G4M129_SCHMA Loading...

Zinc finger protein, putative

AlphaFold DB , UniProt , Accession G4M129, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 353 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	37.1	Very low	55.5	Low	210 Å²	210	105.6 Å²	105.6	100%	1.034	52%	0.52	S	S	*	.				0	69.5	0	-70.1	-166.5	-85.2	0	0	107.8	F3	M1-F3 PolarHBondContact O-N 3.25Å
2	V	36.9	Very low	56	Low	134 Å²	134	99.5 Å²	99.5	81%	0.812	49%	0.49	S	S	*	.			trans	-79.9	104.6	157.9	-179.8	0	0	0	0	102	E4	V2-E4 PolarHBondContact O-N 3.37Å
3	F	46.9	Very low	56.8	Low	141 Å²	141	96.1 Å²	96.1	62%	0.618	48%	0.482	S	S	*	.			trans	-64.4	115	165.7	-79.2	-88.1	0	0	0	104.9	M1 T5 I8	M1-F3 PolarHBondContact O-N 3.25Å; F3-T5 PolarHBondContact O-N 3.29Å; F3-I8 HydrophobicContact CB-CD1 3.94Å; F3-I8 HydrophobicContact CB-CG1 4.01Å
4	E	53.8	Low	57.5	Low	119 Å²	119	94.4 Å²	94.4	56%	0.556	48%	0.475	S	S	*	.			trans	-61.1	137.6	172.8	-69.1	-176.7	169.6	0	0	106.9	V2 H6 D7	V2-E4 PolarHBondContact O-N 3.37Å; E4-H6 PolarHBondContact O-N 2.84Å; E4-D7 PolarHBondContact O-N 2.63Å
5	T	53.7	Low	57.8	Low	86 Å²	86	93.1 Å²	93.1	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-51	-30.1	-178.6	43.3	0	0	0	0	111.9	F3 I8 L9	F3-T5 PolarHBondContact O-N 3.29Å; T5-I8 PolarHBondContact O-N 2.86Å; T5-L9 VanDerWaalsContact O-CG 3.29Å; T5-L9 WeakPolarHBondContact O-CG 3.49Å; T5-L9 PolarHBondContact O-N 3.17Å
6	H	57.2	Low	58	Low	79 Å²	79	89.4 Å²	89.4	37%	0.366	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-42.7	174	-175.9	-95.1	0	0	0	114.1	E4 I8 L9 K10	E4-H6 PolarHBondContact O-N 2.84Å; H6-I8 VanDerWaalsContact C-N 3.3Å; H6-I8 PolarHBondContact O-N 3.38Å; H6-L9 PolarHBondContact O-N 3.16Å; H6-K10 WeakPolarHBondContact O-CB 3.48Å; H6-K10 PolarHBondContact O-N 2.64Å
7	D	64.3	Low	58.5	Low	83 Å²	83	87.5 Å²	87.5	44%	0.444	44%	0.443	S	S	.	.	H	α-helix	trans	-65.6	-37.8	179.4	-69.2	-26.9	0	0	0	111.3	E4 Y11	E4-D7 PolarHBondContact O-N 2.63Å; D7-Y11 VanDerWaalsContact O-CB 3.25Å; D7-Y11 WeakPolarHBondContact O-CB 3.37Å; D7-Y11 PolarHBondContact O-N 3.36Å
8	I	61.1	Low	58.1	Low	38 Å²	38	84.4 Å²	84.4	20%	0.195	43%	0.428	C	S	.	.	H	α-helix	trans	-67.8	-47	176.7	-59	175.4	0	0	0	109.9	F3 T5 H6 K10 Y11 L12 I89 T93	F3-I8 HydrophobicContact CB-CD1 3.94Å; F3-I8 HydrophobicContact CB-CG1 4.01Å; T5-I8 PolarHBondContact O-N 2.86Å; H6-I8 VanDerWaalsContact C-N 3.3Å; H6-I8 PolarHBondContact O-N 3.38Å; I8-K10 PolarHBondContact O-N 3.33Å; I8-Y11 PolarHBondContact O-N 2.79Å; I8-L12 HydrophobicContact CG2-CD1 3.95Å; I8-L12 HydrophobicContact CG2-CG 4.33Å; I8-L12 WeakPolarHBondContact O-CB 3.43Å; I8-L12 VanDerWaalsContact O-CG 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.43Å; I8-L12 PolarHBondContact O-N 2.83Å; I8-I89 HydrophobicContact CD1-CG2 4.08Å; I8-I89 HydrophobicContact CG2-CG2 3.58Å; I8-T93 HydrophobicContact CB-CG2 4.42Å; I8-T93 HydrophobicContact CD1-CG2 4.42Å; I8-T93 HydrophobicContact CG2-CG2 3.92Å
9	L	64.9	Low	57.9	Low	44 Å²	44	85.1 Å²	85.1	23%	0.23	43%	0.425	C	S	.	.	H	α-helix	trans	-64	-41	179.3	-70.8	173.4	0	0	0	112	T5 H6 L12 S13 Y97	T5-L9 VanDerWaalsContact O-CG 3.29Å; T5-L9 WeakPolarHBondContact O-CG 3.49Å; T5-L9 PolarHBondContact O-N 3.17Å; H6-L9 PolarHBondContact O-N 3.16Å; L9-L12 PolarHBondContact O-N 2.79Å; L9-S13 WeakPolarHBondContact O-CB 3.36Å; L9-S13 PolarHBondContact O-N 3.24Å; L9-Y97 HydrophobicContact CD1-CD2 3.98Å; L9-Y97 HydrophobicContact CD1-CE2 4.15Å
10	K	69.1	Low	57.9	Low	92 Å²	92	83.6 Å²	83.6	40%	0.4	42%	0.418	S	S	.	.	H	α-helix	trans	-65.3	-39.9	175.8	-165.4	174.3	-176.2	-178.1	0	111.7	H6 I8 N14	H6-K10 WeakPolarHBondContact O-CB 3.48Å; H6-K10 PolarHBondContact O-N 2.64Å; I8-K10 PolarHBondContact O-N 3.33Å; K10-N14 WeakPolarHBondContact O-CB 3.39Å; K10-N14 PolarHBondContact O-N 3.08Å
11	Y	65.1	Low	57.8	Low	136 Å²	136	81.9 Å²	81.9	53%	0.533	41%	0.412	S	S	.	.	H	α-helix	trans	-63.4	-44.2	173.8	-177	-97.8	0	0	0	112.1	D7 I8 N14 M15	D7-Y11 VanDerWaalsContact O-CB 3.25Å; D7-Y11 WeakPolarHBondContact O-CB 3.37Å; D7-Y11 PolarHBondContact O-N 3.36Å; I8-Y11 PolarHBondContact O-N 2.79Å; Y11-N14 PolarHBondContact O-N 3.05Å; Y11-M15 HydrophobicContact CD1-SD 4.38Å; Y11-M15 HydrophobicContact CE1-CE 4.11Å; Y11-M15 HydrophobicContact CE1-CG 4.12Å; Y11-M15 HydrophobicContact CE1-SD 3.62Å; Y11-M15 PolarHBondContact O-N 3.42Å; Y11-M15 WeakPolarHBondContact OH-CE 3.44Å
12	L	61.8	Low	58.1	Low	32 Å²	32	75.3 Å²	75.3	17%	0.168	38%	0.38	C	S	.	.	H	α-helix	trans	-65.3	-43.1	176.6	-70	173.3	0	0	0	111.9	I8 L9 N14 M15 Q16 I90	I8-L12 HydrophobicContact CG2-CD1 3.95Å; I8-L12 HydrophobicContact CG2-CG 4.33Å; I8-L12 WeakPolarHBondContact O-CB 3.43Å; I8-L12 VanDerWaalsContact O-CG 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.43Å; I8-L12 PolarHBondContact O-N 2.83Å; L9-L12 PolarHBondContact O-N 2.79Å; L12-N14 VanDerWaalsContact C-N 3.35Å; L12-N14 PolarHBondContact O-N 3.16Å; L12-M15 PolarHBondContact O-N 2.96Å; L12-Q16 PolarHBondContact O-N 3.32Å; L12-I90 HydrophobicContact CD1-CG1 3.95Å; L12-I90 HydrophobicContact CD2-CD1 4Å; L12-I90 HydrophobicContact CD2-CG1 3.79Å
13	S	66.2	Low	59.2	Low	55 Å²	55	75.6 Å²	75.6	39%	0.385	37%	0.37	S	S	.	.	H	α-helix	trans	-58.8	-46.8	175.2	-175.6	0	0	0	0	110.9	L9 M15 Q16 T17	L9-S13 WeakPolarHBondContact O-CB 3.36Å; L9-S13 PolarHBondContact O-N 3.24Å; S13-M15 VanDerWaalsContact C-N 3.33Å; S13-M15 PolarHBondContact O-N 2.99Å; S13-Q16 PolarHBondContact O-N 3.47Å; S13-Q16 VanDerWaalsContact O-N 3.17Å; S13-T17 PolarHBondContact O-N 3.38Å; S13-T17 PolarHBondContact O-OG1 2.91Å
14	N	67.1	Low	59.9	Low	72 Å²	72	74.4 Å²	74.4	39%	0.385	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-37.1	177.2	-79.6	-0.2	0	0	0	112.5	K10 Y11 L12 T17 N18	K10-N14 WeakPolarHBondContact O-CB 3.39Å; K10-N14 PolarHBondContact O-N 3.08Å; Y11-N14 PolarHBondContact O-N 3.05Å; L12-N14 VanDerWaalsContact C-N 3.35Å; L12-N14 PolarHBondContact O-N 3.16Å; N14-T17 WeakPolarHBondContact CA-OG1 3.36Å; N14-T17 PolarHBondContact O-OG1 2.85Å; N14-N18 WeakPolarHBondContact O-CB 3.37Å; N14-N18 PolarHBondContact O-N 3.27Å; N14-N18 PolarHBondContact O-ND2 3.25Å
15	M	61.1	Low	59.7	Low	75 Å²	75	71.3 Å²	71.3	37%	0.369	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-41.5	172.4	-82.2	-160	140	0	0	111.7	Y11 L12 S13 N18 W19 F82	Y11-M15 HydrophobicContact CD1-SD 4.38Å; Y11-M15 HydrophobicContact CE1-CE 4.11Å; Y11-M15 HydrophobicContact CE1-CG 4.12Å; Y11-M15 HydrophobicContact CE1-SD 3.62Å; Y11-M15 PolarHBondContact O-N 3.42Å; Y11-M15 WeakPolarHBondContact OH-CE 3.44Å; L12-M15 PolarHBondContact O-N 2.96Å; S13-M15 VanDerWaalsContact C-N 3.33Å; S13-M15 PolarHBondContact O-N 2.99Å; M15-N18 PolarHBondContact O-N 3.29Å; M15-W19 WeakPolarHBondContact O-CB 3.5Å; M15-W19 PolarHBondContact O-N 2.83Å; M15-F82 HydrophobicContact SD-CE1 4.34Å
16	Q	61.9	Low	59.2	Low	34 Å²	34	76 Å²	76	16%	0.159	39%	0.386	C	S	.	.	H	α-helix	trans	-66.4	-43.9	178.4	-166.8	69.2	10.6	0	0	111.8	L12 S13 W19 N20	L12-Q16 PolarHBondContact O-N 3.32Å; S13-Q16 PolarHBondContact O-N 3.47Å; S13-Q16 VanDerWaalsContact O-N 3.17Å; Q16-W19 PolarHBondContact O-N 3.21Å; Q16-N20 WeakPolarHBondContact O-CB 3.41Å; Q16-N20 VanDerWaalsContact O-CG 3.27Å; Q16-N20 PolarHBondContact O-N 2.86Å; Q16-N20 PolarHBondContact O-ND2 3.07Å
17	T	65.7	Low	58.7	Low	58 Å²	58	74.7 Å²	74.7	36%	0.356	38%	0.383	S	S	.	.	H	α-helix	trans	-60.9	-47.2	173.3	14.9	0	0	0	0	110.7	S13 N14 W19 N20 T21	S13-T17 PolarHBondContact O-N 3.38Å; S13-T17 PolarHBondContact O-OG1 2.91Å; N14-T17 WeakPolarHBondContact CA-OG1 3.36Å; N14-T17 PolarHBondContact O-OG1 2.85Å; T17-W19 VanDerWaalsContact C-N 3.27Å; T17-W19 PolarHBondContact O-N 2.96Å; T17-N20 PolarHBondContact O-N 3.36Å; T17-T21 WeakPolarHBondContact O-CB 3.37Å; T17-T21 PolarHBondContact O-N 3.21Å; T17-T21 PolarHBondContact O-OG1 2.87Å
18	N	51.9	Low	57.7	Low	31 Å²	31	73.5 Å²	73.5	17%	0.166	38%	0.382	C	S	.	.	H	α-helix	trans	-58.9	-40.6	177.5	-74.5	-16.2	0	0	0	111.9	N14 M15 T21 M22	N14-N18 WeakPolarHBondContact O-CB 3.37Å; N14-N18 PolarHBondContact O-N 3.27Å; N14-N18 PolarHBondContact O-ND2 3.25Å; M15-N18 PolarHBondContact O-N 3.29Å; N18-T21 PolarHBondContact O-N 2.92Å; N18-M22 WeakPolarHBondContact O-CB 3.24Å; N18-M22 VanDerWaalsContact O-CG 3.29Å; N18-M22 WeakPolarHBondContact O-CG 3.29Å; N18-M22 PolarHBondContact O-N 3.32Å
19	W	53.5	Low	56.4	Low	98 Å²	98	76.2 Å²	76.2	37%	0.371	40%	0.396	S	S	.	.	H	α-helix	trans	-69.1	-39.9	177.8	-171.6	82.8	0	0	0	112.9	M15 Q16 T17 T21 M22 K23	M15-W19 WeakPolarHBondContact O-CB 3.5Å; M15-W19 PolarHBondContact O-N 2.83Å; Q16-W19 PolarHBondContact O-N 3.21Å; T17-W19 VanDerWaalsContact C-N 3.27Å; T17-W19 PolarHBondContact O-N 2.96Å; W19-T21 VanDerWaalsContact C-N 3.31Å; W19-T21 PolarHBondContact O-N 3.31Å; W19-M22 PolarHBondContact O-N 3.31Å; W19-K23 HydrophobicContact CD2-CD 4.36Å; W19-K23 HydrophobicContact CE3-CD 3.95Å; W19-K23 HydrophobicContact CH2-CD 3.87Å; W19-K23 HydrophobicContact CZ2-CD 4.14Å; W19-K23 HydrophobicContact CZ3-CD 3.7Å; W19-K23 PolarHBondContact O-N 3.49Å
20	N	59	Low	55.1	Low	55 Å²	55	79.3 Å²	79.3	29%	0.294	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-37.2	173	-72.4	-23.7	0	0	0	111.4	Q16 T17 K23 T24	Q16-N20 WeakPolarHBondContact O-CB 3.41Å; Q16-N20 VanDerWaalsContact O-CG 3.27Å; Q16-N20 PolarHBondContact O-N 2.86Å; Q16-N20 PolarHBondContact O-ND2 3.07Å; T17-N20 PolarHBondContact O-N 3.36Å; N20-K23 PolarHBondContact O-N 2.82Å; N20-T24 WeakPolarHBondContact O-CG2 3.35Å; N20-T24 PolarHBondContact O-N 3.3Å; N20-T24 VanDerWaalsContact O-N 3.07Å; N20-T24 PolarHBondContact O-OG1 3.4Å
21	T	56.5	Low	54.1	Low	47 Å²	47	79.9 Å²	79.9	29%	0.288	41%	0.414	S	S	.	.	H	α-helix	trans	-68.1	-41.7	174.5	-47.3	0	0	0	0	110.7	T17 N18 W19 K23 T24 T25 L32	T17-T21 WeakPolarHBondContact O-CB 3.37Å; T17-T21 PolarHBondContact O-N 3.21Å; T17-T21 PolarHBondContact O-OG1 2.87Å; N18-T21 PolarHBondContact O-N 2.92Å; W19-T21 VanDerWaalsContact C-N 3.31Å; W19-T21 PolarHBondContact O-N 3.31Å; T21-K23 VanDerWaalsContact C-N 3.26Å; T21-K23 PolarHBondContact O-N 3.31Å; T21-T24 WeakPolarHBondContact CA-OG1 3.36Å; T21-T24 PolarHBondContact O-N 2.84Å; T21-T24 VanDerWaalsContact O-N 3.16Å; T21-T24 PolarHBondContact O-OG1 3.46Å; T21-T25 HydrophobicContact CG2-CG2 4.27Å; T21-T25 WeakPolarHBondContact O-CB 3.35Å; T21-T25 PolarHBondContact O-N 3Å; T21-T25 PolarHBondContact O-OG1 3.43Å; T21-L32 HydrophobicContact CG2-CD1 4.08Å; T21-L32 HydrophobicContact CG2-CD2 3.56Å; T21-L32 HydrophobicContact CG2-CG 4.4Å
22	M	43.1	Very low	53	Low	72 Å²	72	74.7 Å²	74.7	36%	0.355	40%	0.395	S	S	.	.	H	α-helix	trans	-62.2	-30.6	172.4	-74.8	-176.8	81.6	0	0	113.4	N18 W19 T25 L29 L32	N18-M22 WeakPolarHBondContact O-CB 3.24Å; N18-M22 VanDerWaalsContact O-CG 3.29Å; N18-M22 WeakPolarHBondContact O-CG 3.29Å; N18-M22 PolarHBondContact O-N 3.32Å; W19-M22 PolarHBondContact O-N 3.31Å; M22-T25 CarbonylContact C-O 3.49Å; M22-L29 HydrophobicContact CE-CB 3.87Å; M22-L29 HydrophobicContact CE-CD1 3.65Å; M22-L29 HydrophobicContact CE-CG 3.78Å; M22-L29 HydrophobicContact SD-CB 4.11Å; M22-L29 HydrophobicContact SD-CD1 3.59Å; M22-L29 VanDerWaalsContact SD-CD1 3.59Å; M22-L29 HydrophobicContact SD-CG 3.45Å; M22-L29 WeakPolarHBondContact SD-CG 3.2Å; M22-L32 HydrophobicContact CG-CD1 3.7Å
23	K	59.6	Low	51.9	Low	141 Å²	141	76 Å²	76	61%	0.613	40%	0.404	S	S	*	.	H	α-helix	trans	-74.8	-30.7	175	-94	-175.8	166.6	-176.4	0	113.1	W19 N20 T21	W19-K23 HydrophobicContact CD2-CD 4.36Å; W19-K23 HydrophobicContact CE3-CD 3.95Å; W19-K23 HydrophobicContact CH2-CD 3.87Å; W19-K23 HydrophobicContact CZ2-CD 4.14Å; W19-K23 HydrophobicContact CZ3-CD 3.7Å; W19-K23 PolarHBondContact O-N 3.49Å; N20-K23 PolarHBondContact O-N 2.82Å; T21-K23 VanDerWaalsContact C-N 3.26Å; T21-K23 PolarHBondContact O-N 3.31Å
24	T	61.6	Low	51	Low	116 Å²	116	76.8 Å²	76.8	71%	0.712	41%	0.406	S	S	*	.	H	α-helix	trans	-96.9	-21.5	-174.7	50.8	0	0	0	0	112.8	N20 T21	N20-T24 WeakPolarHBondContact O-CG2 3.35Å; N20-T24 PolarHBondContact O-N 3.3Å; N20-T24 VanDerWaalsContact O-N 3.07Å; N20-T24 PolarHBondContact O-OG1 3.4Å; T21-T24 WeakPolarHBondContact CA-OG1 3.36Å; T21-T24 PolarHBondContact O-N 2.84Å; T21-T24 VanDerWaalsContact O-N 3.16Å; T21-T24 PolarHBondContact O-OG1 3.46Å
25	T	48.5	Very low	49.9	Very low	53 Å²	53	78.3 Å²	78.3	33%	0.325	42%	0.415	S	S	.	.	S	Bend	trans	-128	136.4	-179.6	66	0	0	0	0	108.8	T21 M22 T27	T21-T25 HydrophobicContact CG2-CG2 4.27Å; T21-T25 WeakPolarHBondContact O-CB 3.35Å; T21-T25 PolarHBondContact O-N 3Å; T21-T25 PolarHBondContact O-OG1 3.43Å; M22-T25 CarbonylContact C-O 3.49Å; T25-T27 PolarHBondContact O-N 3.38Å; T25-T27 PolarHBondContact OG1-OG1 3.27Å
26	D	43.5	Very low	49.1	Very low	185 Å²	185	78.6 Å²	78.6	99%	0.989	42%	0.415	S	S	*	.			trans	-72	30.9	171.9	-132.3	0.6	0	0	0	111
27	T	48	Very low	48	Very low	51 Å²	51	82 Å²	82	31%	0.313	43%	0.433	S	S	.	.			trans	-81.4	137.6	-180	49.7	0	0	0	0	110.4	T25 L32	T25-T27 PolarHBondContact O-N 3.38Å; T25-T27 PolarHBondContact OG1-OG1 3.27Å; T27-L32 WeakPolarHBondContact OG1-CD1 3.34Å
28	S	42	Very low	46.9	Very low	58 Å²	58	86.2 Å²	86.2	41%	0.406	45%	0.449	S	S	.	.			trans	-65.2	142.8	177.2	77.3	0	0	0	0	110.4	Q30 E31 L32	S28-Q30 PolarHBondContact O-N 3.15Å; S28-Q30 VanDerWaalsContact O-N 3.08Å; S28-E31 PolarHBondContact O-N 3.4Å; S28-E31 PolarHBondContact OG-N 3.08Å; S28-E31 VanDerWaalsContact OG-N 3.16Å; S28-L32 PolarHBondContact O-N 3.04Å
29	L	34.1	Very low	46.6	Very low	96 Å²	96	90.8 Å²	90.8	50%	0.503	47%	0.469	S	S	.	.	H	α-helix	trans	-52.5	-32.8	174	-142.1	161.8	0	0	0	111.2	M22 V33	M22-L29 HydrophobicContact CE-CB 3.87Å; M22-L29 HydrophobicContact CE-CD1 3.65Å; M22-L29 HydrophobicContact CE-CG 3.78Å; M22-L29 HydrophobicContact SD-CB 4.11Å; M22-L29 HydrophobicContact SD-CD1 3.59Å; M22-L29 VanDerWaalsContact SD-CD1 3.59Å; M22-L29 HydrophobicContact SD-CG 3.45Å; M22-L29 WeakPolarHBondContact SD-CG 3.2Å; L29-V33 HydrophobicContact CD2-CG2 3.69Å; L29-V33 WeakPolarHBondContact O-CB 3.44Å; L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 2.65Å
30	Q	38.5	Very low	46.3	Very low	108 Å²	108	88.7 Å²	88.7	51%	0.505	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-43.6	175.4	-112.3	-179.9	0.2	0	0	113	S28 V33 T34 D321	S28-Q30 PolarHBondContact O-N 3.15Å; S28-Q30 VanDerWaalsContact O-N 3.08Å; Q30-V33 PolarHBondContact O-N 2.88Å; Q30-T34 WeakPolarHBondContact O-CB 3.33Å; Q30-T34 WeakPolarHBondContact O-CG2 3.1Å; Q30-T34 PolarHBondContact O-N 3.23Å; Q30-T34 PolarHBondContact O-OG1 2.96Å; Q30-D321 PolarHBondContact NE2-OD2 2.88Å
31	E	47.7	Very low	45.6	Very low	105 Å²	105	94.8 Å²	94.8	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-41.6	176.7	-86.7	176.8	139.2	0	0	112.3	S28 T34 N35	S28-E31 PolarHBondContact O-N 3.4Å; S28-E31 PolarHBondContact OG-N 3.08Å; S28-E31 VanDerWaalsContact OG-N 3.16Å; E31-T34 WeakPolarHBondContact CA-OG1 3.29Å; E31-T34 PolarHBondContact O-OG1 3.16Å; E31-N35 WeakPolarHBondContact O-CB 3.32Å; E31-N35 PolarHBondContact O-N 3.22Å; E31-N35 PolarHBondContact O-ND2 3.17Å; E31-N35 VanDerWaalsContact O-ND2 3.08Å
