A0A077YY64_TRITR Loading...

Lipase

AlphaFold DB , UniProt , Accession A0A077YY64, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 356 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	30.7	Very low	35.2	Very low	233 Å²	233	152 Å²	152	100%	1.148	72%	0.72	S	S	*	*				0	111.5	0	-170.7	173	-94.2	0	0	106.7
2	F	29	Very low	36.7	Very low	170 Å²	170	142.3 Å²	142.3	75%	0.746	67%	0.674	S	S	*	*			trans	62.3	81.9	177.4	-79.1	-86.1	0	0	0	119.5	L4	F2-L4 HydrophobicContact CD1-CD1 3.53Å; F2-L4 HydrophobicContact CD1-CG 3.93Å; F2-L4 HydrophobicContact CE1-CD1 3.74Å; F2-L4 HydrophobicContact CE1-CG 4.27Å
3	W	25.9	Very low	38.8	Very low	256 Å²	256	136.1 Å²	136.1	97%	0.97	65%	0.646	S	S	*	*			trans	-97.5	99	145.2	-83.7	87.8	0	0	0	107.3
4	L	30.3	Very low	41.6	Very low	135 Å²	135	129.6 Å²	129.6	71%	0.707	62%	0.617	S	S	*	*			trans	-88.1	125.2	176.2	-112.1	157.8	0	0	0	108.7	F2 L6	F2-L4 HydrophobicContact CD1-CD1 3.53Å; F2-L4 HydrophobicContact CD1-CG 3.93Å; F2-L4 HydrophobicContact CE1-CD1 3.74Å; F2-L4 HydrophobicContact CE1-CG 4.27Å; L4-L6 PolarHBondContact O-N 3.08Å
5	F	28.6	Very low	44.3	Very low	195 Å²	195	120.9 Å²	120.9	86%	0.855	58%	0.575	S	S	*	*			trans	-48.7	116.2	177.1	-70.5	-100	0	0	0	113.1
6	L	31.9	Very low	46.8	Very low	146 Å²	146	115.1 Å²	115.1	76%	0.764	55%	0.55	S	S	*	.			trans	-105.1	124.1	150.4	-71.2	173	0	0	0	106.7	L4 H8	L4-L6 PolarHBondContact O-N 3.08Å; L6-H8 VanDerWaalsContact C-N 3.29Å; L6-H8 PolarHBondContact O-N 3.3Å
7	K	27.4	Very low	49.2	Very low	218 Å²	218	114.9 Å²	114.9	95%	0.948	55%	0.548	S	S	*	.			trans	-62.5	93.7	169.5	-78.4	-179	173.4	-178.6	0	107.6	D9	K7-D9 PolarHBondContact O-N 2.65Å
8	H	35.7	Very low	51.3	Low	121 Å²	121	110.3 Å²	110.3	56%	0.56	53%	0.527	S	S	*	.			trans	-69.2	122.4	170.6	-92.1	-63	0	0	0	108.9	L6 E12 I13	L6-H8 VanDerWaalsContact C-N 3.29Å; L6-H8 PolarHBondContact O-N 3.3Å; H8-E12 IonicContact CE1-OE2 3.27Å; H8-E12 PolarHBondContact CE1-OE2 3.16Å; H8-E12 VanDerWaalsContact CE1-OE2 3.27Å; H8-E12 IonicContact CG-OE2 3.9Å; H8-E12 IonicContact ND1-OE2 2.68Å; H8-E12 PolarHBondContact ND1-OE2 3.12Å; H8-I13 HydrophobicContact CB-CG1 4.49Å
9	D	47.1	Very low	53.5	Low	82 Å²	82	104.5 Å²	104.5	44%	0.439	50%	0.499	S	S	.	.			trans	-59.3	136.1	166.2	-160.5	-9.6	0	0	0	108	K7 T11 E12	K7-D9 PolarHBondContact O-N 2.65Å; D9-T11 PolarHBondContact O-N 3.44Å; D9-E12 PolarHBondContact O-N 3.21Å
10	S	49.2	Very low	55.4	Low	85 Å²	85	105.1 Å²	105.1	59%	0.594	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.7	-170.9	58.9	0	0	0	0	113.4	I13	S10-I13 WeakPolarHBondContact O-CB 3.29Å
11	T	51.2	Low	57.1	Low	31 Å²	31	109.4 Å²	109.4	19%	0.19	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-47.6	177.5	52.7	0	0	0	0	111.7	D9 I13 I14 Q15 I100 Y101	D9-T11 PolarHBondContact O-N 3.44Å; T11-I13 PolarHBondContact O-N 3.5Å; T11-I14 PolarHBondContact O-N 3.31Å; T11-I14 VanDerWaalsContact O-N 3.13Å; T11-Q15 PolarHBondContact O-OE1 3.11Å; T11-I100 HydrophobicContact CG2-CB 4.36Å; T11-Y101 WeakPolarHBondContact O-CE1 3.31Å
12	E	53.2	Low	60	Low	36 Å²	36	102.4 Å²	102.4	17%	0.168	47%	0.474	C	S	.	.	H	α-helix	trans	-54.2	-23.9	178.4	-82.2	-173.3	147.4	0	0	113.6	H8 D9 Q15 T16 T40	H8-E12 IonicContact CE1-OE2 3.27Å; H8-E12 PolarHBondContact CE1-OE2 3.16Å; H8-E12 VanDerWaalsContact CE1-OE2 3.27Å; H8-E12 IonicContact CG-OE2 3.9Å; H8-E12 IonicContact ND1-OE2 2.68Å; H8-E12 PolarHBondContact ND1-OE2 3.12Å; D9-E12 PolarHBondContact O-N 3.21Å; E12-Q15 PolarHBondContact O-OE1 3.25Å; E12-T16 VanDerWaalsContact O-CG2 3.28Å; E12-T16 WeakPolarHBondContact O-CG2 3.37Å; E12-T16 PolarHBondContact O-OG1 3.2Å; E12-T40 HydrophobicContact CG-CG2 4.42Å
13	I	63.8	Low	63.1	Low	61 Å²	61	97.6 Å²	97.6	31%	0.313	47%	0.472	S	S	.	.	H	α-helix	trans	-72	-32.5	-175.5	-60.3	-178.4	0	0	0	112	H8 S10 T11 T16 Q17	H8-I13 HydrophobicContact CB-CG1 4.49Å; S10-I13 WeakPolarHBondContact O-CB 3.29Å; T11-I13 PolarHBondContact O-N 3.5Å; I13-T16 PolarHBondContact O-OG1 2.77Å; I13-T16 VanDerWaalsContact O-OG1 3.05Å; I13-Q17 HydrophobicContact CG2-CG 3.97Å; I13-Q17 WeakPolarHBondContact O-CB 3.46Å; I13-Q17 WeakPolarHBondContact O-CG 3.07Å; I13-Q17 PolarHBondContact O-N 3.39Å
14	I	78.3	Confident	66.3	Low	45 Å²	45	86.7 Å²	86.7	23%	0.231	43%	0.431	C	S	.	.	H	α-helix	trans	-73.6	-54.4	-165.6	-65.2	162.8	0	0	0	111.9	T11 Q17 I18 I69 F256	T11-I14 PolarHBondContact O-N 3.31Å; T11-I14 VanDerWaalsContact O-N 3.13Å; I14-Q17 PolarHBondContact O-N 3.14Å; I14-I18 HydrophobicContact CG2-CD1 4.06Å; I14-I18 VanDerWaalsContact O-CG1 3.3Å; I14-I18 WeakPolarHBondContact O-CG1 3.41Å; I14-I18 PolarHBondContact O-N 2.88Å; I14-I69 HydrophobicContact CG2-CD1 3.98Å; I14-F256 HydrophobicContact CD1-CD1 4.47Å; I14-F256 HydrophobicContact CD1-CE1 3.98Å; I14-F256 HydrophobicContact CG1-CE1 4.44Å; I14-F256 HydrophobicContact CG2-CD1 3.99Å; I14-F256 HydrophobicContact CG2-CE1 3.43Å; I14-F256 VanDerWaalsContact CG2-CE1 3.43Å; I14-F256 HydrophobicContact CG2-CZ 3.78Å
15	Q	81.7	Confident	69	Low	0 Å²	0	86.4 Å²	86.4	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-68.4	-36.6	-177.8	70.6	-72.9	15.2	0	0	111.6	T11 E12 I18 I19 I42 I69 I72 Y101	T11-Q15 PolarHBondContact O-OE1 3.11Å; E12-Q15 PolarHBondContact O-OE1 3.25Å; Q15-I18 PolarHBondContact O-N 3.36Å; Q15-I19 VanDerWaalsContact O-CD1 3.31Å; Q15-I19 WeakPolarHBondContact O-CD1 3.41Å; Q15-I19 WeakPolarHBondContact O-CG1 3.24Å; Q15-I19 PolarHBondContact O-N 3.44Å; Q15-I42 HydrophobicContact CG-CD1 3.63Å; Q15-I42 HydrophobicContact CG-CG1 3.62Å; Q15-I69 HydrophobicContact CB-CG1 4.01Å; Q15-I72 HydrophobicContact CB-CD1 4.04Å; Q15-Y101 VanDerWaalsContact CD-CZ 3.46Å; Q15-Y101 HydrophobicContact CG-CE1 4.32Å; Q15-Y101 PolarHBondContact OE1-OH 2.75Å
