.4	-23.1	176.1	-162.8	163.9	0	0	0	114.1	V80 A84 V85 R88 A139 A140 F144	V80-I142 WeakPolarHBondContact CG1-O 3.11Å; A84-I142 HydrophobicContact CB-CD1 3.9Å; A84-I142 HydrophobicContact CB-CG1 4.42Å; A84-I142 HydrophobicContact CB-CG2 4.34Å; V85-I142 HydrophobicContact CB-CG2 4.45Å; V85-I142 HydrophobicContact CG2-CG2 3.69Å; R88-I142 HydrophobicContact CB-CD1 4.46Å; A139-I142 VanDerWaalsContact O-CG2 3.24Å; A139-I142 WeakPolarHBondContact O-CG2 3.31Å; A140-I142 PolarHBondContact O-N 2.83Å; A140-I142 VanDerWaalsContact O-N 3.14Å; I142-F144 VanDerWaalsContact C-N 3.29Å
143	L	92	Very high	85.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-74.9	-20.9	176.4	-61	-178.1	0	0	0	112.7	V80 V85 A140 E141 I153 L185 F188	V80-L143 HydrophobicContact CG1-CD2 3.68Å; V85-L143 HydrophobicContact CG2-CD1 3.88Å; V85-L143 HydrophobicContact CG2-CD2 3.75Å; V85-L143 HydrophobicContact CG2-CG 3.64Å; A140-L143 WeakPolarHBondContact O-CB 3.41Å; A140-L143 PolarHBondContact O-N 3.22Å; E141-L143 PolarHBondContact O-N 3.38Å; L143-I153 HydrophobicContact CB-CD1 3.89Å; L143-I153 HydrophobicContact CD1-CD1 4.43Å; L143-I153 HydrophobicContact CD2-CD1 4.28Å; L143-I153 HydrophobicContact CG-CD1 4.42Å; L143-I153 WeakPolarHBondContact O-CG1 3.38Å; L143-I153 PolarHBondContact O-N 3.39Å; L143-I153 VanDerWaalsContact O-N 3.13Å; L143-L185 HydrophobicContact CD1-CD1 4.06Å; L143-F188 HydrophobicContact CD1-CD2 4.33Å; L143-F188 HydrophobicContact CD1-CE2 3.83Å
144	F	92.3	Very high	86.4	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.053	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-22.5	-174.9	-60	-80	0	0	0	112.7	E141 I142 S152 P154 F188 R191 L192 E195	E141-F144 CarbonylContact O-C 3.55Å; E141-F144 PolarHBondContact O-N 3.35Å; I142-F144 VanDerWaalsContact C-N 3.29Å; F144-S152 WeakPolarHBondContact O-CB 3.48Å; F144-P154 HydrophobicContact CD1-CG 3.97Å; F144-P154 HydrophobicContact CE1-CG 4.46Å; F144-F188 HydrophobicContact CE1-CE2 4.49Å; F144-F188 HydrophobicContact CE2-CD2 4.09Å; F144-F188 HydrophobicContact CE2-CE2 4.03Å; F144-F188 AromaticContact CZ-CD2 3.76Å; F144-F188 HydrophobicContact CZ-CD2 3.76Å; F144-F188 AromaticContact CZ-CE2 3.57Å; F144-F188 HydrophobicContact CZ-CE2 3.57Å; F144-F188 HydrophobicContact CZ-CZ 4.25Å; F144-R191 HydrophobicContact CD1-CG 4.1Å; F144-R191 HydrophobicContact CD2-CG 4.1Å; F144-R191 HydrophobicContact CE1-CG 3.79Å; F144-R191 HydrophobicContact CE2-CG 3.78Å; F144-R191 HydrophobicContact CG-CG 4.25Å; F144-R191 HydrophobicContact CZ-CB 4.15Å; F144-R191 HydrophobicContact CZ-CG 3.62Å; F144-L192 HydrophobicContact CE1-CB 4.16Å; F144-L192 HydrophobicContact CE1-CD1 4.14Å; F144-E195 HydrophobicContact CD1-CG 4Å
145	E	86.7	Confident	86.7	Confident	67 Å²	67	47.9 Å²	47.9	31%	0.313	24%	0.241	S	C	.	.	S	Bend	trans	-57.5	140	175.1	-76.3	170.9	-179.1	0	0	112.3	E141 S152	E141-E145 HydrophobicContact CG-CG 3.87Å; E141-E145 WeakPolarHBondContact CG-OE1 3.41Å; E141-E145 WeakPolarHBondContact O-CG 3.29Å; E141-E145 PolarHBondContact O-N 3.19Å; E145-S152 WeakPolarHBondContact O-CB 3.01Å
146	H	76.8	Confident	87.1	Confident	114 Å²	114	46.8 Å²	46.8	53%	0.528	23%	0.234	S	C	.	.			trans	-85.6	110.3	169.9	-61.2	-52.9	0	0	0	109.2	S152 Q155	H146-S152 PolarHBondContact CE1-OG 2.78Å; H146-S152 PolarHBondContact ND1-OG 2.83Å; H146-Q155 PolarHBondContact CE1-NE2 2.91Å; H146-Q155 PolarHBondContact ND1-NE2 3.22Å; H146-Q155 PolarHBondContact ND1-OE1 2.96Å
147	N	73.6	Confident	87.4	Confident	73 Å²	73	43.9 Å²	43.9	39%	0.39	22%	0.223	S	C	.	.			trans	-100.6	154.3	170.6	-68	-24.9	0	0	0	109.6	D149 D150	N147-D149 VanDerWaalsContact C-N 3.27Å; N147-D149 PolarHBondContact O-N 2.96Å; N147-D150 HydrophobicContact CB-CB 4.49Å; N147-D150 VanDerWaalsContact O-O 3.07Å
148	E	70	Confident	87.6	Confident	204 Å²	204	40.3 Å²	40.3	95%	0.953	21%	0.206	S	C	*	.	S	Bend	trans	-66.6	-32.7	176.9	-66.1	-178.7	173.8	0	0	111.6
149	D	76.8	Confident	87.8	Confident	156 Å²	156	41.8 Å²	41.8	83%	0.834	21%	0.209	S	C	*	.	S	Bend	trans	-89.4	-29.4	-176.6	-62	-39.9	0	0	0	113.8	N147	N147-D149 VanDerWaalsContact C-N 3.27Å; N147-D149 PolarHBondContact O-N 2.96Å
150	D	81.1	Confident	88	Confident	49 Å²	49	41.7 Å²	41.7	26%	0.262	21%	0.209	S	C	.	.	S	Bend	trans	-131.1	137.7	-171.3	-78.2	-52.5	0	0	0	111.7	V80 N147	V80-D150 HydrophobicContact CG2-CB 3.68Å; N147-D150 HydrophobicContact CB-CB 4.49Å; N147-D150 VanDerWaalsContact O-O 3.07Å
151	M	87	Confident	88	Confident	65 Å²	65	40.7 Å²	40.7	32%	0.32	20%	0.2	S	C	.	.			trans	-77.1	141.3	173.1	-68.6	178.6	-76	0	0	111.4	S78 Q155 L156 E159	S78-M151 PolarHBondContact OG-O 2.91Å; S78-M151 VanDerWaalsContact OG-O 3.13Å; M151-Q155 HydrophobicContact CB-CB 4.38Å; M151-L156 HydrophobicContact CB-CD1 4.37Å; M151-L156 HydrophobicContact CE-CD1 3.62Å; M151-L156 HydrophobicContact SD-CD1 4.4Å; M151-E159 HydrophobicContact SD-CG 4Å
152	S	91.5	Very high	88.1	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.014	20%	0.203	C	C	.	.			trans	-69.4	157.5	169.4	69.9	0	0	0	0	111.2	F144 E145 H146 Q155 L156	F144-S152 WeakPolarHBondContact O-CB 3.48Å; E145-S152 WeakPolarHBondContact O-CB 3.01Å; H146-S152 PolarHBondContact CE1-OG 2.78Å; H146-S152 PolarHBondContact ND1-OG 2.83Å; S152-Q155 PolarHBondContact O-N 2.92Å; S152-Q155 VanDerWaalsContact O-N 3.16Å; S152-Q155 PolarHBondContact OG-OE1 2.87Å; S152-L156 WeakPolarHBondContact O-CB 3.32Å; S152-L156 PolarHBondContact O-N 3.13Å
153	I	93.9	Very high	88.2	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-56.2	-44.6	-179.3	-61.2	178.1	0	0	0	112.5	V53 V55 T60 L143 Q155 L156 I157 F188 L192	V53-I153 HydrophobicContact CG1-CG2 4.12Å; V55-I153 HydrophobicContact CG1-CD1 4.1Å; V55-I153 HydrophobicContact CG2-CD1 4.11Å; T60-I153 HydrophobicContact CG2-CD1 4.41Å; T60-I153 HydrophobicContact CG2-CG1 4.19Å; L143-I153 HydrophobicContact CB-CD1 3.89Å; L143-I153 HydrophobicContact CD1-CD1 4.43Å; L143-I153 HydrophobicContact CD2-CD1 4.28Å; L143-I153 HydrophobicContact CG-CD1 4.42Å; L143-I153 WeakPolarHBondContact O-CG1 3.38Å; L143-I153 PolarHBondContact O-N 3.39Å; L143-I153 VanDerWaalsContact O-N 3.13Å; I153-Q155 VanDerWaalsContact C-N 3.35Å; I153-Q155 PolarHBondContact O-N 2.77Å; I153-L156 WeakPolarHBondContact O-CB 3.45Å; I153-L156 PolarHBondContact O-N 3.01Å; I153-I157 HydrophobicContact CG2-CD1 4.11Å; I153-I157 WeakPolarHBondContact O-CG1 3.48Å; I153-I157 PolarHBondContact O-N 3.48Å; I153-I157 VanDerWaalsContact O-N 3.09Å; I153-F188 HydrophobicContact CD1-CE2 4.1Å; I153-F188 HydrophobicContact CD1-CZ 3.88Å; I153-L192 HydrophobicContact CG2-CD1 3.92Å
154	P	92.6	Very high	88.2	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-42.3	176.4	-22.7	31.9	0	0	0	113.3	F144 I157 L158 L192 E195 L196	F144-P154 HydrophobicContact CD1-CG 3.97Å; F144-P154 HydrophobicContact CE1-CG 4.46Å; P154-I157 WeakPolarHBondContact O-CB 3.46Å; P154-I157 PolarHBondContact O-N 2.91Å; P154-L158 WeakPolarHBondContact O-CG 3.27Å; P154-L158 PolarHBondContact O-N 3.37Å; P154-L158 VanDerWaalsContact O-N 3.14Å; P154-L192 HydrophobicContact CG-CD1 4.04Å; P154-E195 HydrophobicContact CB-CB 4.25Å; P154-E195 HydrophobicContact CG-CB 3.67Å; P154-E195 HydrophobicContact CG-CG 4.47Å; P154-L196 HydrophobicContact CB-CD2 3.9Å; P154-L196 HydrophobicContact CB-CG 4.21Å
155	Q	91.3	Very high	88.2	Confident	24 Å²	24	47.7 Å²	47.7	11%	0.112	24%	0.237	C	C	.	.	H	α-helix	trans	-65.4	-42.2	176.7	-73.3	176.9	-30.5	0	0	111.4	H146 M151 S152 I153 I157 L158 E159	H146-Q155 PolarHBondContact CE1-NE2 2.91Å; H146-Q155 PolarHBondContact ND1-NE2 3.22Å; H146-Q155 PolarHBondContact ND1-OE1 2.96Å; M151-Q155 HydrophobicContact CB-CB 4.38Å; S152-Q155 PolarHBondContact O-N 2.92Å; S152-Q155 VanDerWaalsContact O-N 3.16Å; S152-Q155 PolarHBondContact OG-OE1 2.87Å; I153-Q155 VanDerWaalsContact C-N 3.35Å; I153-Q155 PolarHBondContact O-N 2.77Å; Q155-I157 PolarHBondContact O-N 3.3Å; Q155-L158 PolarHBondContact O-N 2.83Å; Q155-L158 VanDerWaalsContact O-N 3.09Å; Q155-E159 WeakPolarHBondContact O-CG 3.29Å; Q155-E159 PolarHBondContact O-N 2.86Å
156	L	93.4	Very high	88.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.1	-41.2	178.5	-160.7	70.4	0	0	0	111.7	T60 V62 Q76 M151 S152 I153 A160	T60-L156 HydrophobicContact CG2-CD2 3.97Å; V62-L156 HydrophobicContact CB-CG 4.43Å; V62-L156 HydrophobicContact CG2-CB 4.25Å; V62-L156 HydrophobicContact CG2-CD2 3.72Å; V62-L156 HydrophobicContact CG2-CG 3.83Å; Q76-L156 HydrophobicContact CB-CD1 3.61Å; Q76-L156 HydrophobicContact CB-CG 3.78Å; M151-L156 HydrophobicContact CB-CD1 4.37Å; M151-L156 HydrophobicContact CE-CD1 3.62Å; M151-L156 HydrophobicContact SD-CD1 4.4Å; S152-L156 WeakPolarHBondContact O-CB 3.32Å; S152-L156 PolarHBondContact O-N 3.13Å; I153-L156 WeakPolarHBondContact O-CB 3.45Å; I153-L156 PolarHBondContact O-N 3.01Å; L156-A160 WeakPolarHBondContact O-CB 3.39Å; L156-A160 PolarHBondContact O-N 2.78Å; L156-A160 VanDerWaalsContact O-N 3.09Å