32	L	42.6	Very low	44.9	Very low	26 Å²	26	96.3 Å²	96.3	14%	0.136	50%	0.496	C	S	.	.	H	α-helix	trans	-65.4	-42	176.4	-83.5	159	0	0	0	112.3	T21 M22 T27 S28 H36	T21-L32 HydrophobicContact CG2-CD1 4.08Å; T21-L32 HydrophobicContact CG2-CD2 3.56Å; T21-L32 HydrophobicContact CG2-CG 4.4Å; M22-L32 HydrophobicContact CG-CD1 3.7Å; T27-L32 WeakPolarHBondContact OG1-CD1 3.34Å; S28-L32 PolarHBondContact O-N 3.04Å; L32-H36 PolarHBondContact O-N 3.16Å
33	V	39.2	Very low	44.7	Very low	60 Å²	60	96.6 Å²	96.6	36%	0.364	50%	0.499	S	S	.	.	H	α-helix	trans	-69.8	-39.6	178.3	170.1	0	0	0	0	111.4	L29 Q30 I37	L29-V33 HydrophobicContact CD2-CG2 3.69Å; L29-V33 WeakPolarHBondContact O-CB 3.44Å; L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 2.65Å; Q30-V33 PolarHBondContact O-N 2.88Å; V33-I37 HydrophobicContact CG1-CD1 3.77Å; V33-I37 WeakPolarHBondContact O-CD1 3.38Å; V33-I37 WeakPolarHBondContact O-CG1 3.43Å; V33-I37 PolarHBondContact O-N 3.28Å; V33-I37 VanDerWaalsContact O-N 3.15Å
34	T	45.3	Very low	43.6	Very low	71 Å²	71	97.8 Å²	97.8	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-71	-41.6	-179.3	43.5	0	0	0	0	113.3	Q30 E31 H36 I37 Q38	Q30-T34 WeakPolarHBondContact O-CB 3.33Å; Q30-T34 WeakPolarHBondContact O-CG2 3.1Å; Q30-T34 PolarHBondContact O-N 3.23Å; Q30-T34 PolarHBondContact O-OG1 2.96Å; E31-T34 WeakPolarHBondContact CA-OG1 3.29Å; E31-T34 PolarHBondContact O-OG1 3.16Å; T34-H36 VanDerWaalsContact C-N 3.3Å; T34-H36 PolarHBondContact O-N 3.45Å; T34-I37 PolarHBondContact O-N 3.47Å; T34-Q38 PolarHBondContact O-N 3.42Å
35	N	45.2	Very low	42.5	Very low	104 Å²	104	97.4 Å²	97.4	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-61.6	-39.4	176.7	-75.7	-34.9	0	0	0	111.5	E31 Q38	E31-N35 WeakPolarHBondContact O-CB 3.32Å; E31-N35 PolarHBondContact O-N 3.22Å; E31-N35 PolarHBondContact O-ND2 3.17Å; E31-N35 VanDerWaalsContact O-ND2 3.08Å; N35-Q38 PolarHBondContact O-N 3.24Å
36	H	43.5	Very low	41.9	Very low	82 Å²	82	98.9 Å²	98.9	38%	0.38	50%	0.502	S	S	.	.	H	α-helix	trans	-74	-29.4	177.9	-102.1	-50.9	0	0	0	114.2	L32 T34 Q38 E39 D40	L32-H36 PolarHBondContact O-N 3.16Å; T34-H36 VanDerWaalsContact C-N 3.3Å; T34-H36 PolarHBondContact O-N 3.45Å; H36-Q38 PolarHBondContact O-N 3.41Å; H36-E39 IonicContact CE1-OE2 3.52Å; H36-E39 IonicContact ND1-OE2 3.86Å; H36-E39 PolarHBondContact O-N 3.06Å; H36-D40 VanDerWaalsContact O-CB 3.24Å; H36-D40 WeakPolarHBondContact O-CB 3.34Å; H36-D40 PolarHBondContact O-N 3.4Å
37	I	39.4	Very low	41.5	Very low	104 Å²	104	93.9 Å²	93.9	53%	0.533	48%	0.475	S	S	.	.	H	α-helix	trans	-63.7	-29.2	174.9	-70.6	163.4	0	0	0	111.4	V33 T34	V33-I37 HydrophobicContact CG1-CD1 3.77Å; V33-I37 WeakPolarHBondContact O-CD1 3.38Å; V33-I37 WeakPolarHBondContact O-CG1 3.43Å; V33-I37 PolarHBondContact O-N 3.28Å; V33-I37 VanDerWaalsContact O-N 3.15Å; T34-I37 PolarHBondContact O-N 3.47Å
38	Q	42.1	Very low	40.9	Very low	148 Å²	148	96 Å²	96	69%	0.692	49%	0.491	S	S	*	.	H	α-helix	trans	-74.3	-37.2	176.4	-102.1	165.9	-65.1	0	0	113.1	T34 N35 H36	T34-Q38 PolarHBondContact O-N 3.42Å; N35-Q38 PolarHBondContact O-N 3.24Å; H36-Q38 PolarHBondContact O-N 3.41Å
39	E	45.9	Very low	40.7	Very low	127 Å²	127	100.9 Å²	100.9	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-75.6	-31.7	176.1	-67.2	-175.1	161.2	0	0	112.6	H36 R41 S42	H36-E39 IonicContact CE1-OE2 3.52Å; H36-E39 IonicContact ND1-OE2 3.86Å; H36-E39 PolarHBondContact O-N 3.06Å; E39-R41 VanDerWaalsContact C-N 3.25Å; E39-R41 PolarHBondContact O-N 3.06Å; E39-S42 WeakPolarHBondContact O-CB 3.14Å; E39-S42 PolarHBondContact O-N 3.05Å; E39-S42 PolarHBondContact O-OG 3.37Å
40	D	48.1	Very low	40.9	Very low	53 Å²	53	99.8 Å²	99.8	28%	0.283	50%	0.504	S	S	.	.	H	α-helix	trans	-71.6	-14.9	-177.8	-161.6	40.9	0	0	0	113.5	H36 S42 L43 R44	H36-D40 VanDerWaalsContact O-CB 3.24Å; H36-D40 WeakPolarHBondContact O-CB 3.34Å; H36-D40 PolarHBondContact O-N 3.4Å; D40-S42 VanDerWaalsContact C-N 3.31Å; D40-S42 PolarHBondContact O-N 2.82Å; D40-L43 PolarHBondContact O-N 3.37Å; D40-R44 WeakPolarHBondContact O-CB 3.18Å; D40-R44 WeakPolarHBondContact O-CG 3.45Å; D40-R44 PolarHBondContact O-N 3.07Å; D40-R44 IonicContact OD2-CZ 3.86Å; D40-R44 IonicContact OD2-NE 2.7Å; D40-R44 PolarHBondContact OD2-NE 3.37Å; D40-R44 VanDerWaalsContact OD2-NE 3.08Å; D40-R44 IonicContact OD2-NH2 3.76Å; D40-R44 PolarHBondContact OD2-NH2 2.98Å; D40-R44 VanDerWaalsContact OD2-NH2 3.09Å
41	R	43.5	Very low	41	Very low	184 Å²	184	99.7 Å²	99.7	69%	0.694	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-37	171.3	-98.7	-176.4	175.5	-178.9	-0.4	112.5	E39 N45	E39-R41 VanDerWaalsContact C-N 3.25Å; E39-R41 PolarHBondContact O-N 3.06Å; R41-N45 PolarHBondContact O-N 3.42Å
42	S	42	Very low	40.4	Very low	78 Å²	78	98 Å²	98	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-67	-45.7	177.8	-41.2	0	0	0	0	109.9	E39 D40 N45 T46	E39-S42 WeakPolarHBondContact O-CB 3.14Å; E39-S42 PolarHBondContact O-N 3.05Å; E39-S42 PolarHBondContact O-OG 3.37Å; D40-S42 VanDerWaalsContact C-N 3.31Å; D40-S42 PolarHBondContact O-N 2.82Å; S42-N45 PolarHBondContact O-N 3.09Å; S42-T46 PolarHBondContact O-N 3.17Å; S42-T46 PolarHBondContact O-OG1 3.21Å
43	L	37.8	Very low	40.2	Very low	78 Å²	78	105.2 Å²	105.2	41%	0.408	56%	0.555	S	S	.	*	H	α-helix	trans	-65.5	-42.1	177.5	-101.6	137.5	0	0	0	112.6	D40 N45 T46 I47	D40-L43 PolarHBondContact O-N 3.37Å; L43-N45 VanDerWaalsContact C-N 3.29Å; L43-N45 PolarHBondContact O-N 2.81Å; L43-T46 PolarHBondContact O-N 2.89Å; L43-I47 HydrophobicContact CB-CD1 4.41Å; L43-I47 HydrophobicContact CD2-CD1 4.02Å; L43-I47 VanDerWaalsContact O-CB 3.29Å; L43-I47 WeakPolarHBondContact O-CB 3.43Å; L43-I47 WeakPolarHBondContact O-CD1 3.29Å; L43-I47 WeakPolarHBondContact O-CG1 3.46Å; L43-I47 PolarHBondContact O-N 3.47Å
44	R	36.4	Very low	39.9	Very low	167 Å²	167	107.1 Å²	107.1	63%	0.63	56%	0.562	S	S	*	*	H	α-helix	trans	-60.6	-38.2	174.9	-77.9	177.5	-163	-111.5	-3.3	112.6	D40 C48	D40-R44 WeakPolarHBondContact O-CB 3.18Å; D40-R44 WeakPolarHBondContact O-CG 3.45Å; D40-R44 PolarHBondContact O-N 3.07Å; D40-R44 IonicContact OD2-CZ 3.86Å; D40-R44 IonicContact OD2-NE 2.7Å; D40-R44 PolarHBondContact OD2-NE 3.37Å; D40-R44 VanDerWaalsContact OD2-NE 3.08Å; D40-R44 IonicContact OD2-NH2 3.76Å; D40-R44 PolarHBondContact OD2-NH2 2.98Å; D40-R44 VanDerWaalsContact OD2-NH2 3.09Å; R44-C48 WeakPolarHBondContact O-CB 3.33Å; R44-C48 PolarHBondContact O-N 3.33Å; R44-C48 VanDerWaalsContact O-N 3.07Å
45	N	39.1	Very low	39.3	Very low	107 Å²	107	113 Å²	113	57%	0.572	59%	0.585	S	S	*	*	H	α-helix	trans	-70.8	-40.8	176	-74.2	-16.6	0	0	0	111.7	R41 S42 L43 C48 H49	R41-N45 PolarHBondContact O-N 3.42Å; S42-N45 PolarHBondContact O-N 3.09Å; L43-N45 VanDerWaalsContact C-N 3.29Å; L43-N45 PolarHBondContact O-N 2.81Å; N45-C48 PolarHBondContact O-N 2.97Å; N45-H49 PolarHBondContact O-CD2 3.08Å; N45-H49 PolarHBondContact O-N 3.09Å
46	T	36.8	Very low	39.1	Very low	85 Å²	85	111.3 Å²	111.3	52%	0.521	58%	0.581	S	S	.	*	H	α-helix	trans	-64.7	-42.3	175.2	-48.4	0	0	0	0	111.9	S42 L43 C48 H49 T50	S42-T46 PolarHBondContact O-N 3.17Å; S42-T46 PolarHBondContact O-OG1 3.21Å; L43-T46 PolarHBondContact O-N 2.89Å; T46-C48 VanDerWaalsContact C-N 3.3Å; T46-C48 PolarHBondContact O-N 3.43Å; T46-H49 PolarHBondContact O-N 3.46Å; T46-H49 VanDerWaalsContact O-N 3.09Å; T46-T50 PolarHBondContact O-N 3.42Å; T46-T50 PolarHBondContact O-OG1 3.27Å; T46-T50 VanDerWaalsContact O-OG1 3.06Å
47	I	34	Very low	38.7	Very low	80 Å²	80	117.4 Å²	117.4	41%	0.41	60%	0.601	S	S	.	*	H	α-helix	trans	-65.2	-33.3	178.4	-67.7	163.5	0	0	0	111.3	L43 H49 T51	L43-I47 HydrophobicContact CB-CD1 4.41Å; L43-I47 HydrophobicContact CD2-CD1 4.02Å; L43-I47 VanDerWaalsContact O-CB 3.29Å; L43-I47 WeakPolarHBondContact O-CB 3.43Å; L43-I47 WeakPolarHBondContact O-CD1 3.29Å; L43-I47 WeakPolarHBondContact O-CG1 3.46Å; L43-I47 PolarHBondContact O-N 3.47Å; I47-H49 VanDerWaalsContact C-N 3.28Å; I47-H49 PolarHBondContact O-N 2.96Å; I47-T51 HydrophobicContact CG2-CG2 4.29Å; I47-T51 WeakPolarHBondContact O-CB 3.47Å; I47-T51 WeakPolarHBondContact O-CG2 3.27Å; I47-T51 PolarHBondContact O-N 3.45Å; I47-T51 PolarHBondContact O-OG1 2.95Å
48	C	35.7	Very low	39	Very low	96 Å²	96	117.7 Å²	117.7	65%	0.649	60%	0.6	S	S	*	*	H	α-helix	trans	-69.1	-24.4	174.8	-129.4	0	0	0	0	113.1	R44 N45 T46 T51	R44-C48 WeakPolarHBondContact O-CB 3.33Å; R44-C48 PolarHBondContact O-N 3.33Å; R44-C48 VanDerWaalsContact O-N 3.07Å; N45-C48 PolarHBondContact O-N 2.97Å; T46-C48 VanDerWaalsContact C-N 3.3Å; T46-C48 PolarHBondContact O-N 3.43Å; C48-T51 PolarHBondContact O-OG1 3.35Å
49	H	38.2	Very low	38.8	Very low	160 Å²	160	111.8 Å²	111.8	74%	0.741	58%	0.579	S	S	*	*	H	α-helix	trans	-94.4	-28	-179.7	-71.7	-59.3	0	0	0	113.7	N45 T46 I47	N45-H49 PolarHBondContact O-CD2 3.08Å; N45-H49 PolarHBondContact O-N 3.09Å; T46-H49 PolarHBondContact O-N 3.46Å; T46-H49 VanDerWaalsContact O-N 3.09Å; I47-H49 VanDerWaalsContact C-N 3.28Å; I47-H49 PolarHBondContact O-N 2.96Å
50	T	38.8	Very low	38.3	Very low	72 Å²	72	109.2 Å²	109.2	44%	0.442	57%	0.568	S	S	.	*	H	α-helix	trans	-85.7	-14.5	179.1	48.5	0	0	0	0	114.1	T46 G52 Q53	T46-T50 PolarHBondContact O-N 3.42Å; T46-T50 PolarHBondContact O-OG1 3.27Å; T46-T50 VanDerWaalsContact O-OG1 3.06Å; T50-G52 PolarHBondContact O-N 2.95Å; T50-Q53 PolarHBondContact O-N 3.31Å
51	T	40.2	Very low	38	Very low	106 Å²	106	110.7 Å²	110.7	65%	0.65	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	4.8	-176	34.9	0	0	0	0	115.2	I47 C48	I47-T51 HydrophobicContact CG2-CG2 4.29Å; I47-T51 WeakPolarHBondContact O-CB 3.47Å; I47-T51 WeakPolarHBondContact O-CG2 3.27Å; I47-T51 PolarHBondContact O-N 3.45Å; I47-T51 PolarHBondContact O-OG1 2.95Å; C48-T51 PolarHBondContact O-OG1 3.35Å
52	G	35.2	Very low	38.1	Very low	71 Å²	71	106.6 Å²	106.6	73%	0.732	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-6.4	174.3	0	0	0	0	0	116.5	T50	T50-G52 PolarHBondContact O-N 2.95Å
53	Q	37	Very low	38	Very low	176 Å²	176	108.6 Å²	108.6	82%	0.822	57%	0.571	S	S	*	*	S	Bend	trans	-129.7	2.3	-162.3	-92.4	179.7	-23.1	0	0	117.7	T50	T50-Q53 PolarHBondContact O-N 3.31Å
54	I	33.2	Very low	38	Very low	101 Å²	101	108.7 Å²	108.7	52%	0.518	57%	0.572	S	S	.	*			trans	-108	89.6	-173.5	-51.7	179.3	0	0	0	110.2	I60	I54-I60 HydrophobicContact CG2-CG1 4.17Å
55	Q	34	Very low	38.4	Very low	195 Å²	195	104.6 Å²	104.6	91%	0.911	57%	0.574	S	S	*	*			trans	-97.8	20	-177.3	-73.8	-167.9	-9.6	0	0	115.1
56	S	39.4	Very low	38.6	Very low	68 Å²	68	106.1 Å²	106.1	48%	0.476	58%	0.581	S	S	.	*			trans	-148.2	138	172.7	71.1	0	0	0	0	113.7	Q58 G59	S56-Q58 PolarHBondContact O-N 3.19Å; S56-Q58 VanDerWaalsContact O-N 3.13Å; S56-G59 PolarHBondContact O-N 3.35Å; S56-G59 PolarHBondContact OG-N 2.86Å
57	R	36.3	Very low	38.9	Very low	209 Å²	209	105.5 Å²	105.5	79%	0.789	58%	0.581	S	S	*	*	H	α-helix	trans	-51.9	-29.7	172.9	-172.1	177.8	171.6	-167	-4.4	112.5
58	Q	45.4	Very low	39	Very low	110 Å²	110	111.3 Å²	111.3	51%	0.514	60%	0.603	S	S	.	*	H	α-helix	trans	-72.5	-32.6	177.3	-161.5	61.7	40.2	0	0	113	S56 I60 I61 N62	S56-Q58 PolarHBondContact O-N 3.19Å; S56-Q58 VanDerWaalsContact O-N 3.13Å; Q58-I60 PolarHBondContact O-N 3.13Å; Q58-I61 PolarHBondContact O-N 3.47Å; Q58-N62 PolarHBondContact O-N 2.73Å
59	G	38.5	Very low	39.1	Very low	24 Å²	24	114 Å²	114	25%	0.247	61%	0.606	C	S	.	*	H	α-helix	trans	-64.2	-30.5	177.2	0	0	0	0	0	113.2	S56 L63	S56-G59 PolarHBondContact O-N 3.35Å; S56-G59 PolarHBondContact OG-N 2.86Å; G59-L63 PolarHBondContact O-N 2.89Å
60	I	34.4	Very low	39	Very low	74 Å²	74	115.4 Å²	115.4	38%	0.379	61%	0.613	S	S	.	*	H	α-helix	trans	-76	-39.6	177.2	-60.1	177.1	0	0	0	111.1	I54 Q58 N62 L63 L64	I54-I60 HydrophobicContact CG2-CG1 4.17Å; Q58-I60 PolarHBondContact O-N 3.13Å; I60-N62 VanDerWaalsContact C-N 3.33Å; I60-N62 PolarHBondContact O-N 2.98Å; I60-L63 PolarHBondContact O-N 3.33Å; I60-L64 HydrophobicContact CG2-CD1 4Å; I60-L64 WeakPolarHBondContact O-CG 3.25Å; I60-L64 PolarHBondContact O-N 3.45Å; I60-L64 VanDerWaalsContact O-N 3.17Å
61	I	41.7	Very low	39.1	Very low	84 Å²	84	119 Å²	119	43%	0.431	63%	0.629	S	S	.	*	H	α-helix	trans	-62.7	-41.2	178.1	-66	170.7	0	0	0	110.9	Q58 L63 L64 A65	Q58-I61 PolarHBondContact O-N 3.47Å; I61-L63 VanDerWaalsContact C-N 3.31Å; I61-L63 PolarHBondContact O-N 3.42Å; I61-L64 PolarHBondContact O-N 3.29Å; I61-A65 PolarHBondContact O-N 3.3Å
62	N	46.5	Very low	39.1	Very low	98 Å²	98	117.6 Å²	117.6	52%	0.524	62%	0.617	S	S	.	*	H	α-helix	trans	-68.4	-30	179.7	-67.1	-2	0	0	0	112.8	Q58 I60	Q58-N62 PolarHBondContact O-N 2.73Å; I60-N62 VanDerWaalsContact C-N 3.33Å; I60-N62 PolarHBondContact O-N 2.98Å
63	L	38.8	Very low	39.4	Very low	119 Å²	119	118.1 Å²	118.1	62%	0.623	60%	0.602	S	S	*	*	H	α-helix	trans	-75.4	-27.1	174.9	-84.1	160.7	0	0	0	112.9	G59 I60 I61	G59-L63 PolarHBondContact O-N 2.89Å; I60-L63 PolarHBondContact O-N 3.33Å; I61-L63 VanDerWaalsContact C-N 3.31Å; I61-L63 PolarHBondContact O-N 3.42Å
64	L	39	Very low	40.1	Very low	81 Å²	81	117 Å²	117	42%	0.424	60%	0.597	S	S	.	*	H	α-helix	trans	-78	-27.1	177.5	-74.1	164.7	0	0	0	112.9	I60 I61 D66 S67	I60-L64 HydrophobicContact CG2-CD1 4Å; I60-L64 WeakPolarHBondContact O-CG 3.25Å; I60-L64 PolarHBondContact O-N 3.45Å; I60-L64 VanDerWaalsContact O-N 3.17Å; I61-L64 PolarHBondContact O-N 3.29Å; L64-D66 VanDerWaalsContact C-N 3.25Å; L64-D66 PolarHBondContact O-N 2.98Å; L64-S67 PolarHBondContact O-OG 2.87Å
65	A	44.7	Very low	41	Very low	81 Å²	81	114.6 Å²	114.6	67%	0.669	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-21.5	177.8	0	0	0	0	0	113.5	I61	I61-A65 PolarHBondContact O-N 3.3Å
66	D	44	Very low	42	Very low	138 Å²	138	106.3 Å²	106.3	74%	0.738	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-12.2	-178.3	-84.9	-20.7	0	0	0	114	L64 K68	L64-D66 VanDerWaalsContact C-N 3.25Å; L64-D66 PolarHBondContact O-N 2.98Å; D66-K68 PolarHBondContact O-N 3.5Å
67	S	41.1	Very low	43	Very low	72 Å²	72	109 Å²	109	50%	0.503	56%	0.561	S	S	.	*			trans	-86.1	97.1	175.5	60.8	0	0	0	0	110.9	L64 H69	L64-S67 PolarHBondContact O-OG 2.87Å; S67-H69 PolarHBondContact O-N 3.33Å
68	K	37.7	Very low	44.2	Very low	202 Å²	202	104.4 Å²	104.4	88%	0.878	55%	0.549	S	S	*	.			trans	-65.8	47.9	174.4	-64.3	-175.4	175.3	-175.5	0	114.8	D66	D66-K68 PolarHBondContact O-N 3.5Å
69	H	36.8	Very low	44.9	Very low	153 Å²	153	100.5 Å²	100.5	71%	0.708	53%	0.53	S	S	*	.			trans	-111.5	69.1	171.3	-85.7	-72.5	0	0	0	109.7	S67 D71	S67-H69 PolarHBondContact O-N 3.33Å; H69-D71 VanDerWaalsContact C-N 3.34Å
70	E	37	Very low	46.1	Very low	190 Å²	190	104.6 Å²	104.6	89%	0.888	55%	0.551	S	S	*	*			trans	-80.4	-6.2	176.3	-82.7	-176.3	144	0	0	113.9
71	D	40.1	Very low	47.7	Very low	147 Å²	147	107.1 Å²	107.1	79%	0.786	56%	0.561	S	S	*	*	S	Bend	trans	-110.6	18.2	-163.6	-68	-33.7	0	0	0	117.6	H69	H69-D71 VanDerWaalsContact C-N 3.34Å
72	L	40.8	Very low	48.4	Very low	77 Å²	77	105 Å²	105	40%	0.403	55%	0.548	S	S	.	.			trans	-120.4	12.8	-163.3	-81.7	167.3	0	0	0	120