16	T	85.7	Confident	72.1	Confident	27 Å²	27	77.9 Å²	77.9	17%	0.166	39%	0.39	C	S	.	.	H	α-helix	trans	-64.6	-45.7	174.5	52.6	0	0	0	0	110.5	E12 I13 I18 I19 E20 P26 I42	E12-T16 VanDerWaalsContact O-CG2 3.28Å; E12-T16 WeakPolarHBondContact O-CG2 3.37Å; E12-T16 PolarHBondContact O-OG1 3.2Å; I13-T16 PolarHBondContact O-OG1 2.77Å; I13-T16 VanDerWaalsContact O-OG1 3.05Å; T16-I18 PolarHBondContact O-N 2.77Å; T16-I19 PolarHBondContact O-N 3.38Å; T16-I19 VanDerWaalsContact O-N 3.16Å; T16-E20 WeakPolarHBondContact O-CG 3.41Å; T16-E20 PolarHBondContact O-N 3.17Å; T16-P26 HydrophobicContact CG2-CB 4.03Å; T16-P26 HydrophobicContact CG2-CG 4.13Å; T16-I42 HydrophobicContact CG2-CD1 4.38Å
17	Q	86.5	Confident	75.1	Confident	112 Å²	112	73.2 Å²	73.2	52%	0.523	37%	0.366	S	S	.	.	H	α-helix	trans	-60.7	-39.3	173.9	-77.7	175.9	-7.7	0	0	113.5	I13 I14 I19 R21	I13-Q17 HydrophobicContact CG2-CG 3.97Å; I13-Q17 WeakPolarHBondContact O-CB 3.46Å; I13-Q17 WeakPolarHBondContact O-CG 3.07Å; I13-Q17 PolarHBondContact O-N 3.39Å; I14-Q17 PolarHBondContact O-N 3.14Å; Q17-I19 VanDerWaalsContact C-N 3.33Å; Q17-R21 WeakPolarHBondContact O-CB 3.45Å; Q17-R21 PolarHBondContact O-N 2.7Å
18	I	87.6	Confident	78.3	Confident	32 Å²	32	64.9 Å²	64.9	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-46.3	175.4	-70	165.1	0	0	0	109.8	I14 Q15 T16 R21 W22 I69 I72 F82	I14-I18 HydrophobicContact CG2-CD1 4.06Å; I14-I18 VanDerWaalsContact O-CG1 3.3Å; I14-I18 WeakPolarHBondContact O-CG1 3.41Å; I14-I18 PolarHBondContact O-N 2.88Å; Q15-I18 PolarHBondContact O-N 3.36Å; T16-I18 PolarHBondContact O-N 2.77Å; I18-R21 PolarHBondContact O-N 3.26Å; I18-W22 PolarHBondContact O-N 3.15Å; I18-I69 HydrophobicContact CD1-CD1 4.45Å; I18-I72 HydrophobicContact CB-CD1 4.21Å; I18-I72 HydrophobicContact CG2-CB 4.4Å; I18-I72 HydrophobicContact CG2-CD1 3.95Å; I18-I72 HydrophobicContact CG2-CG1 4.25Å; I18-F82 HydrophobicContact CG2-CZ 4.41Å
19	I	92.2	Very high	81.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-48	-178.6	-66.5	162.8	0	0	0	111	Q15 T16 Q17 R21 W22 G23 Y24 P26 I42 I44 I72 F82 M93	Q15-I19 VanDerWaalsContact O-CD1 3.31Å; Q15-I19 WeakPolarHBondContact O-CD1 3.41Å; Q15-I19 WeakPolarHBondContact O-CG1 3.24Å; Q15-I19 PolarHBondContact O-N 3.44Å; T16-I19 PolarHBondContact O-N 3.38Å; T16-I19 VanDerWaalsContact O-N 3.16Å; Q17-I19 VanDerWaalsContact C-N 3.33Å; I19-R21 VanDerWaalsContact C-N 3.31Å; I19-R21 PolarHBondContact O-N 3.19Å; I19-W22 PolarHBondContact O-N 3.22Å; I19-W22 VanDerWaalsContact O-N 3.12Å; I19-G23 PolarHBondContact O-N 3.41Å; I19-Y24 PolarHBondContact O-N 3.24Å; I19-P26 HydrophobicContact CB-CB 4.01Å; I19-P26 HydrophobicContact CB-CG 4.23Å; I19-P26 HydrophobicContact CD1-CB 3.88Å; I19-P26 HydrophobicContact CG2-CB 3.77Å; I19-P26 HydrophobicContact CG2-CG 4.09Å; I19-I42 HydrophobicContact CD1-CG2 3.52Å; I19-I44 HydrophobicContact CD1-CD1 3.85Å; I19-I44 HydrophobicContact CD1-CG1 3.97Å; I19-I44 HydrophobicContact CG1-CD1 3.95Å; I19-I44 HydrophobicContact CG1-CG1 4.46Å; I19-I44 HydrophobicContact CG2-CD1 4.16Å; I19-I44 HydrophobicContact CG2-CG1 4.18Å; I19-I72 HydrophobicContact CD1-CD1 4.03Å; I19-I72 HydrophobicContact CG1-CD1 3.79Å; I19-I72 HydrophobicContact CG1-CG2 4.28Å; I19-F82 HydrophobicContact CB-CE1 4.23Å; I19-F82 HydrophobicContact CG1-CE1 3.97Å; I19-F82 HydrophobicContact CG1-CZ 4.21Å; I19-F82 HydrophobicContact CG2-CE1 4.18Å; I19-M93 HydrophobicContact CD1-CE 4.03Å
20	E	92.2	Very high	83.6	Confident	117 Å²	117	61.4 Å²	61.4	55%	0.547	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-38.9	178.4	-72.1	175.2	158.9	0	0	112.2	T16 W22 G23 Y24 P26	T16-E20 WeakPolarHBondContact O-CG 3.41Å; T16-E20 PolarHBondContact O-N 3.17Å; E20-W22 PolarHBondContact O-N 3.24Å; E20-G23 PolarHBondContact O-N 3.08Å; E20-Y24 WeakPolarHBondContact CA-O 3.44Å; E20-P26 HydrophobicContact CG-CG 3.71Å
21	R	91.4	Very high	85.9	Confident	195 Å²	195	58 Å²	58	74%	0.736	29%	0.294	S	S	*	.	H	α-helix	trans	-59.3	-29.9	176.8	178.8	179.9	178.6	167.4	8.3	112.8	Q17 I18 I19 G23	Q17-R21 WeakPolarHBondContact O-CB 3.45Å; Q17-R21 PolarHBondContact O-N 2.7Å; I18-R21 PolarHBondContact O-N 3.26Å; I19-R21 VanDerWaalsContact C-N 3.31Å; I19-R21 PolarHBondContact O-N 3.19Å; R21-G23 VanDerWaalsContact C-N 3.32Å
22	W	92.2	Very high	88.2	Confident	86 Å²	86	59 Å²	59	33%	0.326	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2.9	175.8	-69.8	111.2	0	0	0	113.5	I18 I19 E20 Y24 L75 P76 F82	I18-W22 PolarHBondContact O-N 3.15Å; I19-W22 PolarHBondContact O-N 3.22Å; I19-W22 VanDerWaalsContact O-N 3.12Å; E20-W22 PolarHBondContact O-N 3.24Å; W22-Y24 HydrophobicContact CB-CD2 3.69Å; W22-Y24 HydrophobicContact CB-CE2 3.81Å; W22-Y24 WeakPolarHBondContact O-CD2 3.31Å; W22-Y24 WeakPolarHBondContact O-CE2 3.16Å; W22-L75 HydrophobicContact CH2-CD2 3.61Å; W22-L75 HydrophobicContact CZ2-CD2 4.41Å; W22-L75 HydrophobicContact CZ3-CD2 4.09Å; W22-P76 HydrophobicContact CD2-CG 4.09Å; W22-P76 HydrophobicContact CE3-CG 3.67Å; W22-P76 HydrophobicContact CG-CG 4.47Å; W22-P76 HydrophobicContact CZ3-CG 4.28Å; W22-F82 HydrophobicContact CB-CE1 4.32Å; W22-F82 HydrophobicContact CB-CE2 4.3Å; W22-F82 HydrophobicContact CB-CZ 4.08Å; W22-F82 AromaticContact CD1-CE2 3.38Å; W22-F82 AromaticContact CD1-CZ 3.48Å; W22-F82 VanDerWaalsContact CD1-CZ 3.48Å; W22-F82 AromaticContact CG-CE2 3.91Å; W22-F82 HydrophobicContact CG-CE2 3.91Å; W22-F82 HydrophobicContact CG-CZ 4.04Å; W22-F82 AromaticContact NE1-CE2 3.98Å