157	I	94.7	Very high	89.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-49.8	174.4	-69.5	169.8	0	0	0	111	L51 V53 V62 I153 P154 Q155 A160 V161 I176 L192 L196	L51-I157 HydrophobicContact CD2-CG2 3.74Å; V53-I157 HydrophobicContact CG1-CD1 4.22Å; V53-I157 HydrophobicContact CG1-CG1 4.38Å; V53-I157 HydrophobicContact CG2-CD1 3.76Å; V53-I157 HydrophobicContact CG2-CG1 3.68Å; V62-I157 HydrophobicContact CG2-CG1 4.06Å; I153-I157 HydrophobicContact CG2-CD1 4.11Å; I153-I157 WeakPolarHBondContact O-CG1 3.48Å; I153-I157 PolarHBondContact O-N 3.48Å; I153-I157 VanDerWaalsContact O-N 3.09Å; P154-I157 WeakPolarHBondContact O-CB 3.46Å; P154-I157 PolarHBondContact O-N 2.91Å; Q155-I157 PolarHBondContact O-N 3.3Å; I157-A160 PolarHBondContact O-N 2.91Å; I157-V161 WeakPolarHBondContact O-CG2 3.4Å; I157-V161 PolarHBondContact O-N 3.01Å; I157-I176 HydrophobicContact CG2-CD1 4.14Å; I157-L192 HydrophobicContact CD1-CD1 3.97Å; I157-L192 HydrophobicContact CD1-CD2 4.27Å; I157-L196 HydrophobicContact CB-CD2 4.08Å; I157-L196 HydrophobicContact CD1-CD1 4Å; I157-L196 HydrophobicContact CD1-CD2 4.3Å; I157-L196 HydrophobicContact CG2-CD1 4.43Å; I157-L196 HydrophobicContact CG2-CD2 3.87Å
158	L	92.3	Very high	90.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-41.9	-178.1	-66.5	176.2	0	0	0	112.3	P154 Q155 A160 V161 I162 I173 L196 L200 Y206 L210	P154-L158 WeakPolarHBondContact O-CG 3.27Å; P154-L158 PolarHBondContact O-N 3.37Å; P154-L158 VanDerWaalsContact O-N 3.14Å; Q155-L158 PolarHBondContact O-N 2.83Å; Q155-L158 VanDerWaalsContact O-N 3.09Å; L158-A160 VanDerWaalsContact C-N 3.33Å; L158-A160 PolarHBondContact O-N 3.36Å; L158-V161 PolarHBondContact O-N 2.78Å; L158-I162 WeakPolarHBondContact O-CD1 3.22Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.12Å; L158-I162 PolarHBondContact O-N 3.26Å; L158-I173 HydrophobicContact CD2-CD1 4.24Å; L158-L196 HydrophobicContact CD2-CD2 4.39Å; L158-L196 HydrophobicContact CG-CD2 4.21Å; L158-L200 HydrophobicContact CD2-CD2 3.55Å; L158-L200 HydrophobicContact CD2-CG 4.01Å; L158-Y206 HydrophobicContact CB-CD1 4.35Å; L158-Y206 HydrophobicContact CB-CE1 4.03Å; L158-Y206 HydrophobicContact CB-CE2 4.38Å; L158-Y206 HydrophobicContact CD1-CD2 3.61Å; L158-Y206 HydrophobicContact CD1-CE2 3.62Å; L158-Y206 HydrophobicContact CD1-CG 4.14Å; L158-L210 HydrophobicContact CD2-CD1 3.93Å
159	E	92.3	Very high	91.3	Very high	55 Å²	55	41.5 Å²	41.5	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-63.1	-38.9	175.5	-67.3	-57.6	150.5	0	0	111.8	Q76 M151 Q155 V161 I162 K163 Y206	Q76-E159 HydrophobicContact CG-CB 4.21Å; Q76-E159 VanDerWaalsContact NE2-CB 3.26Å; M151-E159 HydrophobicContact SD-CG 4Å; Q155-E159 WeakPolarHBondContact O-CG 3.29Å; Q155-E159 PolarHBondContact O-N 2.86Å; E159-V161 VanDerWaalsContact C-N 3.32Å; E159-V161 PolarHBondContact O-N 3.09Å; E159-I162 PolarHBondContact O-N 3.17Å; E159-K163 WeakPolarHBondContact O-CG 3.3Å; E159-K163 PolarHBondContact O-N 3.48Å; E159-Y206 WeakPolarHBondContact OE1-CE1 3.31Å; E159-Y206 PolarHBondContact OE1-OH 3.46Å
160	A	94.1	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-41.5	176.1	0	0	0	0	0	111.1	L51 V62 Q76 L156 I157 L158 K163 C164	L51-A160 HydrophobicContact CD1-CB 4.3Å; V62-A160 HydrophobicContact CB-CB 4.19Å; V62-A160 HydrophobicContact CG1-CB 3.52Å; Q76-A160 HydrophobicContact CB-CB 4.11Å; Q76-A160 HydrophobicContact CG-CB 3.65Å; L156-A160 WeakPolarHBondContact O-CB 3.39Å; L156-A160 PolarHBondContact O-N 2.78Å; L156-A160 VanDerWaalsContact O-N 3.09Å; I157-A160 PolarHBondContact O-N 2.91Å; L158-A160 VanDerWaalsContact C-N 3.33Å; L158-A160 PolarHBondContact O-N 3.36Å; A160-K163 PolarHBondContact O-N 3.5Å; A160-C164 PolarHBondContact O-N 3.35Å; A160-C164 PolarHBondContact O-SG 2.99Å
161	V	93.8	Very high	92.5	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-36.3	175.9	175.6	0	0	0	0	111.6	L51 I157 L158 E159 C164 R169 M172 I173 L210	L51-V161 HydrophobicContact CD2-CG2 3.66Å; I157-V161 WeakPolarHBondContact O-CG2 3.4Å; I157-V161 PolarHBondContact O-N 3.01Å; L158-V161 PolarHBondContact O-N 2.78Å; E159-V161 VanDerWaalsContact C-N 3.32Å; E159-V161 PolarHBondContact O-N 3.09Å; V161-C164 WeakPolarHBondContact O-CB 3.45Å; V161-C164 PolarHBondContact O-N 3.2Å; V161-R169 HydrophobicContact CG1-CB 3.78Å; V161-R169 HydrophobicContact CG1-CG 4.17Å; V161-R169 VanDerWaalsContact O-CD 3.25Å; V161-R169 WeakPolarHBondContact O-CD 3.34Å; V161-R169 VanDerWaalsContact O-CG 3.26Å; V161-R169 WeakPolarHBondContact O-CG 3.43Å; V161-R169 PolarHBondContact O-NE 3.16Å; V161-M172 HydrophobicContact CG2-CB 4.11Å; V161-I173 HydrophobicContact CG2-CD1 4.37Å; V161-L210 HydrophobicContact CG1-CD2 3.88Å
162	I	92.2	Very high	92.9	Very high	20 Å²	20	38 Å²	38	10%	0.103	19%	0.188	C	C	.	.	H	α-helix	trans	-70.9	-37.6	178.5	-68.9	161.2	0	0	0	111.6	L158 E159 C164 R169 Y206 K209 L210	L158-I162 WeakPolarHBondContact O-CD1 3.22Å; L158-I162 VanDerWaalsContact O-CG1 3.26Å; L158-I162 WeakPolarHBondContact O-CG1 3.12Å; L158-I162 PolarHBondContact O-N 3.26Å; E159-I162 PolarHBondContact O-N 3.17Å; I162-C164 PolarHBondContact O-N 3.3Å; I162-R169 PolarHBondContact O-NE 3.43Å; I162-R169 PolarHBondContact O-NH2 3.27Å; I162-Y206 HydrophobicContact CD1-CD1 3.38Å; I162-Y206 HydrophobicContact CD1-CE1 3.57Å; I162-K209 HydrophobicContact CD1-CD 4.44Å; I162-K209 HydrophobicContact CG2-CD 3.94Å; I162-L210 HydrophobicContact CD1-CD1 4.2Å; I162-L210 HydrophobicContact CD1-CG 4.48Å; I162-L210 HydrophobicContact CG1-CD1 4.01Å; I162-L210 HydrophobicContact CG1-CD2 4.02Å; I162-L210 HydrophobicContact CG1-CG 4.01Å
163	K	93.4	Very high	93	Very high	105 Å²	105	38 Å²	38	46%	0.457	19%	0.188	S	C	.	.	H	α-helix	trans	-65	-26.5	174.4	-74.7	-173.7	173.9	-172.5	0	112.7	S74 E159 A160	S74-K163 PolarHBondContact OG-O 3.37Å; E159-K163 WeakPolarHBondContact O-CG 3.3Å; E159-K163 PolarHBondContact O-N 3.48Å; A160-K163 PolarHBondContact O-N 3.5Å
164	C	93.1	Very high	92.9	Very high	1 Å²	1	41 Å²	41	1%	0.007	20%	0.202	C	C	.	.	S	Bend	trans	-65.1	149.2	174.7	-68.7	0	0	0	0	112.2	P64 S74 A160 V161 I162 I168 R169	P64-C164 WeakPolarHBondContact CG-SG 3.46Å; S74-C164 WeakPolarHBondContact OG-CA 3.48Å; S74-C164 PolarHBondContact OG-N 3.07Å; A160-C164 PolarHBondContact O-N 3.35Å; A160-C164 PolarHBondContact O-SG 2.99Å; V161-C164 WeakPolarHBondContact O-CB 3.45Å; V161-C164 PolarHBondContact O-N 3.2Å; I162-C164 PolarHBondContact O-N 3.3Å; C164-I168 HydrophobicContact CB-CD1 3.85Å; C164-I168 HydrophobicContact CB-CG1 3.76Å; C164-R169 HydrophobicContact CB-CG 4.3Å; C164-R169 PolarHBondContact O-NE 3.05Å; C164-R169 PolarHBondContact O-NH2 3.35Å
165	P	92.6	Very high	93	Very high	64 Å²	64	41.1 Å²	41.1	42%	0.416	20%	0.203	S	C	.	.			trans	-51.1	145.3	166.8	-26.7	33.6	0	0	0	112.6	D167 I168 R169	P165-D167 PolarHBondContact O-N 2.98Å; P165-D167 VanDerWaalsContact O-N 3.16Å; P165-I168 HydrophobicContact CB-CG1 4.41Å; P165-I168 HydrophobicContact CG-CD1 4.36Å; P165-I168 WeakPolarHBondContact O-CG1 3.36Å; P165-I168 PolarHBondContact O-N 3.46Å; P165-R169 VanDerWaalsContact O-CG 3.25Å; P165-R169 WeakPolarHBondContact O-CG 3.42Å; P165-R169 PolarHBondContact O-N 3.22Å
166	I	91	Very high	93.2	Very high	124 Å²	124	40 Å²	40	64%	0.636	20%	0.198	S	C	*	.	H	α-helix	trans	-54.3	-39.9	-171.9	-64.9	168.9	0	0	0	112.1	I168 R169	I166-I168 PolarHBondContact O-N 3.41Å; I166-R169 PolarHBondContact O-N 3.41Å
167	D	92.6	Very high	93.3	Very high	149 Å²	149	40 Å²	40	80%	0.797	20%	0.198	S	C	*	.	H	α-helix	trans	-66	-35.8	-174.5	-56.3	-38.3	0	0	0	113.1	P165	P165-D167 PolarHBondContact O-N 2.98Å; P165-D167 VanDerWaalsContact O-N 3.16Å
168	I	93.3	Very high	93.4	Very high	16 Å²	16	40.2 Å²	40.2	8%	0.082	20%	0.199	C	C	.	.	H	α-helix	trans	-88.8	-14.3	-176.2	72.1	174.7	0	0	0	112.8	F66 L71 C164 P165 I166 R170 S171 M172	F66-I168 HydrophobicContact CD1-CG2 4.48Å; F66-I168 HydrophobicContact CD2-CB 4.08Å; F66-I168 HydrophobicContact CD2-CG2 3.67Å; F66-I168 HydrophobicContact CE1-CG2 4.27Å; F66-I168 HydrophobicContact CE2-CB 4.15Å; F66-I168 HydrophobicContact CE2-CG2 3.43Å; F66-I168 VanDerWaalsContact CE2-CG2 3.43Å; F66-I168 HydrophobicContact CG-CG2 4.2Å; F66-I168 HydrophobicContact CZ-CG2 3.76Å; L71-I168 HydrophobicContact CD1-CD1 3.2Å; C164-I168 HydrophobicContact CB-CD1 3.85Å; C164-I168 HydrophobicContact CB-CG1 3.76Å; P165-I168 HydrophobicContact CB-CG1 4.41Å; P165-I168 HydrophobicContact CG-CD1 4.36Å; P165-I168 WeakPolarHBondContact O-CG1 3.36Å; P165-I168 PolarHBondContact O-N 3.46Å; I166-I168 PolarHBondContact O-N 3.41Å; I168-R170 VanDerWaalsContact C-N 3.28Å; I168-R170 PolarHBondContact O-N 3.43Å; I168-S171 WeakPolarHBondContact O-CA 3.17Å; I168-S171 WeakPolarHBondContact O-CB 3.36Å; I168-S171 PolarHBondContact O-N 3.22Å; I168-M172 HydrophobicContact CB-CE 4.3Å; I168-M172 HydrophobicContact CD1-CE 4.1Å; I168-M172 HydrophobicContact CG1-CE 4.46Å; I168-M172 WeakPolarHBondContact O-CG 3.44Å; I168-M172 PolarHBondContact O-N 3.38Å
169	R	93.5	Very high	93.5	Very high	40 Å²	40	40.4 Å²	40.4	15%	0.151	20%	0.2	C	C	.	.	H	α-helix	trans	-55.9	-41	-175.2	-60.3	-165.3	-178.4	154.8	2.2	112.9	V161 I162 C164 P165 I166 M172 I173 K209 F212	V161-R169 HydrophobicContact CG1-CB 3.78Å; V161-R169 HydrophobicContact CG1-CG 4.17Å; V161-R169 VanDerWaalsContact O-CD 3.25Å; V161-R169 WeakPolarHBondContact O-CD 3.34Å; V161-R169 VanDerWaalsContact O-CG 3.26Å; V161-R169 WeakPolarHBondContact O-CG 3.43Å; V161-R169 PolarHBondContact O-NE 3.16Å; I162-R169 PolarHBondContact O-NE 3.43Å; I162-R169 PolarHBondContact O-NH2 3.27Å; C164-R169 HydrophobicContact CB-CG 4.3Å; C164-R169 PolarHBondContact O-NE 3.05Å; C164-R169 PolarHBondContact O-NH2 3.35Å; P165-R169 VanDerWaalsContact O-CG 3.25Å; P165-R169 WeakPolarHBondContact O-CG 3.42Å; P165-R169 PolarHBondContact O-N 3.22Å; I166-R169 PolarHBondContact O-N 3.41Å; R169-M172 PolarHBondContact O-N 3.44Å; R169-I173 PolarHBondContact O-N 3.2Å; R169-I173 VanDerWaalsContact O-N 3.08Å; R169-K209 PolarHBondContact NH1-O 2.94Å; R169-F212 HydrophobicContact CB-CE2 3.82Å; R169-F212 HydrophobicContact CB-CZ 4.39Å