73	I	41.5	Very low	49	Very low	81 Å²	81	104 Å²	104	42%	0.415	55%	0.548	S	S	.	.			trans	-134.2	83.4	172	-49.1	178.5	0	0	0	111.3
74	H	50.5	Low	50	Low	152 Å²	152	104.7 Å²	104.7	70%	0.704	55%	0.552	S	S	*	*			trans	-78.2	126.3	164.9	-79.4	-41.1	0	0	0	109.9
75	S	52.5	Low	51	Low	52 Å²	52	105.4 Å²	105.4	36%	0.364	56%	0.556	S	S	.	*			trans	37.3	130.7	169.5	-164.6	0	0	0	0	119.7	D77 E78	S75-D77 PolarHBondContact O-N 3.34Å; S75-D77 PolarHBondContact OG-N 3.33Å; S75-D77 PolarHBondContact OG-OD2 2.95Å; S75-E78 PolarHBondContact O-N 3.4Å
76	P	55.8	Low	51.8	Low	21 Å²	21	104 Å²	104	14%	0.136	54%	0.536	C	S	.	.	G	3₁₀ helix	trans	-62.1	-11.8	175	26.6	-31.8	0	0	0	113.9	E78 F79 W94	P76-E78 VanDerWaalsContact C-N 3.25Å; P76-E78 PolarHBondContact O-N 3.33Å; P76-F79 PolarHBondContact O-N 3.29Å; P76-W94 HydrophobicContact CB-CD2 4.38Å; P76-W94 HydrophobicContact CB-CG 4.43Å; P76-W94 HydrophobicContact CG-CD2 3.86Å; P76-W94 HydrophobicContact CG-CE3 3.95Å; P76-W94 HydrophobicContact CG-CG 4.4Å; P76-W94 HydrophobicContact CG-CH2 4.32Å; P76-W94 HydrophobicContact CG-CZ2 4.23Å; P76-W94 HydrophobicContact CG-CZ3 4.17Å
77	D	60.1	Low	52.8	Low	123 Å²	123	99.5 Å²	99.5	66%	0.658	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-69.5	-15.9	-179.5	-64.7	-32.1	0	0	0	114.1	S75 F79	S75-D77 PolarHBondContact O-N 3.34Å; S75-D77 PolarHBondContact OG-N 3.33Å; S75-D77 PolarHBondContact OG-OD2 2.95Å; D77-F79 PolarHBondContact O-N 3.28Å
78	E	60.8	Low	53.9	Low	114 Å²	114	102 Å²	102	53%	0.533	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-73.8	-9.5	176.3	-68.3	-165.8	158.9	0	0	113.5	S75 P76	S75-E78 PolarHBondContact O-N 3.4Å; P76-E78 VanDerWaalsContact C-N 3.25Å; P76-E78 PolarHBondContact O-N 3.33Å
79	F	60.5	Low	55.2	Low	27 Å²	27	95.2 Å²	95.2	12%	0.118	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-104.5	17.2	-169.7	-58.4	-58.7	0	0	0	114.8	P76 D77 H81 F82 Q87 I90	P76-F79 PolarHBondContact O-N 3.29Å; D77-F79 PolarHBondContact O-N 3.28Å; F79-H81 PolarHBondContact O-N 3.01Å; F79-H81 VanDerWaalsContact O-N 3.1Å; F79-F82 HydrophobicContact CB-CD2 3.88Å; F79-F82 HydrophobicContact CB-CE2 4.45Å; F79-F82 AromaticContact CD1-CD2 3.95Å; F79-F82 HydrophobicContact CD1-CD2 3.95Å; F79-F82 AromaticContact CD1-CE2 3.63Å; F79-F82 HydrophobicContact CD1-CE2 3.63Å; F79-F82 HydrophobicContact CE1-CE2 4.39Å; F79-F82 HydrophobicContact CG-CD2 4.35Å; F79-F82 HydrophobicContact CG-CE2 4.46Å; F79-F82 PolarHBondContact O-N 3.2Å; F79-F82 VanDerWaalsContact O-N 3.12Å; F79-Q87 WeakPolarHBondContact O-CG 3.35Å; F79-Q87 PolarHBondContact O-NE2 3.35Å; F79-I90 HydrophobicContact CB-CD1 3.86Å; F79-I90 HydrophobicContact CD1-CD1 4.29Å; F79-I90 HydrophobicContact CD2-CD1 4.3Å; F79-I90 HydrophobicContact CD2-CG2 3.73Å; F79-I90 HydrophobicContact CE2-CG2 4.27Å; F79-I90 HydrophobicContact CG-CD1 3.87Å; F79-I90 HydrophobicContact CG-CG2 4.33Å
80	T	64.6	Low	56.7	Low	111 Å²	111	88.4 Å²	88.4	68%	0.681	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-16.7	-178.9	55	0	0	0	0	114.3	F82 Q87	T80-F82 VanDerWaalsContact C-N 3.33Å; T80-Q87 VanDerWaalsContact C-NE2 3.3Å; T80-Q87 PolarHBondContact O-NE2 2.95Å
81	H	68.1	Low	58.1	Low	127 Å²	127	82.5 Å²	82.5	59%	0.588	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.9	177.2	99.2	73.6	0	0	0	113.6	F79	F79-H81 PolarHBondContact O-N 3.01Å; F79-H81 VanDerWaalsContact O-N 3.1Å
82	F	55.1	Low	59.5	Low	38 Å²	38	82.6 Å²	82.6	17%	0.167	43%	0.426	C	S	.	.	S	Bend	trans	-77.4	147.8	-175.9	-77.6	-72.5	0	0	0	112	M15 F79 T80 I86 Q87 I90	M15-F82 HydrophobicContact SD-CE1 4.34Å; F79-F82 HydrophobicContact CB-CD2 3.88Å; F79-F82 HydrophobicContact CB-CE2 4.45Å; F79-F82 AromaticContact CD1-CD2 3.95Å; F79-F82 HydrophobicContact CD1-CD2 3.95Å; F79-F82 AromaticContact CD1-CE2 3.63Å; F79-F82 HydrophobicContact CD1-CE2 3.63Å; F79-F82 HydrophobicContact CE1-CE2 4.39Å; F79-F82 HydrophobicContact CG-CD2 4.35Å; F79-F82 HydrophobicContact CG-CE2 4.46Å; F79-F82 PolarHBondContact O-N 3.2Å; F79-F82 VanDerWaalsContact O-N 3.12Å; T80-F82 VanDerWaalsContact C-N 3.33Å; F82-I86 HydrophobicContact CB-CB 3.99Å; F82-I86 HydrophobicContact CB-CG2 3.76Å; F82-I86 HydrophobicContact CD1-CB 4.48Å; F82-I86 HydrophobicContact CD1-CG2 3.82Å; F82-I86 HydrophobicContact CG-CB 4.48Å; F82-I86 HydrophobicContact CG-CG2 3.79Å; F82-Q87 HydrophobicContact CB-CG 4.14Å; F82-Q87 WeakPolarHBondContact O-CG 3.44Å; F82-Q87 PolarHBondContact O-NE2 3.34Å; F82-I90 HydrophobicContact CD2-CD1 4.19Å
83	P	59	Low	60.6	Low	79 Å²	79	79.5 Å²	79.5	51%	0.513	41%	0.41	S	S	.	.			trans	-52.7	145.8	171	-28.7	37	0	0	0	112.9	N85 I86 Q87	P83-N85 WeakPolarHBondContact CB-OD1 3.23Å; P83-N85 PolarHBondContact O-N 3.38Å; P83-I86 WeakPolarHBondContact O-CA 3.45Å; P83-I86 WeakPolarHBondContact O-CB 3.27Å; P83-I86 PolarHBondContact O-N 3.43Å; P83-Q87 PolarHBondContact O-N 3.31Å; P83-Q87 VanDerWaalsContact O-N 3.1Å
84	N	60.9	Low	62	Low	133 Å²	133	79.7 Å²	79.7	71%	0.711	41%	0.406	S	S	*	.	H	α-helix	trans	-51.3	-32.6	-173.1	-70.5	-14.5	0	0	0	114.9	M88	N84-M88 WeakPolarHBondContact O-CB 3.38Å; N84-M88 PolarHBondContact O-N 3.21Å
85	N	59.7	Low	62.9	Low	96 Å²	96	78.2 Å²	78.2	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-66.7	-39.4	176.2	59.3	-46.2	0	0	0	112.3	P83 I89	P83-N85 WeakPolarHBondContact CB-OD1 3.23Å; P83-N85 PolarHBondContact O-N 3.38Å; N85-I89 VanDerWaalsContact O-CG1 3.31Å; N85-I89 WeakPolarHBondContact O-CG1 3.48Å; N85-I89 PolarHBondContact O-N 3.43Å
86	I	60.4	Low	63.5	Low	50 Å²	50	78.8 Å²	78.8	26%	0.256	40%	0.398	S	S	.	.	H	α-helix	trans	-71.4	-46.6	176.6	-61.3	-75.9	0	0	0	109.6	F82 P83 M88 I89 I90	F82-I86 HydrophobicContact CB-CB 3.99Å; F82-I86 HydrophobicContact CB-CG2 3.76Å; F82-I86 HydrophobicContact CD1-CB 4.48Å; F82-I86 HydrophobicContact CD1-CG2 3.82Å; F82-I86 HydrophobicContact CG-CB 4.48Å; F82-I86 HydrophobicContact CG-CG2 3.79Å; P83-I86 WeakPolarHBondContact O-CA 3.45Å; P83-I86 WeakPolarHBondContact O-CB 3.27Å; P83-I86 PolarHBondContact O-N 3.43Å; I86-M88 VanDerWaalsContact C-N 3.26Å; I86-M88 PolarHBondContact O-N 3.2Å; I86-I89 WeakPolarHBondContact O-CA 3.5Å; I86-I89 WeakPolarHBondContact O-CB 3.17Å; I86-I89 PolarHBondContact O-N 3.35Å; I86-I90 HydrophobicContact CG2-CD1 3.75Å; I86-I90 HydrophobicContact CG2-CG1 4.24Å; I86-I90 WeakPolarHBondContact O-CG1 3.42Å; I86-I90 PolarHBondContact O-N 2.93Å
87	Q	65.1	Low	63.4	Low	45 Å²	45	84.2 Å²	84.2	21%	0.21	42%	0.417	C	S	.	.	H	α-helix	trans	-56.4	-40.5	175.1	-72.8	-177.4	10.5	0	0	112.3	F79 T80 F82 P83 I89 I90 N91	F79-Q87 WeakPolarHBondContact O-CG 3.35Å; F79-Q87 PolarHBondContact O-NE2 3.35Å; T80-Q87 VanDerWaalsContact C-NE2 3.3Å; T80-Q87 PolarHBondContact O-NE2 2.95Å; F82-Q87 HydrophobicContact CB-CG 4.14Å; F82-Q87 WeakPolarHBondContact O-CG 3.44Å; F82-Q87 PolarHBondContact O-NE2 3.34Å; P83-Q87 PolarHBondContact O-N 3.31Å; P83-Q87 VanDerWaalsContact O-N 3.1Å; Q87-I89 VanDerWaalsContact C-N 3.33Å; Q87-I89 PolarHBondContact O-N 2.85Å; Q87-I90 PolarHBondContact O-N 3Å; Q87-N91 VanDerWaalsContact O-CB 3.26Å; Q87-N91 WeakPolarHBondContact O-CB 3.47Å; Q87-N91 PolarHBondContact O-N 2.96Å; Q87-N91 PolarHBondContact O-ND2 2.99Å; Q87-N91 VanDerWaalsContact O-ND2 3.1Å
88	M	65.3	Low	63.4	Low	123 Å²	123	82.9 Å²	82.9	61%	0.606	40%	0.403	S	S	*	.	H	α-helix	trans	-62	-41.1	175.6	-175.9	-166.3	69.8	0	0	111.7	N84 I86 K92	N84-M88 WeakPolarHBondContact O-CB 3.38Å; N84-M88 PolarHBondContact O-N 3.21Å; I86-M88 VanDerWaalsContact C-N 3.26Å; I86-M88 PolarHBondContact O-N 3.2Å; M88-K92 WeakPolarHBondContact O-CB 3.5Å; M88-K92 PolarHBondContact O-N 3.43Å
89	I	65.4	Low	63.2	Low	61 Å²	61	82.7 Å²	82.7	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-65.3	-51.2	177.3	-68	165	0	0	0	109.6	I8 N85 I86 Q87 N91 K92 T93	I8-I89 HydrophobicContact CD1-CG2 4.08Å; I8-I89 HydrophobicContact CG2-CG2 3.58Å; N85-I89 VanDerWaalsContact O-CG1 3.31Å; N85-I89 WeakPolarHBondContact O-CG1 3.48Å; N85-I89 PolarHBondContact O-N 3.43Å; I86-I89 WeakPolarHBondContact O-CA 3.5Å; I86-I89 WeakPolarHBondContact O-CB 3.17Å; I86-I89 PolarHBondContact O-N 3.35Å; Q87-I89 VanDerWaalsContact C-N 3.33Å; Q87-I89 PolarHBondContact O-N 2.85Å; I89-N91 PolarHBondContact O-N 3.23Å; I89-K92 PolarHBondContact O-N 3.46Å; I89-K92 VanDerWaalsContact O-N 3.11Å; I89-T93 HydrophobicContact CG2-CG2 4.32Å; I89-T93 WeakPolarHBondContact O-CG2 3.45Å; I89-T93 PolarHBondContact O-N 3.17Å; I89-T93 PolarHBondContact O-OG1 3.41Å
90	I	66.6	Low	62.6	Low	9 Å²	9	87.6 Å²	87.6	5%	0.046	43%	0.426	C	S	.	.	H	α-helix	trans	-55.1	-50.3	178.1	-66.4	171.9	0	0	0	110.6	L12 F79 F82 I86 Q87 K92 T93 W94	L12-I90 HydrophobicContact CD1-CG1 3.95Å; L12-I90 HydrophobicContact CD2-CD1 4Å; L12-I90 HydrophobicContact CD2-CG1 3.79Å; F79-I90 HydrophobicContact CB-CD1 3.86Å; F79-I90 HydrophobicContact CD1-CD1 4.29Å; F79-I90 HydrophobicContact CD2-CD1 4.3Å; F79-I90 HydrophobicContact CD2-CG2 3.73Å; F79-I90 HydrophobicContact CE2-CG2 4.27Å; F79-I90 HydrophobicContact CG-CD1 3.87Å; F79-I90 HydrophobicContact CG-CG2 4.33Å; F82-I90 HydrophobicContact CD2-CD1 4.19Å; I86-I90 HydrophobicContact CG2-CD1 3.75Å; I86-I90 HydrophobicContact CG2-CG1 4.24Å; I86-I90 WeakPolarHBondContact O-CG1 3.42Å; I86-I90 PolarHBondContact O-N 2.93Å; Q87-I90 PolarHBondContact O-N 3Å; I90-K92 VanDerWaalsContact C-N 3.31Å; I90-K92 PolarHBondContact O-N 3.43Å; I90-T93 WeakPolarHBondContact CA-OG1 3.45Å; I90-T93 PolarHBondContact O-N 2.8Å; I90-T93 PolarHBondContact O-OG1 2.8Å; I90-W94 WeakPolarHBondContact O-CB 3.29Å; I90-W94 PolarHBondContact O-N 3.37Å
91	N	67.9	Low	61.6	Low	66 Å²	66	86.8 Å²	86.8	35%	0.353	42%	0.418	S	S	.	.	H	α-helix	trans	-62.7	-37.7	179	-80.9	-42.8	0	0	0	112.5	Q87 I89 K95	Q87-N91 VanDerWaalsContact O-CB 3.26Å; Q87-N91 WeakPolarHBondContact O-CB 3.47Å; Q87-N91 PolarHBondContact O-N 2.96Å; Q87-N91 PolarHBondContact O-ND2 2.99Å; Q87-N91 VanDerWaalsContact O-ND2 3.1Å; I89-N91 PolarHBondContact O-N 3.23Å; N91-K95 WeakPolarHBondContact O-CB 3.09Å; N91-K95 VanDerWaalsContact O-CG 3.31Å; N91-K95 WeakPolarHBondContact O-CG 3.31Å; N91-K95 PolarHBondContact O-N 3.33Å
92	K	69.1	Low	60.5	Low	150 Å²	150	86.2 Å²	86.2	65%	0.652	42%	0.419	S	S	*	.	H	α-helix	trans	-71.3	-42.3	178.6	-167.7	174.7	-177.4	-177.3	0	111.3	M88 I89 I90 T96	M88-K92 WeakPolarHBondContact O-CB 3.5Å; M88-K92 PolarHBondContact O-N 3.43Å; I89-K92 PolarHBondContact O-N 3.46Å; I89-K92 VanDerWaalsContact O-N 3.11Å; I90-K92 VanDerWaalsContact C-N 3.31Å; I90-K92 PolarHBondContact O-N 3.43Å; K92-T96 PolarHBondContact O-N 2.96Å; K92-T96 PolarHBondContact O-OG1 2.81Å
93	T	64.7	Low	60	Low	12 Å²	12	89.6 Å²	89.6	7%	0.074	44%	0.439	C	S	.	.	H	α-helix	trans	-66.6	-43.5	176.7	48.2	0	0	0	0	111.4	I8 I89 I90 T96 Y97	I8-T93 HydrophobicContact CB-CG2 4.42Å; I8-T93 HydrophobicContact CD1-CG2 4.42Å; I8-T93 HydrophobicContact CG2-CG2 3.92Å; I89-T93 HydrophobicContact CG2-CG2 4.32Å; I89-T93 WeakPolarHBondContact O-CG2 3.45Å; I89-T93 PolarHBondContact O-N 3.17Å; I89-T93 PolarHBondContact O-OG1 3.41Å; I90-T93 WeakPolarHBondContact CA-OG1 3.45Å; I90-T93 PolarHBondContact O-N 2.8Å; I90-T93 PolarHBondContact O-OG1 2.8Å; T93-T96 VanDerWaalsContact CA-OG1 3.27Å; T93-T96 WeakPolarHBondContact CA-OG1 3.35Å; T93-T96 PolarHBondContact O-N 2.86Å; T93-T96 PolarHBondContact O-OG1 3.36Å; T93-Y97 WeakPolarHBondContact O-CB 3.26Å; T93-Y97 PolarHBondContact O-N 2.87Å
94	W	69.1	Low	59.3	Low	85 Å²	85	89.6 Å²	89.6	32%	0.322	45%	0.445	S	S	.	.	H	α-helix	trans	-60.2	-47.7	176.3	-171.8	83.1	0	0	0	110.9	P76 I90 T96 Y97 Y98	P76-W94 HydrophobicContact CB-CD2 4.38Å; P76-W94 HydrophobicContact CB-CG 4.43Å; P76-W94 HydrophobicContact CG-CD2 3.86Å; P76-W94 HydrophobicContact CG-CE3 3.95Å; P76-W94 HydrophobicContact CG-CG 4.4Å; P76-W94 HydrophobicContact CG-CH2 4.32Å; P76-W94 HydrophobicContact CG-CZ2 4.23Å; P76-W94 HydrophobicContact CG-CZ3 4.17Å; I90-W94 WeakPolarHBondContact O-CB 3.29Å; I90-W94 PolarHBondContact O-N 3.37Å; W94-T96 PolarHBondContact O-N 2.9Å; W94-Y97 PolarHBondContact O-N 3.44Å; W94-Y98 AromaticContact CD1-CD2 3.54Å; W94-Y98 AromaticContact CD1-CE2 3.4Å; W94-Y98 AromaticContact CD2-CD2 3.95Å; W94-Y98 HydrophobicContact CD2-CD2 3.95Å; W94-Y98 HydrophobicContact CD2-CE2 4.47Å; W94-Y98 AromaticContact CE2-CD2 3.54Å; W94-Y98 AromaticContact CE2-CE2 3.81Å; W94-Y98 AromaticContact CG-CD2 3.92Å; W94-Y98 HydrophobicContact CG-CD2 3.92Å; W94-Y98 HydrophobicContact CG-CE2 4.23Å; W94-Y98 HydrophobicContact CZ2-CD2 4.15Å; W94-Y98 HydrophobicContact CZ2-CE2 4.49Å; W94-Y98 AromaticContact NE1-CD2 3.28Å; W94-Y98 VanDerWaalsContact NE1-CD2 3.28Å; W94-Y98 AromaticContact NE1-CE2 3.08Å; W94-Y98 WeakPolarHBondContact O-CD2 3.2Å; W94-Y98 PolarHBondContact O-N 3.28Å
95	K	70.1	Confident	58.4	Low	120 Å²	120	87 Å²	87	52%	0.522	44%	0.443	S	S	.	.	H	α-helix	trans	-59.4	-44.1	173.6	-78.9	-176.4	179.8	-173.8	0	112.8	N91 Y97 Q99	N91-K95 WeakPolarHBondContact O-CB 3.09Å; N91-K95 VanDerWaalsContact O-CG 3.31Å; N91-K95 WeakPolarHBondContact O-CG 3.31Å; N91-K95 PolarHBondContact O-N 3.33Å; K95-Y97 VanDerWaalsContact C-N 3.3Å; K95-Y97 PolarHBondContact O-N 3Å; K95-Q99 WeakPolarHBondContact O-CA 3.49Å; K95-Q99 WeakPolarHBondContact O-CB 3.34Å; K95-Q99 VanDerWaalsContact O-CG 3.29Å; K95-Q99 WeakPolarHBondContact O-CG 3.48Å; K95-Q99 PolarHBondContact O-N 3.1Å
96	T	66.1	Low	57.6	Low	64 Å²	64	90.6 Å²	90.6	39%	0.393	46%	0.456	S	S	.	.	H	α-helix	trans	-67.2	-30.1	178.1	39.6	0	0	0	0	113.7	K92 T93 W94 Q100	K92-T96 PolarHBondContact O-N 2.96Å; K92-T96 PolarHBondContact O-OG1 2.81Å; T93-T96 VanDerWaalsContact CA-OG1 3.27Å; T93-T96 WeakPolarHBondContact CA-OG1 3.35Å; T93-T96 PolarHBondContact O-N 2.86Å; T93-T96 PolarHBondContact O-OG1 3.36Å; W94-T96 PolarHBondContact O-N 2.9Å; T96-Q100 VanDerWaalsContact O-CG 3.23Å; T96-Q100 WeakPolarHBondContact O-CG 3.31Å
97	Y	52.7	Low	56.5	Low	135 Å²	135	94.9 Å²	94.9	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-75.4	-53.7	179.1	-157.6	-93	0	0	0	110.1	L9 T93 W94 K95 Q100	L9-Y97 HydrophobicContact CD1-CD2 3.98Å; L9-Y97 HydrophobicContact CD1-CE2 4.15Å; T93-Y97 WeakPolarHBondContact O-CB 3.26Å; T93-Y97 PolarHBondContact O-N 2.87Å; W94-Y97 PolarHBondContact O-N 3.44Å; K95-Y97 VanDerWaalsContact C-N 3.3Å; K95-Y97 PolarHBondContact O-N 3Å; Y97-Q100 PolarHBondContact O-N 3.46Å
98	Y	60	Low	55	Low	95 Å²	95	102 Å²	102	37%	0.373	51%	0.51	S	S	.	.	H	α-helix	trans	-79	-28.4	-176.7	-72.5	-80.2	0	0	0	114.3	W94 Q100 D101 D102	W94-Y98 AromaticContact CD1-CD2 3.54Å; W94-Y98 AromaticContact CD1-CE2 3.4Å; W94-Y98 AromaticContact CD2-CD2 3.95Å; W94-Y98 HydrophobicContact CD2-CD2 3.95Å; W94-Y98 HydrophobicContact CD2-CE2 4.47Å; W94-Y98 AromaticContact CE2-CD2 3.54Å; W94-Y98 AromaticContact CE2-CE2 3.81Å; W94-Y98 AromaticContact CG-CD2 3.92Å; W94-Y98 HydrophobicContact CG-CD2 3.92Å; W94-Y98 HydrophobicContact CG-CE2 4.23Å; W94-Y98 HydrophobicContact CZ2-CD2 4.15Å; W94-Y98 HydrophobicContact CZ2-CE2 4.49Å; W94-Y98 AromaticContact NE1-CD2 3.28Å; W94-Y98 VanDerWaalsContact NE1-CD2 3.28Å; W94-Y98 AromaticContact NE1-CE2 3.08Å; W94-Y98 WeakPolarHBondContact O-CD2 3.2Å; W94-Y98 PolarHBondContact O-N 3.28Å; Y98-Q100 PolarHBondContact O-N 3.12Å; Y98-D101 PolarHBondContact O-N 2.92Å; Y98-D102 PolarHBondContact O-N 3.09Å