23	G	92.8	Very high	90.3	Very high	70 Å²	70	57.5 Å²	57.5	72%	0.722	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	13.4	177	0	0	0	0	0	114.6	I19 E20 R21	I19-G23 PolarHBondContact O-N 3.41Å; E20-G23 PolarHBondContact O-N 3.08Å; R21-G23 VanDerWaalsContact C-N 3.32Å
24	Y	93.6	Very high	92	Very high	26 Å²	26	62.8 Å²	62.8	10%	0.102	32%	0.317	C	S	.	.			trans	-96.8	155.9	175.9	-61.6	-96.2	0	0	0	110.4	I19 E20 W22 P26 I44 P76 F82 S85 D86	I19-Y24 PolarHBondContact O-N 3.24Å; E20-Y24 WeakPolarHBondContact CA-O 3.44Å; W22-Y24 HydrophobicContact CB-CD2 3.69Å; W22-Y24 HydrophobicContact CB-CE2 3.81Å; W22-Y24 WeakPolarHBondContact O-CD2 3.31Å; W22-Y24 WeakPolarHBondContact O-CE2 3.16Å; Y24-P26 VanDerWaalsContact O-CD 3.28Å; Y24-P26 WeakPolarHBondContact O-CD 3.05Å; Y24-I44 HydrophobicContact CD1-CG2 3.99Å; Y24-I44 HydrophobicContact CG-CG2 4.31Å; Y24-P76 HydrophobicContact CE2-CG 4.38Å; Y24-F82 HydrophobicContact CD1-CD1 4.19Å; Y24-F82 AromaticContact CD2-CD1 3.39Å; Y24-F82 HydrophobicContact CD2-CD1 3.39Å; Y24-F82 AromaticContact CD2-CE1 3.65Å; Y24-F82 HydrophobicContact CD2-CE1 3.65Å; Y24-F82 HydrophobicContact CD2-CG 4.19Å; Y24-F82 HydrophobicContact CE1-CB 4.38Å; Y24-F82 HydrophobicContact CE1-CD1 4.27Å; Y24-F82 HydrophobicContact CE2-CB 4.02Å; Y24-F82 AromaticContact CE2-CD1 3.49Å; Y24-F82 HydrophobicContact CE2-CD1 3.49Å; Y24-F82 VanDerWaalsContact CE2-CD1 3.49Å; Y24-F82 HydrophobicContact CE2-CE1 4.12Å; Y24-F82 AromaticContact CE2-CG 3.82Å; Y24-F82 HydrophobicContact CE2-CG 3.82Å; Y24-F82 AromaticContact CG-CD1 3.79Å; Y24-F82 HydrophobicContact CG-CD1 3.79Å; Y24-F82 HydrophobicContact CG-CE1 4.11Å; Y24-F82 AromaticContact CZ-CD1 3.95Å; Y24-S85 WeakPolarHBondContact CD1-OG 3.41Å; Y24-D86 WeakPolarHBondContact CE1-OD1 3.43Å; Y24-D86 PolarHBondContact OH-OD1 3.12Å; Y24-D86 PolarHBondContact OH-OD2 3.39Å
25	Q	87.7	Confident	92.9	Very high	130 Å²	130	63.1 Å²	63.1	61%	0.607	32%	0.32	S	S	*	.			trans	-97.8	106.3	176.9	-174	178.7	2.7	0	0	110.1
26	P	92.7	Very high	93.7	Very high	15 Å²	15	63.4 Å²	63.4	10%	0.097	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	147	173.1	32.1	-33.2	0	0	0	111	T16 I19 E20 Y24	T16-P26 HydrophobicContact CG2-CB 4.03Å; T16-P26 HydrophobicContact CG2-CG 4.13Å; I19-P26 HydrophobicContact CB-CB 4.01Å; I19-P26 HydrophobicContact CB-CG 4.23Å; I19-P26 HydrophobicContact CD1-CB 3.88Å; I19-P26 HydrophobicContact CG2-CB 3.77Å; I19-P26 HydrophobicContact CG2-CG 4.09Å; E20-P26 HydrophobicContact CG-CG 3.71Å; Y24-P26 VanDerWaalsContact O-CD 3.28Å; Y24-P26 WeakPolarHBondContact O-CD 3.05Å
27	L	95.2	Very high	94.2	Very high	48 Å²	48	62.4 Å²	62.4	25%	0.251	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135	164.3	-61.3	169.1	0	0	0	107.9	Y29 I42 R43 L45	L27-Y29 HydrophobicContact CB-CD2 4.46Å; L27-Y29 HydrophobicContact CB-CE2 3.66Å; L27-Y29 HydrophobicContact CD1-CE2 4.49Å; L27-I42 CarbonylContact O-C 3.59Å; L27-I42 WeakPolarHBondContact O-CA 3.38Å; L27-R43 HydrophobicContact CB-CB 4.21Å; L27-R43 PolarHBondContact N-O 3.33Å; L27-R43 PolarHBondContact O-N 3.41Å; L27-L45 HydrophobicContact CD1-CD1 3.99Å; L27-L45 HydrophobicContact CD1-CD2 4.43Å; L27-L45 HydrophobicContact CD1-CG 4.07Å
28	A	94.9	Very high	94.8	Very high	43 Å²	43	58.6 Å²	58.6	36%	0.355	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	139.2	176.6	0	0	0	0	0	110.1	T40 L41 I42	A28-T40 HydrophobicContact CB-CG2 4.33Å; A28-L41 WeakPolarHBondContact CA-O 3.18Å; A28-I42 HydrophobicContact CB-CD1 3.92Å
29	Y	96.7	Very high	95.2	Very high	65 Å²	65	57 Å²	57	26%	0.255	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136.6	178.2	-65.5	-87.8	0	0	0	110.3	L27 T40 L41 R43 W92 V138	L27-Y29 HydrophobicContact CB-CD2 4.46Å; L27-Y29 HydrophobicContact CB-CE2 3.66Å; L27-Y29 HydrophobicContact CD1-CE2 4.49Å; Y29-T40 CarbonylContact O-C 3.34Å; Y29-T40 WeakPolarHBondContact O-CA 3.22Å; Y29-L41 PolarHBondContact N-O 3.41Å; Y29-L41 PolarHBondContact O-N 2.97Å; Y29-R43 HydrophobicContact CD2-CB 4.31Å; Y29-R43 HydrophobicContact CE2-CB 4.03Å; Y29-W92 AromaticContact CD2-CH2 3.6Å; Y29-W92 HydrophobicContact CD2-CH2 3.6Å; Y29-W92 AromaticContact CD2-CZ3 3.6Å; Y29-W92 HydrophobicContact CD2-CZ3 3.6Å; Y29-W92 AromaticContact CE2-CH2 3.74Å; Y29-W92 HydrophobicContact CE2-CH2 3.74Å; Y29-W92 HydrophobicContact CE2-CZ3 4.17Å; Y29-W92 HydrophobicContact CG-CH2 4.14Å; Y29-W92 HydrophobicContact CG-CZ3 4.12Å; Y29-V138 HydrophobicContact CD1-CG1 4.49Å; Y29-V138 HydrophobicContact CD1-CG2 4.17Å; Y29-V138 HydrophobicContact CE1-CG1 3.8Å; Y29-V138 HydrophobicContact CE1-CG2 4.16Å; Y29-V138 HydrophobicContact CE2-CG1 4.27Å
30	D	96.9	Very high	95.3	Very high	65 Å²	65	57.2 Å²	57.2	35%	0.348	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	142.6	169.8	-80	-9.5	0	0	0	111.3	I38 L39 T40 R104 K134	D30-I38 HydrophobicContact CB-CG2 4.07Å; D30-L39 WeakPolarHBondContact CA-O 3.38Å; D30-T40 PolarHBondContact OD1-OG1 3.42Å; D30-R104 IonicContact OD1-CZ 3.84Å; D30-R104 IonicContact OD1-NH2 2.75Å; D30-R104 PolarHBondContact OD1-NH2 3.08Å; D30-R104 IonicContact OD2-CZ 3.25Å; D30-R104 VanDerWaalsContact OD2-CZ 3.25Å; D30-R104 IonicContact OD2-NH1 2.75Å; D30-R104 PolarHBondContact OD2-NH1 3.46Å; D30-R104 IonicContact OD2-NH2 2.87Å; D30-R104 PolarHBondContact OD2-NH2 3.26Å; D30-K134 WeakPolarHBondContact O-CE 3.35Å