170	R	91.7	Very high	93.5	Very high	143 Å²	143	38.2 Å²	38.2	54%	0.54	19%	0.193	S	C	.	.	H	α-helix	trans	-62.1	-45.4	176	-175.5	177.7	-73.9	153.6	-2.5	111.1	I168 M172 I173 E174 F212	I168-R170 VanDerWaalsContact C-N 3.28Å; I168-R170 PolarHBondContact O-N 3.43Å; R170-M172 PolarHBondContact O-N 3.18Å; R170-I173 WeakPolarHBondContact O-CG2 3.42Å; R170-I173 PolarHBondContact O-N 3.22Å; R170-E174 WeakPolarHBondContact CG-OE1 3.42Å; R170-E174 WeakPolarHBondContact O-CB 3.38Å; R170-E174 WeakPolarHBondContact O-CG 3.25Å; R170-E174 PolarHBondContact O-N 3.48Å; R170-F212 HydrophobicContact CB-CD1 4.23Å; R170-F212 HydrophobicContact CB-CE1 3.63Å; R170-F212 HydrophobicContact CB-CE2 4.31Å; R170-F212 HydrophobicContact CB-CZ 3.66Å; R170-F212 HydrophobicContact CG-CD1 4.15Å; R170-F212 HydrophobicContact CG-CE1 3.94Å; R170-F212 HydrophobicContact CG-CZ 4.45Å; R170-F212 VanDerWaalsContact NE-CE1 3.29Å
171	S	93	Very high	93.4	Very high	52 Å²	52	40.2 Å²	40.2	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-33.6	178.7	-167.8	0	0	0	0	112.1	T49 I168 G175	T49-S171 VanDerWaalsContact CG2-OG 3.28Å; T49-S171 WeakPolarHBondContact CG2-OG 3.42Å; I168-S171 WeakPolarHBondContact O-CA 3.17Å; I168-S171 WeakPolarHBondContact O-CB 3.36Å; I168-S171 PolarHBondContact O-N 3.22Å; S171-G175 PolarHBondContact O-N 3.49Å
172	M	94.5	Very high	93.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-72.7	-45.4	179	-64.6	-55.2	150	0	0	112.4	T49 L51 P64 V65 F66 V161 I168 R169 R170 E174 G175 I176	T49-M172 HydrophobicContact CG2-CE 3.66Å; L51-M172 HydrophobicContact CB-CB 4.14Å; L51-M172 HydrophobicContact CB-SD 4.21Å; P64-M172 HydrophobicContact CB-CE 4.41Å; P64-M172 HydrophobicContact CB-CG 4.46Å; P64-M172 HydrophobicContact CB-SD 3.86Å; V65-M172 WeakPolarHBondContact O-CE 3.47Å; F66-M172 HydrophobicContact CB-CE 3.88Å; F66-M172 HydrophobicContact CD2-CE 3.83Å; F66-M172 HydrophobicContact CG-CE 4.33Å; V161-M172 HydrophobicContact CG2-CB 4.11Å; I168-M172 HydrophobicContact CB-CE 4.3Å; I168-M172 HydrophobicContact CD1-CE 4.1Å; I168-M172 HydrophobicContact CG1-CE 4.46Å; I168-M172 WeakPolarHBondContact O-CG 3.44Å; I168-M172 PolarHBondContact O-N 3.38Å; R169-M172 PolarHBondContact O-N 3.44Å; R170-M172 PolarHBondContact O-N 3.18Å; M172-E174 VanDerWaalsContact C-N 3.32Å; M172-E174 PolarHBondContact O-N 3.35Å; M172-G175 CarbonylContact O-C 3.57Å; M172-G175 PolarHBondContact O-N 3Å; M172-I176 WeakPolarHBondContact O-CG1 3.41Å
173	I	92.5	Very high	93.3	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-71.3	-28.7	-179.8	-157.5	72.6	0	0	0	112.5	L158 V161 R169 R170 G175 I176 L200 F212 A215 K216	L158-I173 HydrophobicContact CD2-CD1 4.24Å; V161-I173 HydrophobicContact CG2-CD1 4.37Å; R169-I173 PolarHBondContact O-N 3.2Å; R169-I173 VanDerWaalsContact O-N 3.08Å; R170-I173 WeakPolarHBondContact O-CG2 3.42Å; R170-I173 PolarHBondContact O-N 3.22Å; I173-G175 VanDerWaalsContact C-N 3.32Å; I173-I176 HydrophobicContact CD1-CD1 4.25Å; I173-L200 HydrophobicContact CD1-CD1 4.5Å; I173-L200 HydrophobicContact CG1-CD1 4.45Å; I173-F212 HydrophobicContact CG2-CB 4.14Å; I173-F212 HydrophobicContact CG2-CD2 4.08Å; I173-F212 HydrophobicContact CG2-CG 4.18Å; I173-A215 HydrophobicContact CG1-CB 4.38Å; I173-A215 WeakPolarHBondContact O-CA 3.25Å; I173-K216 PolarHBondContact O-N 3.24Å
174	E	92.8	Very high	93.2	Very high	65 Å²	65	38.6 Å²	38.6	30%	0.304	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.7	173.7	-67.9	-167.9	-143.7	0	0	113.8	R170 M172 K216	R170-E174 WeakPolarHBondContact CG-OE1 3.42Å; R170-E174 WeakPolarHBondContact O-CB 3.38Å; R170-E174 WeakPolarHBondContact O-CG 3.25Å; R170-E174 PolarHBondContact O-N 3.48Å; M172-E174 VanDerWaalsContact C-N 3.32Å; M172-E174 PolarHBondContact O-N 3.35Å; E174-K216 HydrophobicContact CB-CD 4.28Å; E174-K216 HydrophobicContact CG-CD 4.47Å; E174-K216 VanDerWaalsContact O-CB 3.29Å; E174-K216 WeakPolarHBondContact O-CB 3.49Å; E174-K216 IonicContact OE2-NZ 3.29Å; E174-K216 PolarHBondContact OE2-NZ 2.88Å
175	G	93.8	Very high	93.1	Very high	3 Å²	3	41.6 Å²	41.6	3%	0.031	23%	0.225	C	C	.	.			trans	-135.7	49.1	-173.2	0	0	0	0	0	112.6	A50 L51 S171 M172 I173 F218	A50-G175 CarbonylContact C-O 3.59Å; A50-G175 VanDerWaalsContact CA-O 3.25Å; A50-G175 WeakPolarHBondContact CA-O 3.47Å; A50-G175 WeakPolarHBondContact CB-O 3.36Å; L51-G175 PolarHBondContact N-O 3.14Å; S171-G175 PolarHBondContact O-N 3.49Å; M172-G175 CarbonylContact O-C 3.57Å; M172-G175 PolarHBondContact O-N 3Å; I173-G175 VanDerWaalsContact C-N 3.32Å; G175-F218 VanDerWaalsContact O-CE2 3.31Å; G175-F218 WeakPolarHBondContact O-CE2 3.44Å
176	I	96.3	Very high	92.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	123.3	-178.9	-53.2	177.4	0	0	0	109.8	L51 V53 I157 M172 I173 V178 L196 A215 K216 F217 F218	L51-I176 HydrophobicContact CB-CG1 4.48Å; L51-I176 HydrophobicContact CD2-CG1 4.32Å; L51-I176 WeakPolarHBondContact O-CA 3.21Å; V53-I176 HydrophobicContact CG2-CG2 3.75Å; I157-I176 HydrophobicContact CG2-CD1 4.14Å; M172-I176 WeakPolarHBondContact O-CG1 3.41Å; I173-I176 HydrophobicContact CD1-CD1 4.25Å; I176-V178 HydrophobicContact CG2-CG2 4.02Å; I176-L196 HydrophobicContact CD1-CD1 4.09Å; I176-A215 HydrophobicContact CD1-CB 4.38Å; I176-K216 PolarHBondContact N-O 2.83Å; I176-K216 VanDerWaalsContact N-O 3.09Å; I176-F217 HydrophobicContact CB-CD1 3.86Å; I176-F217 HydrophobicContact CB-CE1 4.1Å; I176-F217 HydrophobicContact CD1-CE1 4.3Å; I176-F217 HydrophobicContact CD1-CZ 4.5Å; I176-F217 HydrophobicContact CG2-CD1 3.85Å; I176-F217 HydrophobicContact CG2-CE1 3.81Å; I176-F217 CarbonylContact O-C 3.5Å; I176-F217 VanDerWaalsContact O-CA 3.3Å; I176-F217 WeakPolarHBondContact O-CA 3.41Å; I176-F218 PolarHBondContact O-N 2.81Å
177	L	96	Very high	92.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.7	173.1	177.6	61.9	0	0	0	109	L45 L47 A50 L51 V52 V53 V179 F218 M227	L45-L177 HydrophobicContact CD1-CD1 3.65Å; L47-L177 HydrophobicContact CD1-CD2 4.36Å; A50-L177 HydrophobicContact CB-CB 4.25Å; L51-L177 PolarHBondContact O-N 3.22Å; V52-L177 CarbonylContact C-O 3.57Å; V52-L177 WeakPolarHBondContact CA-O 3.46Å; V52-L177 HydrophobicContact CG2-CD2 4.38Å; V53-L177 PolarHBondContact N-O 2.7Å; L177-V179 HydrophobicContact CD1-CG1 4.26Å; L177-V179 HydrophobicContact CD2-CG1 4.33Å; L177-V179 HydrophobicContact CG-CG1 3.95Å; L177-F218 HydrophobicContact CB-CD2 4.19Å; L177-F218 HydrophobicContact CD1-CB 4.05Å; L177-M227 HydrophobicContact CD1-CE 4.26Å
178	V	95.7	Very high	92.9	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.03	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.6	179.1	-173.6	0	0	0	0	109.3	V53 V55 I176 C183 F188 M189 L192 F217	V53-V178 HydrophobicContact CB-CG2 4.29Å; V53-V178 CarbonylContact O-C 3.57Å; V53-V178 WeakPolarHBondContact O-CA 3.38Å; V55-V178 HydrophobicContact CG2-CG1 4.42Å; I176-V178 HydrophobicContact CG2-CG2 4.02Å; V178-C183 HydrophobicContact CG1-CB 3.45Å; V178-C183 VanDerWaalsContact CG1-CB 3.45Å; V178-F188 HydrophobicContact CG1-CE1 3.98Å; V178-M189 HydrophobicContact CB-CE 4.13Å; V178-M189 HydrophobicContact CB-SD 3.73Å; V178-M189 HydrophobicContact CG1-SD 3.96Å; V178-M189 HydrophobicContact CG2-CE 3.87Å; V178-M189 HydrophobicContact CG2-SD 3.83Å; V178-L192 HydrophobicContact CG2-CD2 3.9Å; V178-F217 HydrophobicContact CG2-CD1 3.8Å; V178-F217 HydrophobicContact CG2-CE1 3.86Å
179	V	95	Very high	92.8	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.024	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	167.9	-178.4	-62.9	0	0	0	0	111	V52 V53 D54 V55 L177 M227	V52-V179 HydrophobicContact CG1-CG2 3.71Å; V53-V179 PolarHBondContact O-N 3.13Å; D54-V179 CarbonylContact C-O 3.57Å; D54-V179 WeakPolarHBondContact CA-O 3.33Å; D54-V179 HydrophobicContact CB-CG2 3.93Å; V55-V179 PolarHBondContact N-O 3.23Å; L177-V179 HydrophobicContact CD1-CG1 4.26Å; L177-V179 HydrophobicContact CD2-CG1 4.33Å; L177-V179 HydrophobicContact CG-CG1 3.95Å; V179-M227 HydrophobicContact CG1-CB 3.9Å; V179-M227 HydrophobicContact CG1-CG 4.03Å
180	G	93	Very high	92.8	Very high	9 Å²	9	37.9 Å²	37.9	9%	0.093	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.8	-178	177.8	0	0	0	0	0	113.8	V55 C183 E224 N225	V55-G180 CarbonylContact O-C 3.56Å; G180-C183 PolarHBondContact O-SG 3.34Å; G180-E224 PolarHBondContact N-O 3.16Å; G180-E224 VanDerWaalsContact N-O 3.16Å; G180-N225 WeakPolarHBondContact O-CA 3.35Å; G180-N225 PolarHBondContact O-N 3.35Å
181	G	91.8	Very high	92.8	Very high	42 Å²	42	33 Å²	33	43%	0.433	21%	0.208	S	C	.	.	S	Bend	trans	-82.5	-35.7	-179.5	0	0	0	0	0	112.9	V55 C183 M184	V55-G181 PolarHBondContact O-N 3.3Å; V55-G181 VanDerWaalsContact O-N 3.12Å; G181-C183 VanDerWaalsContact C-N 3.3Å; G181-C183 PolarHBondContact O-N 3.46Å; G181-M184 WeakPolarHBondContact O-CB 3.45Å; G181-M184 PolarHBondContact O-N 3.5Å
182	G	91.1	Very high	92.8	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.021	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-70.4	-25.2	-175.5	0	0	0	0	0	113.7	V55 S82 M184 L185	V55-G182 PolarHBondContact O-N 2.84Å; S82-G182 WeakPolarHBondContact OG-CA 3.29Å; S82-G182 PolarHBondContact OG-N 2.85Å; G182-M184 PolarHBondContact O-N 3.48Å; G182-L185 WeakPolarHBondContact O-CG 3.5Å