99	Q	56.6	Low	53.6	Low	111 Å²	111	104.3 Å²	104.3	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-73.8	-11.6	171.3	-68.2	-176.6	-68.8	0	0	113	K95 D101 N103	K95-Q99 WeakPolarHBondContact O-CA 3.49Å; K95-Q99 WeakPolarHBondContact O-CB 3.34Å; K95-Q99 VanDerWaalsContact O-CG 3.29Å; K95-Q99 WeakPolarHBondContact O-CG 3.48Å; K95-Q99 PolarHBondContact O-N 3.1Å; Q99-D101 VanDerWaalsContact C-N 3.34Å; Q99-N103 PolarHBondContact O-ND2 3.43Å
100	Q	49	Very low	52	Low	129 Å²	129	108.7 Å²	108.7	60%	0.603	54%	0.543	S	S	*	.	H	α-helix	trans	-75	-28.7	169	-81	178.1	2.6	0	0	111.7	T96 Y97 Y98 A104	T96-Q100 VanDerWaalsContact O-CG 3.23Å; T96-Q100 WeakPolarHBondContact O-CG 3.31Å; Y97-Q100 PolarHBondContact O-N 3.46Å; Y98-Q100 PolarHBondContact O-N 3.12Å; Q100-A104 WeakPolarHBondContact O-CB 3.19Å; Q100-A104 PolarHBondContact O-N 3.11Å
101	D	42.4	Very low	50.2	Low	95 Å²	95	116.1 Å²	116.1	51%	0.508	58%	0.581	S	S	.	*	H	α-helix	trans	-76.5	-38.3	178.5	-67.8	-29.7	0	0	0	112.3	Y98 Q99 N103 A104 A105	Y98-D101 PolarHBondContact O-N 2.92Å; Q99-D101 VanDerWaalsContact C-N 3.34Å; D101-N103 VanDerWaalsContact C-N 3.32Å; D101-N103 PolarHBondContact O-N 2.78Å; D101-A104 PolarHBondContact O-N 2.97Å; D101-A105 PolarHBondContact O-N 3.1Å
102	D	45	Very low	48.5	Very low	115 Å²	115	120.1 Å²	120.1	62%	0.615	60%	0.603	S	S	*	*	H	α-helix	trans	-66.7	-33.9	177.6	-67.7	-25.4	0	0	0	112.5	Y98 A104	Y98-D102 PolarHBondContact O-N 3.09Å; D102-A104 VanDerWaalsContact C-N 3.33Å
103	N	45.4	Very low	46.6	Very low	109 Å²	109	122.1 Å²	122.1	58%	0.583	61%	0.607	S	S	*	*	H	α-helix	trans	-81.9	-10.8	178.3	-69.5	-65.2	0	0	0	113.5	Q99 D101 N107	Q99-N103 PolarHBondContact O-ND2 3.43Å; D101-N103 VanDerWaalsContact C-N 3.32Å; D101-N103 PolarHBondContact O-N 2.78Å; N103-N107 PolarHBondContact O-ND2 2.99Å
104	A	43.1	Very low	45	Very low	78 Å²	78	128 Å²	128	65%	0.645	64%	0.639	S	S	*	*	H	α-helix	trans	-90.6	-20.7	175.9	0	0	0	0	0	113	Q100 D101 D102	Q100-A104 WeakPolarHBondContact O-CB 3.19Å; Q100-A104 PolarHBondContact O-N 3.11Å; D101-A104 PolarHBondContact O-N 2.97Å; D102-A104 VanDerWaalsContact C-N 3.33Å
105	A	41.9	Very low	43.1	Very low	80 Å²	80	132 Å²	132	66%	0.661	67%	0.666	S	S	*	*	H	α-helix	trans	-88.6	-29.2	-179	0	0	0	0	0	114.5	D101	D101-A105 PolarHBondContact O-N 3.1Å
106	E	43.6	Very low	41.1	Very low	171 Å²	171	132.2 Å²	132.2	80%	0.799	68%	0.678	S	S	*	*	S	Bend	trans	-90.5	-6.3	-176.1	-75.8	-171.2	156.7	0	0	115.5	K108	E106-K108 PolarHBondContact O-N 3.48Å
107	N	36.8	Very low	39.5	Very low	139 Å²	139	138.7 Å²	138.7	74%	0.743	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	31.5	-175.5	-76.6	-51.4	0	0	0	115.1	N103	N103-N107 PolarHBondContact O-ND2 2.99Å
108	K	34.7	Very low	38.5	Very low	196 Å²	196	138.2 Å²	138.2	85%	0.852	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-3.5	179.2	-118.2	178.6	-175.3	175.1	0	116.8	E106	E106-K108 PolarHBondContact O-N 3.48Å
109	E	34.4	Very low	36.9	Very low	171 Å²	171	144.4 Å²	144.4	80%	0.799	73%	0.731	S	S	*	*	S	Bend	trans	-137.1	131.8	175.2	-67.8	-172	168.4	0	0	111.6
110	N	31.7	Very low	35.8	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	74%	0.74	S	S	*	*			trans	72.8	79.3	175.1	-64	-52.7	0	0	0	116.7	D112	N110-D112 VanDerWaalsContact C-N 3.34Å; N110-D112 PolarHBondContact O-N 3.23Å; N110-D112 VanDerWaalsContact O-N 3.09Å
111	I	29.1	Very low	34.8	Very low	165 Å²	165	144.4 Å²	144.4	85%	0.846	75%	0.749	S	S	*	*			trans	-53.4	102.6	137.5	-60.3	166.5	0	0	0	107.2
112	D	32.1	Very low	34.2	Very low	151 Å²	151	145 Å²	145	81%	0.807	76%	0.761	S	S	*	*			trans	-128.1	132.9	149	-156.8	1.7	0	0	0	109.1	N110	N110-D112 VanDerWaalsContact C-N 3.34Å; N110-D112 PolarHBondContact O-N 3.23Å; N110-D112 VanDerWaalsContact O-N 3.09Å
113	Y	29.3	Very low	33.4	Very low	191 Å²	191	143.4 Å²	143.4	75%	0.749	76%	0.763	S	S	*	*			trans	-71.8	144.9	-169.8	-122.1	-108.6	0	0	0	109.5
114	N	31.1	Very low	32.8	Very low	137 Å²	137	145.4 Å²	145.4	73%	0.733	77%	0.773	S	S	*	*			trans	92.7	81.7	169.6	-46.3	-44.3	0	0	0	117.3
115	N	29.9	Very low	32.1	Very low	167 Å²	167	147.5 Å²	147.5	89%	0.893	78%	0.781	S	S	*	*				175	76.4	126.9	-94.4	-33.9	0	0	0	111.1	K117	N115-K117 PolarHBondContact O-N 2.98Å; N115-K117 VanDerWaalsContact O-N 3.12Å
116	T	29	Very low	31.6	Very low	126 Å²	126	149.6 Å²	149.6	77%	0.773	79%	0.786	S	S	*	*			trans	-74	95.6	166.1	-4.3	0	0	0	0	108.9	L118	T116-L118 HydrophobicContact CG2-CD1 3.37Å; T116-L118 PolarHBondContact O-N 3.1Å
117	K	32.4	Very low	31.2	Very low	200 Å²	200	146.7 Å²	146.7	87%	0.87	78%	0.783	S	S	*	*			trans	-78.3	72.1	158.3	-99.1	-178.8	179.6	173.1	0	108.6	N115 Y119	N115-K117 PolarHBondContact O-N 2.98Å; N115-K117 VanDerWaalsContact O-N 3.12Å; K117-Y119 PolarHBondContact O-N 2.9Å
118	L	30	Very low	31.2	Very low	125 Å²	125	149.3 Å²	149.3	65%	0.654	79%	0.791	S	S	*	*			trans	-56.3	128	153.8	-98.5	78.3	0	0	0	106.9	T116 P120	T116-L118 HydrophobicContact CG2-CD1 3.37Å; T116-L118 PolarHBondContact O-N 3.1Å; L118-P120 WeakPolarHBondContact O-CD 3.48Å
119	Y	27.5	Very low	31.3	Very low	225 Å²	225	144 Å²	144	88%	0.882	78%	0.783	S	S	*	*			trans	-69.6	107.2	158.6	-75.4	-84	0	0	0	107.2	K117 T121	K117-Y119 PolarHBondContact O-N 2.9Å; Y119-T121 PolarHBondContact O-N 2.98Å
120	P	33	Very low	31.4	Very low	108 Å²	108	142.8 Å²	142.8	70%	0.701	78%	0.783	S	S	*	*			trans	-83.8	108.8	-180	6.3	14.9	0	0	0	106.5	L118 S122	L118-P120 WeakPolarHBondContact O-CD 3.48Å; P120-S122 PolarHBondContact O-N 2.84Å
121	T	28.9	Very low	31.6	Very low	132 Å²	132	142.6 Å²	142.6	81%	0.81	78%	0.782	S	S	*	*			trans	-63.3	118.3	153.6	51.6	0	0	0	0	107.3	Y119	Y119-T121 PolarHBondContact O-N 2.98Å
122	S	29.4	Very low	31.8	Very low	107 Å²	107	140 Å²	140	75%	0.748	78%	0.778	S	S	*	*	S	Bend	trans	84.7	134.3	171.3	81.2	0	0	0	0	118.6	P120	P120-S122 PolarHBondContact O-N 2.84Å
123	A	28.7	Very low	31.9	Very low	81 Å²	81	140.6 Å²	140.6	67%	0.669	78%	0.78	S	S	*	*			trans	92	133.1	141.6	0	0	0	0	0	119.6
124	I	33.1	Very low	32.2	Very low	152 Å²	152	139 Å²	139	78%	0.779	78%	0.783	S	S	*	*			trans	86.1	107.8	146.5	-57.7	147.7	0	0	0	117.2	T126	I124-T126 HydrophobicContact CG2-CG2 4.22Å
125	C	27.2	Very low	32.2	Very low	121 Å²	121	143.1 Å²	143.1	82%	0.818	79%	0.789	S	S	*	*			trans	-85.9	126.6	168.2	170.9	0	0	0	0	109.7
126	T	32.6	Very low	32.4	Very low	124 Å²	124	141 Å²	141	76%	0.761	79%	0.785	S	S	*	*			trans	-149.1	93.9	167.6	45.7	0	0	0	0	111.2	I124	I124-T126 HydrophobicContact CG2-CG2 4.22Å
127	C	33.5	Very low	32.5	Very low	111 Å²	111	140.2 Å²	140.2	75%	0.75	79%	0.785	S	S	*	*			trans	-179.9	105.3	153.6	43.2	0	0	0	0	107.9
128	Q	38.5	Very low	32.4	Very low	193 Å²	193	136.3 Å²	136.3	90%	0.902	78%	0.781	S	S	*	*				46.6	94.6	79.8	-80.9	179.1	-25.3	0	0	114.4
129	A	35.5	Very low	32.5	Very low	84 Å²	84	135.1 Å²	135.1	69%	0.694	78%	0.783	S	S	*	*			trans	21.5	117.7	143.4	0	0	0	0	0	119.2
130	N	36.7	Very low	32.8	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	78%	0.78	S	S	*	*				-173	121.5	102.8	-85.1	-11.3	0	0	0	110.6
131	D	36.6	Very low	32.8	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	79%	0.785	S	S	*	*			trans	46.1	124.8	142.8	-60	-23.7	0	0	0	123.4
132	S	33.2	Very low	33.2	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	78%	0.782	S	S	*	*			trans	78.8	77.6	141.6	-53.5	0	0	0	0	119.2
133	I	33.2	Very low	33.6	Very low	164 Å²	164	130.4 Å²	130.4	84%	0.841	78%	0.78	S	S	*	*			trans	-138.2	126.5	149.6	-55.7	-178.3	0	0	0	111
134	I	36.3	Very low	34	Very low	158 Å²	158	134.2 Å²	134.2	81%	0.81	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-71.4	133.5	179.6	-65.4	160.7	0	0	0	109.9
135	Y	30.6	Very low	34.3	Very low	222 Å²	222	132 Å²	132	87%	0.871	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-82.5	134.3	172	-74.9	-85.5	0	0	0	111.1
136	P	33.9	Very low	34.9	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-84.2	126.4	168.7	31.2	-27.8	0	0	0	110.7
137	S	32.9	Very low	35.2	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	79%	0.79	S	S	*	*			trans	-75.8	114.8	163.5	53	0	0	0	0	109.7	S139	S137-S139 PolarHBondContact O-N 2.95Å
138	C	29.9	Very low	35.4	Very low	117 Å²	117	134.5 Å²	134.5	79%	0.791	79%	0.788	S	S	*	*			trans	-79.3	110.3	168.5	177.1	0	0	0	0	109.4
139	S	31.2	Very low	35.3	Very low	100 Å²	100	132.5 Å²	132.5	70%	0.699	78%	0.783	S	S	*	*			trans	-81	117.2	164.7	10	0	0	0	0	109.1	S137	S137-S139 PolarHBondContact O-N 2.95Å
140	T	34.6	Very low	35.6	Very low	134 Å²	134	137.1 Å²	137.1	82%	0.822	79%	0.79	S	S	*	*			trans	-91.6	107.8	161.3	49.7	0	0	0	0	108.9
141	T	31.8	Very low	35.8	Very low	130 Å²	130	138.4 Å²	138.4	80%	0.798	80%	0.796	S	S	*	*			trans	-75	132.2	171.5	48.9	0	0	0	0	111.4
142	S	37.4	Very low	35.9	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	80%	0.797	S	S	*	*			trans	-158.5	106.5	143.6	56.2	0	0	0	0	109.6
143	S	38.3	Very low	36.1	Very low	102 Å²	102	141.4 Å²	141.4	71%	0.713	80%	0.795	S	S	*	*			trans	33.6	109.3	147.2	55	0	0	0	0	118.7
144	D	36.7	Very low	36.3	Very low	160 Å²	160	142.4 Å²	142.4	86%	0.856	80%	0.796	S	S	*	*				-169.2	152.7	105.1	-90.2	-25.7	0	0	0	112.2
145	S	39.3	Very low	36.3	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	80%	0.797	S	S	*	*			trans	-79.1	167.2	-159.1	-55	0	0	0	0	114.8
146	I	40.6	Very low	36.4	Very low	153 Å²	153	141.2 Å²	141.2	79%	0.785	80%	0.799	S	S	*	*			trans	108.6	111.2	149.7	-56.9	163.5	0	0	0	116.8
147	M	38.5	Very low	36.3	Very low	171 Å²	171	138.8 Å²	138.8	84%	0.842	80%	0.796	S	S	*	*			trans	65.2	100.3	152.1	-60.1	-92.3	-142.8	0	0	118
148	A	36.9	Very low	36.4	Very low	86 Å²	86	138.7 Å²	138.7	71%	0.711	80%	0.796	S	S	*	*				70.9	97.6	80.3	0	0	0	0	0	115.2
149	N	37.8	Very low	36.2	Very low	151 Å²	151	139.3 Å²	139.3	81%	0.807	80%	0.8	S	S	*	*			trans	39.4	119.8	133.4	-77.1	-25.1	0	0	0	120.5
150	Q	41.4	Very low	36.4	Very low	181 Å²	181	141.1 Å²	141.1	85%	0.846	80%	0.8	S	S	*	*				141.2	108	127.3	-82.4	167.3	-3.5	0	0	111.5
151	L	41	Very low	36.2	Very low	174 Å²	174	142.1 Å²	142.1	91%	0.911	80%	0.796	S	S	*	*				166	125.3	117.1	-93.4	150.1	0	0	0	111.1
152	K	38.8	Very low	36.3	Very low	182 Å²	182	146.5 Å²	146.5	79%	0.791	80%	0.797	S	S	*	*			trans	-73.5	147.9	171.9	-100.9	174.5	174.9	175.1	0	110.5
153	N	36.7	Very low	36.1	Very low	138 Å²	138	147.1 Å²	147.1	74%	0.738	79%	0.788	S	S	*	*			trans	82.9	138.8	144	-67.6	-17.3	0	0	0	120.1
154	Q	36.8	Very low	36	Very low	185 Å²	185	148 Å²	148	86%	0.864	79%	0.79	S	S	*	*			trans	96.2	129.7	155.9	-71.3	172.3	7.6	0	0	118.2
155	L	37.3	Very low	36.1	Very low	161 Å²	161	148.4 Å²	148.4	84%	0.843	78%	0.784	S	S	*	*			trans	114	81.1	167.1	-60.8	161.4	0	0	0	111.6
156	Q	32.6	Very low	36	Very low	195 Å²	195	151.1 Å²	151.1	91%	0.911	79%	0.789	S	S	*	*				40.9	104.1	85.6	-73.7	-171.7	-4.2	0	0	113
157	G	32.6	Very low	35.9	Very low	70 Å²	70	154.8 Å²	154.8	72%	0.722	79%	0.793	S	S	*	*			trans	173.9	97.5	171.6	0	0	0	0	0	114.4
158	S	33.5	Very low	35.8	Very low	110 Å²	110	152.6 Å²	152.6	77%	0.769	79%	0.792	S	S	*	*			trans	56.3	101.5	154.5	53.6	0	0	0	0	120.9	I160	S158-I160 PolarHBondContact O-N 3.18Å
159	C	26.8	Very low	36.1	Very low	130 Å²	130	159.3 Å²	159.3	88%	0.878	80%	0.799	S	S	*	*			trans	-53.8	123.1	153.4	-58.4	0	0	0	0	111.6
160	I	34.7	Very low	36	Very low	138 Å²	138	157.7 Å²	157.7	71%	0.708	80%	0.796	S	S	*	*			trans	-127	96.6	155.9	-60.5	179	0	0	0	107.5	S158 R162	S158-I160 PolarHBondContact O-N 3.18Å; I160-R162 HydrophobicContact CG2-CG 4.27Å; I160-R162 PolarHBondContact O-N 3.07Å; I160-R162 VanDerWaalsContact O-N 3.12Å
161	E	30	Very low	35.7	Very low	155 Å²	155	156.7 Å²	156.7	72%	0.724	80%	0.796	S	S	*	*			trans	-74.1	91.8	179.8	-153.6	-178.3	168.3	0	0	109.7	Q163	E161-Q163 HydrophobicContact CG-CG 4.07Å; E161-Q163 PolarHBondContact O-N 2.8Å; E161-Q163 PolarHBondContact OE1-NE2 3.3Å
162	R	35.3	Very low	35.5	Very low	222 Å²	222	156.5 Å²	156.5	84%	0.838	80%	0.795	S	S	*	*			trans	-88.1	79	169.8	-72.2	-172.5	-179.8	-177.3	1.3	109.7	I160 T164	I160-R162 HydrophobicContact CG2-CG 4.27Å; I160-R162 PolarHBondContact O-N 3.07Å; I160-R162 VanDerWaalsContact O-N 3.12Å; R162-T164 VanDerWaalsContact C-N 3.31Å; R162-T164 PolarHBondContact O-N 3.4Å
163	Q	33.1	Very low	35.3	Very low	121 Å²	121	159 Å²	159	57%	0.565	80%	0.799	S	S	*	*			trans	-68.5	85.4	166.9	-65.4	-171.7	5.3	0	0	110	E161 K165	E161-Q163 HydrophobicContact CG-CG 4.07Å; E161-Q163 PolarHBondContact O-N 2.8Å; E161-Q163 PolarHBondContact OE1-NE2 3.3Å; Q163-K165 VanDerWaalsContact C-N 3.31Å; Q163-K165 PolarHBondContact O-N 2.79Å; Q163-K165 VanDerWaalsContact O-N 3.07Å
164	T	36	Very low	35.4	Very low	120 Å²	120	160.9 Å²	160.9	74%	0.736	80%	0.804	S	S	*	*			trans	-79.8	84.4	165.2	49.7	0	0	0	0	108.9	R162 L166	R162-T164 VanDerWaalsContact C-N 3.31Å; R162-T164 PolarHBondContact O-N 3.4Å; T164-L166 VanDerWaalsContact C-N 3.3Å; T164-L166 PolarHBondContact O-N 3.09Å
165	K	39.3	Very low	35.5	Very low	168 Å²	168	160.9 Å²	160.9	73%	0.73	80%	0.801	S	S	*	*			trans	-64.1	88	169.5	-72.8	179.3	-179	173.5	0	109.7	Q163 R167	Q163-K165 VanDerWaalsContact C-N 3.31Å; Q163-K165 PolarHBondContact O-N 2.79Å; Q163-K165 VanDerWaalsContact O-N 3.07Å; K165-R167 PolarHBondContact O-N 3.02Å; K165-R167 VanDerWaalsContact O-N 3.08Å
166	L	36.8	Very low	35.5	Very low	162 Å²	162	161.3 Å²	161.3	85%	0.848	80%	0.799	S	S	*	*			trans	-69.3	98.8	165	-71.1	172.8	0	0	0	108.2	T164	T164-L166 VanDerWaalsContact C-N 3.3Å; T164-L166 PolarHBondContact O-N 3.09Å
167	R	38	Very low	35.6	Very low	231 Å²	231	159 Å²	159	87%	0.872	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.8	128.6	171.1	-74.3	-176.3	177.3	178.5	-0.6	109.3	K165 R169	K165-R167 PolarHBondContact O-N 3.02Å; K165-R167 VanDerWaalsContact O-N 3.08Å; R167-R169 PolarHBondContact O-N 3.12Å
168	P	36.8	Very low	35.8	Very low	125 Å²	125	162.9 Å²	162.9	81%	0.812	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.4	126.9	171	-17.9	29.9	0	0	0	110
169	R	43.4	Very low	35.8	Very low	227 Å²	227	166.5 Å²	166.5	86%	0.857	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-70.4	133.7	172.1	-164	178.8	-170.1	-169.6	3.2	108.6	R167 L171	R167-R169 PolarHBondContact O-N 3.12Å; R169-L171 PolarHBondContact O-N 2.87Å
170	P	34.5	Very low	36.3	Very low	116 Å²	116	169.3 Å²	169.3	75%	0.753	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-59.9	126.6	174.7	-17	28.9	0	0	0	109.2	L172	P170-L172 PolarHBondContact O-N 2.82Å
171	L	36.9	Very low	36.3	Very low	161 Å²	161	172.5 Å²	172.5	84%	0.843	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-64.1	117.8	169.5	-71.3	171.3	0	0	0	107.2	R169 R173	R169-L171 PolarHBondContact O-N 2.87Å; L171-R173 PolarHBondContact O-N 3.42Å
172	L	34.8	Very low	36.5	Very low	170 Å²	170	169.8 Å²	169.8	89%	0.89	80%	0.795	S	S	*	*			trans	-64.4	92.7	169.2	-138.9	103.3	0	0	0	106.6	P170 Q174	P170-L172 PolarHBondContact O-N 2.82Å; L172-Q174 PolarHBondContact O-N 3.02Å