31	T	98.1	Very high	95.5	Very high	13 Å²	13	51.6 Å²	51.6	8%	0.08	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.7	164.6	-163.8	0	0	0	0	109.7	I38 L39 L41 A130 L131	T31-I38 WeakPolarHBondContact O-CA 3.45Å; T31-L39 HydrophobicContact CG2-CB 4.02Å; T31-L39 PolarHBondContact N-O 2.86Å; T31-L39 PolarHBondContact O-N 2.76Å; T31-L41 HydrophobicContact CG2-CD1 3.63Å; T31-A130 HydrophobicContact CG2-CB 3.9Å; T31-A130 PolarHBondContact OG1-O 3.03Å; T31-L131 HydrophobicContact CG2-CD2 4.08Å
32	V	98.3	Very high	95.7	Very high	53 Å²	53	42.3 Å²	42.3	32%	0.321	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.8	175.9	-170	0	0	0	0	108.9	Y37 I38 R106	V32-Y37 WeakPolarHBondContact CA-O 3.28Å; V32-I38 HydrophobicContact CG1-CG1 4.48Å; V32-I38 HydrophobicContact CG2-CG1 4.23Å; V32-I38 HydrophobicContact CG2-CG2 4.42Å; V32-R106 HydrophobicContact CG1-CG 4.17Å
33	T	98.5	Very high	95.9	Very high	4 Å²	4	39.7 Å²	39.7	3%	0.025	22%	0.22	C	C	.	.			trans	-68.3	158.5	172.6	59.8	0	0	0	0	111	D35 G36 Y37 L39 D127 A130	T33-D35 WeakPolarHBondContact CB-OD1 3.17Å; T33-D35 PolarHBondContact O-N 3.38Å; T33-D35 PolarHBondContact OG1-OD1 3.34Å; T33-G36 PolarHBondContact O-N 2.9Å; T33-G36 VanDerWaalsContact O-N 3.07Å; T33-G36 PolarHBondContact OG1-N 3.24Å; T33-Y37 PolarHBondContact N-O 2.55Å; T33-Y37 WeakPolarHBondContact OG1-CA 3.41Å; T33-Y37 WeakPolarHBondContact OG1-CB 3.44Å; T33-Y37 PolarHBondContact OG1-N 3.31Å; T33-Y37 PolarHBondContact OG1-O 3.49Å; T33-L39 HydrophobicContact CG2-CD1 3.67Å; T33-L39 HydrophobicContact CG2-CG 4.11Å; T33-D127 WeakPolarHBondContact CG2-OD1 3.4Å; T33-A130 HydrophobicContact CG2-CB 3.95Å
34	E	98.1	Very high	96.1	Very high	172 Å²	172	36.4 Å²	36.4	80%	0.804	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.4	179.8	-64.9	-176.7	178	0	0	112.6	Y126	E34-Y126 HydrophobicContact CB-CD1 3.88Å; E34-Y126 HydrophobicContact CB-CE1 4.09Å; E34-Y126 HydrophobicContact CG-CD1 4.41Å
35	D	97.7	Very high	96.1	Very high	53 Å²	53	37.1 Å²	37.1	28%	0.283	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-2.1	179.1	68.9	-39.1	0	0	0	113.8	T33 Y37 R97 H105 Y126	T33-D35 WeakPolarHBondContact CB-OD1 3.17Å; T33-D35 PolarHBondContact O-N 3.38Å; T33-D35 PolarHBondContact OG1-OD1 3.34Å; D35-Y37 WeakPolarHBondContact OD2-CE2 3.31Å; D35-R97 IonicContact OD1-CZ 3.61Å; D35-R97 IonicContact OD1-NH1 3.42Å; D35-R97 IonicContact OD1-NH2 3.55Å; D35-R97 PolarHBondContact OD1-NH2 2.89Å; D35-R97 IonicContact OD2-CZ 3.48Å; D35-R97 IonicContact OD2-NH1 3.49Å; D35-R97 PolarHBondContact OD2-NH1 2.68Å; D35-R97 IonicContact OD2-NH2 2.65Å; D35-R97 PolarHBondContact OD2-NH2 3.02Å; D35-H105 PolarHBondContact O-CE1 3Å; D35-H105 VanDerWaalsContact O-CE1 3.23Å; D35-H105 PolarHBondContact O-NE2 2.92Å; D35-Y126 HydrophobicContact CB-CD2 4.32Å; D35-Y126 HydrophobicContact CB-CE2 4.28Å
36	G	98.1	Very high	96.3	Very high	5 Å²	5	31.4 Å²	31.4	5%	0.052	17%	0.165	C	C	.	.	S	Bend	trans	109.4	0	161.9	0	0	0	0	0	116.4	T33 H105 R106	T33-G36 PolarHBondContact O-N 2.9Å; T33-G36 VanDerWaalsContact O-N 3.07Å; T33-G36 PolarHBondContact OG1-N 3.24Å; G36-H105 VanDerWaalsContact C-CD2 3.42Å; G36-H105 CarbonylContact O-C 3.55Å; G36-H105 VanDerWaalsContact O-CA 3.32Å; G36-H105 WeakPolarHBondContact O-CA 3.1Å; G36-R106 PolarHBondContact O-N 3.43Å
37	Y	97.4	Very high	95.9	Very high	6 Å²	6	33.3 Å²	33.3	2%	0.024	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	139.9	169.9	-67.2	-98.2	0	0	0	111	V32 T33 D35 R97 R104 H105 F115 F118	V32-Y37 WeakPolarHBondContact CA-O 3.28Å; T33-Y37 PolarHBondContact N-O 2.55Å; T33-Y37 WeakPolarHBondContact OG1-CA 3.41Å; T33-Y37 WeakPolarHBondContact OG1-CB 3.44Å; T33-Y37 PolarHBondContact OG1-N 3.31Å; T33-Y37 PolarHBondContact OG1-O 3.49Å; D35-Y37 WeakPolarHBondContact OD2-CE2 3.31Å; Y37-R97 HydrophobicContact CD1-CB 3.65Å; Y37-R97 VanDerWaalsContact CD2-CZ 3.49Å; Y37-R97 VanDerWaalsContact CD2-NH1 3.29Å; Y37-R97 HydrophobicContact CE1-CB 4.13Å; Y37-R97 HydrophobicContact CG-CB 4Å; Y37-R104 WeakPolarHBondContact CA-O 3.17Å; Y37-H105 AromaticContact CD1-CD2 3.9Å; Y37-H105 AromaticContact CD2-CD2 3.56Å; Y37-H105 AromaticContact CD2-NE2 3.77Å; Y37-H105 AromaticContact CE1-CD2 3.99Å; Y37-H105 AromaticContact CE2-CD2 3.62Å; Y37-H105 AromaticContact CE2-NE2 3.69Å; Y37-H105 AromaticContact CG-CD2 3.69Å; Y37-H105 AromaticContact CZ-CD2 3.84Å; Y37-H105 PolarHBondContact N-CD2 2.99Å; Y37-F115 HydrophobicContact CD1-CE2 4.04Å; Y37-F115 HydrophobicContact CD1-CZ 4.01Å; Y37-F115 HydrophobicContact CE1-CD2 4.15Å; Y37-F115 HydrophobicContact CE1-CE1 4.18Å; Y37-F115 AromaticContact CE1-CE2 3.78Å; Y37-F115 HydrophobicContact CE1-CE2 3.78Å; Y37-F115 HydrophobicContact CE1-CG 4.46Å; Y37-F115 AromaticContact CE1-CZ 3.74Å; Y37-F115 HydrophobicContact CE1-CZ 3.74Å; Y37-F115 PolarHBondContact OH-O 3.2Å; Y37-F118 HydrophobicContact CE1-CD1 4.07Å; Y37-F118 HydrophobicContact CE1-CE1 4.13Å; Y37-F118 AromaticContact CZ-CD1 3.91Å; Y37-F118 WeakPolarHBondContact OH-CD1 3.21Å