183	C	91.5	Very high	92.8	Very high	6 Å²	6	35.4 Å²	35.4	4%	0.041	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-75.9	-10.3	176.2	65	0	0	0	0	113.9	V55 V178 G180 G181 L185 F188 E224	V55-C183 HydrophobicContact CB-CB 4.48Å; V55-C183 HydrophobicContact CG2-CB 4.38Å; V178-C183 HydrophobicContact CG1-CB 3.45Å; V178-C183 VanDerWaalsContact CG1-CB 3.45Å; G180-C183 PolarHBondContact O-SG 3.34Å; G181-C183 VanDerWaalsContact C-N 3.3Å; G181-C183 PolarHBondContact O-N 3.46Å; C183-L185 PolarHBondContact O-N 3.43Å; C183-F188 HydrophobicContact CB-CD1 3.7Å; C183-F188 HydrophobicContact CB-CE1 3.71Å; C183-F188 HydrophobicContact CB-CG 4.48Å; C183-E224 WeakPolarHBondContact SG-CB 3.13Å
184	M	92.2	Very high	92.7	Very high	84 Å²	84	37.8 Å²	37.8	41%	0.414	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-76.5	-2	175.9	-62.7	-172.9	68.1	0	0	113.4	G181 G182 K223 N225	G181-M184 WeakPolarHBondContact O-CB 3.45Å; G181-M184 PolarHBondContact O-N 3.5Å; G182-M184 PolarHBondContact O-N 3.48Å; M184-K223 HydrophobicContact CE-CD 4.47Å; M184-N225 HydrophobicContact SD-CB 3.6Å
185	L	91.2	Very high	92.6	Very high	64 Å²	64	36.2 Å²	36.2	34%	0.335	22%	0.216	S	C	.	.	S	Bend	trans	-59.9	131.5	173.2	-69.7	173.3	0	0	0	109.9	A140 L143 G182 C183 G187 F188	A140-L185 HydrophobicContact CB-CD1 4.03Å; L143-L185 HydrophobicContact CD1-CD1 4.06Å; G182-L185 WeakPolarHBondContact O-CG 3.5Å; C183-L185 PolarHBondContact O-N 3.43Å; L185-G187 PolarHBondContact O-N 3.33Å; L185-F188 HydrophobicContact CB-CB 4.12Å; L185-F188 WeakPolarHBondContact O-CB 3.26Å; L185-F188 PolarHBondContact O-N 3.36Å
186	P	89	Confident	92.5	Very high	131 Å²	131	36 Å²	36	85%	0.851	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	129.1	177.5	-25	34.1	0	0	0	111.4	F188	P186-F188 VanDerWaalsContact C-N 3.29Å; P186-F188 PolarHBondContact O-N 2.9Å
187	G	89.9	Confident	92.1	Very high	42 Å²	42	38.6 Å²	38.6	43%	0.433	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-4.2	-179.1	0	0	0	0	0	115.4	L185 M189 S190 R191	L185-G187 PolarHBondContact O-N 3.33Å; G187-M189 PolarHBondContact O-N 3.49Å; G187-S190 PolarHBondContact O-N 2.99Å; G187-R191 PolarHBondContact O-N 2.89Å
188	F	92.8	Very high	91.7	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-54.8	-49.1	-178.7	-178.7	-91.9	0	0	0	112.8	V55 L143 F144 I153 V178 C183 L185 P186 S190 R191 L192	V55-F188 HydrophobicContact CG2-CE1 4.33Å; V55-F188 HydrophobicContact CG2-CZ 3.96Å; L143-F188 HydrophobicContact CD1-CD2 4.33Å; L143-F188 HydrophobicContact CD1-CE2 3.83Å; F144-F188 HydrophobicContact CE1-CE2 4.49Å; F144-F188 HydrophobicContact CE2-CD2 4.09Å; F144-F188 HydrophobicContact CE2-CE2 4.03Å; F144-F188 AromaticContact CZ-CD2 3.76Å; F144-F188 HydrophobicContact CZ-CD2 3.76Å; F144-F188 AromaticContact CZ-CE2 3.57Å; F144-F188 HydrophobicContact CZ-CE2 3.57Å; F144-F188 HydrophobicContact CZ-CZ 4.25Å; I153-F188 HydrophobicContact CD1-CE2 4.1Å; I153-F188 HydrophobicContact CD1-CZ 3.88Å; V178-F188 HydrophobicContact CG1-CE1 3.98Å; C183-F188 HydrophobicContact CB-CD1 3.7Å; C183-F188 HydrophobicContact CB-CE1 3.71Å; C183-F188 HydrophobicContact CB-CG 4.48Å; L185-F188 HydrophobicContact CB-CB 4.12Å; L185-F188 WeakPolarHBondContact O-CB 3.26Å; L185-F188 PolarHBondContact O-N 3.36Å; P186-F188 VanDerWaalsContact C-N 3.29Å; P186-F188 PolarHBondContact O-N 2.9Å; F188-S190 VanDerWaalsContact C-N 3.34Å; F188-S190 PolarHBondContact O-N 3.34Å; F188-R191 PolarHBondContact O-N 3.06Å; F188-L192 HydrophobicContact CE1-CB 4.44Å; F188-L192 HydrophobicContact CE1-CD2 3.87Å; F188-L192 HydrophobicContact CZ-CD2 4.4Å; F188-L192 VanDerWaalsContact O-CB 3.31Å; F188-L192 WeakPolarHBondContact O-CB 3.39Å; F188-L192 PolarHBondContact O-N 3.16Å
189	M	92.3	Very high	91.3	Very high	60 Å²	60	44.1 Å²	44.1	30%	0.296	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-38.9	-179.1	-69.2	-61	-68.1	0	0	112.7	V178 G187 K193 F217	V178-M189 HydrophobicContact CB-CE 4.13Å; V178-M189 HydrophobicContact CB-SD 3.73Å; V178-M189 HydrophobicContact CG1-SD 3.96Å; V178-M189 HydrophobicContact CG2-CE 3.87Å; V178-M189 HydrophobicContact CG2-SD 3.83Å; G187-M189 PolarHBondContact O-N 3.49Å; M189-K193 WeakPolarHBondContact O-CB 3.45Å; M189-K193 PolarHBondContact O-N 2.97Å; M189-F217 HydrophobicContact CE-CB 3.88Å; M189-F217 HydrophobicContact CE-CD1 3.48Å; M189-F217 VanDerWaalsContact CE-CD1 3.48Å; M189-F217 HydrophobicContact CE-CE1 4.1Å; M189-F217 HydrophobicContact CE-CG 3.76Å
190	S	92.3	Very high	90.8	Very high	74 Å²	74	44.1 Å²	44.1	52%	0.517	26%	0.255	S	S	.	.	H	α-helix	trans	-66.5	-45.4	177.4	-58	0	0	0	0	110.9	G187 F188 K193 E194	G187-S190 PolarHBondContact O-N 2.99Å; F188-S190 VanDerWaalsContact C-N 3.34Å; F188-S190 PolarHBondContact O-N 3.34Å; S190-K193 PolarHBondContact O-N 3.46Å; S190-E194 PolarHBondContact O-N 3.21Å
191	R	92	Very high	90.2	Very high	40 Å²	40	50.1 Å²	50.1	15%	0.151	28%	0.281	C	S	.	.	H	α-helix	trans	-61.6	-49.6	176.4	176.1	61.7	-176.2	-70.9	-1.3	111.4	E141 F144 G187 F188 K193 E194 E195	E141-R191 IonicContact OE1-CZ 2.8Å; E141-R191 IonicContact OE1-NH1 2.8Å; E141-R191 IonicContact OE1-NH2 3.96Å; E141-R191 PolarHBondContact OE1-NH2 3.17Å; E141-R191 IonicContact OE2-CZ 2.88Å; E141-R191 IonicContact OE2-NH1 3.18Å; E141-R191 PolarHBondContact OE2-NH1 3.03Å; E141-R191 IonicContact OE2-NH2 2.78Å; E141-R191 PolarHBondContact OE2-NH2 3.08Å; F144-R191 HydrophobicContact CD1-CG 4.1Å; F144-R191 HydrophobicContact CD2-CG 4.1Å; F144-R191 HydrophobicContact CE1-CG 3.79Å; F144-R191 HydrophobicContact CE2-CG 3.78Å; F144-R191 HydrophobicContact CG-CG 4.25Å; F144-R191 HydrophobicContact CZ-CB 4.15Å; F144-R191 HydrophobicContact CZ-CG 3.62Å; G187-R191 PolarHBondContact O-N 2.89Å; F188-R191 PolarHBondContact O-N 3.06Å; R191-K193 PolarHBondContact O-N 3.35Å; R191-E194 PolarHBondContact O-N 3.42Å; R191-E194 VanDerWaalsContact O-N 3.13Å; R191-E195 HydrophobicContact CG-CG 4.27Å; R191-E195 IonicContact CZ-OE1 2.78Å; R191-E195 VanDerWaalsContact NE-CG 3.31Å; R191-E195 IonicContact NE-OE1 3.54Å; R191-E195 PolarHBondContact NE-OE1 2.86Å; R191-E195 IonicContact NH2-OE1 2.69Å; R191-E195 PolarHBondContact NH2-OE1 3.33Å; R191-E195 WeakPolarHBondContact O-CG 3.27Å; R191-E195 PolarHBondContact O-N 3.45Å
192	L	93.9	Very high	89.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-39.2	178.7	-178.9	61.8	0	0	0	111.8	F144 I153 P154 I157 V178 F188 L196 F217	F144-L192 HydrophobicContact CE1-CB 4.16Å; F144-L192 HydrophobicContact CE1-CD1 4.14Å; I153-L192 HydrophobicContact CG2-CD1 3.92Å; P154-L192 HydrophobicContact CG-CD1 4.04Å; I157-L192 HydrophobicContact CD1-CD1 3.97Å; I157-L192 HydrophobicContact CD1-CD2 4.27Å; V178-L192 HydrophobicContact CG2-CD2 3.9Å; F188-L192 HydrophobicContact CE1-CB 4.44Å; F188-L192 HydrophobicContact CE1-CD2 3.87Å; F188-L192 HydrophobicContact CZ-CD2 4.4Å; F188-L192 VanDerWaalsContact O-CB 3.31Å; F188-L192 WeakPolarHBondContact O-CB 3.39Å; F188-L192 PolarHBondContact O-N 3.16Å; L192-L196 HydrophobicContact CD1-CD1 4.15Å; L192-L196 HydrophobicContact CD1-CG 4.27Å; L192-L196 HydrophobicContact CG-CD1 4.05Å; L192-L196 WeakPolarHBondContact O-CB 3.41Å; L192-L196 VanDerWaalsContact O-CG 3.25Å; L192-L196 WeakPolarHBondContact O-CG 3.44Å; L192-L196 PolarHBondContact O-N 3.07Å; L192-F217 HydrophobicContact CD2-CE1 3.89Å; L192-F217 HydrophobicContact CD2-CZ 4.3Å; L192-F217 HydrophobicContact CG-CE1 4.28Å; L192-F217 HydrophobicContact CG-CZ 4.18Å
193	K	92.9	Very high	88.2	Confident	104 Å²	104	56.1 Å²	56.1	45%	0.452	31%	0.305	S	S	.	.	H	α-helix	trans	-65.4	-45.3	175.7	-176.6	174.7	-179.5	-172.9	0	112.3	M189 S190 R191 L197 F217	M189-K193 WeakPolarHBondContact O-CB 3.45Å; M189-K193 PolarHBondContact O-N 2.97Å; S190-K193 PolarHBondContact O-N 3.46Å; R191-K193 PolarHBondContact O-N 3.35Å; K193-L197 HydrophobicContact CG-CD1 4.17Å; K193-L197 VanDerWaalsContact O-CG 3.26Å; K193-L197 WeakPolarHBondContact O-CG 3.39Å; K193-L197 PolarHBondContact O-N 2.83Å; K193-L197 VanDerWaalsContact O-N 3.11Å; K193-F217 HydrophobicContact CB-CE2 3.65Å; K193-F217 HydrophobicContact CB-CZ 4.23Å; K193-F217 HydrophobicContact CD-CE2 4.27Å; K193-F217 HydrophobicContact CG-CE2 3.86Å
194	E	91.3	Very high	86.8	Confident	52 Å²	52	61.5 Å²	61.5	24%	0.243	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-50	178	-172.9	174	-174.3	0	0	110.8	R109 W110 S190 R191 L196 L197 E198	R109-E194 IonicContact CZ-OE1 3.77Å; R109-E194 IonicContact NE-OE1 3.08Å; R109-E194 PolarHBondContact NE-OE1 3.28Å; R109-E194 VanDerWaalsContact NE-OE1 3.08Å; R109-E194 IonicContact NH2-OE1 3.53Å; W110-E194 PolarHBondContact NE1-OE2 2.86Å; S190-E194 PolarHBondContact O-N 3.21Å; R191-E194 PolarHBondContact O-N 3.42Å; R191-E194 VanDerWaalsContact O-N 3.13Å; E194-L196 VanDerWaalsContact C-N 3.34Å; E194-L196 PolarHBondContact O-N 3.2Å; E194-L197 PolarHBondContact O-N 2.97Å; E194-L197 VanDerWaalsContact O-N 3.14Å; E194-E198 PolarHBondContact O-N 3.06Å
195	E	90.7	Very high	85.7	Confident	31 Å²	31	64.1 Å²	64.1	15%	0.145	35%	0.347	C	S	.	.	H	α-helix	trans	-61.8	-38.1	-179.7	-70	-67.4	166.7	0	0	113.2	F144 P154 R191 S199	F144-E195 HydrophobicContact CD1-CG 4Å; P154-E195 HydrophobicContact CB-CB 4.25Å; P154-E195 HydrophobicContact CG-CB 3.67Å; P154-E195 HydrophobicContact CG-CG 4.47Å; R191-E195 HydrophobicContact CG-CG 4.27Å; R191-E195 IonicContact CZ-OE1 2.78Å; R191-E195 VanDerWaalsContact NE-CG 3.31Å; R191-E195 IonicContact NE-OE1 3.54Å; R191-E195 PolarHBondContact NE-OE1 2.86Å; R191-E195 IonicContact NH2-OE1 2.69Å; R191-E195 PolarHBondContact NH2-OE1 3.33Å; R191-E195 WeakPolarHBondContact O-CG 3.27Å; R191-E195 PolarHBondContact O-N 3.45Å; E195-S199 WeakPolarHBondContact O-CB 3.37Å; E195-S199 PolarHBondContact O-N 3.29Å; E195-S199 PolarHBondContact O-OG 3.45Å