173	R	36.4	Very low	36.4	Very low	234 Å²	234	165.6 Å²	165.6	88%	0.883	79%	0.79	S	S	*	*			trans	-71	109.9	174.4	-155.4	173.4	168.5	-153.4	-5.9	105.6	L171 K175	L171-R173 PolarHBondContact O-N 3.42Å; R173-K175 PolarHBondContact O-N 2.99Å
174	Q	38.4	Very low	36.5	Very low	178 Å²	178	166.6 Å²	166.6	83%	0.832	80%	0.799	S	S	*	*			trans	-57.9	114.6	167.8	-77.1	179.9	-49.3	0	0	106.7	L172 E176	L172-Q174 PolarHBondContact O-N 3.02Å; Q174-E176 PolarHBondContact O-N 2.92Å
175	K	38.7	Very low	36.5	Very low	185 Å²	185	168.2 Å²	168.2	80%	0.804	80%	0.802	S	S	*	*			trans	-66.9	113.4	169.6	-169.6	178.6	-179.4	-175.6	0	105.8	R173 N177	R173-K175 PolarHBondContact O-N 2.99Å; K175-N177 PolarHBondContact O-N 2.79Å
176	E	37.8	Very low	36.3	Very low	170 Å²	170	167.4 Å²	167.4	79%	0.794	81%	0.805	S	S	*	*			trans	-67.3	129.2	166.1	-71.3	174.2	164.1	0	0	106.9	Q174 D178	Q174-E176 PolarHBondContact O-N 2.92Å; E176-D178 PolarHBondContact O-N 3.24Å
177	N	33.8	Very low	36.4	Very low	145 Å²	145	164.6 Å²	164.6	78%	0.775	79%	0.794	S	S	*	*			trans	-79.1	101.6	-179.3	-65	-37	0	0	0	107.8	K175	K175-N177 PolarHBondContact O-N 2.79Å
178	D	37.4	Very low	36.3	Very low	153 Å²	153	161.5 Å²	161.5	82%	0.818	79%	0.79	S	S	*	*			trans	-89.4	95.8	161.3	-67.3	-34.1	0	0	0	107.9	E176 H180	E176-D178 PolarHBondContact O-N 3.24Å; D178-H180 PolarHBondContact O-N 3.15Å
179	E	33.7	Very low	36.2	Very low	185 Å²	185	160.6 Å²	160.6	86%	0.864	79%	0.786	S	S	*	*			trans	-76.9	98.3	160.1	-73.3	-167.9	158.8	0	0	107.9
180	H	37.3	Very low	36.1	Very low	189 Å²	189	161 Å²	161	88%	0.875	79%	0.788	S	S	*	*			trans	-120	114.2	159.5	-89.1	25.3	0	0	0	109.6	D178	D178-H180 PolarHBondContact O-N 3.15Å
181	Y	33.2	Very low	36.1	Very low	205 Å²	205	163.2 Å²	163.2	80%	0.804	79%	0.792	S	S	*	*			trans	-82.5	120.6	-177.5	174	-92.1	0	0	0	109.9
182	I	34.5	Very low	36.4	Very low	98 Å²	98	162.4 Å²	162.4	50%	0.503	79%	0.794	S	S	.	*			trans	68.1	112.7	138.7	-62.1	-157.9	0	0	0	119.3
183	N	34.6	Very low	36.6	Very low	135 Å²	135	160.2 Å²	160.2	72%	0.722	79%	0.788	S	S	*	*				173.3	149	103.5	-98.2	-37.3	0	0	0	113.1
184	D	34.1	Very low	36.4	Very low	141 Å²	141	154.2 Å²	154.2	75%	0.754	78%	0.781	S	S	*	*			trans	79.3	88.5	153.3	-60	-22.7	0	0	0	121.7
185	L	35.9	Very low	36.7	Very low	154 Å²	154	155.1 Å²	155.1	81%	0.806	79%	0.785	S	S	*	*				3.5	132.7	123.8	-80.7	144.5	0	0	0	118.3
186	L	35.4	Very low	36.9	Very low	151 Å²	151	153.4 Å²	153.4	79%	0.791	78%	0.784	S	S	*	*				129.7	132.9	120.8	-138	89.2	0	0	0	114.6
187	V	39	Very low	37	Very low	104 Å²	104	154.1 Å²	154.1	63%	0.63	79%	0.788	S	S	*	*			trans	101.4	94.5	149.6	-165.1	0	0	0	0	119.5
188	E	36.1	Very low	37.5	Very low	166 Å²	166	155.5 Å²	155.5	78%	0.776	79%	0.794	S	S	*	*				76.2	107.4	129.1	-68	173.5	155.4	0	0	122.9
189	S	34.8	Very low	38	Very low	105 Å²	105	156.1 Å²	156.1	73%	0.734	79%	0.792	S	S	*	*			trans	-38.9	131.9	143.8	46.5	0	0	0	0	116.4
190	R	40.7	Very low	38.1	Very low	235 Å²	235	153.5 Å²	153.5	89%	0.887	79%	0.794	S	S	*	*			trans	-137.7	114.9	147.3	-70.8	-170.9	-178.6	-168.9	0.3	111
191	L	34.8	Very low	38.6	Very low	163 Å²	163	150 Å²	150	85%	0.853	79%	0.787	S	S	*	*			trans	-66.7	142.4	159.9	-82.5	99.3	0	0	0	109.8
192	V	43	Very low	39.4	Very low	145 Å²	145	145.3 Å²	145.3	88%	0.879	78%	0.784	S	S	*	*			trans	-135.1	137	152	178.8	0	0	0	0	109.5
193	T	39.1	Very low	39.9	Very low	124 Å²	124	148.5 Å²	148.5	76%	0.761	80%	0.801	S	S	*	*			trans	-83.3	158.5	-159	-41.5	0	0	0	0	114.1
194	C	31.5	Very low	40.8	Very low	108 Å²	108	147.4 Å²	147.4	73%	0.73	80%	0.8	S	S	*	*			trans	-56.8	150.2	174.7	-32.6	0	0	0	0	114.3
195	Q	44.6	Very low	42	Very low	197 Å²	197	149.2 Å²	149.2	92%	0.921	80%	0.803	S	S	*	*			trans	-150.5	137.6	145.8	-103.7	169	22	0	0	110.9
196	N	43	Very low	43.2	Very low	148 Å²	148	152.3 Å²	152.3	79%	0.791	80%	0.804	S	S	*	*			trans	-78.5	145.8	-166.9	-55.5	-51.2	0	0	0	113
197	E	40.4	Very low	44.7	Very low	185 Å²	185	150.5 Å²	150.5	86%	0.864	80%	0.801	S	S	*	*			trans	-139.1	117.9	142.9	-74.3	-165.7	141.4	0	0	110.2	Q199	E197-Q199 PolarHBondContact O-N 3.4Å
198	L	43.9	Very low	46.1	Very low	174 Å²	174	153.8 Å²	153.8	91%	0.911	81%	0.812	S	S	*	*			trans	-72.4	114.9	172.7	-80.4	135.9	0	0	0	109.2
199	Q	48.2	Very low	47.5	Very low	167 Å²	167	155 Å²	155	78%	0.78	82%	0.818	S	S	*	*			trans	-130.8	113.7	155.6	-74.2	-174.1	11.6	0	0	110.1	E197 T201	E197-Q199 PolarHBondContact O-N 3.4Å; Q199-T201 PolarHBondContact O-N 3Å
200	S	35	Very low	48.9	Very low	130 Å²	130	155.6 Å²	155.6	91%	0.909	82%	0.817	S	S	*	*			trans	-51.9	108.2	172.6	36.7	0	0	0	0	112
201	T	48.8	Very low	50	Low	116 Å²	116	152 Å²	152	71%	0.712	81%	0.81	S	S	*	*			trans	-121.2	125.9	165	63.3	0	0	0	0	109.3	Q199 N203	Q199-T201 PolarHBondContact O-N 3Å; T201-N203 PolarHBondContact O-N 3.44Å
202	S	50	Low	51.3	Low	106 Å²	106	152 Å²	152	74%	0.741	81%	0.807	S	S	*	*			trans	-50	115.1	177.1	39.5	0	0	0	0	111.6	T204	S202-T204 VanDerWaalsContact C-N 3.26Å; S202-T204 PolarHBondContact O-N 3.12Å
203	N	44.8	Very low	52.2	Low	164 Å²	164	155.7 Å²	155.7	88%	0.877	81%	0.805	S	S	*	*			trans	-73	79.9	172.5	-92	-21.4	0	0	0	109.8	T201 H205	T201-N203 PolarHBondContact O-N 3.44Å; N203-H205 PolarHBondContact O-N 3.36Å
204	T	54.3	Low	53.1	Low	112 Å²	112	159.5 Å²	159.5	69%	0.687	81%	0.807	S	S	*	*			trans	-72.8	103.1	157.6	57.2	0	0	0	0	107.1	S202 R206	S202-T204 VanDerWaalsContact C-N 3.26Å; S202-T204 PolarHBondContact O-N 3.12Å; T204-R206 VanDerWaalsContact C-N 3.33Å; T204-R206 PolarHBondContact O-N 3.29Å
205	H	58.4	Low	54.6	Low	179 Å²	179	158.9 Å²	158.9	83%	0.829	80%	0.802	S	S	*	*			trans	-61.1	93.1	175.8	-164.1	-82	0	0	0	108.7	N203 P207	N203-H205 PolarHBondContact O-N 3.36Å; H205-P207 WeakPolarHBondContact O-CD 3.26Å
206	R	61.8	Low	55.5	Low	220 Å²	220	156 Å²	156	83%	0.83	79%	0.792	S	S	*	*			trans	-59.7	122.4	173.4	-75.7	-173.1	177.2	-153.2	0.1	107.2	T204 M208	T204-R206 VanDerWaalsContact C-N 3.33Å; T204-R206 PolarHBondContact O-N 3.29Å; R206-M208 PolarHBondContact O-N 3.5Å
207	P	66.1	Low	56.5	Low	112 Å²	112	152.4 Å²	152.4	73%	0.727	78%	0.776	S	S	*	*			trans	-57.7	132.8	175.4	23.9	-31.4	0	0	0	108.1	H205 Q209	H205-P207 WeakPolarHBondContact O-CD 3.26Å; P207-Q209 PolarHBondContact O-N 3.41Å
208	M	67.9	Low	58.2	Low	173 Å²	173	149 Å²	149	85%	0.852	76%	0.756	S	S	*	*			trans	-51.1	110.1	173.8	-94.6	171.8	62.1	0	0	108	R206 V210	R206-M208 PolarHBondContact O-N 3.5Å; M208-V210 VanDerWaalsContact C-N 3.25Å; M208-V210 PolarHBondContact O-N 3.31Å
209	Q	66.3	Low	59.7	Low	193 Å²	193	148.6 Å²	148.6	90%	0.902	75%	0.746	S	S	*	*			trans	-70.6	90.7	176	-149.4	173.3	-2.2	0	0	106.3	P207 H211	P207-Q209 PolarHBondContact O-N 3.41Å; Q209-H211 VanDerWaalsContact C-N 3.34Å; Q209-H211 PolarHBondContact O-N 3.09Å
210	V	63.9	Low	61.3	Low	117 Å²	117	147.5 Å²	147.5	71%	0.709	74%	0.741	S	S	*	*			trans	-65.8	100.7	174	-172	0	0	0	0	105.5	M208 M212	M208-V210 VanDerWaalsContact C-N 3.25Å; M208-V210 PolarHBondContact O-N 3.31Å; V210-M212 PolarHBondContact O-N 3.29Å
211	H	63.5	Low	63.7	Low	160 Å²	160	143.4 Å²	143.4	74%	0.741	71%	0.709	S	S	*	*			trans	-58.7	106.5	172.6	-159.6	84.5	0	0	0	106.5	Q209 R213	Q209-H211 VanDerWaalsContact C-N 3.34Å; Q209-H211 PolarHBondContact O-N 3.09Å; H211-R213 PolarHBondContact O-N 3.19Å
212	M	62.6	Low	65.5	Low	163 Å²	163	138.9 Å²	138.9	80%	0.803	68%	0.684	S	S	*	*			trans	-59.6	92.9	172.9	-86.4	-68.5	-173.3	0	0	106.5	V210 Y214	V210-M212 PolarHBondContact O-N 3.29Å; M212-Y214 PolarHBondContact O-N 2.84Å
213	R	61.2	Low	67.3	Low	221 Å²	221	138.7 Å²	138.7	83%	0.834	67%	0.673	S	S	*	*			trans	-68.9	107.1	171.9	-71.2	-173.1	174.7	-149.7	-1.5	105.2	H211	H211-R213 PolarHBondContact O-N 3.19Å
214	Y	58.3	Low	69.3	Low	204 Å²	204	138.7 Å²	138.7	80%	0.8	66%	0.662	S	S	*	*			trans	-43.7	129	167	-79.2	-87.1	0	0	0	108.1	M212 I216	M212-Y214 PolarHBondContact O-N 2.84Å; Y214-I216 VanDerWaalsContact C-N 3.29Å; Y214-I216 PolarHBondContact O-N 2.76Å
215	P	64.1	Low	71.1	Confident	96 Å²	96	135.8 Å²	135.8	62%	0.623	64%	0.642	S	S	*	*			trans	-64.3	91.3	-180	21.5	-28.7	0	0	0	109	P217 N247	P215-P217 WeakPolarHBondContact O-CD 3.14Å; P215-N247 VanDerWaalsContact CA-ND2 3.33Å; P215-N247 WeakPolarHBondContact CA-ND2 3.25Å; P215-N247 WeakPolarHBondContact CB-ND2 3.25Å; P215-N247 PolarHBondContact O-ND2 3.41Å
216	I	62.8	Low	72.7	Confident	137 Å²	137	127.9 Å²	127.9	70%	0.703	61%	0.608	S	S	*	*			trans	-62	122	175.6	-59.5	172.9	0	0	0	107.6	Y214 R218 N247	Y214-I216 VanDerWaalsContact C-N 3.29Å; Y214-I216 PolarHBondContact O-N 2.76Å; I216-R218 PolarHBondContact O-N 3.46Å; I216-R218 VanDerWaalsContact O-N 3.14Å; I216-N247 PolarHBondContact O-ND2 3.36Å; I216-N247 VanDerWaalsContact O-ND2 3.15Å; I216-N247 PolarHBondContact O-OD1 3.13Å
217	P	65	Low	74.2	Confident	72 Å²	72	122.7 Å²	122.7	47%	0.468	59%	0.588	S	S	.	*			trans	-58.5	114.9	-178.9	21.1	-31.1	0	0	0	110.9	P215 K219 N247	P215-P217 WeakPolarHBondContact O-CD 3.14Å; P217-K219 PolarHBondContact O-N 3.4Å; P217-N247 WeakPolarHBondContact CA-OD1 3Å
218	R	76.6	Confident	75.5	Confident	114 Å²	114	118 Å²	118	43%	0.43	56%	0.556	S	S	.	*			trans	-75.6	43.9	-179.2	-57.6	-171.5	-156.6	170.1	4.4	114.1	I216 Q220 D221 N247 H249	I216-R218 PolarHBondContact O-N 3.46Å; I216-R218 VanDerWaalsContact O-N 3.14Å; R218-Q220 PolarHBondContact O-N 3.32Å; R218-Q220 VanDerWaalsContact O-N 3.08Å; R218-D221 HydrophobicContact CB-CB 4.49Å; R218-D221 WeakPolarHBondContact CB-OD2 3.34Å; R218-D221 WeakPolarHBondContact CD-OD2 3.3Å; R218-D221 WeakPolarHBondContact O-CB 3.35Å; R218-D221 PolarHBondContact O-N 3.21Å; R218-N247 PolarHBondContact N-OD1 2.9Å; R218-H249 PolarHBondContact NH1-CE1 3.48Å; R218-H249 VanDerWaalsContact NH1-CE1 3.26Å; R218-H249 PolarHBondContact NH1-NE2 2.9Å
219	K	74.7	Confident	76.8	Confident	165 Å²	165	110.5 Å²	110.5	72%	0.717	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-26	176.4	-70.2	-176.6	179.7	-179.9	0	112.2	P217 D221 A222	P217-K219 PolarHBondContact O-N 3.4Å; K219-D221 VanDerWaalsContact C-N 3.26Å; K219-D221 PolarHBondContact O-N 3.43Å; K219-A222 WeakPolarHBondContact O-CB 3.41Å; K219-A222 PolarHBondContact O-N 2.89Å
220	Q	81.5	Confident	78.2	Confident	144 Å²	144	101.8 Å²	101.8	67%	0.673	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-27.5	176.9	-64.8	174.8	3.8	0	0	113.6	R218 A222 I223 Y224	R218-Q220 PolarHBondContact O-N 3.32Å; R218-Q220 VanDerWaalsContact O-N 3.08Å; Q220-A222 PolarHBondContact O-N 3.49Å; Q220-I223 WeakPolarHBondContact O-CB 3.31Å; Q220-I223 PolarHBondContact O-N 3.4Å; Q220-I223 VanDerWaalsContact O-N 3.08Å; Q220-Y224 WeakPolarHBondContact O-CD2 3.47Å
221	D	85.2	Confident	79.7	Confident	44 Å²	44	101.7 Å²	101.7	24%	0.235	47%	0.471	C	S	.	.	H	α-helix	trans	-63.6	-26.5	179.9	-70.3	-13.7	0	0	0	111.7	R218 K219 I223 Y224 N225 Y228 H249	R218-D221 HydrophobicContact CB-CB 4.49Å; R218-D221 WeakPolarHBondContact CB-OD2 3.34Å; R218-D221 WeakPolarHBondContact CD-OD2 3.3Å; R218-D221 WeakPolarHBondContact O-CB 3.35Å; R218-D221 PolarHBondContact O-N 3.21Å; K219-D221 VanDerWaalsContact C-N 3.26Å; K219-D221 PolarHBondContact O-N 3.43Å; D221-I223 PolarHBondContact O-N 3.23Å; D221-Y224 PolarHBondContact O-N 3.27Å; D221-N225 WeakPolarHBondContact O-CA 3.08Å; D221-N225 VanDerWaalsContact O-CB 3.23Å; D221-N225 WeakPolarHBondContact O-CB 3.4Å; D221-N225 PolarHBondContact O-N 3.39Å; D221-Y228 HydrophobicContact CB-CD2 3.73Å; D221-Y228 HydrophobicContact CB-CE2 4.04Å; D221-Y228 HydrophobicContact CB-CG 4.48Å; D221-H249 IonicContact OD2-CD2 2.94Å; D221-H249 IonicContact OD2-CE1 3.99Å; D221-H249 IonicContact OD2-NE2 3.82Å; D221-H249 PolarHBondContact OD2-NE2 3.5Å
222	A	86.7	Confident	81.3	Confident	21 Å²	21	96.8 Å²	96.8	17%	0.174	45%	0.453	C	S	.	.	H	α-helix	trans	-63.5	-19.9	176.8	0	0	0	0	0	114.1	K219 Q220 Y228 H263	K219-A222 WeakPolarHBondContact O-CB 3.41Å; K219-A222 PolarHBondContact O-N 2.89Å; Q220-A222 PolarHBondContact O-N 3.49Å; A222-Y228 HydrophobicContact CB-CD1 3.51Å; A222-Y228 HydrophobicContact CB-CE1 3.83Å; A222-Y228 HydrophobicContact CB-CG 4.13Å; A222-H263 PolarHBondContact O-CD2 3.4Å; A222-H263 VanDerWaalsContact O-CD2 3.29Å; A222-H263 PolarHBondContact O-NE2 3.27Å; A222-H263 VanDerWaalsContact O-NE2 3.09Å
223	I	87.2	Confident	83	Confident	101 Å²	101	89.3 Å²	89.3	52%	0.518	42%	0.417	S	S	.	.	H	α-helix	trans	-85.3	-35.8	-178.8	-58.5	172.4	0	0	0	110.6	Q220 D221 H263	Q220-I223 WeakPolarHBondContact O-CB 3.31Å; Q220-I223 PolarHBondContact O-N 3.4Å; Q220-I223 VanDerWaalsContact O-N 3.08Å; D221-I223 PolarHBondContact O-N 3.23Å; I223-H263 PolarHBondContact O-NE2 2.88Å
224	Y	88	Confident	84.8	Confident	164 Å²	164	85 Å²	85	64%	0.643	41%	0.41	S	S	*	.	H	α-helix	trans	-102.1	-27.7	-172.1	-59.7	-70.2	0	0	0	112.9	Q220 D221	Q220-Y224 WeakPolarHBondContact O-CD2 3.47Å; D221-Y224 PolarHBondContact O-N 3.27Å
225	N	90.9	Very high	86.6	Confident	51 Å²	51	79 Å²	79	27%	0.273	39%	0.389	S	S	.	.			trans	-110.4	104.3	-174.1	-176.6	9	0	0	0	111.6	D221 R227 Y228	D221-N225 WeakPolarHBondContact O-CA 3.08Å; D221-N225 VanDerWaalsContact O-CB 3.23Å; D221-N225 WeakPolarHBondContact O-CB 3.4Å; D221-N225 PolarHBondContact O-N 3.39Å; N225-R227 PolarHBondContact O-N 3.49Å; N225-R227 WeakPolarHBondContact OD1-CB 3.46Å; N225-R227 PolarHBondContact OD1-N 2.86Å; N225-Y228 VanDerWaalsContact O-CB 3.3Å; N225-Y228 WeakPolarHBondContact O-CB 3.39Å; N225-Y228 PolarHBondContact O-N 3.24Å
226	A	91.9	Very high	88.2	Confident	13 Å²	13	78 Å²	78	11%	0.107	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-12.4	176	0	0	0	0	0	114.8	T230 H263 Y287	A226-T230 WeakPolarHBondContact O-CG2 3.37Å; A226-H263 WeakPolarHBondContact CA-ND1 3.44Å; A226-H263 HydrophobicContact CB-CB 4.19Å; A226-H263 WeakPolarHBondContact CB-ND1 3.46Å; A226-Y287 HydrophobicContact CB-CD1 4.34Å; A226-Y287 WeakPolarHBondContact O-CE1 3.37Å
227	R	93.3	Very high	89.9	Confident	111 Å²	111	76.8 Å²	76.8	42%	0.419	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.3	177.4	-60.1	179.4	175.6	84.9	0.1	113.4	N225 K229 T230 Y287 F288	N225-R227 PolarHBondContact O-N 3.49Å; N225-R227 WeakPolarHBondContact OD1-CB 3.46Å; N225-R227 PolarHBondContact OD1-N 2.86Å; R227-K229 PolarHBondContact O-N 3.2Å; R227-T230 PolarHBondContact O-N 2.68Å; R227-T230 PolarHBondContact O-OG1 3.41Å; R227-T230 VanDerWaalsContact O-OG1 3.1Å; R227-Y287 HydrophobicContact CB-CE1 4.31Å; R227-Y287 HydrophobicContact CG-CD1 3.74Å; R227-Y287 HydrophobicContact CG-CE1 3.52Å; R227-Y287 HydrophobicContact CG-CE2 4.47Å; R227-Y287 HydrophobicContact CG-CG 4.3Å; R227-F288 VanDerWaalsContact NH2-CE2 3.26Å
228	Y	94.9	Very high	91.4	Very high	14 Å²	14	80.5 Å²	80.5	6%	0.055	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	122.7	-176.7	-179.2	-95.7	0	0	0	111	D221 A222 N225 T230 K258	D221-Y228 HydrophobicContact CB-CD2 3.73Å; D221-Y228 HydrophobicContact CB-CE2 4.04Å; D221-Y228 HydrophobicContact CB-CG 4.48Å; A222-Y228 HydrophobicContact CB-CD1 3.51Å; A222-Y228 HydrophobicContact CB-CE1 3.83Å; A222-Y228 HydrophobicContact CB-CG 4.13Å; N225-Y228 VanDerWaalsContact O-CB 3.3Å; N225-Y228 WeakPolarHBondContact O-CB 3.39Å; N225-Y228 PolarHBondContact O-N 3.24Å; Y228-T230 PolarHBondContact O-N 3.37Å; Y228-T230 VanDerWaalsContact O-N 3.15Å; Y228-K258 HydrophobicContact CD1-CD 4.3Å