38	I	97.6	Very high	95	Very high	32 Å²	32	35.6 Å²	35.6	16%	0.164	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119	175.4	-46.3	175.2	0	0	0	107.9	D30 T31 V32 R104	D30-I38 HydrophobicContact CB-CG2 4.07Å; T31-I38 WeakPolarHBondContact O-CA 3.45Å; V32-I38 HydrophobicContact CG1-CG1 4.48Å; V32-I38 HydrophobicContact CG2-CG1 4.23Å; V32-I38 HydrophobicContact CG2-CG2 4.42Å; I38-R104 HydrophobicContact CB-CB 3.9Å; I38-R104 HydrophobicContact CD1-CB 4.29Å; I38-R104 HydrophobicContact CG1-CB 4.38Å; I38-R104 VanDerWaalsContact CG2-NH1 3.34Å; I38-R104 PolarHBondContact N-O 2.95Å
39	L	96	Very high	94.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.4	-174.1	-48.4	177.2	0	0	0	109.5	D30 T31 T33 R97 D127 L131	D30-L39 WeakPolarHBondContact CA-O 3.38Å; T31-L39 HydrophobicContact CG2-CB 4.02Å; T31-L39 PolarHBondContact N-O 2.86Å; T31-L39 PolarHBondContact O-N 2.76Å; T33-L39 HydrophobicContact CG2-CD1 3.67Å; T33-L39 HydrophobicContact CG2-CG 4.11Å; L39-R97 HydrophobicContact CD2-CB 4.02Å; L39-D127 HydrophobicContact CD1-CB 3.65Å; L39-D127 VanDerWaalsContact CD1-CG 3.46Å; L39-L131 HydrophobicContact CB-CD2 4.04Å; L39-L131 HydrophobicContact CD1-CD1 4.34Å; L39-L131 HydrophobicContact CD1-CD2 4.02Å; L39-L131 HydrophobicContact CD1-CG 4.05Å
40	T	94.8	Very high	93.6	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	121.6	176.4	-57	0	0	0	0	110.6	E12 A28 Y29 D30 N95 Y101 R104	E12-T40 HydrophobicContact CG-CG2 4.42Å; A28-T40 HydrophobicContact CB-CG2 4.33Å; Y29-T40 CarbonylContact O-C 3.34Å; Y29-T40 WeakPolarHBondContact O-CA 3.22Å; D30-T40 PolarHBondContact OD1-OG1 3.42Å; T40-N95 WeakPolarHBondContact O-CB 3.49Å; T40-N95 PolarHBondContact O-ND2 3.07Å; T40-Y101 PolarHBondContact N-O 3.09Å; T40-R104 PolarHBondContact OG1-NH2 3.4Å
41	L	96.1	Very high	93	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	149.9	170.5	-58.6	88.2	0	0	0	110.5	A28 Y29 T31 F59 W92 M93 L131 K134	A28-L41 WeakPolarHBondContact CA-O 3.18Å; Y29-L41 PolarHBondContact N-O 3.41Å; Y29-L41 PolarHBondContact O-N 2.97Å; T31-L41 HydrophobicContact CG2-CD1 3.63Å; L41-F59 HydrophobicContact CD2-CE2 3.78Å; L41-F59 HydrophobicContact CD2-CZ 4.21Å; L41-W92 HydrophobicContact CB-CE3 4.27Å; L41-W92 HydrophobicContact CB-CZ3 4.41Å; L41-W92 HydrophobicContact CD2-CE3 4.17Å; L41-M93 WeakPolarHBondContact CA-O 3.29Å; L41-L131 HydrophobicContact CD1-CD2 3.58Å; L41-L131 HydrophobicContact CD2-CB 4.05Å; L41-L131 HydrophobicContact CD2-CD2 3.7Å; L41-L131 HydrophobicContact CD2-CG 4.5Å; L41-L131 WeakPolarHBondContact CD2-O 3.47Å; L41-L131 HydrophobicContact CG-CD2 3.45Å; L41-L131 VanDerWaalsContact CG-CD2 3.45Å; L41-K134 HydrophobicContact CD1-CB 4.48Å; L41-K134 HydrophobicContact CD1-CG 4.25Å
42	I	96.4	Very high	92.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.4	171.9	-58	-62.7	0	0	0	110	Q15 T16 I19 L27 A28 W92 M93	Q15-I42 HydrophobicContact CG-CD1 3.63Å; Q15-I42 HydrophobicContact CG-CG1 3.62Å; T16-I42 HydrophobicContact CG2-CD1 4.38Å; I19-I42 HydrophobicContact CD1-CG2 3.52Å; L27-I42 CarbonylContact O-C 3.59Å; L27-I42 WeakPolarHBondContact O-CA 3.38Å; A28-I42 HydrophobicContact CB-CD1 3.92Å; I42-W92 CarbonylContact O-C 3.6Å; I42-W92 WeakPolarHBondContact O-CA 3.31Å; I42-M93 HydrophobicContact CB-CE 3.74Å; I42-M93 HydrophobicContact CG2-CE 3.47Å; I42-M93 VanDerWaalsContact CG2-CE 3.47Å; I42-M93 PolarHBondContact N-O 2.94Å; I42-M93 PolarHBondContact O-N 2.97Å
43	R	97.2	Very high	91.4	Very high	31 Å²	31	53.9 Å²	53.9	12%	0.117	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133	173.8	-177.9	-168.8	-170.5	-176.1	6	109.7	L27 Y29 D90 V91 W92	L27-R43 HydrophobicContact CB-CB 4.21Å; L27-R43 PolarHBondContact N-O 3.33Å; L27-R43 PolarHBondContact O-N 3.41Å; Y29-R43 HydrophobicContact CD2-CB 4.31Å; Y29-R43 HydrophobicContact CE2-CB 4.03Å; R43-D90 IonicContact CZ-OD1 3.91Å; R43-D90 IonicContact CZ-OD2 3.06Å; R43-D90 IonicContact NE-OD1 3.99Å; R43-D90 PolarHBondContact NE-OD1 3.48Å; R43-D90 IonicContact NE-OD2 3.83Å; R43-D90 PolarHBondContact NE-OD2 2.81Å; R43-D90 VanDerWaalsContact NH2-CG 3.35Å; R43-D90 IonicContact NH2-OD1 3.88Å; R43-D90 PolarHBondContact NH2-OD1 2.97Å; R43-D90 IonicContact NH2-OD2 3.57Å; R43-D90 PolarHBondContact NH2-OD2 3.05Å; R43-V91 CarbonylContact C-O 3.56Å; R43-V91 WeakPolarHBondContact CA-O 3.43Å; R43-W92 HydrophobicContact CB-CD2 4.11Å; R43-W92 HydrophobicContact CB-CE3 4.1Å; R43-W92 HydrophobicContact CB-CH2 4.26Å; R43-W92 HydrophobicContact CB-CZ2 4.27Å; R43-W92 HydrophobicContact CB-CZ3 4.17Å; R43-W92 VanDerWaalsContact CD-CZ2 3.41Å; R43-W92 HydrophobicContact CG-CD2 4.13Å; R43-W92 HydrophobicContact CG-CH2 4.43Å; R43-W92 HydrophobicContact CG-CZ2 3.96Å
44	I	96.1	Very high	90.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.1	170	-53.6	176.9	0	0	0	106.9	I19 Y24 I72 F82 V91 M93	I19-I44 HydrophobicContact CD1-CD1 3.85Å; I19-I44 HydrophobicContact CD1-CG1 3.97Å; I19-I44 HydrophobicContact CG1-CD1 3.95Å; I19-I44 HydrophobicContact CG1-CG1 4.46Å; I19-I44 HydrophobicContact CG2-CD1 4.16Å; I19-I44 HydrophobicContact CG2-CG1 4.18Å; Y24-I44 HydrophobicContact CD1-CG2 3.99Å; Y24-I44 HydrophobicContact CG-CG2 4.31Å; I44-I72 HydrophobicContact CD1-CG2 3.97Å; I44-F82 HydrophobicContact CD1-CD1 4.18Å; I44-F82 HydrophobicContact CD1-CE1 4.11Å; I44-V91 HydrophobicContact CB-CB 4.23Å; I44-V91 PolarHBondContact N-O 3.38Å; I44-V91 PolarHBondContact O-N 3.02Å; I44-M93 HydrophobicContact CD1-CE 3.78Å; I44-M93 HydrophobicContact CD1-SD 4.46Å; I44-M93 HydrophobicContact CG1-CE 4.1Å