196	L	90.8	Very high	84.8	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-40.3	175.3	-79.3	171.3	0	0	0	112	P154 I157 L158 I176 L192 E194 S199 L200 F217	P154-L196 HydrophobicContact CB-CD2 3.9Å; P154-L196 HydrophobicContact CB-CG 4.21Å; I157-L196 HydrophobicContact CB-CD2 4.08Å; I157-L196 HydrophobicContact CD1-CD1 4Å; I157-L196 HydrophobicContact CD1-CD2 4.3Å; I157-L196 HydrophobicContact CG2-CD1 4.43Å; I157-L196 HydrophobicContact CG2-CD2 3.87Å; L158-L196 HydrophobicContact CD2-CD2 4.39Å; L158-L196 HydrophobicContact CG-CD2 4.21Å; I176-L196 HydrophobicContact CD1-CD1 4.09Å; L192-L196 HydrophobicContact CD1-CD1 4.15Å; L192-L196 HydrophobicContact CD1-CG 4.27Å; L192-L196 HydrophobicContact CG-CD1 4.05Å; L192-L196 WeakPolarHBondContact O-CB 3.41Å; L192-L196 VanDerWaalsContact O-CG 3.25Å; L192-L196 WeakPolarHBondContact O-CG 3.44Å; L192-L196 PolarHBondContact O-N 3.07Å; E194-L196 VanDerWaalsContact C-N 3.34Å; E194-L196 PolarHBondContact O-N 3.2Å; L196-S199 PolarHBondContact O-N 3.2Å; L196-L200 WeakPolarHBondContact O-CB 3.33Å; L196-L200 WeakPolarHBondContact O-CG 3.35Å; L196-L200 PolarHBondContact O-N 2.83Å; L196-F217 HydrophobicContact CD1-CE1 4.38Å; L196-F217 HydrophobicContact CD1-CZ 3.76Å
197	L	89.8	Confident	83.6	Confident	53 Å²	53	56.3 Å²	56.3	28%	0.277	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-44.1	177.2	-69.7	172.1	0	0	0	110.8	K193 E194 L200 E201	K193-L197 HydrophobicContact CG-CD1 4.17Å; K193-L197 VanDerWaalsContact O-CG 3.26Å; K193-L197 WeakPolarHBondContact O-CG 3.39Å; K193-L197 PolarHBondContact O-N 2.83Å; K193-L197 VanDerWaalsContact O-N 3.11Å; E194-L197 PolarHBondContact O-N 2.97Å; E194-L197 VanDerWaalsContact O-N 3.14Å; L197-L200 PolarHBondContact O-N 3.32Å; L197-E201 WeakPolarHBondContact O-CG 3.26Å; L197-E201 PolarHBondContact O-N 3.4Å
198	E	87.5	Confident	82.6	Confident	104 Å²	104	60.1 Å²	60.1	49%	0.486	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-44.2	175.2	-176.9	169.1	-177.1	0	0	111.8	E194 L200 E201 N202	E194-E198 PolarHBondContact O-N 3.06Å; E198-L200 VanDerWaalsContact C-N 3.31Å; E198-L200 PolarHBondContact O-N 3.03Å; E198-E201 PolarHBondContact O-N 3.09Å; E198-N202 PolarHBondContact O-N 3.14Å
199	S	85.7	Confident	81.7	Confident	17 Å²	17	65.7 Å²	65.7	12%	0.119	35%	0.345	C	S	.	.	H	α-helix	trans	-65	-32.8	177.5	-64.4	0	0	0	0	113	E195 L196	E195-S199 WeakPolarHBondContact O-CB 3.37Å; E195-S199 PolarHBondContact O-N 3.29Å; E195-S199 PolarHBondContact O-OG 3.45Å; L196-S199 PolarHBondContact O-N 3.2Å
200	L	84.2	Confident	81	Confident	4 Å²	4	63 Å²	63	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-74.3	-32.1	175.2	-76.1	170.1	0	0	0	112.6	L158 I173 L196 L197 E198 N202 L210	L158-L200 HydrophobicContact CD2-CD2 3.55Å; L158-L200 HydrophobicContact CD2-CG 4.01Å; I173-L200 HydrophobicContact CD1-CD1 4.5Å; I173-L200 HydrophobicContact CG1-CD1 4.45Å; L196-L200 WeakPolarHBondContact O-CB 3.33Å; L196-L200 WeakPolarHBondContact O-CG 3.35Å; L196-L200 PolarHBondContact O-N 2.83Å; L197-L200 PolarHBondContact O-N 3.32Å; E198-L200 VanDerWaalsContact C-N 3.31Å; E198-L200 PolarHBondContact O-N 3.03Å; L200-N202 VanDerWaalsContact C-N 3.32Å; L200-L210 HydrophobicContact CD2-CD1 4.1Å
201	E	81.5	Confident	80.2	Confident	136 Å²	136	64 Å²	64	64%	0.636	34%	0.339	S	S	*	.	H	α-helix	trans	-72.1	-27.7	173.8	-74.8	178.2	-172.8	0	0	112.1	L197 E198 V203	L197-E201 WeakPolarHBondContact O-CG 3.26Å; L197-E201 PolarHBondContact O-N 3.4Å; E198-E201 PolarHBondContact O-N 3.09Å; E201-V203 WeakPolarHBondContact O-CG2 3.25Å; E201-V203 PolarHBondContact O-N 3.29Å
202	N	78.6	Confident	79.5	Confident	84 Å²	84	63.4 Å²	63.4	45%	0.449	34%	0.338	S	S	.	.			trans	-70.2	89	176.4	-166.7	-4.7	0	0	0	112	E198 L200 T204	E198-N202 PolarHBondContact O-N 3.14Å; L200-N202 VanDerWaalsContact C-N 3.32Å; N202-T204 PolarHBondContact O-N 3.25Å; N202-T204 VanDerWaalsContact O-N 3.08Å; N202-T204 PolarHBondContact OD1-OG1 3.06Å
203	V	61.3	Low	78.7	Confident	85 Å²	85	69.4 Å²	69.4	52%	0.515	36%	0.36	S	S	.	.	I	π-helix	trans	-56.4	-28.6	-175.2	-179	0	0	0	0	113	E201 K205 G207	E201-V203 WeakPolarHBondContact O-CG2 3.25Å; E201-V203 PolarHBondContact O-N 3.29Å; V203-K205 PolarHBondContact O-N 3.47Å; V203-G207 PolarHBondContact O-N 3.28Å; V203-G207 VanDerWaalsContact O-N 3.11Å
204	T	63.1	Low	78.2	Confident	119 Å²	119	67.9 Å²	67.9	73%	0.73	36%	0.36	S	S	*	.	I	π-helix	trans	-62.3	-36.3	-168.7	53.3	0	0	0	0	114.8	N202	N202-T204 PolarHBondContact O-N 3.25Å; N202-T204 VanDerWaalsContact O-N 3.08Å; N202-T204 PolarHBondContact OD1-OG1 3.06Å
205	K	68.8	Low	78	Confident	139 Å²	139	65.8 Å²	65.8	60%	0.604	35%	0.352	S	S	*	.	I	π-helix	trans	-102.3	-40.7	179.9	-70.4	-173.6	177.9	-177.9	0	113.3	V203	V203-K205 PolarHBondContact O-N 3.47Å
206	Y	72.4	Confident	78.1	Confident	16 Å²	16	69.7 Å²	69.7	6%	0.063	37%	0.368	C	S	.	.	I	π-helix	trans	-116	-21.1	-166.8	-62.2	-58.1	0	0	0	114.5	L158 E159 I162 S208 K209 L210	L158-Y206 HydrophobicContact CB-CD1 4.35Å; L158-Y206 HydrophobicContact CB-CE1 4.03Å; L158-Y206 HydrophobicContact CB-CE2 4.38Å; L158-Y206 HydrophobicContact CD1-CD2 3.61Å; L158-Y206 HydrophobicContact CD1-CE2 3.62Å; L158-Y206 HydrophobicContact CD1-CG 4.14Å; E159-Y206 WeakPolarHBondContact OE1-CE1 3.31Å; E159-Y206 PolarHBondContact OE1-OH 3.46Å; I162-Y206 HydrophobicContact CD1-CD1 3.38Å; I162-Y206 HydrophobicContact CD1-CE1 3.57Å; Y206-S208 VanDerWaalsContact C-N 3.33Å; Y206-S208 PolarHBondContact O-N 3.09Å; Y206-K209 PolarHBondContact O-N 2.86Å; Y206-L210 PolarHBondContact O-N 3.09Å
207	G	64.9	Low	78.2	Confident	16 Å²	16	72 Å²	72	17%	0.165	38%	0.378	C	S	.	.	I	π-helix	trans	-61	-35.9	-170.1	0	0	0	0	0	114.6	V203 K209	V203-G207 PolarHBondContact O-N 3.28Å; V203-G207 VanDerWaalsContact O-N 3.11Å; G207-K209 VanDerWaalsContact C-N 3.33Å
208	S	67.8	Low	78.4	Confident	121 Å²	121	72.6 Å²	72.6	85%	0.846	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-23.9	177.9	-51.5	0	0	0	0	113.3	Y206	Y206-S208 VanDerWaalsContact C-N 3.33Å; Y206-S208 PolarHBondContact O-N 3.09Å
209	K	74.9	Confident	78.4	Confident	124 Å²	124	76.9 Å²	76.9	54%	0.539	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-25.4	-175.4	-66.8	-176.9	-178	177	0	113.2	I162 R169 Y206 G207	I162-K209 HydrophobicContact CD1-CD 4.44Å; I162-K209 HydrophobicContact CG2-CD 3.94Å; R169-K209 PolarHBondContact NH1-O 2.94Å; Y206-K209 PolarHBondContact O-N 2.86Å; G207-K209 VanDerWaalsContact C-N 3.33Å
210	L	77.5	Confident	78.2	Confident	4 Å²	4	76.9 Å²	76.9	2%	0.021	40%	0.397	C	S	.	.			trans	-125.1	113.1	-176.8	-61.5	177.2	0	0	0	110.1	L158 V161 I162 L200 Y206 F212 R213	L158-L210 HydrophobicContact CD2-CD1 3.93Å; V161-L210 HydrophobicContact CG1-CD2 3.88Å; I162-L210 HydrophobicContact CD1-CD1 4.2Å; I162-L210 HydrophobicContact CD1-CG 4.48Å; I162-L210 HydrophobicContact CG1-CD1 4.01Å; I162-L210 HydrophobicContact CG1-CD2 4.02Å; I162-L210 HydrophobicContact CG1-CG 4.01Å; L200-L210 HydrophobicContact CD2-CD1 4.1Å; Y206-L210 PolarHBondContact O-N 3.09Å; L210-F212 VanDerWaalsContact C-N 3.33Å; L210-R213 PolarHBondContact O-NH1 2.97Å
211	S	74.4	Confident	78.1	Confident	95 Å²	95	86.8 Å²	86.8	66%	0.664	43%	0.434	S	S	*	.			trans	-85.6	-3.4	179.3	55.1	0	0	0	0	113.9
212	F	77.6	Confident	78.2	Confident	28 Å²	28	82.8 Å²	82.8	12%	0.123	42%	0.419	C	S	.	.			trans	-88.4	150.8	-174.5	-39.2	-65.1	0	0	0	111.5	R169 R170 I173 L210	R169-F212 HydrophobicContact CB-CE2 3.82Å; R169-F212 HydrophobicContact CB-CZ 4.39Å; R170-F212 HydrophobicContact CB-CD1 4.23Å; R170-F212 HydrophobicContact CB-CE1 3.63Å; R170-F212 HydrophobicContact CB-CE2 4.31Å; R170-F212 HydrophobicContact CB-CZ 3.66Å; R170-F212 HydrophobicContact CG-CD1 4.15Å; R170-F212 HydrophobicContact CG-CE1 3.94Å; R170-F212 HydrophobicContact CG-CZ 4.45Å; R170-F212 VanDerWaalsContact NE-CE1 3.29Å; I173-F212 HydrophobicContact CG2-CB 4.14Å; I173-F212 HydrophobicContact CG2-CD2 4.08Å; I173-F212 HydrophobicContact CG2-CG 4.18Å; L210-F212 VanDerWaalsContact C-N 3.33Å
213	R	76.5	Confident	78.8	Confident	125 Å²	125	85.6 Å²	85.6	47%	0.472	43%	0.427	S	S	.	.			trans	-126.9	11.1	178.3	-63.6	-67.4	-176.6	-85.4	-1.8	112.8	L210	L210-R213 PolarHBondContact O-NH1 2.97Å
214	T	83.5	Confident	80.2	Confident	72 Å²	72	84.4 Å²	84.4	44%	0.442	42%	0.416	S	S	.	.			trans	-129.1	132.9	-175.6	57.9	0	0	0	0	109.7
215	A	86.8	Confident	81.6	Confident	9 Å²	9	83 Å²	83	7%	0.074	40%	0.404	C	S	.	.			trans	-119.3	129.7	168.7	0	0	0	0	0	109	I173 I176	I173-A215 HydrophobicContact CG1-CB 4.38Å; I173-A215 WeakPolarHBondContact O-CA 3.25Å; I176-A215 HydrophobicContact CD1-CB 4.38Å
216	K	92.1	Very high	82.8	Confident	112 Å²	112	78.2 Å²	78.2	49%	0.487	39%	0.388	S	S	.	.			trans	-120.3	143.9	177.4	-66.9	172.8	-172.5	159	0	109.2	I173 E174 I176	I173-K216 PolarHBondContact O-N 3.24Å; E174-K216 HydrophobicContact CB-CD 4.28Å; E174-K216 HydrophobicContact CG-CD 4.47Å; E174-K216 VanDerWaalsContact O-CB 3.29Å; E174-K216 WeakPolarHBondContact O-CB 3.49Å; E174-K216 IonicContact OE2-NZ 3.29Å; E174-K216 PolarHBondContact OE2-NZ 2.88Å; I176-K216 PolarHBondContact N-O 2.83Å; I176-K216 VanDerWaalsContact N-O 3.09Å