229	K	95.1	Very high	92.4	Very high	15 Å²	15	81.4 Å²	81.4	7%	0.065	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	28.3	-177.6	-64.8	-176.2	175.1	-73.9	0	114.3	R227 Q231 C248 H249 F250 A251 E256 L257 K258	R227-K229 PolarHBondContact O-N 3.2Å; K229-Q231 VanDerWaalsContact C-N 3.29Å; K229-C248 PolarHBondContact NZ-O 3.24Å; K229-H249 VanDerWaalsContact CA-O 3.25Å; K229-H249 WeakPolarHBondContact CA-O 3.23Å; K229-H249 PolarHBondContact N-O 3.25Å; K229-F250 PolarHBondContact NZ-O 3.06Å; K229-A251 HydrophobicContact CB-CB 4.4Å; K229-E256 VanDerWaalsContact CB-O 3.31Å; K229-E256 WeakPolarHBondContact CB-O 3.49Å; K229-E256 HydrophobicContact CD-CB 4.22Å; K229-E256 IonicContact NZ-OE1 3.53Å; K229-E256 IonicContact NZ-OE2 3.17Å; K229-E256 PolarHBondContact NZ-OE2 3.14Å; K229-L257 WeakPolarHBondContact O-CA 3.32Å; K229-K258 HydrophobicContact CB-CD 4.44Å; K229-K258 HydrophobicContact CB-CG 4.22Å; K229-K258 PolarHBondContact O-N 3.48Å
230	T	95	Very high	93.4	Very high	11 Å²	11	80.5 Å²	80.5	7%	0.067	37%	0.374	C	S	.	.			trans	-84.5	-4.3	176.8	62.3	0	0	0	0	114.2	A226 R227 Y228 K258 P260 Y287	A226-T230 WeakPolarHBondContact O-CG2 3.37Å; R227-T230 PolarHBondContact O-N 2.68Å; R227-T230 PolarHBondContact O-OG1 3.41Å; R227-T230 VanDerWaalsContact O-OG1 3.1Å; Y228-T230 PolarHBondContact O-N 3.37Å; Y228-T230 VanDerWaalsContact O-N 3.15Å; T230-K258 VanDerWaalsContact CA-O 3.29Å; T230-K258 WeakPolarHBondContact CA-O 3.3Å; T230-P260 HydrophobicContact CG2-CB 3.97Å; T230-P260 HydrophobicContact CG2-CG 4.46Å; T230-Y287 PolarHBondContact OG1-OH 3.01Å
231	Q	95.9	Very high	94.1	Very high	114 Å²	114	79.4 Å²	79.4	53%	0.533	37%	0.368	S	S	.	.	S	Bend	trans	-137.3	148.7	179.8	-68.7	-64.6	-61.6	0	0	109.9	K229 F250 A251	K229-Q231 VanDerWaalsContact C-N 3.29Å; Q231-F250 HydrophobicContact CB-CD1 3.98Å; Q231-F250 HydrophobicContact CB-CE1 4.34Å; Q231-F250 WeakPolarHBondContact O-CA 3.48Å; Q231-F250 WeakPolarHBondContact O-CB 3.39Å; Q231-A251 PolarHBondContact O-N 3.04Å
232	P	97.4	Very high	94.7	Very high	57 Å²	57	77.8 Å²	77.8	37%	0.37	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-69.6	147.8	178.4	29.7	-35	0	0	0	111.6	L234 A251	P232-L234 PolarHBondContact O-N 3.05Å; P232-A251 CarbonylContact C-O 3.48Å; P232-A251 WeakPolarHBondContact CA-O 3.27Å
233	C	98.1	Very high	95.1	Very high	7 Å²	7	81.5 Å²	81.5	5%	0.047	38%	0.383	C	S	.	.			trans	-78.9	106.2	174.4	-177	0	0	0	0	109.5	H235 Y236 Q237 C248 F250 A251	C233-H235 PolarHBondContact O-N 3.25Å; C233-Y236 PolarHBondContact O-N 3.29Å; C233-Y236 PolarHBondContact SG-N 3.34Å; C233-Y236 VanDerWaalsContact SG-N 3.44Å; C233-Q237 WeakPolarHBondContact O-CB 3.32Å; C233-Q237 PolarHBondContact O-N 3.06Å; C233-C248 PolarHBondContact SG-SG 2.93Å; C233-F250 HydrophobicContact CB-CB 3.62Å; C233-A251 WeakPolarHBondContact CB-O 3.31Å; C233-A251 PolarHBondContact N-O 3.26Å
234	L	97.4	Very high	95.4	Very high	130 Å²	130	81.1 Å²	81.1	68%	0.681	38%	0.381	S	S	*	.	H	α-helix	trans	-59.9	-34.4	179.8	-60.8	179.9	0	0	0	112.9	P232 Q237 K238	P232-L234 PolarHBondContact O-N 3.05Å; L234-Q237 PolarHBondContact O-N 3.3Å; L234-K238 VanDerWaalsContact O-CB 3.3Å; L234-K238 WeakPolarHBondContact O-CB 3.32Å; L234-K238 PolarHBondContact O-N 3.08Å
235	H	97.5	Very high	95.6	Very high	78 Å²	78	74.9 Å²	74.9	36%	0.361	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-45.9	179.5	-169.8	91.6	0	0	0	111.4	C233 K238 Y239 H241 P243	C233-H235 PolarHBondContact O-N 3.25Å; H235-K238 PolarHBondContact O-N 2.85Å; H235-Y239 AromaticContact CD2-CD2 3.98Å; H235-Y239 AromaticContact CE1-CD2 3.43Å; H235-Y239 VanDerWaalsContact CE1-CD2 3.43Å; H235-Y239 WeakPolarHBondContact CE1-CD2 3.37Å; H235-Y239 AromaticContact CE1-CE2 3.65Å; H235-Y239 AromaticContact CG-CD2 3.9Å; H235-Y239 AromaticContact ND1-CD2 3.56Å; H235-Y239 AromaticContact ND1-CE2 3.63Å; H235-Y239 AromaticContact NE2-CD2 3.71Å; H235-Y239 WeakPolarHBondContact O-CD2 3.28Å; H235-Y239 PolarHBondContact O-N 3.18Å; H235-H241 PolarHBondContact CD2-O 3.15Å; H235-P243 VanDerWaalsContact CD2-CD 3.44Å; H235-P243 WeakPolarHBondContact CD2-CD 3.18Å; H235-P243 WeakPolarHBondContact NE2-CD 3.19Å
236	Y	98.1	Very high	95.6	Very high	74 Å²	74	78.3 Å²	78.3	29%	0.29	39%	0.385	S	S	.	.	H	α-helix	trans	-65.1	-40	173.4	-172.4	-90.1	0	0	0	111.7	C233 K238 K240 C242 H252	C233-Y236 PolarHBondContact O-N 3.29Å; C233-Y236 PolarHBondContact SG-N 3.34Å; C233-Y236 VanDerWaalsContact SG-N 3.44Å; Y236-K238 VanDerWaalsContact C-N 3.27Å; Y236-K238 PolarHBondContact O-N 3.08Å; Y236-K240 VanDerWaalsContact CE2-O 3.31Å; Y236-K240 WeakPolarHBondContact CE2-O 3.34Å; Y236-K240 WeakPolarHBondContact O-CA 3.31Å; Y236-K240 PolarHBondContact O-N 3.01Å; Y236-C242 HydrophobicContact CD2-CB 4.21Å; Y236-H252 WeakPolarHBondContact CB-CD2 3.37Å; Y236-H252 HydrophobicContact CD1-CB 3.62Å; Y236-H252 AromaticContact CD1-CG 3.99Å; Y236-H252 WeakPolarHBondContact CD1-O 3.3Å; Y236-H252 HydrophobicContact CD2-CB 4.03Å; Y236-H252 AromaticContact CD2-CD2 3.72Å; Y236-H252 AromaticContact CD2-CG 3.62Å; Y236-H252 AromaticContact CD2-ND1 3.83Å; Y236-H252 AromaticContact CD2-NE2 3.98Å; Y236-H252 HydrophobicContact CE1-CB 3.73Å; Y236-H252 WeakPolarHBondContact CE1-O 3.48Å; Y236-H252 HydrophobicContact CE2-CB 4.12Å; Y236-H252 HydrophobicContact CG-CB 3.78Å; Y236-H252 AromaticContact CG-CD2 3.45Å; Y236-H252 VanDerWaalsContact CG-CD2 3.45Å; Y236-H252 AromaticContact CG-CG 3.59Å
237	Q	97.1	Very high	95.6	Very high	113 Å²	113	78.6 Å²	78.6	53%	0.528	39%	0.385	S	S	.	.	H	α-helix	trans	-59.8	-40.7	177.5	-173.1	174.9	-8.6	0	0	111.7	C233 L234 K240	C233-Q237 WeakPolarHBondContact O-CB 3.32Å; C233-Q237 PolarHBondContact O-N 3.06Å; L234-Q237 PolarHBondContact O-N 3.3Å; Q237-K240 PolarHBondContact O-NZ 3.25Å
238	K	97.6	Very high	95.7	Very high	149 Å²	149	73.4 Å²	73.4	65%	0.648	37%	0.365	S	S	*	.	H	α-helix	trans	-78.1	-46.6	-178.9	-173	174.2	-179.7	-174.8	0	113.8	L234 H235 Y236	L234-K238 VanDerWaalsContact O-CB 3.3Å; L234-K238 WeakPolarHBondContact O-CB 3.32Å; L234-K238 PolarHBondContact O-N 3.08Å; H235-K238 PolarHBondContact O-N 2.85Å; Y236-K238 VanDerWaalsContact C-N 3.27Å; Y236-K238 PolarHBondContact O-N 3.08Å
239	Y	96.9	Very high	95.7	Very high	133 Å²	133	75.4 Å²	75.4	52%	0.522	38%	0.375	S	S	.	.	H	α-helix	trans	-108.1	-4	-171.2	-57.2	-66	0	0	0	114.1	H235 H241	H235-Y239 AromaticContact CD2-CD2 3.98Å; H235-Y239 AromaticContact CE1-CD2 3.43Å; H235-Y239 VanDerWaalsContact CE1-CD2 3.43Å; H235-Y239 WeakPolarHBondContact CE1-CD2 3.37Å; H235-Y239 AromaticContact CE1-CE2 3.65Å; H235-Y239 AromaticContact CG-CD2 3.9Å; H235-Y239 AromaticContact ND1-CD2 3.56Å; H235-Y239 AromaticContact ND1-CE2 3.63Å; H235-Y239 AromaticContact NE2-CD2 3.71Å; H235-Y239 WeakPolarHBondContact O-CD2 3.28Å; H235-Y239 PolarHBondContact O-N 3.18Å; Y239-H241 PolarHBondContact O-N 2.77Å
240	K	96.1	Very high	95.8	Very high	147 Å²	147	79.9 Å²	79.9	64%	0.639	40%	0.395	S	S	*	.	S	Bend	trans	56.7	12	-172.5	-53.6	-55.4	-174.4	-172.5	0	114.6	Y236 Q237	Y236-K240 VanDerWaalsContact CE2-O 3.31Å; Y236-K240 WeakPolarHBondContact CE2-O 3.34Å; Y236-K240 WeakPolarHBondContact O-CA 3.31Å; Y236-K240 PolarHBondContact O-N 3.01Å; Q237-K240 PolarHBondContact O-NZ 3.25Å
241	H	96.4	Very high	95.9	Very high	120 Å²	120	79.5 Å²	79.5	56%	0.556	39%	0.393	S	S	*	.			trans	-135.1	143.9	177.1	172	71.4	0	0	0	108	H235 Y239	H235-H241 PolarHBondContact CD2-O 3.15Å; Y239-H241 PolarHBondContact O-N 2.77Å
242	C	96.9	Very high	96	Very high	11 Å²	11	75.4 Å²	75.4	7%	0.074	37%	0.374	C	S	.	.			trans	-129	127.7	171.5	-171.4	0	0	0	0	109.7	Y236 L244 G245 H252	Y236-C242 HydrophobicContact CD2-CB 4.21Å; C242-L244 PolarHBondContact O-N 2.96Å; C242-G245 PolarHBondContact O-N 3.1Å; C242-H252 WeakPolarHBondContact CB-NE2 3.47Å
243	P	95.3	Very high	95.9	Very high	98 Å²	98	74 Å²	74	64%	0.636	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.5	-179.9	27.2	-36.3	0	0	0	112.5	H235	H235-P243 VanDerWaalsContact CD2-CD 3.44Å; H235-P243 WeakPolarHBondContact CD2-CD 3.18Å; H235-P243 WeakPolarHBondContact NE2-CD 3.19Å
244	L	93.7	Very high	95.8	Very high	94 Å²	94	78.9 Å²	78.9	49%	0.492	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-12.6	174	-59.8	179	0	0	0	113.2	C242 D246 N247 C248	C242-L244 PolarHBondContact O-N 2.96Å; L244-D246 PolarHBondContact O-N 3.08Å; L244-N247 VanDerWaalsContact O-CB 3.29Å; L244-N247 WeakPolarHBondContact O-CB 3.47Å; L244-N247 PolarHBondContact O-N 3.43Å; L244-C248 HydrophobicContact CB-CB 4.16Å
245	G	92.3	Very high	95.7	Very high	33 Å²	33	80.6 Å²	80.6	34%	0.34	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	49.1	-136.1	-173.1	0	0	0	0	0	111.9	C242 N247 C248 H252	C242-G245 PolarHBondContact O-N 3.1Å; G245-N247 PolarHBondContact O-N 2.81Å; G245-N247 VanDerWaalsContact O-N 3.09Å; G245-C248 WeakPolarHBondContact O-CB 3.06Å; G245-C248 PolarHBondContact O-N 3.37Å; G245-H252 PolarHBondContact O-CE1 2.96Å
246	D	91.6	Very high	95.6	Very high	123 Å²	123	79.8 Å²	79.8	66%	0.658	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-66.2	-11.6	-179.9	-61.9	-18.6	0	0	0	114.2	L244 C248	L244-D246 PolarHBondContact O-N 3.08Å; D246-C248 PolarHBondContact O-N 3.25Å
247	N	91.7	Very high	95.5	Very high	19 Å²	19	79.3 Å²	79.3	10%	0.102	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-81.7	1.8	173.3	-76.1	-30.8	0	0	0	114.2	P215 I216 P217 R218 L244 G245 H249	P215-N247 VanDerWaalsContact CA-ND2 3.33Å; P215-N247 WeakPolarHBondContact CA-ND2 3.25Å; P215-N247 WeakPolarHBondContact CB-ND2 3.25Å; P215-N247 PolarHBondContact O-ND2 3.41Å; I216-N247 PolarHBondContact O-ND2 3.36Å; I216-N247 VanDerWaalsContact O-ND2 3.15Å; I216-N247 PolarHBondContact O-OD1 3.13Å; P217-N247 WeakPolarHBondContact CA-OD1 3Å; R218-N247 PolarHBondContact N-OD1 2.9Å; L244-N247 VanDerWaalsContact O-CB 3.29Å; L244-N247 WeakPolarHBondContact O-CB 3.47Å; L244-N247 PolarHBondContact O-N 3.43Å; G245-N247 PolarHBondContact O-N 2.81Å; G245-N247 VanDerWaalsContact O-N 3.09Å; N247-H249 PolarHBondContact O-CD2 2.97Å; N247-H249 PolarHBondContact O-N 3.26Å
248	C	95.1	Very high	95.3	Very high	1 Å²	1	78.5 Å²	78.5	1%	0.007	40%	0.404	C	S	.	.			trans	-62.4	123.3	173.5	-168.1	0	0	0	0	110.8	K229 C233 L244 G245 D246 F250 H252	K229-C248 PolarHBondContact NZ-O 3.24Å; C233-C248 PolarHBondContact SG-SG 2.93Å; L244-C248 HydrophobicContact CB-CB 4.16Å; G245-C248 WeakPolarHBondContact O-CB 3.06Å; G245-C248 PolarHBondContact O-N 3.37Å; D246-C248 PolarHBondContact O-N 3.25Å; C248-F250 PolarHBondContact O-N 2.91Å; C248-H252 WeakPolarHBondContact CB-NE2 3.29Å; C248-H252 PolarHBondContact SG-NE2 3.19Å; C248-H252 VanDerWaalsContact SG-NE2 3.37Å
249	H	94.6	Very high	95.1	Very high	57 Å²	57	78.3 Å²	78.3	26%	0.264	40%	0.4	S	S	.	.	S	Bend	trans	-71.1	-9.8	174.2	-71.3	-168.4	0	0	0	113.1	R218 D221 K229 N247	R218-H249 PolarHBondContact NH1-CE1 3.48Å; R218-H249 VanDerWaalsContact NH1-CE1 3.26Å; R218-H249 PolarHBondContact NH1-NE2 2.9Å; D221-H249 IonicContact OD2-CD2 2.94Å; D221-H249 IonicContact OD2-CE1 3.99Å; D221-H249 IonicContact OD2-NE2 3.82Å; D221-H249 PolarHBondContact OD2-NE2 3.5Å; K229-H249 VanDerWaalsContact CA-O 3.25Å; K229-H249 WeakPolarHBondContact CA-O 3.23Å; K229-H249 PolarHBondContact N-O 3.25Å; N247-H249 PolarHBondContact O-CD2 2.97Å; N247-H249 PolarHBondContact O-N 3.26Å
250	F	96.8	Very high	94.9	Very high	108 Å²	108	73.1 Å²	73.1	47%	0.474	38%	0.383	S	S	.	.	S	Bend	trans	-103.3	159.1	177.5	-59.4	-81.5	0	0	0	109.7	K229 Q231 C233 C248	K229-F250 PolarHBondContact NZ-O 3.06Å; Q231-F250 HydrophobicContact CB-CD1 3.98Å; Q231-F250 HydrophobicContact CB-CE1 4.34Å; Q231-F250 WeakPolarHBondContact O-CA 3.48Å; Q231-F250 WeakPolarHBondContact O-CB 3.39Å; C233-F250 HydrophobicContact CB-CB 3.62Å; C248-F250 PolarHBondContact O-N 2.91Å
251	A	97.1	Very high	94.6	Very high	3 Å²	3	70.7 Å²	70.7	3%	0.025	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-79.6	129.5	-179.1	0	0	0	0	0	111.3	K229 Q231 P232 C233 G253 E256 L257	K229-A251 HydrophobicContact CB-CB 4.4Å; Q231-A251 PolarHBondContact O-N 3.04Å; P232-A251 CarbonylContact C-O 3.48Å; P232-A251 WeakPolarHBondContact CA-O 3.27Å; C233-A251 WeakPolarHBondContact CB-O 3.31Å; C233-A251 PolarHBondContact N-O 3.26Å; A251-G253 VanDerWaalsContact C-N 3.3Å; A251-E256 HydrophobicContact CB-CB 3.84Å; A251-L257 HydrophobicContact CB-CB 3.97Å; A251-L257 HydrophobicContact CB-CD1 3.8Å
252	H	97.3	Very high	94.4	Very high	29 Å²	29	72.6 Å²	72.6	13%	0.134	38%	0.381	C	S	.	.	S	Bend	trans	-81.3	-8.9	173.1	-69.9	166.2	0	0	0	113.2	Y236 C242 G245 C248 E256	Y236-H252 WeakPolarHBondContact CB-CD2 3.37Å; Y236-H252 HydrophobicContact CD1-CB 3.62Å; Y236-H252 AromaticContact CD1-CG 3.99Å; Y236-H252 WeakPolarHBondContact CD1-O 3.3Å; Y236-H252 HydrophobicContact CD2-CB 4.03Å; Y236-H252 AromaticContact CD2-CD2 3.72Å; Y236-H252 AromaticContact CD2-CG 3.62Å; Y236-H252 AromaticContact CD2-ND1 3.83Å; Y236-H252 AromaticContact CD2-NE2 3.98Å; Y236-H252 HydrophobicContact CE1-CB 3.73Å; Y236-H252 WeakPolarHBondContact CE1-O 3.48Å; Y236-H252 HydrophobicContact CE2-CB 4.12Å; Y236-H252 HydrophobicContact CG-CB 3.78Å; Y236-H252 AromaticContact CG-CD2 3.45Å; Y236-H252 VanDerWaalsContact CG-CD2 3.45Å; Y236-H252 AromaticContact CG-CG 3.59Å; C242-H252 WeakPolarHBondContact CB-NE2 3.47Å; G245-H252 PolarHBondContact O-CE1 2.96Å; C248-H252 WeakPolarHBondContact CB-NE2 3.29Å; C248-H252 PolarHBondContact SG-NE2 3.19Å; C248-H252 VanDerWaalsContact SG-NE2 3.37Å; H252-E256 IonicContact CG-OE2 3.02Å; H252-E256 PolarHBondContact N-OE2 3.15Å
253	G	95.7	Very high	94.2	Very high	27 Å²	27	73.3 Å²	73.3	28%	0.278	38%	0.383	S	S	.	.	S	Bend	trans	-168	177.9	174.6	0	0	0	0	0	111.9	A251 N255 E256 L257	A251-G253 VanDerWaalsContact C-N 3.3Å; G253-N255 PolarHBondContact O-N 2.83Å; G253-E256 PolarHBondContact O-N 2.9Å; G253-E256 VanDerWaalsContact O-N 3.08Å; G253-L257 PolarHBondContact O-N 3.01Å
254	P	95.9	Very high	94.1	Very high	110 Å²	110	73.8 Å²	73.8	71%	0.714	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-59	-34.3	178.8	24.3	-33.5	0	0	0	112.2	E256 L257	P254-E256 PolarHBondContact O-N 2.8Å; P254-L257 WeakPolarHBondContact O-CB 3.49Å; P254-L257 PolarHBondContact O-N 3.43Å; P254-L257 VanDerWaalsContact O-N 3.13Å
255	N	95.5	Very high	94	Very high	166 Å²	166	73.8 Å²	73.8	89%	0.888	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-65.5	-23.9	179	-57.6	-6.2	0	0	0	113.2	G253	G253-N255 PolarHBondContact O-N 2.83Å