45	L	94	Very high	90.5	Very high	42 Å²	42	50.6 Å²	50.6	22%	0.22	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-69.2	157.3	177.4	-68.4	177.8	0	0	0	110.7	L27 S85	L27-L45 HydrophobicContact CD1-CD1 3.99Å; L27-L45 HydrophobicContact CD1-CD2 4.43Å; L27-L45 HydrophobicContact CD1-CG 4.07Å; L45-S85 PolarHBondContact O-OG 2.98Å
46	P	91.9	Very high	90.4	Very high	9 Å²	9	48.1 Å²	48.1	6%	0.058	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-53.3	144.9	170.1	-20.1	26.3	0	0	0	111.2	S48 S85 F89	P46-S48 PolarHBondContact O-N 2.86Å; P46-S85 WeakPolarHBondContact CA-O 3.5Å; P46-F89 WeakPolarHBondContact CD-O 2.75Å; P46-F89 WeakPolarHBondContact CG-O 3.34Å
47	N	84.1	Confident	90.4	Very high	56 Å²	56	48.1 Å²	48.1	30%	0.299	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-52.6	137	167.8	-166.7	-41.7	0	0	0	109.5	N49 K50 W51 S85 D86	N47-N49 PolarHBondContact O-N 3.31Å; N47-K50 CarbonylContact O-C 3.26Å; N47-K50 WeakPolarHBondContact O-CA 3.29Å; N47-K50 PolarHBondContact O-N 3.38Å; N47-W51 PolarHBondContact O-N 3.3Å; N47-S85 PolarHBondContact N-O 2.94Å; N47-S85 VanDerWaalsContact N-O 3.11Å; N47-S85 PolarHBondContact N-OG 3.19Å; N47-D86 PolarHBondContact ND2-OD1 3.11Å
48	S	76	Confident	90.5	Very high	96 Å²	96	47.9 Å²	47.9	67%	0.671	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-55.1	-33.2	-170.7	55.3	0	0	0	0	112.8	P46 K50 W51	P46-S48 PolarHBondContact O-N 2.86Å; S48-K50 PolarHBondContact O-N 3.32Å; S48-W51 PolarHBondContact O-N 3.17Å
49	N	80.6	Confident	90.5	Very high	147 Å²	147	46.3 Å²	46.3	79%	0.786	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-69	-12.4	177	-66.3	-29	0	0	0	114.3	N47	N47-N49 PolarHBondContact O-N 3.31Å
50	K	80.8	Confident	90.6	Very high	124 Å²	124	46.3 Å²	46.3	54%	0.539	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-120.5	3.9	-177.7	-63.6	-67.7	-168.9	175.7	0	113	N47 S48 K52 D86	N47-K50 CarbonylContact O-C 3.26Å; N47-K50 WeakPolarHBondContact O-CA 3.29Å; N47-K50 PolarHBondContact O-N 3.38Å; S48-K50 PolarHBondContact O-N 3.32Å; K50-K52 PolarHBondContact O-N 3.33Å; K50-D86 WeakPolarHBondContact CG-O 3.38Å
51	W	84.5	Confident	90.8	Very high	142 Å²	142	46.2 Å²	46.2	54%	0.538	23%	0.234	S	C	.	.			trans	-63.7	127.8	-177.9	-171.3	103	0	0	0	110.9	N47 S48 P53	N47-W51 PolarHBondContact O-N 3.3Å; S48-W51 PolarHBondContact O-N 3.17Å; W51-P53 HydrophobicContact CH2-CB 4.23Å; W51-P53 HydrophobicContact CH2-CG 3.87Å; W51-P53 HydrophobicContact CZ3-CB 4.38Å; W51-P53 VanDerWaalsContact CZ3-CD 3.48Å; W51-P53 HydrophobicContact CZ3-CG 3.59Å
52	K	83.2	Confident	90.7	Very high	109 Å²	109	46.3 Å²	46.3	47%	0.474	24%	0.235	S	C	.	.			trans	-129.7	141.9	171.3	-67.6	-173.8	178.7	-173.6	0	109.7	K50 N54 R55 W349	K50-K52 PolarHBondContact O-N 3.33Å; K52-N54 VanDerWaalsContact C-N 3.34Å; K52-N54 WeakPolarHBondContact CB-O 3.27Å; K52-N54 PolarHBondContact O-N 3.36Å; K52-R55 PolarHBondContact O-NE 3.44Å; K52-R55 PolarHBondContact O-NH2 2.73Å; K52-W349 HydrophobicContact CD-CH2 3.69Å; K52-W349 HydrophobicContact CD-CZ2 3.85Å
53	P	81	Confident	90.4	Very high	100 Å²	100	46.4 Å²	46.4	65%	0.649	24%	0.236	S	C	*	.	S	Bend	trans	-54	-49.4	177.3	-24.9	32.5	0	0	0	112.5	W51	W51-P53 HydrophobicContact CH2-CB 4.23Å; W51-P53 HydrophobicContact CH2-CG 3.87Å; W51-P53 HydrophobicContact CZ3-CB 4.38Å; W51-P53 VanDerWaalsContact CZ3-CD 3.48Å; W51-P53 HydrophobicContact CZ3-CG 3.59Å
54	N	85.9	Confident	89.7	Confident	74 Å²	74	46.5 Å²	46.5	40%	0.396	24%	0.238	S	C	.	.	S	Bend	trans	-90.9	121.9	171	-67	5.7	0	0	0	108.7	K52 W349 Q354	K52-N54 VanDerWaalsContact C-N 3.34Å; K52-N54 WeakPolarHBondContact CB-O 3.27Å; K52-N54 PolarHBondContact O-N 3.36Å; N54-W349 WeakPolarHBondContact O-CH2 3.21Å; N54-Q354 PolarHBondContact ND2-NE2 3.22Å
55	R	91.6	Very high	88.6	Confident	33 Å²	33	46.9 Å²	46.9	13%	0.125	24%	0.24	C	C	.	.			trans	-148.8	149.5	180	73	-165.4	78.4	146.3	7	110.8	K52 V57 D90 Y348	K52-R55 PolarHBondContact O-NE 3.44Å; K52-R55 PolarHBondContact O-NH2 2.73Å; R55-V57 PolarHBondContact O-N 3.28Å; R55-D90 HydrophobicContact CG-CB 4.02Å; R55-Y348 PolarHBondContact O-OH 2.78Å
56	P	95.7	Very high	87.9	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.013	23%	0.232	C	C	.	.			trans	-65.3	134.6	174.6	27.1	-33.9	0	0	0	110.8	F89 D90 Y145 I344 Y348	P56-F89 HydrophobicContact CB-CD1 3.89Å; P56-F89 HydrophobicContact CB-CE1 4Å; P56-F89 HydrophobicContact CG-CD1 3.54Å; P56-F89 HydrophobicContact CG-CE1 3.67Å; P56-F89 HydrophobicContact CG-CG 4.06Å; P56-F89 HydrophobicContact CG-CZ 4.24Å; P56-D90 PolarHBondContact O-N 3.26Å; P56-Y145 HydrophobicContact CB-CD2 4.05Å; P56-Y145 HydrophobicContact CB-CE2 3.84Å; P56-I344 HydrophobicContact CB-CG2 3.79Å; P56-I344 HydrophobicContact CG-CG2 4.18Å; P56-Y348 HydrophobicContact CB-CD2 3.95Å; P56-Y348 HydrophobicContact CB-CE2 4.28Å; P56-Y348 HydrophobicContact CB-CG 4.17Å
57	V	97.7	Very high	87.8	Confident	5 Å²	5	45 Å²	45	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.3	168.7	179.2	0	0	0	0	108.3	R55 D90 A141 L144 Y145	R55-V57 PolarHBondContact O-N 3.28Å; V57-D90 WeakPolarHBondContact CA-O 3.46Å; V57-D90 HydrophobicContact CG2-CB 4.11Å; V57-A141 HydrophobicContact CB-CB 4.38Å; V57-A141 HydrophobicContact CG2-CB 3.54Å; V57-L144 HydrophobicContact CB-CB 3.92Å; V57-L144 HydrophobicContact CG1-CB 3.79Å; V57-L144 HydrophobicContact CG1-CD2 4.39Å; V57-Y145 PolarHBondContact O-N 2.76Å