217	F	93.6	Very high	83.8	Confident	48 Å²	48	77.5 Å²	77.5	21%	0.211	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-116.3	135.6	-178.9	-64.8	-90.6	0	0	0	109.9	I176 V178 M189 L192 K193 L196	I176-F217 HydrophobicContact CB-CD1 3.86Å; I176-F217 HydrophobicContact CB-CE1 4.1Å; I176-F217 HydrophobicContact CD1-CE1 4.3Å; I176-F217 HydrophobicContact CD1-CZ 4.5Å; I176-F217 HydrophobicContact CG2-CD1 3.85Å; I176-F217 HydrophobicContact CG2-CE1 3.81Å; I176-F217 CarbonylContact O-C 3.5Å; I176-F217 VanDerWaalsContact O-CA 3.3Å; I176-F217 WeakPolarHBondContact O-CA 3.41Å; V178-F217 HydrophobicContact CG2-CD1 3.8Å; V178-F217 HydrophobicContact CG2-CE1 3.86Å; M189-F217 HydrophobicContact CE-CB 3.88Å; M189-F217 HydrophobicContact CE-CD1 3.48Å; M189-F217 VanDerWaalsContact CE-CD1 3.48Å; M189-F217 HydrophobicContact CE-CE1 4.1Å; M189-F217 HydrophobicContact CE-CG 3.76Å; L192-F217 HydrophobicContact CD2-CE1 3.89Å; L192-F217 HydrophobicContact CD2-CZ 4.3Å; L192-F217 HydrophobicContact CG-CE1 4.28Å; L192-F217 HydrophobicContact CG-CZ 4.18Å; K193-F217 HydrophobicContact CB-CE2 3.65Å; K193-F217 HydrophobicContact CB-CZ 4.23Å; K193-F217 HydrophobicContact CD-CE2 4.27Å; K193-F217 HydrophobicContact CG-CE2 3.86Å; L196-F217 HydrophobicContact CD1-CE1 4.38Å; L196-F217 HydrophobicContact CD1-CZ 3.76Å
218	F	93.1	Very high	85.1	Confident	67 Å²	67	77.7 Å²	77.7	29%	0.294	39%	0.385	S	S	.	.			trans	-69.3	132.7	167.4	-70.5	-67.5	0	0	0	109.6	L45 L47 A50 G175 I176 L177 A220	L45-F218 HydrophobicContact CD1-CB 4.15Å; L47-F218 HydrophobicContact CD1-CB 4.28Å; L47-F218 HydrophobicContact CD1-CD1 3.94Å; L47-F218 HydrophobicContact CD1-CD2 3.57Å; L47-F218 HydrophobicContact CD1-CE1 4.13Å; L47-F218 HydrophobicContact CD1-CE2 3.73Å; L47-F218 HydrophobicContact CD1-CG 3.66Å; L47-F218 HydrophobicContact CD1-CZ 4.02Å; L47-F218 HydrophobicContact CD2-CD1 4Å; L47-F218 HydrophobicContact CD2-CE1 3.52Å; L47-F218 HydrophobicContact CD2-CE2 4.21Å; L47-F218 HydrophobicContact CD2-CZ 3.64Å; L47-F218 HydrophobicContact CG-CE1 4.49Å; L47-F218 HydrophobicContact CG-CZ 4.45Å; A50-F218 HydrophobicContact CB-CD2 4.23Å; A50-F218 HydrophobicContact CB-CE2 3.8Å; G175-F218 VanDerWaalsContact O-CE2 3.31Å; G175-F218 WeakPolarHBondContact O-CE2 3.44Å; I176-F218 PolarHBondContact O-N 2.81Å; L177-F218 HydrophobicContact CB-CD2 4.19Å; L177-F218 HydrophobicContact CD1-CB 4.05Å; F218-A220 PolarHBondContact O-N 3.13Å
219	K	88.2	Confident	86.3	Confident	193 Å²	193	80.8 Å²	80.8	84%	0.839	38%	0.378	S	S	*	.			trans	-81.7	115.9	172.7	-173.3	175.7	179.7	178.7	0	108.7	R221	K219-R221 PolarHBondContact O-N 3.24Å
220	A	81.9	Confident	87.2	Confident	18 Å²	18	77.2 Å²	77.2	15%	0.149	37%	0.365	C	S	.	.			trans	-61	135.6	173.1	0	0	0	0	0	110.1	F218 T222 E224 M227	F218-A220 PolarHBondContact O-N 3.13Å; A220-T222 VanDerWaalsContact C-N 3.33Å; A220-T222 VanDerWaalsContact CB-O 3.28Å; A220-T222 WeakPolarHBondContact CB-O 3.26Å; A220-E224 HydrophobicContact CB-CG 4.12Å; A220-M227 HydrophobicContact CB-SD 4.15Å
221	R	81	Confident	88	Confident	212 Å²	212	77 Å²	77	80%	0.8	36%	0.364	S	S	*	.	S	Bend	trans	-80.7	-20.1	173.9	-71.3	-179.4	-175.8	-160.7	2.9	112	L45 K219	L45-R221 HydrophobicContact CD2-CB 4.19Å; L45-R221 HydrophobicContact CD2-CG 3.69Å; K219-R221 PolarHBondContact O-N 3.24Å
222	T	85.4	Confident	88.9	Confident	52 Å²	52	72.9 Å²	72.9	32%	0.319	34%	0.336	S	S	.	.	S	Bend	trans	-125.7	175.7	178.9	60.2	0	0	0	0	109.9	A220 E224 M227 L230	A220-T222 VanDerWaalsContact C-N 3.33Å; A220-T222 VanDerWaalsContact CB-O 3.28Å; A220-T222 WeakPolarHBondContact CB-O 3.26Å; T222-E224 PolarHBondContact O-N 2.92Å; T222-M227 PolarHBondContact OG1-SD 3.41Å; T222-L230 HydrophobicContact CG2-CD2 3.76Å
223	K	90.4	Very high	89.6	Confident	142 Å²	142	74.3 Å²	74.3	62%	0.617	35%	0.349	S	S	*	.			trans	-58.2	137.8	173.4	-60.3	-177.2	179.1	179.5	0	110.1	M184 N225 C226	M184-K223 HydrophobicContact CE-CD 4.47Å; K223-N225 VanDerWaalsContact CB-OD1 3.25Å; K223-N225 WeakPolarHBondContact CB-OD1 3.47Å; K223-N225 PolarHBondContact O-N 3.34Å; K223-C226 PolarHBondContact O-N 3.18Å; K223-C226 VanDerWaalsContact O-N 3.09Å; K223-C226 PolarHBondContact O-SG 2.96Å
224	E	91.4	Very high	90.4	Very high	61 Å²	61	71.1 Å²	71.1	29%	0.285	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-64.1	-28.5	-172.2	-66.4	78.5	-177.3	0	0	112	G180 C183 A220 T222	G180-E224 PolarHBondContact N-O 3.16Å; G180-E224 VanDerWaalsContact N-O 3.16Å; C183-E224 WeakPolarHBondContact SG-CB 3.13Å; A220-E224 HydrophobicContact CB-CG 4.12Å; T222-E224 PolarHBondContact O-N 2.92Å
225	N	92	Very high	90.8	Very high	88 Å²	88	67.8 Å²	67.8	47%	0.471	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-76.4	-15.9	177.5	70.6	-27	0	0	0	114.6	G180 M184 K223	G180-N225 WeakPolarHBondContact O-CA 3.35Å; G180-N225 PolarHBondContact O-N 3.35Å; M184-N225 HydrophobicContact SD-CB 3.6Å; K223-N225 VanDerWaalsContact CB-OD1 3.25Å; K223-N225 WeakPolarHBondContact CB-OD1 3.47Å; K223-N225 PolarHBondContact O-N 3.34Å
226	C	93.1	Very high	91	Very high	40 Å²	40	69.1 Å²	69.1	27%	0.27	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-106.4	-2.1	-179.7	71.2	0	0	0	0	113.8	K223 A228 W229 L230	K223-C226 PolarHBondContact O-N 3.18Å; K223-C226 VanDerWaalsContact O-N 3.09Å; K223-C226 PolarHBondContact O-SG 2.96Å; C226-A228 PolarHBondContact O-N 3.06Å; C226-W229 PolarHBondContact O-N 3.24Å; C226-L230 WeakPolarHBondContact O-CB 3.49Å; C226-L230 PolarHBondContact O-N 3.16Å
227	M	93.5	Very high	90.9	Very high	1 Å²	1	68.3 Å²	68.3	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-55.4	-48.8	-177.5	-74.3	-69.8	-72.9	0	0	112.6	S41 P44 L45 L177 V179 A220 T222 W229 L230 G231	S41-M227 VanDerWaalsContact O-CE 3.22Å; S41-M227 WeakPolarHBondContact O-CE 3.4Å; P44-M227 HydrophobicContact CB-CE 4.26Å; P44-M227 HydrophobicContact CB-SD 4.34Å; P44-M227 HydrophobicContact CG-CE 4.38Å; P44-M227 WeakPolarHBondContact CG-O 3.36Å; P44-M227 HydrophobicContact CG-SD 4.45Å; L45-M227 HydrophobicContact CD1-CE 3.72Å; L45-M227 HydrophobicContact CG-CE 3.73Å; L177-M227 HydrophobicContact CD1-CE 4.26Å; V179-M227 HydrophobicContact CG1-CB 3.9Å; V179-M227 HydrophobicContact CG1-CG 4.03Å; A220-M227 HydrophobicContact CB-SD 4.15Å; T222-M227 PolarHBondContact OG1-SD 3.41Å; M227-W229 PolarHBondContact O-N 2.97Å; M227-L230 PolarHBondContact O-N 2.95Å; M227-G231 PolarHBondContact O-N 2.99Å
228	A	93.1	Very high	90.7	Very high	19 Å²	19	69.6 Å²	69.6	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-58.9	-46.8	177.6	0	0	0	0	0	113.3	V13 N37 C40 C226 G231 G232	V13-A228 HydrophobicContact CG1-CB 4.37Å; N37-A228 WeakPolarHBondContact OD1-CB 3.47Å; C40-A228 WeakPolarHBondContact CB-O 3.38Å; C226-A228 PolarHBondContact O-N 3.06Å; A228-G231 PolarHBondContact O-N 3.14Å; A228-G232 PolarHBondContact O-N 3.46Å
229	W	93.3	Very high	90.4	Very high	186 Å²	186	74.8 Å²	74.8	71%	0.705	38%	0.378	S	S	*	.	H	α-helix	trans	-64.8	-43	179.4	178.4	84.8	0	0	0	111.4	C226 M227 G231 G232 S233	C226-W229 PolarHBondContact O-N 3.24Å; M227-W229 PolarHBondContact O-N 2.97Å; W229-G231 VanDerWaalsContact C-N 3.31Å; W229-G231 PolarHBondContact O-N 2.84Å; W229-G232 PolarHBondContact O-N 3.14Å; W229-S233 PolarHBondContact O-N 2.96Å
230	L	93.9	Very high	90	Very high	50 Å²	50	66.9 Å²	66.9	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-41.7	175.3	-178.4	59.1	0	0	0	111.1	P44 T222 C226 M227 S233 I234	P44-L230 HydrophobicContact CB-CD2 3.71Å; P44-L230 HydrophobicContact CB-CG 4.15Å; P44-L230 HydrophobicContact CG-CB 3.97Å; P44-L230 HydrophobicContact CG-CD2 3.87Å; P44-L230 HydrophobicContact CG-CG 3.82Å; T222-L230 HydrophobicContact CG2-CD2 3.76Å; C226-L230 WeakPolarHBondContact O-CB 3.49Å; C226-L230 PolarHBondContact O-N 3.16Å; M227-L230 PolarHBondContact O-N 2.95Å; L230-S233 WeakPolarHBondContact O-CB 3.43Å; L230-S233 PolarHBondContact O-N 3.43Å; L230-I234 HydrophobicContact CG-CD1 4.42Å; L230-I234 WeakPolarHBondContact O-CG1 3.27Å; L230-I234 PolarHBondContact O-N 3.07Å
231	G	93.6	Very high	90.1	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58	-46.9	171.8	0	0	0	0	0	113.4	C40 M227 A228 W229 S233 I234 I235	C40-G231 WeakPolarHBondContact O-CA 3.24Å; M227-G231 PolarHBondContact O-N 2.99Å; A228-G231 PolarHBondContact O-N 3.14Å; W229-G231 VanDerWaalsContact C-N 3.31Å; W229-G231 PolarHBondContact O-N 2.84Å; G231-S233 VanDerWaalsContact C-N 3.28Å; G231-S233 PolarHBondContact O-N 3.02Å; G231-I234 WeakPolarHBondContact O-CB 3.33Å; G231-I234 PolarHBondContact O-N 3.35Å; G231-I234 VanDerWaalsContact O-N 3.12Å; G231-I235 WeakPolarHBondContact O-CG1 3.43Å; G231-I235 PolarHBondContact O-N 3.3Å
232	G	92.2	Very high	90.2	Very high	8 Å²	8	59.5 Å²	59.5	8%	0.082	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-38.3	174.3	0	0	0	0	0	113	A228 W229 I235 G236	A228-G232 PolarHBondContact O-N 3.46Å; W229-G232 PolarHBondContact O-N 3.14Å; G232-I235 PolarHBondContact O-N 3.13Å; G232-G236 PolarHBondContact O-N 3.14Å
233	S	94	Very high	90.1	Very high	57 Å²	57	66.4 Å²	66.4	40%	0.399	34%	0.343	S	S	.	.	H	α-helix	trans	-66.1	-37.4	174.5	-172.5	0	0	0	0	112.5	W229 L230 G231 G236 S237	W229-S233 PolarHBondContact O-N 2.96Å; L230-S233 WeakPolarHBondContact O-CB 3.43Å; L230-S233 PolarHBondContact O-N 3.43Å; G231-S233 VanDerWaalsContact C-N 3.28Å; G231-S233 PolarHBondContact O-N 3.02Å; S233-G236 PolarHBondContact O-N 2.88Å; S233-S237 PolarHBondContact O-N 3.11Å; S233-S237 PolarHBondContact O-OG 2.96Å