256	E	95.5	Very high	94.1	Very high	61 Å²	61	74.4 Å²	74.4	29%	0.285	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-95.7	-13.8	177.3	-70.9	-166	171.6	0	0	113.1	K229 A251 H252 G253 P254 K258	K229-E256 VanDerWaalsContact CB-O 3.31Å; K229-E256 WeakPolarHBondContact CB-O 3.49Å; K229-E256 HydrophobicContact CD-CB 4.22Å; K229-E256 IonicContact NZ-OE1 3.53Å; K229-E256 IonicContact NZ-OE2 3.17Å; K229-E256 PolarHBondContact NZ-OE2 3.14Å; A251-E256 HydrophobicContact CB-CB 3.84Å; H252-E256 IonicContact CG-OE2 3.02Å; H252-E256 PolarHBondContact N-OE2 3.15Å; G253-E256 PolarHBondContact O-N 2.9Å; G253-E256 VanDerWaalsContact O-N 3.08Å; P254-E256 PolarHBondContact O-N 2.8Å; E256-K258 PolarHBondContact O-N 2.82Å
257	L	95.6	Very high	94.1	Very high	64 Å²	64	73.1 Å²	73.1	34%	0.335	36%	0.36	S	S	.	.			trans	-73.8	123.8	-173.8	-168.5	70.6	0	0	0	109.9	K229 A251 G253 P254	K229-L257 WeakPolarHBondContact O-CA 3.32Å; A251-L257 HydrophobicContact CB-CB 3.97Å; A251-L257 HydrophobicContact CB-CD1 3.8Å; G253-L257 PolarHBondContact O-N 3.01Å; P254-L257 WeakPolarHBondContact O-CB 3.49Å; P254-L257 PolarHBondContact O-N 3.43Å; P254-L257 VanDerWaalsContact O-N 3.13Å
258	K	94	Very high	94.1	Very high	95 Å²	95	76.2 Å²	76.2	41%	0.413	38%	0.38	S	S	.	.			trans	-105.1	147.8	-179.1	-63.3	-170	178.6	-168.4	0	111.1	Y228 K229 T230 E256	Y228-K258 HydrophobicContact CD1-CD 4.3Å; K229-K258 HydrophobicContact CB-CD 4.44Å; K229-K258 HydrophobicContact CB-CG 4.22Å; K229-K258 PolarHBondContact O-N 3.48Å; T230-K258 VanDerWaalsContact CA-O 3.29Å; T230-K258 WeakPolarHBondContact CA-O 3.3Å; E256-K258 PolarHBondContact O-N 2.82Å
259	Y	93.2	Very high	94	Very high	145 Å²	145	85 Å²	85	57%	0.569	41%	0.413	S	S	*	.			trans	-94.5	118.8	176.2	-71.9	-74	0	0	0	109.8	Q261 F262	Y259-Q261 PolarHBondContact O-N 2.7Å; Y259-F262 HydrophobicContact CD2-CD2 4.47Å; Y259-F262 HydrophobicContact CD2-CE2 4.12Å; Y259-F262 HydrophobicContact CG-CD2 4.36Å; Y259-F262 HydrophobicContact CG-CE2 4.09Å; Y259-F262 PolarHBondContact O-N 3.31Å
260	P	92.1	Very high	94	Very high	24 Å²	24	86.9 Å²	86.9	16%	0.156	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-60.4	-31.2	-174.6	24.4	-34.1	0	0	0	112.7	T230 F262 H263 Y266 Y287	T230-P260 HydrophobicContact CG2-CB 3.97Å; T230-P260 HydrophobicContact CG2-CG 4.46Å; P260-F262 PolarHBondContact O-N 3.32Å; P260-F262 VanDerWaalsContact O-N 3.15Å; P260-H263 WeakPolarHBondContact O-CB 3.47Å; P260-H263 PolarHBondContact O-N 3.28Å; P260-Y266 HydrophobicContact CB-CD2 3.81Å; P260-Y266 HydrophobicContact CB-CE2 3.87Å; P260-Y266 HydrophobicContact CG-CE2 4.35Å; P260-Y266 WeakPolarHBondContact O-CB 3.33Å; P260-Y266 VanDerWaalsContact O-CG 3.24Å; P260-Y287 HydrophobicContact CB-CD1 4.18Å; P260-Y287 HydrophobicContact CB-CE1 3.44Å; P260-Y287 VanDerWaalsContact CB-CE1 3.44Å; P260-Y287 HydrophobicContact CG-CE1 4.23Å
261	Q	91.4	Very high	94	Very high	97 Å²	97	82 Å²	82	45%	0.453	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-60.5	-23.5	-179	65.5	-89.9	30.9	0	0	114.6	Y259 Y266	Y259-Q261 PolarHBondContact O-N 2.7Å; Q261-Y266 HydrophobicContact CB-CD1 4.36Å; Q261-Y266 HydrophobicContact CB-CE1 4.2Å
262	F	91.6	Very high	93.9	Very high	159 Å²	159	87.6 Å²	87.6	70%	0.697	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-90.8	-3.1	178.4	-55.7	-52	0	0	0	113.2	Y259 P260	Y259-F262 HydrophobicContact CD2-CD2 4.47Å; Y259-F262 HydrophobicContact CD2-CE2 4.12Å; Y259-F262 HydrophobicContact CG-CD2 4.36Å; Y259-F262 HydrophobicContact CG-CE2 4.09Å; Y259-F262 PolarHBondContact O-N 3.31Å; P260-F262 PolarHBondContact O-N 3.32Å; P260-F262 VanDerWaalsContact O-N 3.15Å
263	H	92.7	Very high	93.8	Very high	27 Å²	27	89.8 Å²	89.8	13%	0.125	44%	0.443	C	S	.	.	S	Bend	trans	-78.4	132.4	178.6	-174.6	-84.8	0	0	0	110.3	A222 I223 A226 P260 K265 Y266	A222-H263 PolarHBondContact O-CD2 3.4Å; A222-H263 VanDerWaalsContact O-CD2 3.29Å; A222-H263 PolarHBondContact O-NE2 3.27Å; A222-H263 VanDerWaalsContact O-NE2 3.09Å; I223-H263 PolarHBondContact O-NE2 2.88Å; A226-H263 WeakPolarHBondContact CA-ND1 3.44Å; A226-H263 HydrophobicContact CB-CB 4.19Å; A226-H263 WeakPolarHBondContact CB-ND1 3.46Å; P260-H263 WeakPolarHBondContact O-CB 3.47Å; P260-H263 PolarHBondContact O-N 3.28Å; H263-K265 VanDerWaalsContact CE1-CB 3.48Å; H263-K265 WeakPolarHBondContact CE1-CB 3.11Å; H263-K265 PolarHBondContact ND1-N 3.02Å; H263-K265 PolarHBondContact O-N 2.94Å; H263-Y266 VanDerWaalsContact O-CB 3.25Å; H263-Y266 WeakPolarHBondContact O-CB 3.39Å; H263-Y266 PolarHBondContact O-N 3.24Å
264	P	92.3	Very high	93.8	Very high	107 Å²	107	91 Å²	91	70%	0.695	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.4	-174.9	23.1	-34.9	0	0	0	114	T268	P264-T268 VanDerWaalsContact O-CG2 3.26Å; P264-T268 WeakPolarHBondContact O-CG2 3.08Å
265	K	91.6	Very high	93.7	Very high	94 Å²	94	88.6 Å²	88.6	41%	0.409	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.9	175.4	-53.3	177.2	179	-91.6	0	114.6	H263 R267 T268	H263-K265 VanDerWaalsContact CE1-CB 3.48Å; H263-K265 WeakPolarHBondContact CE1-CB 3.11Å; H263-K265 PolarHBondContact ND1-N 3.02Å; H263-K265 PolarHBondContact O-N 2.94Å; K265-R267 PolarHBondContact O-N 3.17Å; K265-T268 PolarHBondContact O-OG1 2.76Å
266	Y	93.9	Very high	93.7	Very high	47 Å²	47	86.3 Å²	86.3	18%	0.184	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	129.7	177.9	179.5	-106.8	0	0	0	110.5	P260 Q261 H263 T268 Y287	P260-Y266 HydrophobicContact CB-CD2 3.81Å; P260-Y266 HydrophobicContact CB-CE2 3.87Å; P260-Y266 HydrophobicContact CG-CE2 4.35Å; P260-Y266 WeakPolarHBondContact O-CB 3.33Å; P260-Y266 VanDerWaalsContact O-CG 3.24Å; Q261-Y266 HydrophobicContact CB-CD1 4.36Å; Q261-Y266 HydrophobicContact CB-CE1 4.2Å; H263-Y266 VanDerWaalsContact O-CB 3.25Å; H263-Y266 WeakPolarHBondContact O-CB 3.39Å; H263-Y266 PolarHBondContact O-N 3.24Å; Y266-T268 PolarHBondContact O-N 3.19Å; Y266-T268 VanDerWaalsContact O-N 3.12Å; Y266-Y287 AromaticContact CD2-CD1 3.97Å; Y266-Y287 HydrophobicContact CD2-CD1 3.97Å; Y266-Y287 HydrophobicContact CD2-CG 4.48Å; Y266-Y287 HydrophobicContact CE2-CD1 4.1Å; Y266-Y287 HydrophobicContact CE2-CG 4.29Å
267	R	92.4	Very high	93.6	Very high	96 Å²	96	88.8 Å²	88.8	36%	0.362	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	44.4	-178.6	-67	-176.3	177.6	174.4	2.2	112.7	K265 N284 C286 Y287 L289	K265-R267 PolarHBondContact O-N 3.17Å; R267-N284 PolarHBondContact NH2-O 3.07Å; R267-C286 PolarHBondContact NE-O 2.79Å; R267-Y287 WeakPolarHBondContact CA-O 3.42Å; R267-Y287 PolarHBondContact N-O 3.41Å; R267-L289 HydrophobicContact CB-CD2 3.75Å; R267-L289 HydrophobicContact CB-CG 4Å; R267-L289 WeakPolarHBondContact O-CD1 3.46Å; R267-L289 VanDerWaalsContact O-CD2 3.25Å; R267-L289 WeakPolarHBondContact O-CD2 3.07Å; R267-L289 WeakPolarHBondContact O-CG 3.25Å
268	T	92.2	Very high	93.4	Very high	83 Å²	83	88 Å²	88	51%	0.509	44%	0.439	S	S	.	.			trans	-98.4	-15.7	172.7	53.2	0	0	0	0	113.2	P264 K265 Y266	P264-T268 VanDerWaalsContact O-CG2 3.26Å; P264-T268 WeakPolarHBondContact O-CG2 3.08Å; K265-T268 PolarHBondContact O-OG1 2.76Å; Y266-T268 PolarHBondContact O-N 3.19Å; Y266-T268 VanDerWaalsContact O-N 3.12Å
269	R	92.9	Very high	93.4	Very high	187 Å²	187	88.1 Å²	88.1	71%	0.706	45%	0.448	S	S	*	.	S	Bend	trans	-119.7	149	177.7	-53.3	-171	85.7	-179.3	6.4	109.7	F288 L289	R269-F288 HydrophobicContact CB-CD1 4.17Å; R269-F288 CarbonylContact O-C 3.5Å; R269-F288 VanDerWaalsContact O-CA 3.3Å; R269-F288 WeakPolarHBondContact O-CA 3.33Å; R269-F288 WeakPolarHBondContact O-CB 3.32Å; R269-L289 PolarHBondContact O-N 2.82Å
270	I	94.1	Very high	93.6	Very high	96 Å²	96	82 Å²	82	49%	0.492	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-68.8	142.3	178.8	-59.2	170.8	0	0	0	110.3	M272 A275 L289	I270-M272 PolarHBondContact O-N 3.26Å; I270-A275 HydrophobicContact CG2-CB 4.08Å; I270-L289 CarbonylContact C-O 3.57Å
271	C	96.4	Very high	93.9	Very high	5 Å²	5	86 Å²	86	3%	0.034	45%	0.452	C	S	.	.			trans	-77	111.9	172	-175.8	0	0	0	0	109.6	N273 Y274 A275 C286 F288 L289 H290	C271-N273 VanDerWaalsContact C-N 3.32Å; C271-N273 PolarHBondContact O-N 3.03Å; C271-Y274 PolarHBondContact O-N 3.43Å; C271-A275 WeakPolarHBondContact O-CB 3.29Å; C271-A275 PolarHBondContact O-N 3.16Å; C271-C286 VanDerWaalsContact SG-SG 3.63Å; C271-F288 HydrophobicContact CB-CB 3.68Å; C271-L289 WeakPolarHBondContact CB-O 3.44Å; C271-L289 PolarHBondContact N-O 3.09Å; C271-H290 WeakPolarHBondContact CB-CD2 3.4Å
272	M	94.9	Very high	94	Very high	120 Å²	120	88.5 Å²	88.5	59%	0.591	46%	0.459	S	S	*	.	H	α-helix	trans	-62.5	-37.7	178.8	-62.1	-56.5	-64	0	0	112.6	I270 A275 N276	I270-M272 PolarHBondContact O-N 3.26Å; M272-A275 PolarHBondContact O-N 3.07Å; M272-N276 VanDerWaalsContact O-CB 3.27Å; M272-N276 WeakPolarHBondContact O-CB 3.24Å; M272-N276 PolarHBondContact O-N 3.27Å; M272-N276 PolarHBondContact O-ND2 3.37Å; M272-N276 PolarHBondContact O-OD1 3.5Å
273	N	95.2	Very high	94.1	Very high	75 Å²	75	82.5 Å²	82.5	40%	0.401	44%	0.441	S	S	.	.	H	α-helix	trans	-62.2	-46.8	177.9	-66	5.6	0	0	0	111	C271 N276 N277 T279	C271-N273 VanDerWaalsContact C-N 3.32Å; C271-N273 PolarHBondContact O-N 3.03Å; N273-N276 PolarHBondContact O-N 2.78Å; N273-N277 VanDerWaalsContact O-CB 3.3Å; N273-N277 WeakPolarHBondContact O-CB 3.45Å; N273-N277 PolarHBondContact O-N 2.84Å; N273-N277 PolarHBondContact O-OD1 3.27Å; N273-T279 CarbonylContact C-O 3.59Å
274	Y	96.5	Very high	94	Very high	52 Å²	52	87.7 Å²	87.7	20%	0.204	47%	0.47	C	S	.	.	H	α-helix	trans	-66.5	-42.7	177.2	-169.1	-94	0	0	0	111.9	C271 N276 G278 C280 H290 T292	C271-Y274 PolarHBondContact O-N 3.43Å; Y274-N276 VanDerWaalsContact C-N 3.3Å; Y274-N276 PolarHBondContact O-N 3.44Å; Y274-G278 WeakPolarHBondContact CE2-O 3.34Å; Y274-G278 WeakPolarHBondContact O-CA 3.22Å; Y274-G278 PolarHBondContact O-N 3.25Å; Y274-C280 HydrophobicContact CD2-CB 4.19Å; Y274-H290 WeakPolarHBondContact CB-CD2 3.08Å; Y274-H290 HydrophobicContact CD1-CB 3.52Å; Y274-H290 AromaticContact CD1-CG 3.85Å; Y274-H290 HydrophobicContact CD2-CB 4.01Å; Y274-H290 AromaticContact CD2-CD2 3.95Å; Y274-H290 AromaticContact CD2-CE1 3.96Å; Y274-H290 AromaticContact CD2-CG 3.57Å; Y274-H290 AromaticContact CD2-ND1 3.58Å; Y274-H290 HydrophobicContact CE1-CB 3.69Å; Y274-H290 HydrophobicContact CE2-CB 4.18Å; Y274-H290 AromaticContact CE2-ND1 3.98Å; Y274-H290 HydrophobicContact CG-CB 3.68Å; Y274-H290 AromaticContact CG-CD2 3.56Å; Y274-H290 AromaticContact CG-CG 3.43Å; Y274-H290 VanDerWaalsContact CG-CG 3.43Å; Y274-H290 AromaticContact CG-ND1 3.94Å; Y274-T292 PolarHBondContact OH-OG1 3.08Å
275	A	93.7	Very high	94	Very high	61 Å²	61	88.9 Å²	88.9	50%	0.504	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-37.9	179.4	0	0	0	0	0	112.5	I270 C271 M272	I270-A275 HydrophobicContact CG2-CB 4.08Å; C271-A275 WeakPolarHBondContact O-CB 3.29Å; C271-A275 PolarHBondContact O-N 3.16Å; M272-A275 PolarHBondContact O-N 3.07Å
276	N	94.5	Very high	94.1	Very high	118 Å²	118	84.5 Å²	84.5	63%	0.631	45%	0.452	S	S	*	.	H	α-helix	trans	-86.8	-38.8	-176.3	-65.2	-7	0	0	0	113	M272 N273 Y274	M272-N276 VanDerWaalsContact O-CB 3.27Å; M272-N276 WeakPolarHBondContact O-CB 3.24Å; M272-N276 PolarHBondContact O-N 3.27Å; M272-N276 PolarHBondContact O-ND2 3.37Å; M272-N276 PolarHBondContact O-OD1 3.5Å; N273-N276 PolarHBondContact O-N 2.78Å; Y274-N276 VanDerWaalsContact C-N 3.3Å; Y274-N276 PolarHBondContact O-N 3.44Å
277	N	93.6	Very high	94.1	Very high	113 Å²	113	84.3 Å²	84.3	60%	0.604	45%	0.451	S	S	*	.	H	α-helix	trans	-109.2	-6	-170.7	-59	90.4	0	0	0	113.6	N273 T279	N273-N277 VanDerWaalsContact O-CB 3.3Å; N273-N277 WeakPolarHBondContact O-CB 3.45Å; N273-N277 PolarHBondContact O-N 2.84Å; N273-N277 PolarHBondContact O-OD1 3.27Å; N277-T279 PolarHBondContact O-N 3.29Å
278	G	92.4	Very high	94.3	Very high	46 Å²	46	83.5 Å²	83.5	47%	0.474	45%	0.45	S	S	.	.	S	Bend	trans	67.4	-1.9	-171.3	0	0	0	0	0	114.4	Y274	Y274-G278 WeakPolarHBondContact CE2-O 3.34Å; Y274-G278 WeakPolarHBondContact O-CA 3.22Å; Y274-G278 PolarHBondContact O-N 3.25Å
279	T	94.7	Very high	94.3	Very high	98 Å²	98	83 Å²	83	60%	0.601	44%	0.444	S	S	*	.			trans	-137.5	146.1	-176.3	57.5	0	0	0	0	109.8	N273 N277	N273-T279 CarbonylContact C-O 3.59Å; N277-T279 PolarHBondContact O-N 3.29Å
280	C	96.9	Very high	94.4	Very high	16 Å²	16	76.7 Å²	76.7	11%	0.108	42%	0.422	C	S	.	.			trans	-131.7	127.2	177.8	178.4	0	0	0	0	108.7	Y274 Y282 G283 H290	Y274-C280 HydrophobicContact CD2-CB 4.19Å; C280-Y282 PolarHBondContact O-N 3.03Å; C280-G283 PolarHBondContact O-N 2.88Å; C280-H290 WeakPolarHBondContact CB-CE1 2.97Å; C280-H290 VanDerWaalsContact CB-NE2 3.28Å; C280-H290 WeakPolarHBondContact CB-NE2 3.42Å; C280-H290 PolarHBondContact SG-NE2 2.92Å; C280-H290 VanDerWaalsContact SG-NE2 3.39Å
281	P	96.9	Very high	93.9	Very high	109 Å²	109	79.2 Å²	79.2	71%	0.708	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.1	-179.1	27.1	-35.8	0	0	0	112.7
282	Y	94.5	Very high	93	Very high	150 Å²	150	82 Å²	82	59%	0.588	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-10.5	177	-55.1	-65.2	0	0	0	113.7	C280 N284 N285	C280-Y282 PolarHBondContact O-N 3.03Å; Y282-N284 PolarHBondContact O-N 2.9Å; Y282-N285 WeakPolarHBondContact O-CA 3.08Å; Y282-N285 WeakPolarHBondContact O-CB 3.31Å; Y282-N285 PolarHBondContact O-N 2.98Å
283	G	92.6	Very high	91.4	Very high	33 Å²	33	80.8 Å²	80.8	34%	0.34	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	48.5	-131.9	-178.6	0	0	0	0	0	113	C280 N285 C286 H290	C280-G283 PolarHBondContact O-N 2.88Å; G283-N285 PolarHBondContact O-N 2.75Å; G283-C286 VanDerWaalsContact O-CB 3.31Å; G283-C286 WeakPolarHBondContact O-CB 3.47Å; G283-C286 PolarHBondContact O-N 3.32Å; G283-H290 PolarHBondContact O-CE1 3.49Å; G283-H290 VanDerWaalsContact O-CE1 3.24Å
284	N	91.8	Very high	88.9	Confident	136 Å²	136	86.4 Å²	86.4	73%	0.727	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-68.5	-15	178.5	-66.2	-9.7	0	0	0	113.4	R267 Y282 C286	R267-N284 PolarHBondContact NH2-O 3.07Å; Y282-N284 PolarHBondContact O-N 2.9Å; N284-C286 PolarHBondContact O-N 3.03Å
285	N	91.7	Very high	86.2	Confident	132 Å²	132	87.6 Å²	87.6	71%	0.706	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-85.2	3.7	176.5	-61.3	-27.3	0	0	0	112.6	Y282 G283 Y287	Y282-N285 WeakPolarHBondContact O-CA 3.08Å; Y282-N285 WeakPolarHBondContact O-CB 3.31Å; Y282-N285 PolarHBondContact O-N 2.98Å; G283-N285 PolarHBondContact O-N 2.75Å; N285-Y287 WeakPolarHBondContact O-CD2 3.36Å; N285-Y287 PolarHBondContact O-N 3.34Å
286	C	94.8	Very high	83.5	Confident	2 Å²	2	89.2 Å²	89.2	1%	0.014	50%	0.498	C	S	.	.			trans	-61.3	132.4	175.9	-166.9	0	0	0	0	111.3	R267 C271 G283 N284 F288 H290	R267-C286 PolarHBondContact NE-O 2.79Å; C271-C286 VanDerWaalsContact SG-SG 3.63Å; G283-C286 VanDerWaalsContact O-CB 3.31Å; G283-C286 WeakPolarHBondContact O-CB 3.47Å; G283-C286 PolarHBondContact O-N 3.32Å; N284-C286 PolarHBondContact O-N 3.03Å; C286-F288 PolarHBondContact O-N 3.48Å; C286-F288 PolarHBondContact SG-N 2.89Å; C286-F288 PolarHBondContact SG-O 3.36Å; C286-H290 VanDerWaalsContact CB-NE2 3.32Å; C286-H290 WeakPolarHBondContact CB-NE2 3.3Å; C286-H290 PolarHBondContact SG-NE2 2.84Å