58	I	98.5	Very high	88.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.6	175.6	-166	167.5	0	0	0	110.3	L60 F84 F89 D90 V91 W92 Y145 V147 I344	I58-L60 HydrophobicContact CD1-CD2 4.28Å; I58-L60 HydrophobicContact CG1-CD2 4.04Å; I58-F84 HydrophobicContact CD1-CD1 3.98Å; I58-F84 HydrophobicContact CD1-CD2 3.7Å; I58-F84 HydrophobicContact CD1-CE1 3.94Å; I58-F84 HydrophobicContact CD1-CE2 3.65Å; I58-F84 HydrophobicContact CD1-CG 3.88Å; I58-F84 HydrophobicContact CD1-CZ 3.78Å; I58-F84 HydrophobicContact CG2-CB 4.06Å; I58-F84 HydrophobicContact CG2-CD2 4.45Å; I58-F84 HydrophobicContact CG2-CG 4.33Å; I58-F89 HydrophobicContact CB-CD1 3.95Å; I58-F89 HydrophobicContact CD1-CD1 4.4Å; I58-F89 HydrophobicContact CD1-CE1 4.49Å; I58-F89 HydrophobicContact CG2-CB 3.8Å; I58-F89 HydrophobicContact CG2-CD1 3.97Å; I58-F89 HydrophobicContact CG2-CG 4.2Å; I58-D90 PolarHBondContact N-O 2.73Å; I58-V91 HydrophobicContact CG2-CB 4.24Å; I58-V91 HydrophobicContact CG2-CG1 4.34Å; I58-V91 HydrophobicContact CG2-CG2 3.85Å; I58-W92 PolarHBondContact O-N 3.2Å; I58-Y145 CarbonylContact C-O 3.6Å; I58-Y145 WeakPolarHBondContact CA-O 3.38Å; I58-V147 HydrophobicContact CD1-CG2 3.79Å; I58-V147 HydrophobicContact CG1-CG2 3.94Å; I58-I344 HydrophobicContact CD1-CD1 3.88Å
59	F	98.8	Very high	88.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.9	-177.9	-167.5	-78.8	0	0	0	110.2	L41 Q61 W92 L131 A135 L144 Y145 Y146 V147	L41-F59 HydrophobicContact CD2-CE2 3.78Å; L41-F59 HydrophobicContact CD2-CZ 4.21Å; F59-Q61 HydrophobicContact CD1-CB 4.43Å; F59-Q61 HydrophobicContact CE1-CB 4.13Å; F59-W92 CarbonylContact C-O 3.44Å; F59-W92 WeakPolarHBondContact CA-O 3.37Å; F59-W92 HydrophobicContact CD2-CB 3.74Å; F59-W92 HydrophobicContact CE2-CB 4.25Å; F59-W92 HydrophobicContact CG-CB 4.48Å; F59-L131 HydrophobicContact CE2-CB 4.19Å; F59-L131 HydrophobicContact CZ-CB 3.75Å; F59-L131 HydrophobicContact CZ-CD1 4.47Å; F59-A135 HydrophobicContact CD2-CB 3.96Å; F59-A135 HydrophobicContact CE2-CB 4.21Å; F59-L144 HydrophobicContact CB-CD1 3.78Å; F59-L144 HydrophobicContact CB-CD2 3.95Å; F59-L144 HydrophobicContact CB-CG 4.45Å; F59-L144 HydrophobicContact CD2-CD2 4.25Å; F59-L144 HydrophobicContact CG-CD2 4.41Å; F59-Y145 PolarHBondContact N-O 3.32Å; F59-Y146 HydrophobicContact CB-CD2 4.23Å; F59-Y146 AromaticContact CD1-CD2 3.69Å; F59-Y146 HydrophobicContact CD1-CD2 3.69Å; F59-Y146 AromaticContact CD1-CE2 3.56Å; F59-Y146 HydrophobicContact CD1-CE2 3.56Å; F59-Y146 AromaticContact CE1-CE2 3.99Å; F59-Y146 HydrophobicContact CE1-CE2 3.99Å; F59-Y146 HydrophobicContact CG-CD2 4.26Å; F59-V147 PolarHBondContact O-N 3.21Å
60	L	98.7	Very high	89.2	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.5	-176.6	-48.7	-178.6	0	0	0	110.1	I58 W71 A80 F84 V91 W92 M93 G94 V147	I58-L60 HydrophobicContact CD1-CD2 4.28Å; I58-L60 HydrophobicContact CG1-CD2 4.04Å; L60-W71 HydrophobicContact CB-CD2 3.81Å; L60-W71 HydrophobicContact CB-CG 3.84Å; L60-W71 HydrophobicContact CB-CZ2 4.2Å; L60-W71 HydrophobicContact CD1-CB 3.84Å; L60-W71 HydrophobicContact CD1-CD2 4.08Å; L60-W71 HydrophobicContact CD1-CE3 4.38Å; L60-W71 HydrophobicContact CD1-CG 3.84Å; L60-W71 HydrophobicContact CG-CD2 4.48Å; L60-W71 HydrophobicContact CG-CG 4.49Å; L60-A80 HydrophobicContact CD1-CB 3.91Å; L60-F84 HydrophobicContact CD2-CD2 4.22Å; L60-F84 HydrophobicContact CD2-CE2 4.15Å; L60-V91 HydrophobicContact CD1-CG1 3.88Å; L60-V91 HydrophobicContact CG-CG1 4.33Å; L60-W92 PolarHBondContact N-O 3.1Å; L60-M93 HydrophobicContact CB-CG 4.24Å; L60-M93 HydrophobicContact CD1-CG 4.12Å; L60-M93 HydrophobicContact CD1-SD 4.47Å; L60-M93 HydrophobicContact CG-CG 4.46Å; L60-M93 WeakPolarHBondContact O-CA 3.34Å; L60-G94 PolarHBondContact O-N 3.4Å; L60-V147 WeakPolarHBondContact CA-O 3.38Å; L60-V147 HydrophobicContact CD2-CB 3.71Å; L60-V147 HydrophobicContact CD2-CG1 4.36Å; L60-V147 HydrophobicContact CD2-CG2 3.86Å
61	Q	98.2	Very high	89.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118	-178.3	-171.7	57.9	60.5	0	0	112.2	F59 W71 F96 Y146 V147 H149	F59-Q61 HydrophobicContact CD1-CB 4.43Å; F59-Q61 HydrophobicContact CE1-CB 4.13Å; Q61-W71 WeakPolarHBondContact O-CZ2 3.31Å; Q61-F96 HydrophobicContact CG-CE1 4.26Å; Q61-F96 HydrophobicContact CG-CE2 3.65Å; Q61-F96 HydrophobicContact CG-CZ 3.43Å; Q61-F96 VanDerWaalsContact CG-CZ 3.43Å; Q61-F96 VanDerWaalsContact NE2-CE2 3.27Å; Q61-Y146 HydrophobicContact CB-CE1 4.37Å; Q61-Y146 HydrophobicContact CB-CE2 4.01Å; Q61-Y146 WeakPolarHBondContact CB-OH 3.4Å; Q61-Y146 VanDerWaalsContact CG-OH 3.26Å; Q61-Y146 WeakPolarHBondContact CG-OH 3.48Å; Q61-V147 PolarHBondContact N-O 3.28Å; Q61-H149 PolarHBondContact O-N 2.93Å
62	H	94.4	Very high	90.3	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.009	10%	0.097	C	C	.	.			trans	-68.2	168.1	-177.9	69.1	77.6	0	0	0	113.4	S66 S67 G94 F96 N99 G152	H62-S66 PolarHBondContact CE1-O 3Å; H62-S66 PolarHBondContact ND1-O 3.14Å; H62-S67 WeakPolarHBondContact CB-O 3.36Å; H62-S67 VanDerWaalsContact CD2-C 3.42Å; H62-S67 VanDerWaalsContact CD2-CA 3.43Å; H62-S67 WeakPolarHBondContact CD2-CA 3.19Å; H62-G94 PolarHBondContact CD2-O 3.25Å; H62-G94 VanDerWaalsContact CD2-O 3.31Å; H62-F96 AromaticContact CE1-CD2 3.87Å; H62-F96 PolarHBondContact NE2-N 2.66Å; H62-N99 PolarHBondContact NE2-ND2 3.46Å; H62-G152 WeakPolarHBondContact O-CA 3.42Å; H62-G152 PolarHBondContact O-N 3.33Å