234	I	93.4	Very high	89.7	Confident	58 Å²	58	62.4 Å²	62.4	30%	0.297	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-51.9	174.2	-68.1	164.5	0	0	0	109	L43 P44 L230 G231 G236 S237 L238	L43-I234 HydrophobicContact CB-CD1 4.33Å; P44-I234 HydrophobicContact CB-CD1 4.44Å; P44-I234 HydrophobicContact CG-CD1 4.23Å; L230-I234 HydrophobicContact CG-CD1 4.42Å; L230-I234 WeakPolarHBondContact O-CG1 3.27Å; L230-I234 PolarHBondContact O-N 3.07Å; G231-I234 WeakPolarHBondContact O-CB 3.33Å; G231-I234 PolarHBondContact O-N 3.35Å; G231-I234 VanDerWaalsContact O-N 3.12Å; I234-G236 VanDerWaalsContact C-N 3.27Å; I234-G236 PolarHBondContact O-N 3.26Å; I234-S237 WeakPolarHBondContact O-CA 3.25Å; I234-S237 WeakPolarHBondContact O-CB 3.26Å; I234-S237 PolarHBondContact O-N 2.93Å; I234-L238 WeakPolarHBondContact O-CG 3.33Å; I234-L238 PolarHBondContact O-N 3.28Å
235	I	90.7	Very high	89.5	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-55.6	-43.4	177.4	-63.4	172	0	0	0	111.2	V11 M33 A35 C40 L43 G231 G232 S237 L238	V11-I235 HydrophobicContact CG1-CB 4.34Å; V11-I235 HydrophobicContact CG1-CG2 4.11Å; V11-I235 HydrophobicContact CG2-CB 4.49Å; V11-I235 HydrophobicContact CG2-CG2 3.96Å; M33-I235 HydrophobicContact CE-CG2 3.8Å; M33-I235 HydrophobicContact SD-CG2 3.72Å; A35-I235 HydrophobicContact CB-CD1 3.87Å; C40-I235 VanDerWaalsContact SG-CD1 3.56Å; L43-I235 HydrophobicContact CD1-CD1 3.59Å; L43-I235 HydrophobicContact CD1-CG1 3.27Å; G231-I235 WeakPolarHBondContact O-CG1 3.43Å; G231-I235 PolarHBondContact O-N 3.3Å; G232-I235 PolarHBondContact O-N 3.13Å; I235-S237 PolarHBondContact O-N 3.36Å; I235-S237 VanDerWaalsContact O-N 3.14Å; I235-L238 WeakPolarHBondContact O-CB 3.19Å; I235-L238 PolarHBondContact O-N 3.39Å
236	G	90.3	Very high	89.2	Confident	37 Å²	37	56.6 Å²	56.6	38%	0.381	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-21	178.4	0	0	0	0	0	114	G232 S233 I234	G232-G236 PolarHBondContact O-N 3.14Å; S233-G236 PolarHBondContact O-N 2.88Å; I234-G236 VanDerWaalsContact C-N 3.27Å; I234-G236 PolarHBondContact O-N 3.26Å
237	S	90.8	Very high	88.9	Confident	96 Å²	96	56.1 Å²	56.1	67%	0.671	29%	0.292	S	S	*	.	H	α-helix	trans	-96.3	-9.1	177.8	-51.3	0	0	0	0	113.1	S233 I234 I235	S233-S237 PolarHBondContact O-N 3.11Å; S233-S237 PolarHBondContact O-OG 2.96Å; I234-S237 WeakPolarHBondContact O-CA 3.25Å; I234-S237 WeakPolarHBondContact O-CB 3.26Å; I234-S237 PolarHBondContact O-N 2.93Å; I235-S237 PolarHBondContact O-N 3.36Å; I235-S237 VanDerWaalsContact O-N 3.14Å
238	L	89.5	Confident	88.5	Confident	74 Å²	74	60.4 Å²	60.4	39%	0.387	31%	0.308	S	S	.	.	S	Bend	trans	-80.1	142.7	179.5	-65	179	0	0	0	111.3	I234 I235 I240 L241	I234-L238 WeakPolarHBondContact O-CG 3.33Å; I234-L238 PolarHBondContact O-N 3.28Å; I235-L238 WeakPolarHBondContact O-CB 3.19Å; I235-L238 PolarHBondContact O-N 3.39Å; L238-I240 HydrophobicContact CB-CG2 3.58Å; L238-I240 HydrophobicContact CD1-CG2 4.07Å; L238-I240 HydrophobicContact CG-CG2 4.49Å; L238-I240 PolarHBondContact O-N 3.47Å; L238-I240 VanDerWaalsContact O-N 3.15Å; L238-L241 WeakPolarHBondContact O-CB 3.36Å; L238-L241 PolarHBondContact O-N 2.92Å
239	E	86.1	Confident	88.2	Confident	176 Å²	176	64.3 Å²	64.3	82%	0.822	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.4	176.6	-62.9	-177.6	172.7	0	0	113.6	L241 P242	E239-L241 PolarHBondContact O-N 3.38Å; E239-P242 WeakPolarHBondContact O-CD 3.35Å
240	I	81.2	Confident	87.8	Confident	27 Å²	27	59.5 Å²	59.5	14%	0.138	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.2	173.4	-168.3	174.7	0	0	0	112.8	L238 P242 Y243 R244 V268	L238-I240 HydrophobicContact CB-CG2 3.58Å; L238-I240 HydrophobicContact CD1-CG2 4.07Å; L238-I240 HydrophobicContact CG-CG2 4.49Å; L238-I240 PolarHBondContact O-N 3.47Å; L238-I240 VanDerWaalsContact O-N 3.15Å; I240-P242 VanDerWaalsContact C-CD 3.47Å; I240-Y243 PolarHBondContact O-N 3.4Å; I240-R244 HydrophobicContact CD1-CG 4.02Å; I240-R244 HydrophobicContact CG1-CG 3.74Å; I240-R244 PolarHBondContact O-N 2.75Å; I240-V268 HydrophobicContact CD1-CB 4.3Å; I240-V268 HydrophobicContact CD1-CG2 3.36Å; I240-V268 HydrophobicContact CG1-CG2 3.91Å
241	L	83.2	Confident	87.5	Confident	18 Å²	18	57.9 Å²	57.9	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-52.8	-44.6	-172	-179.6	64.3	0	0	0	113.5	R9 V11 M33 L238 E239 Y243 R244 S245	R9-L241 HydrophobicContact CB-CD2 3.97Å; R9-L241 HydrophobicContact CB-CG 4.18Å; V11-L241 HydrophobicContact CG2-CD1 3.47Å; V11-L241 VanDerWaalsContact CG2-CD1 3.47Å; V11-L241 HydrophobicContact CG2-CD2 4.34Å; M33-L241 HydrophobicContact CB-CD1 3.73Å; M33-L241 HydrophobicContact CG-CD1 4.32Å; M33-L241 HydrophobicContact SD-CD1 3.62Å; L238-L241 WeakPolarHBondContact O-CB 3.36Å; L238-L241 PolarHBondContact O-N 2.92Å; E239-L241 PolarHBondContact O-N 3.38Å; L241-Y243 VanDerWaalsContact C-N 3.29Å; L241-Y243 PolarHBondContact O-N 3.05Å; L241-R244 PolarHBondContact O-N 3.44Å; L241-S245 WeakPolarHBondContact O-CB 3.22Å; L241-S245 PolarHBondContact O-N 3.34Å; L241-S245 PolarHBondContact O-OG 2.88Å; L241-S245 VanDerWaalsContact O-OG 3.12Å
242	P	82.4	Confident	87.2	Confident	58 Å²	58	63.4 Å²	63.4	38%	0.377	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-31.7	178.1	-23.3	37.3	0	0	0	114.7	E239 I240 S245	E239-P242 WeakPolarHBondContact O-CD 3.35Å; I240-P242 VanDerWaalsContact C-CD 3.47Å; P242-S245 PolarHBondContact O-OG 2.81Å
243	Y	83.5	Confident	87	Confident	196 Å²	196	71.5 Å²	71.5	77%	0.769	37%	0.365	S	S	*	.	H	α-helix	trans	-80	-24.1	-178.7	-59.2	-82.9	0	0	0	112.7	I240 L241	I240-Y243 PolarHBondContact O-N 3.4Å; L241-Y243 VanDerWaalsContact C-N 3.29Å; L241-Y243 PolarHBondContact O-N 3.05Å
244	R	82.8	Confident	86.6	Confident	59 Å²	59	73.1 Å²	73.1	22%	0.223	37%	0.369	C	S	.	.	H	α-helix	trans	-104.5	-19.8	-179.2	-68.3	-71	178.4	161.3	-0.6	113.6	M33 I240 L241 D262 S264	M33-R244 HydrophobicContact CE-CB 3.84Å; M33-R244 HydrophobicContact CE-CG 4.33Å; M33-R244 HydrophobicContact CG-CB 4.26Å; M33-R244 HydrophobicContact SD-CB 3.71Å; I240-R244 HydrophobicContact CD1-CG 4.02Å; I240-R244 HydrophobicContact CG1-CG 3.74Å; I240-R244 PolarHBondContact O-N 2.75Å; L241-R244 PolarHBondContact O-N 3.44Å; R244-D262 PolarHBondContact NH1-O 3.08Å; R244-S264 PolarHBondContact NH1-O 3Å; R244-S264 PolarHBondContact NH2-O 2.96Å
245	S	86.6	Confident	86.2	Confident	8 Å²	8	72.6 Å²	72.6	6%	0.056	38%	0.378	C	S	.	.	S	Bend	trans	-72.7	136.3	175	67.3	0	0	0	0	110.5	R9 V32 L241 P242	R9-S245 WeakPolarHBondContact CD-OG 3.09Å; R9-S245 PolarHBondContact NE-OG 2.94Å; V32-S245 WeakPolarHBondContact O-CA 3.22Å; L241-S245 WeakPolarHBondContact O-CB 3.22Å; L241-S245 PolarHBondContact O-N 3.34Å; L241-S245 PolarHBondContact O-OG 2.88Å; L241-S245 VanDerWaalsContact O-OG 3.12Å; P242-S245 PolarHBondContact O-OG 2.81Å
246	I	87	Confident	85.8	Confident	18 Å²	18	82.5 Å²	82.5	9%	0.092	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-88.5	121.6	169	-61.5	166	0	0	0	107	S31 V32 E250 I257	S31-I246 CarbonylContact C-O 3.58Å; S31-I246 WeakPolarHBondContact CA-O 3.22Å; V32-I246 PolarHBondContact N-O 2.9Å; V32-I246 PolarHBondContact O-N 2.8Å; I246-E250 HydrophobicContact CG2-CB 4.45Å; I246-E250 HydrophobicContact CG2-CG 4.4Å; I246-I257 HydrophobicContact CD1-CB 4.45Å; I246-I257 HydrophobicContact CD1-CG2 3.99Å
247	S	86.8	Confident	85.5	Confident	30 Å²	30	82.3 Å²	82.3	21%	0.21	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-72.2	149.9	173.4	68.2	0	0	0	0	110.5	T249 E250 Y251	S247-T249 PolarHBondContact O-N 3.03Å; S247-T249 PolarHBondContact OG-OG1 3.49Å; S247-T249 VanDerWaalsContact OG-OG1 3.12Å; S247-E250 PolarHBondContact N-OE2 2.72Å; S247-E250 WeakPolarHBondContact O-CB 3.41Å; S247-E250 PolarHBondContact O-N 3.34Å; S247-E250 VanDerWaalsContact O-N 3.08Å; S247-E250 WeakPolarHBondContact OG-CB 3.43Å; S247-E250 PolarHBondContact OG-N 2.78Å; S247-E250 VanDerWaalsContact OG-N 3.17Å; S247-Y251 PolarHBondContact O-N 2.94Å
248	R	84.7	Confident	85	Confident	91 Å²	91	80.4 Å²	80.4	34%	0.343	39%	0.39	S	S	.	.	H	α-helix	trans	-54.4	-43.6	175.6	176	-176.3	162.4	164.8	2	112	K28 S31 E250 Y251 E252	K28-R248 WeakPolarHBondContact O-CD 3.41Å; K28-R248 PolarHBondContact O-NE 2.69Å; S31-R248 PolarHBondContact OG-N 2.93Å; R248-E250 VanDerWaalsContact C-N 3.29Å; R248-E250 PolarHBondContact O-N 3.49Å; R248-Y251 PolarHBondContact O-N 2.88Å; R248-E252 HydrophobicContact CG-CG 4.49Å; R248-E252 IonicContact CZ-OE1 2.72Å; R248-E252 VanDerWaalsContact CZ-OE1 3.29Å; R248-E252 IonicContact NE-OE1 3.6Å; R248-E252 PolarHBondContact NE-OE1 2.67Å; R248-E252 IonicContact NH2-OE1 3.52Å; R248-E252 PolarHBondContact NH2-OE1 2.73Å; R248-E252 WeakPolarHBondContact O-CG 3.22Å; R248-E252 PolarHBondContact O-N 3.47Å
249	T	86.2	Confident	84.5	Confident	101 Å²	101	80.6 Å²	80.6	62%	0.62	39%	0.391	S	S	*	.	H	α-helix	trans	-62.9	-35.9	178.9	45.4	0	0	0	0	112.5	S247 K253	S247-T249 PolarHBondContact O-N 3.03Å; S247-T249 PolarHBondContact OG-OG1 3.49Å; S247-T249 VanDerWaalsContact OG-OG1 3.12Å; T249-K253 PolarHBondContact O-N 2.99Å
250	E	85.9	Confident	84.2	Confident	85 Å²	85	73.1 Å²	73.1	40%	0.397	36%	0.356	S	S	.	.	H	α-helix	trans	-71	-40.4	175.2	179.4	179	-168.1	0	0	111.6	I246 S247 R248 K253 N254	I246-E250 HydrophobicContact CG2-CB 4.45Å; I246-E250 HydrophobicContact CG2-CG 4.4Å; S247-E250 PolarHBondContact N-OE2 2.72Å; S247-E250 WeakPolarHBondContact O-CB 3.41Å; S247-E250 PolarHBondContact O-N 3.34Å; S247-E250 VanDerWaalsContact O-N 3.08Å; S247-E250 WeakPolarHBondContact OG-CB 3.43Å; S247-E250 PolarHBondContact OG-N 2.78Å; S247-E250 VanDerWaalsContact OG-N 3.17Å; R248-E250 VanDerWaalsContact C-N 3.29Å; R248-E250 PolarHBondContact O-N 3.49Å; E250-K253 PolarHBondContact O-N 3.35Å; E250-N254 WeakPolarHBondContact O-CB 3.43Å; E250-N254 PolarHBondContact O-N 2.91Å