287	Y	93.6	Very high	80.8	Confident	43 Å²	43	88.9 Å²	88.9	17%	0.169	50%	0.501	C	S	.	.	S	Bend	trans	-79.9	-4.9	176.9	-77.9	-107.8	0	0	0	113	A226 R227 T230 P260 Y266 R267 N285	A226-Y287 HydrophobicContact CB-CD1 4.34Å; A226-Y287 WeakPolarHBondContact O-CE1 3.37Å; R227-Y287 HydrophobicContact CB-CE1 4.31Å; R227-Y287 HydrophobicContact CG-CD1 3.74Å; R227-Y287 HydrophobicContact CG-CE1 3.52Å; R227-Y287 HydrophobicContact CG-CE2 4.47Å; R227-Y287 HydrophobicContact CG-CG 4.3Å; T230-Y287 PolarHBondContact OG1-OH 3.01Å; P260-Y287 HydrophobicContact CB-CD1 4.18Å; P260-Y287 HydrophobicContact CB-CE1 3.44Å; P260-Y287 VanDerWaalsContact CB-CE1 3.44Å; P260-Y287 HydrophobicContact CG-CE1 4.23Å; Y266-Y287 AromaticContact CD2-CD1 3.97Å; Y266-Y287 HydrophobicContact CD2-CD1 3.97Å; Y266-Y287 HydrophobicContact CD2-CG 4.48Å; Y266-Y287 HydrophobicContact CE2-CD1 4.1Å; Y266-Y287 HydrophobicContact CE2-CG 4.29Å; R267-Y287 WeakPolarHBondContact CA-O 3.42Å; R267-Y287 PolarHBondContact N-O 3.41Å; N285-Y287 WeakPolarHBondContact O-CD2 3.36Å; N285-Y287 PolarHBondContact O-N 3.34Å
288	F	95.4	Very high	78.4	Confident	78 Å²	78	92 Å²	92	34%	0.342	51%	0.511	S	S	.	.	S	Bend	trans	-117.9	156.6	-177.4	-56.6	-71	0	0	0	109.5	R227 R269 C271 C286	R227-F288 VanDerWaalsContact NH2-CE2 3.26Å; R269-F288 HydrophobicContact CB-CD1 4.17Å; R269-F288 CarbonylContact O-C 3.5Å; R269-F288 VanDerWaalsContact O-CA 3.3Å; R269-F288 WeakPolarHBondContact O-CA 3.33Å; R269-F288 WeakPolarHBondContact O-CB 3.32Å; C271-F288 HydrophobicContact CB-CB 3.68Å; C286-F288 PolarHBondContact O-N 3.48Å; C286-F288 PolarHBondContact SG-N 2.89Å; C286-F288 PolarHBondContact SG-O 3.36Å
289	L	94.1	Very high	75.7	Confident	74 Å²	74	95.2 Å²	95.2	39%	0.387	52%	0.518	S	S	.	.	B	Isolated β-bridge	trans	-71.6	131.2	-178.8	-69.6	164.3	0	0	0	111.3	R267 R269 I270 C271	R267-L289 HydrophobicContact CB-CD2 3.75Å; R267-L289 HydrophobicContact CB-CG 4Å; R267-L289 WeakPolarHBondContact O-CD1 3.46Å; R267-L289 VanDerWaalsContact O-CD2 3.25Å; R267-L289 WeakPolarHBondContact O-CD2 3.07Å; R267-L289 WeakPolarHBondContact O-CG 3.25Å; R269-L289 PolarHBondContact O-N 2.82Å; I270-L289 CarbonylContact C-O 3.57Å; C271-L289 WeakPolarHBondContact CB-O 3.44Å; C271-L289 PolarHBondContact N-O 3.09Å
290	H	94.7	Very high	72.8	Confident	53 Å²	53	97.7 Å²	97.7	25%	0.245	53%	0.527	C	S	.	.			trans	-92.8	108.3	164.4	-67.3	173.1	0	0	0	107.1	C271 Y274 C280 G283 C286 T292	C271-H290 WeakPolarHBondContact CB-CD2 3.4Å; Y274-H290 WeakPolarHBondContact CB-CD2 3.08Å; Y274-H290 HydrophobicContact CD1-CB 3.52Å; Y274-H290 AromaticContact CD1-CG 3.85Å; Y274-H290 HydrophobicContact CD2-CB 4.01Å; Y274-H290 AromaticContact CD2-CD2 3.95Å; Y274-H290 AromaticContact CD2-CE1 3.96Å; Y274-H290 AromaticContact CD2-CG 3.57Å; Y274-H290 AromaticContact CD2-ND1 3.58Å; Y274-H290 HydrophobicContact CE1-CB 3.69Å; Y274-H290 HydrophobicContact CE2-CB 4.18Å; Y274-H290 AromaticContact CE2-ND1 3.98Å; Y274-H290 HydrophobicContact CG-CB 3.68Å; Y274-H290 AromaticContact CG-CD2 3.56Å; Y274-H290 AromaticContact CG-CG 3.43Å; Y274-H290 VanDerWaalsContact CG-CG 3.43Å; Y274-H290 AromaticContact CG-ND1 3.94Å; C280-H290 WeakPolarHBondContact CB-CE1 2.97Å; C280-H290 VanDerWaalsContact CB-NE2 3.28Å; C280-H290 WeakPolarHBondContact CB-NE2 3.42Å; C280-H290 PolarHBondContact SG-NE2 2.92Å; C280-H290 VanDerWaalsContact SG-NE2 3.39Å; G283-H290 PolarHBondContact O-CE1 3.49Å; G283-H290 VanDerWaalsContact O-CE1 3.24Å; C286-H290 VanDerWaalsContact CB-NE2 3.32Å; C286-H290 WeakPolarHBondContact CB-NE2 3.3Å; C286-H290 PolarHBondContact SG-NE2 2.84Å; H290-T292 PolarHBondContact O-N 3Å
291	F	83.1	Confident	70.2	Confident	149 Å²	149	104.2 Å²	104.2	65%	0.654	56%	0.556	S	S	*	*			trans	-84.7	105.9	173.3	-175.5	-100.6	0	0	0	108.2	P293	F291-P293 HydrophobicContact CE1-CB 3.93Å; F291-P293 WeakPolarHBondContact O-CD 3.43Å
292	T	76.6	Confident	67.3	Low	63 Å²	63	104.7 Å²	104.7	39%	0.387	56%	0.557	S	S	.	*			trans	-92.5	110.6	168.2	-49	0	0	0	0	106.8	Y274 H290 M294 S295	Y274-T292 PolarHBondContact OH-OG1 3.08Å; H290-T292 PolarHBondContact O-N 3Å; T292-M294 PolarHBondContact O-N 3.42Å; T292-S295 VanDerWaalsContact CG2-OG 3.31Å; T292-S295 WeakPolarHBondContact CG2-OG 3.47Å
293	P	62.3	Low	64.2	Low	96 Å²	96	103.9 Å²	103.9	62%	0.623	57%	0.568	S	S	*	*			trans	-62.6	106.6	173.6	24.2	-30.5	0	0	0	108.4	F291 S295	F291-P293 HydrophobicContact CE1-CB 3.93Å; F291-P293 WeakPolarHBondContact O-CD 3.43Å; P293-S295 PolarHBondContact O-N 2.88Å
294	M	41.9	Very low	61.6	Low	193 Å²	193	109 Å²	109	95%	0.951	59%	0.593	S	S	*	*	S	Bend	trans	22.7	77.3	172.7	-75.3	174.9	71.4	0	0	115.2	T292	T292-M294 PolarHBondContact O-N 3.42Å
295	S	40	Very low	58.7	Low	76 Å²	76	110.1 Å²	110.1	53%	0.531	60%	0.599	S	S	.	*			trans	-128.4	106.4	151.4	45.2	0	0	0	0	107.8	T292 P293	T292-S295 VanDerWaalsContact CG2-OG 3.31Å; T292-S295 WeakPolarHBondContact CG2-OG 3.47Å; P293-S295 PolarHBondContact O-N 2.88Å
296	S	38.4	Very low	56.3	Low	96 Å²	96	110.6 Å²	110.6	67%	0.671	61%	0.606	S	S	*	*			trans	45.8	116.7	147.8	53.6	0	0	0	0	117.2	Q298	S296-Q298 PolarHBondContact O-N 3.29Å
297	T	37.3	Very low	53.4	Low	111 Å²	111	119.6 Å²	119.6	68%	0.681	65%	0.646	S	S	*	*				0.1	105.9	129.8	2.6	0	0	0	0	111.8	N299	T297-N299 PolarHBondContact O-N 3.07Å
298	Q	42	Very low	50.9	Low	177 Å²	177	125.5 Å²	125.5	83%	0.827	68%	0.678	S	S	*	*			trans	-72	60	157.2	-71.2	-171.7	1.5	0	0	107.7	S296 N300	S296-Q298 PolarHBondContact O-N 3.29Å; Q298-N300 VanDerWaalsContact C-N 3.33Å; Q298-N300 PolarHBondContact O-N 2.85Å
299	N	35.9	Very low	48.2	Very low	114 Å²	114	128.7 Å²	128.7	61%	0.61	70%	0.699	S	S	*	*			trans	-76.3	99.6	151.2	-82.5	-2.2	0	0	0	104.4	T297 H301	T297-N299 PolarHBondContact O-N 3.07Å; N299-H301 PolarHBondContact O-N 3.49Å
300	N	35.3	Very low	45.3	Very low	151 Å²	151	131.6 Å²	131.6	81%	0.807	72%	0.715	S	S	*	*			trans	-63.2	75.7	156	-69.3	-40.5	0	0	0	107.8	Q298	Q298-N300 VanDerWaalsContact C-N 3.33Å; Q298-N300 PolarHBondContact O-N 2.85Å
301	H	42.5	Very low	42.5	Very low	152 Å²	152	136.5 Å²	136.5	70%	0.704	74%	0.743	S	S	*	*			trans	-130.6	91.5	167.5	-86.9	-69.8	0	0	0	107.4	N299 T303	N299-H301 PolarHBondContact O-N 3.49Å; H301-T303 PolarHBondContact O-N 3.22Å
302	T	35.2	Very low	40	Very low	120 Å²	120	141 Å²	141	74%	0.736	76%	0.756	S	S	*	*			trans	18.1	101.1	139.3	44.5	0	0	0	0	115.7
303	T	30.2	Very low	38.3	Very low	132 Å²	132	144.4 Å²	144.4	81%	0.81	78%	0.776	S	S	*	*			trans	9.9	111.7	141.5	37.1	0	0	0	0	117	H301	H301-T303 PolarHBondContact O-N 3.22Å
304	T	36.2	Very low	37.1	Very low	142 Å²	142	146.2 Å²	146.2	87%	0.871	79%	0.785	S	S	*	*				-170	126.5	124.3	41.8	0	0	0	0	111.8
305	N	31.7	Very low	36.8	Very low	158 Å²	158	141.9 Å²	141.9	85%	0.845	78%	0.78	S	S	*	*			trans	-18.7	131.7	165	-90.5	-35.1	0	0	0	118
306	T	41.8	Very low	36.9	Very low	142 Å²	142	147.6 Å²	147.6	87%	0.871	80%	0.795	S	S	*	*				-171.9	147	114.5	17.5	0	0	0	0	112.9
307	K	33.6	Very low	36.8	Very low	192 Å²	192	148.2 Å²	148.2	84%	0.835	80%	0.797	S	S	*	*			trans	-61.8	152.7	-173.3	-60.5	160	177.4	175.6	0	112.2
308	I	41.5	Very low	36.7	Very low	167 Å²	167	155.7 Å²	155.7	86%	0.856	81%	0.813	S	S	*	*				170.5	113.9	124.6	-80.2	149.9	0	0	0	111.8
309	N	38.3	Very low	36.3	Very low	144 Å²	144	152.9 Å²	152.9	77%	0.77	80%	0.804	S	S	*	*			trans	33.1	137.2	141.3	-158.2	8.2	0	0	0	124.3
310	N	32.1	Very low	36.8	Very low	135 Å²	135	155.2 Å²	155.2	72%	0.722	81%	0.814	S	S	*	*			trans	-61.2	145.4	176.4	-61.7	-37.8	0	0	0	116.2
311	N	37.4	Very low	36.7	Very low	156 Å²	156	152.4 Å²	152.4	83%	0.834	80%	0.8	S	S	*	*			trans	-167.3	100.3	131.8	-97	-18.2	0	0	0	113.4
312	R	31	Very low	36.6	Very low	245 Å²	245	152.9 Å²	152.9	93%	0.925	80%	0.802	S	S	*	*			trans	14.3	100.6	139.3	-149.9	178.3	-161.9	167.7	3.1	118
313	T	40.8	Very low	36.5	Very low	134 Å²	134	157.1 Å²	157.1	82%	0.822	81%	0.81	S	S	*	*			trans	-149.3	117.9	151.5	45.2	0	0	0	0	112.9
314	V	37.1	Very low	36.9	Very low	133 Å²	133	157.7 Å²	157.7	81%	0.806	81%	0.807	S	S	*	*			trans	23.8	114	146.3	-168.4	0	0	0	0	118.6	K316	V314-K316 PolarHBondContact O-N 2.83Å
315	A	35.1	Very low	36.9	Very low	102 Å²	102	158.4 Å²	158.4	84%	0.843	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.2	125.6	170.2	0	0	0	0	0	112
316	K	41.4	Very low	36.9	Very low	196 Å²	196	158.5 Å²	158.5	85%	0.852	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.3	147.3	175.1	-71.2	-179.6	179.3	177.4	0	111.5	V314	V314-K316 PolarHBondContact O-N 2.83Å
317	P	36.7	Very low	36.6	Very low	110 Å²	110	159 Å²	159	71%	0.714	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74	147.1	-178.9	-6.3	24	0	0	0	112.3	N319	P317-N319 PolarHBondContact O-N 3.19Å
318	W	35	Very low	36.7	Very low	267 Å²	267	154.1 Å²	154.1	100%	1.011	79%	0.788	S	S	*	*			trans	-37.9	112.8	179.1	-55.4	74.7	0	0	0	114.1
319	N	34.2	Very low	36.3	Very low	118 Å²	118	153 Å²	153	63%	0.631	78%	0.784	S	S	*	*			trans	-99.3	127.3	167.6	-170.1	-22.5	0	0	0	108.6	P317 D321	P317-N319 PolarHBondContact O-N 3.19Å; N319-D321 VanDerWaalsContact C-N 3.26Å; N319-D321 PolarHBondContact O-N 3.23Å; N319-D321 PolarHBondContact OD1-N 2.95Å
320	I	45.5	Very low	36.2	Very low	163 Å²	163	154.5 Å²	154.5	84%	0.836	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	1.1	-169.6	-139.9	150.8	0	0	0	113.3
321	D	34.3	Very low	36.1	Very low	93 Å²	93	151.5 Å²	151.5	50%	0.497	78%	0.78	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	3.3	-171.9	-68.3	-22.1	0	0	0	115.4	Q30 N319	Q30-D321 PolarHBondContact NE2-OD2 2.88Å; N319-D321 VanDerWaalsContact C-N 3.26Å; N319-D321 PolarHBondContact O-N 3.23Å; N319-D321 PolarHBondContact OD1-N 2.95Å
322	H	39.9	Very low	35.8	Very low	161 Å²	161	151.4 Å²	151.4	75%	0.745	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	24.8	-170.3	-144	-72.5	0	0	0	115.9
323	F	33.7	Very low	36	Very low	209 Å²	209	148 Å²	148	92%	0.917	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	17.5	179.4	-118.6	-88.4	0	0	0	115.4
324	I	38.2	Very low	35.5	Very low	145 Å²	145	146.1 Å²	146.1	74%	0.744	77%	0.77	S	S	*	*	S	Bend	trans	-124.2	74	169.7	-52.8	176.8	0	0	0	107.2
325	Q	36	Very low	35.3	Very low	157 Å²	157	145.8 Å²	145.8	73%	0.734	76%	0.764	S	S	*	*	S	Bend	trans	-164.4	-0.7	167.6	-110.2	152.9	42.6	0	0	116.5
326	D	32.6	Very low	35.4	Very low	160 Å²	160	147.8 Å²	147.8	86%	0.856	76%	0.76	S	S	*	*			trans	-103.9	38.8	176.9	-71.4	-19	0	0	0	113.2
327	D	34.4	Very low	35.4	Very low	153 Å²	153	146.4 Å²	146.4	82%	0.818	76%	0.757	S	S	*	*			trans	-94.3	14.6	173.8	-82.9	-29.3	0	0	0	113.6
328	S	35.7	Very low	35.1	Very low	88 Å²	88	147.2 Å²	147.2	62%	0.615	75%	0.75	S	S	*	*	S	Bend	trans	-114	12	-171.5	46.6	0	0	0	0	116.1
329	N	33.3	Very low	35.2	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	75%	0.746	S	S	*	*			trans	-125	15.1	178.4	-86.3	-33.9	0	0	0	116.2	S331	N329-S331 PolarHBondContact O-N 3.19Å; N329-S331 VanDerWaalsContact O-N 3.09Å
330	I	35.2	Very low	35.2	Very low	174 Å²	174	142.9 Å²	142.9	89%	0.892	74%	0.743	S	S	*	*			trans	-86.4	58	164.1	-51.8	-179.9	0	0	0	109.1
331	S	32	Very low	34.6	Very low	73 Å²	73	140.8 Å²	140.8	51%	0.51	74%	0.738	S	S	.	*	S	Bend	trans	-149.1	116.3	164.2	54.9	0	0	0	0	105	N329	N329-S331 PolarHBondContact O-N 3.19Å; N329-S331 VanDerWaalsContact O-N 3.09Å
332	N	30.4	Very low	34.7	Very low	153 Å²	153	145.5 Å²	145.5	82%	0.818	76%	0.76	S	S	*	*			trans	97.7	73.3	-174.8	-48.2	-32.7	0	0	0	115.4
333	I	34.7	Very low	34.3	Very low	175 Å²	175	145.1 Å²	145.1	90%	0.897	76%	0.761	S	S	*	*				-150.1	77.3	128	-83	134.2	0	0	0	105.1
334	S	30.4	Very low	34.2	Very low	94 Å²	94	143.4 Å²	143.4	66%	0.657	76%	0.761	S	S	*	*			trans	-78.1	151.4	150.9	-177.5	0	0	0	0	107.2
335	N	32.9	Very low	33.7	Very low	126 Å²	126	140.5 Å²	140.5	67%	0.674	75%	0.754	S	S	*	*			trans	95.2	90.9	165.7	-43.8	-24.4	0	0	0	114.5
336	N	38.1	Very low	33.6	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	75%	0.75	S	S	*	*				175.6	127.4	103.1	-86.5	-28.5	0	0	0	114.3
337	H	39.5	Very low	33.5	Very low	167 Å²	167	136.3 Å²	136.3	77%	0.773	74%	0.744	S	S	*	*			trans	74.9	96.4	159.6	-62.8	-64.4	0	0	0	120
338	H	31.6	Very low	33.2	Very low	126 Å²	126	135.4 Å²	135.4	58%	0.583	74%	0.738	S	S	*	*				88.5	87.5	77.4	-157.1	-38.6	0	0	0	112.2	D340	H338-D340 IonicContact CE1-OD1 3.55Å; H338-D340 PolarHBondContact CE1-OD1 3.12Å; H338-D340 IonicContact CE1-OD2 3.09Å; H338-D340 PolarHBondContact CE1-OD2 3.43Å; H338-D340 IonicContact ND1-OD1 3.01Å; H338-D340 IonicContact ND1-OD2 3.08Å; H338-D340 PolarHBondContact ND1-OD2 2.75Å; H338-D340 VanDerWaalsContact ND1-OD2 3.17Å; H338-D340 IonicContact NE2-OD1 3.7Å
339	M	36.8	Very low	33.2	Very low	188 Å²	188	141.6 Å²	141.6	93%	0.926	75%	0.748	S	S	*	*			trans	-138.8	84	142.6	-75	-61.2	175.2	0	0	106.9
340	D	33	Very low	33.1	Very low	106 Å²	106	145.6 Å²	145.6	57%	0.567	75%	0.752	S	S	*	*			trans	16.5	118.4	151.7	-71	-48.9	0	0	0	122.1	H338	H338-D340 IonicContact CE1-OD1 3.55Å; H338-D340 PolarHBondContact CE1-OD1 3.12Å; H338-D340 IonicContact CE1-OD2 3.09Å; H338-D340 PolarHBondContact CE1-OD2 3.43Å; H338-D340 IonicContact ND1-OD1 3.01Å; H338-D340 IonicContact ND1-OD2 3.08Å; H338-D340 PolarHBondContact ND1-OD2 2.75Å; H338-D340 VanDerWaalsContact ND1-OD2 3.17Å; H338-D340 IonicContact NE2-OD1 3.7Å
341	T	33.6	Very low	32.9	Very low	120 Å²	120	142.4 Å²	142.4	74%	0.736	74%	0.741	S	S	*	*				55.5	106.2	126.3	56.3	0	0	0	0	119.6
342	M	36.5	Very low	32.9	Very low	191 Å²	191	144.7 Å²	144.7	94%	0.941	75%	0.752	S	S	*	*				-176.7	100.5	102.9	-76.5	-128.6	-161.4	0	0	108.7
343	I	30.8	Very low	33.6	Very low	153 Å²	153	148.8 Å²	148.8	79%	0.785	77%	0.771	S	S	*	*			trans	-116.5	121	161.2	-64	178.7	0	0	0	106.1
344	L	32.2	Very low	33.6	Very low	174 Å²	174	147.5 Å²	147.5	91%	0.911	76%	0.764	S	S	*	*			trans	-131.2	102.3	140.5	-104.5	109.9	0	0	0	108.3
345	S	28.7	Very low	33.8	Very low	84 Å²	84	150.3 Å²	150.3	59%	0.587	77%	0.77	S	S	*	*			trans	-37.1	143.2	151.4	48.9	0	0	0	0	112
346	S	34.2	Very low	33.8	Very low	95 Å²	95	151.6 Å²	151.6	66%	0.664	78%	0.775	S	S	*	*				169.8	120.2	123.3	-74.7	0	0	0	0	110.9
347	N	28.9	Very low	33.6	Very low	134 Å²	134	152.1 Å²	152.1	72%	0.717	78%	0.776	S	S	*	*				63.6	113.7	128.3	-59.7	-30	0	0	0	120.2
348	L	29	Very low	33.2	Very low	133 Å²	133	151.1 Å²	151.1	70%	0.696	78%	0.776	S	S	*	*				64.1	137.7	125.4	-87.8	95	0	0	0	120.1
349	R	35.8	Very low	33.3	Very low	219 Å²	219	152.8 Å²	152.8	83%	0.826	79%	0.789	S	S	*	*			trans	83.1	105.6	155.5	-67	164.4	-172.1	-166.2	3.8	114.1
350	R	31.5	Very low	33	Very low	229 Å²	229	150.3 Å²	150.3	86%	0.864	78%	0.779	S	S	*	*				95.4	123.6	75.6	-102.3	-163.7	180	176.3	1.4	110.5
351	V	31.1	Very low	33	Very low	107 Å²	107	153.7 Å²	153.7	65%	0.648	80%	0.795	S	S	*	*				84.8	112	129.8	172.8	0	0	0	0	117.4
352	T	30.2	Very low	33	Very low	121 Å²	121	156.5 Å²	156.5	74%	0.742	80%	0.8	S	S	*	*			trans	53.3	135	141.3	62.9	0	0	0	0	117.8
353	I	47	Very low	32.7	Very low	238 Å²	238	153.4 Å²	153.4	100%	1.221	79%	0.787	S	S	*	*				-140.2	0	53.2	-71.1	162.3	0	0	0	110

Retrieved 353 of 353 residues in 49.7 ms (Link to these results)

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