251	Y	86.2	Confident	83.7	Confident	17 Å²	17	75.8 Å²	75.8	7%	0.067	37%	0.373	C	S	.	.	H	α-helix	trans	-65.4	-41.4	174.8	-176.7	-97.5	0	0	0	112.3	S24 A27 K28 S247 R248 K253 N254 G255 I257	S24-Y251 VanDerWaalsContact CB-OH 3.27Å; S24-Y251 WeakPolarHBondContact CB-OH 3.24Å; S24-Y251 PolarHBondContact OG-OH 2.77Å; A27-Y251 HydrophobicContact CB-CD1 3.98Å; A27-Y251 HydrophobicContact CB-CD2 3.76Å; A27-Y251 HydrophobicContact CB-CE1 4.28Å; A27-Y251 HydrophobicContact CB-CE2 4.06Å; A27-Y251 HydrophobicContact CB-CG 3.7Å; K28-Y251 HydrophobicContact CD-CE1 4.37Å; K28-Y251 HydrophobicContact CG-CD1 3.96Å; K28-Y251 HydrophobicContact CG-CE1 3.46Å; K28-Y251 VanDerWaalsContact CG-CE1 3.46Å; S247-Y251 PolarHBondContact O-N 2.94Å; R248-Y251 PolarHBondContact O-N 2.88Å; Y251-K253 PolarHBondContact O-N 3.48Å; Y251-N254 PolarHBondContact O-N 3.08Å; Y251-G255 VanDerWaalsContact O-CA 3.28Å; Y251-G255 WeakPolarHBondContact O-CA 3.42Å; Y251-G255 PolarHBondContact O-N 3.07Å; Y251-I257 HydrophobicContact CD2-CG1 3.95Å; Y251-I257 HydrophobicContact CE2-CD1 4.03Å; Y251-I257 HydrophobicContact CE2-CG1 3.55Å
252	E	87.4	Confident	83	Confident	116 Å²	116	80 Å²	80	54%	0.542	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-31.7	174.9	-76.2	175.4	177.4	0	0	112.2	R248	R248-E252 HydrophobicContact CG-CG 4.49Å; R248-E252 IonicContact CZ-OE1 2.72Å; R248-E252 VanDerWaalsContact CZ-OE1 3.29Å; R248-E252 IonicContact NE-OE1 3.6Å; R248-E252 PolarHBondContact NE-OE1 2.67Å; R248-E252 IonicContact NH2-OE1 3.52Å; R248-E252 PolarHBondContact NH2-OE1 2.73Å; R248-E252 WeakPolarHBondContact O-CG 3.22Å; R248-E252 PolarHBondContact O-N 3.47Å
253	K	88.7	Confident	81.8	Confident	178 Å²	178	78.4 Å²	78.4	77%	0.774	38%	0.383	S	S	*	.	H	α-helix	trans	-79.9	-46.6	177.3	-174.6	-178.3	177.3	-176.4	0	113.2	T249 E250 Y251	T249-K253 PolarHBondContact O-N 2.99Å; E250-K253 PolarHBondContact O-N 3.35Å; Y251-K253 PolarHBondContact O-N 3.48Å
254	N	86	Confident	80.3	Confident	91 Å²	91	69.6 Å²	69.6	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-93.9	-25.8	-169.9	-65.2	-13	0	0	0	113	E250 Y251 R256	E250-N254 WeakPolarHBondContact O-CB 3.43Å; E250-N254 PolarHBondContact O-N 2.91Å; Y251-N254 PolarHBondContact O-N 3.08Å; N254-R256 PolarHBondContact O-N 3.05Å; N254-R256 VanDerWaalsContact O-N 3.09Å
255	G	84.6	Confident	78.9	Confident	47 Å²	47	69.1 Å²	69.1	49%	0.485	35%	0.351	S	S	.	.			trans	63.3	10.6	179.5	0	0	0	0	0	115.4	Y251	Y251-G255 VanDerWaalsContact O-CA 3.28Å; Y251-G255 WeakPolarHBondContact O-CA 3.42Å; Y251-G255 PolarHBondContact O-N 3.07Å
256	R	82.1	Confident	77	Confident	210 Å²	210	71.1 Å²	71.1	79%	0.792	37%	0.368	S	S	*	.			trans	-128.7	147.6	-172.7	-68.1	-178.8	-179.5	-178.2	0.3	111.4	N254	N254-R256 PolarHBondContact O-N 3.05Å; N254-R256 VanDerWaalsContact O-N 3.09Å
257	I	83.5	Confident	74.6	Confident	33 Å²	33	74.9 Å²	74.9	17%	0.169	39%	0.389	C	S	.	.			trans	-113.3	141.1	173.5	-55.3	-179.7	0	0	0	107.3	R23 A27 F34 I246 Y251	R23-I257 HydrophobicContact CB-CD1 3.6Å; R23-I257 WeakPolarHBondContact O-CD1 3.44Å; A27-I257 HydrophobicContact CB-CD1 3.93Å; A27-I257 HydrophobicContact CB-CG1 4.47Å; F34-I257 HydrophobicContact CD2-CG2 3.77Å; F34-I257 HydrophobicContact CE2-CD1 3.86Å; F34-I257 HydrophobicContact CE2-CG2 3.85Å; F34-I257 HydrophobicContact CZ-CD1 4.28Å; I246-I257 HydrophobicContact CD1-CB 4.45Å; I246-I257 HydrophobicContact CD1-CG2 3.99Å; Y251-I257 HydrophobicContact CD2-CG1 3.95Å; Y251-I257 HydrophobicContact CE2-CD1 4.03Å; Y251-I257 HydrophobicContact CE2-CG1 3.55Å
258	T	80	Confident	72.6	Confident	56 Å²	56	75.6 Å²	75.6	34%	0.344	39%	0.392	S	S	.	.			trans	-61.2	141.7	174.4	46.2	0	0	0	0	111.4	R23	R23-T258 PolarHBondContact NH1-O 3Å; R23-T258 VanDerWaalsContact NH1-O 3.08Å
259	D	80.4	Confident	70.3	Confident	78 Å²	78	77.6 Å²	77.6	42%	0.417	41%	0.409	S	S	.	.			trans	-73	159.6	172.2	-173.8	37	0	0	0	110.5	T261 D262	D259-T261 PolarHBondContact O-N 3.11Å; D259-T261 PolarHBondContact OD2-OG1 3.02Å; D259-D262 PolarHBondContact O-N 3.25Å; D259-D262 VanDerWaalsContact O-N 3.15Å
260	W	79.1	Confident	67.8	Low	19 Å²	19	80.7 Å²	80.7	7%	0.072	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-60.1	-30.4	-179.6	-63.7	117.1	0	0	0	113.4	E14 V16 F34 P36 L72 D262 Q263	E14-W260 HydrophobicContact CG-CH2 3.54Å; E14-W260 HydrophobicContact CG-CZ2 3.84Å; V16-W260 HydrophobicContact CG1-CG 4.15Å; V16-W260 HydrophobicContact CG2-CD2 4.42Å; V16-W260 HydrophobicContact CG2-CG 4.43Å; V16-W260 PolarHBondContact O-NE1 3.23Å; F34-W260 HydrophobicContact CB-CH2 3.87Å; F34-W260 HydrophobicContact CB-CZ3 3.89Å; P36-W260 HydrophobicContact CB-CE3 4.41Å; P36-W260 HydrophobicContact CB-CZ3 4.48Å; P36-W260 HydrophobicContact CG-CD2 4.34Å; P36-W260 HydrophobicContact CG-CE3 3.51Å; P36-W260 HydrophobicContact CG-CZ3 3.81Å; L72-W260 HydrophobicContact CD1-CB 3.62Å; L72-W260 HydrophobicContact CD1-CG 4.42Å; W260-D262 VanDerWaalsContact C-N 3.3Å; W260-D262 PolarHBondContact O-N 3.31Å; W260-Q263 VanDerWaalsContact CE3-OE1 3.31Å; W260-Q263 PolarHBondContact O-N 3.46Å
261	T	69.8	Low	65.3	Low	82 Å²	82	83.6 Å²	83.6	50%	0.503	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-71.4	-24.5	178.5	52.9	0	0	0	0	113.4	L72 D259 Q263	L72-T261 HydrophobicContact CD1-CG2 3.64Å; L72-T261 HydrophobicContact CG-CG2 4.17Å; D259-T261 PolarHBondContact O-N 3.11Å; D259-T261 PolarHBondContact OD2-OG1 3.02Å; T261-Q263 VanDerWaalsContact C-N 3.27Å; T261-Q263 PolarHBondContact O-N 3.08Å
262	D	68.8	Low	63	Low	107 Å²	107	85.6 Å²	85.6	57%	0.572	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-86.3	-0.1	-179.2	-156.1	19.1	0	0	0	112.3	R244 D259 W260 S264	R244-D262 PolarHBondContact NH1-O 3.08Å; D259-D262 PolarHBondContact O-N 3.25Å; D259-D262 VanDerWaalsContact O-N 3.15Å; W260-D262 VanDerWaalsContact C-N 3.3Å; W260-D262 PolarHBondContact O-N 3.31Å; D262-S264 PolarHBondContact O-N 3.18Å
263	Q	57.4	Low	60.3	Low	24 Å²	24	87.3 Å²	87.3	11%	0.112	47%	0.472	C	S	.	.			trans	-96.4	28.1	-175.2	-63.7	178.9	10.5	0	0	114.1	F34 W260 T261 M265	F34-Q263 PolarHBondContact O-OE1 3.21Å; F34-Q263 VanDerWaalsContact O-OE1 3.06Å; W260-Q263 VanDerWaalsContact CE3-OE1 3.31Å; W260-Q263 PolarHBondContact O-N 3.46Å; T261-Q263 VanDerWaalsContact C-N 3.27Å; T261-Q263 PolarHBondContact O-N 3.08Å; Q263-M265 PolarHBondContact O-N 2.97Å
264	S	53	Low	57.4	Low	11 Å²	11	84.3 Å²	84.3	8%	0.077	47%	0.474	C	S	.	.			trans	-59.1	121.1	-179.6	62.8	0	0	0	0	111.9	R244 D262 A266 N267	R244-S264 PolarHBondContact NH1-O 3Å; R244-S264 PolarHBondContact NH2-O 2.96Å; D262-S264 PolarHBondContact O-N 3.18Å; S264-A266 PolarHBondContact O-N 2.86Å; S264-N267 VanDerWaalsContact OG-CG 3.25Å; S264-N267 PolarHBondContact OG-ND2 2.72Å; S264-N267 VanDerWaalsContact OG-ND2 3.08Å
265	M	52.1	Low	54.6	Low	49 Å²	49	87 Å²	87	24%	0.241	52%	0.524	C	S	.	.	G	3₁₀ helix	trans	-67	-21.5	176	-72.8	-163.8	-123.7	0	0	112.9	L39 L43 Q263	L39-M265 HydrophobicContact CD1-CE 3.77Å; L39-M265 HydrophobicContact CD2-CE 3.37Å; L39-M265 HydrophobicContact CG-CE 3.38Å; L43-M265 HydrophobicContact CD1-CE 4.17Å; L43-M265 HydrophobicContact CD2-CE 4.02Å; L43-M265 HydrophobicContact CD2-SD 4.43Å; L43-M265 HydrophobicContact CG-CE 4.41Å; Q263-M265 PolarHBondContact O-N 2.97Å
266	A	47.4	Very low	53.1	Low	51 Å²	51	89.1 Å²	89.1	42%	0.421	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-68.7	-30.9	-177.1	0	0	0	0	0	114.3	S264 V268	S264-A266 PolarHBondContact O-N 2.86Å; A266-V268 PolarHBondContact O-N 3.16Å
267	N	37.5	Very low	51.5	Low	96 Å²	96	82.7 Å²	82.7	51%	0.513	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-74.2	12.9	-173.1	-75.6	-2.5	0	0	0	115.1	S264	S264-N267 VanDerWaalsContact OG-CG 3.25Å; S264-N267 PolarHBondContact OG-ND2 2.72Å; S264-N267 VanDerWaalsContact OG-ND2 3.08Å
268	V	44	Very low	49.8	Very low	46 Å²	46	85.4 Å²	85.4	28%	0.279	53%	0.53	S	S	.	.	H	α-helix	trans	-87.6	-24.1	179.9	178.9	0	0	0	0	113	I240 A266 E270 G272	I240-V268 HydrophobicContact CD1-CB 4.3Å; I240-V268 HydrophobicContact CD1-CG2 3.36Å; I240-V268 HydrophobicContact CG1-CG2 3.91Å; A266-V268 PolarHBondContact O-N 3.16Å; V268-E270 VanDerWaalsContact C-N 3.26Å; V268-E270 PolarHBondContact O-N 2.78Å; V268-G272 PolarHBondContact O-N 3.21Å
269	N	36.8	Very low	48	Very low	133 Å²	133	87.2 Å²	87.2	71%	0.711	54%	0.541	S	S	*	.	H	α-helix	trans	-70.3	-21.8	-179.2	-68.4	-14.7	0	0	0	113.3
270	E	33.6	Very low	45.9	Very low	165 Å²	165	87.8 Å²	87.8	77%	0.771	55%	0.549	S	S	*	.	H	α-helix	trans	-88.7	-30.5	-177.7	-68.2	-171.1	165	0	0	113.8	V268	V268-E270 VanDerWaalsContact C-N 3.26Å; V268-E270 PolarHBondContact O-N 2.78Å
271	N	34	Very low	43.7	Very low	146 Å²	146	92.3 Å²	92.3	78%	0.781	58%	0.581	S	S	*	*	H	α-helix	trans	-98.2	-2.8	178.3	-70	-22.4	0	0	0	113.6
272	G	37.5	Very low	41.9	Very low	60 Å²	60	93.1 Å²	93.1	62%	0.619	59%	0.587	S	S	*	*	S	Bend	trans	-93.5	-8.1	-179.3	0	0	0	0	0	115.9	V268	V268-G272 PolarHBondContact O-N 3.21Å
273	I	29.7	Very low	39.8	Very low	151 Å²	151	92 Å²	92	77%	0.774	59%	0.588	S	S	*	*			trans	-120.2	69	179.9	-46.8	178	0	0	0	109.2
274	S	27.3	Very low	38.3	Very low	115 Å²	115	97.7 Å²	97.7	80%	0.804	63%	0.627	S	S	*	*			trans	-139	80.3	157.1	52.7	0	0	0	0	107.8
275	G	27.3	Very low	37	Very low	149 Å²	149	105.5 Å²	105.5	100%	1.536	68%	0.677	S	S	*	*			trans	-178.2	0	180	0	0	0	0	0	110.3

Retrieved 275 of 275 residues in 417.5 ms (Link to these results)

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