63	G	88.7	Confident	90.4	Very high	3 Å²	3	13.9 Å²	13.9	3%	0.031	8%	0.079	C	C	.	.			trans	-90.4	-162.1	177.7	0	0	0	0	0	115.3	H149	G63-H149 VanDerWaalsContact CA-O 3.29Å; G63-H149 WeakPolarHBondContact CA-O 3.44Å; G63-H149 PolarHBondContact N-O 3.35Å
64	L	82.6	Confident	90.7	Very high	32 Å²	32	9.2 Å²	9.2	17%	0.168	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	143.5	176.1	-180	69.2	0	0	0	110.7	S66 Q151 L237 L261 D265	L64-S66 VanDerWaalsContact C-N 3.31Å; L64-S66 PolarHBondContact O-N 3.12Å; L64-Q151 HydrophobicContact CB-CB 4.21Å; L64-L237 HydrophobicContact CD2-CD1 3.79Å; L64-L261 HydrophobicContact CD1-CD1 3.46Å; L64-L261 VanDerWaalsContact CD1-CD1 3.46Å; L64-L261 HydrophobicContact CG-CD1 4.28Å; L64-D265 HydrophobicContact CD1-CB 4.42Å
65	E	73	Confident	91.1	Very high	8 Å²	8	9.2 Å²	9.2	4%	0.037	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	41.7	178.8	-68	-71.1	170.5	0	0	113.9	F206 L233 H260 L261	E65-F206 WeakPolarHBondContact OE1-CD1 3.32Å; E65-F206 WeakPolarHBondContact OE1-CG 3.27Å; E65-L233 HydrophobicContact CG-CD2 3.72Å; E65-L233 HydrophobicContact CG-CG 4.46Å; E65-H260 PolarHBondContact OE2-N 2.68Å; E65-L261 HydrophobicContact CB-CD1 4.48Å; E65-L261 HydrophobicContact CG-CD1 4.09Å
66	S	81	Confident	91.2	Very high	8 Å²	8	9 Å²	9	6%	0.056	5%	0.051	C	C	.	.			trans	-146.1	-170.9	-177.5	-157.9	0	0	0	0	114.9	H62 L64 D70 N99	H62-S66 PolarHBondContact CE1-O 3Å; H62-S66 PolarHBondContact ND1-O 3.14Å; L64-S66 VanDerWaalsContact C-N 3.31Å; L64-S66 PolarHBondContact O-N 3.12Å; S66-D70 WeakPolarHBondContact CB-OD2 3.46Å; S66-D70 PolarHBondContact OG-OD1 3.22Å; S66-D70 PolarHBondContact OG-OD2 2.93Å; S66-N99 PolarHBondContact O-ND2 3.37Å
67	S	88.6	Confident	91.1	Very high	3 Å²	3	11 Å²	11	2%	0.021	7%	0.072	C	C	.	.			trans	-150.7	178.7	-179.8	68.4	0	0	0	0	111.8	H62 I69 D70 N95	H62-S67 WeakPolarHBondContact CB-O 3.36Å; H62-S67 VanDerWaalsContact CD2-C 3.42Å; H62-S67 VanDerWaalsContact CD2-CA 3.43Å; H62-S67 WeakPolarHBondContact CD2-CA 3.19Å; S67-I69 PolarHBondContact O-N 3.1Å; S67-I69 WeakPolarHBondContact OG-CB 3.41Å; S67-I69 PolarHBondContact OG-N 3.44Å; S67-D70 PolarHBondContact O-N 2.83Å; S67-N95 WeakPolarHBondContact CA-OD1 3.32Å; S67-N95 WeakPolarHBondContact CB-OD1 3.24Å
68	C	92.5	Very high	90.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-54.9	-19.4	173.9	65.3	0	0	0	0	114.5	D70 W71 M93 N95	C68-D70 PolarHBondContact O-N 3.05Å; C68-W71 PolarHBondContact O-N 2.83Å; C68-M93 HydrophobicContact CB-CB 3.63Å; C68-N95 PolarHBondContact N-OD1 3.33Å; C68-N95 PolarHBondContact SG-ND2 2.99Å
69	I	89.1	Confident	90.8	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.01	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-57.1	-28.7	177.8	-77.6	-179.2	0	0	0	112.2	I14 Q15 I18 S67 W71 I72 N73 Y101 F256	I14-I69 HydrophobicContact CG2-CD1 3.98Å; Q15-I69 HydrophobicContact CB-CG1 4.01Å; I18-I69 HydrophobicContact CD1-CD1 4.45Å; S67-I69 PolarHBondContact O-N 3.1Å; S67-I69 WeakPolarHBondContact OG-CB 3.41Å; S67-I69 PolarHBondContact OG-N 3.44Å; I69-W71 PolarHBondContact O-N 3Å; I69-W71 VanDerWaalsContact O-N 3.11Å; I69-I72 VanDerWaalsContact O-CG1 3.28Å; I69-I72 WeakPolarHBondContact O-CG1 3.19Å; I69-I72 PolarHBondContact O-N 3.31Å; I69-N73 VanDerWaalsContact CG2-CG 3.4Å; I69-N73 VanDerWaalsContact CG2-ND2 3.32Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.22Å; I69-N73 WeakPolarHBondContact CG2-OD1 3.45Å; I69-N73 PolarHBondContact O-N 3.43Å; I69-N73 PolarHBondContact O-ND2 2.95Å; I69-Y101 HydrophobicContact CD1-CE2 4.26Å; I69-Y101 WeakPolarHBondContact CD1-OH 3.42Å; I69-Y101 HydrophobicContact CG1-CE2 4.24Å; I69-F256 HydrophobicContact CD1-CB 4.08Å; I69-F256 HydrophobicContact CD1-CD1 4.16Å; I69-F256 HydrophobicContact CD1-CG 4.06Å; I69-F256 HydrophobicContact CG2-CB 4.41Å
70	D	89.6	Confident	90.7	Very high	4 Å²	4	12.5 Å²	12.5	2%	0.021	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-53.1	-35.9	178	-81.6	-14.6	0	0	0	113.7	S66 S67 C68 I72 I327 W328	S66-D70 WeakPolarHBondContact CB-OD2 3.46Å; S66-D70 PolarHBondContact OG-OD1 3.22Å; S66-D70 PolarHBondContact OG-OD2 2.93Å; S67-D70 PolarHBondContact O-N 2.83Å; C68-D70 PolarHBondContact O-N 3.05Å; D70-I72 VanDerWaalsContact C-N 3.27Å; D70-I72 PolarHBondContact O-N 3.38Å; D70-I327 HydrophobicContact CB-CB 4.46Å; D70-I327 HydrophobicContact CB-CD1 4.02Å; D70-I327 WeakPolarHBondContact OD2-CD1 3.31Å; D70-W328 VanDerWaalsContact OD1-CZ2 3.22Å; D70-W328 WeakPolarHBondContact OD1-CZ2 3.3Å; D70-W328 PolarHBondContact OD1-NE1 3.18Å; D70-W328 VanDerWaalsContact OD1-NE1 3.11Å
71	W	95.3	Very high	90.6	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-80.2	-7.9	-175.8	-53.4	116.6	0	0	0	113.5	L60 Q61 C68 I69 S79 A80 G81 M93 V147 H149 L176 I327	L60-W71 HydrophobicContact CB-CD2 3.81Å; L60-W71 HydrophobicContact CB-CG 3.84Å; L60-W71 HydrophobicContact CB-CZ2 4.2Å; L60-W71 HydrophobicContact CD1-CB 3.84Å; L60-W71 HydrophobicContact CD1-CD2 4.08Å; L60-W71 HydrophobicContact CD1-CE3 4.38Å; L60-W71 HydrophobicContact CD1-CG 3.84Å; L60-W71 HydrophobicContact CG-CD2 4.48Å; L60-W71 HydrophobicContact CG-CG 4.49Å; Q61-W71 WeakPolarHBondContact O-CZ2 3.31Å; C68-W71 PolarHBondContact O-N 2.83Å; I69-W71 PolarHBondContact O-N 3Å; I69-W71 VanDerWaalsContact O-N 3.11Å; W71-S79 CarbonylContact O-C 3.51Å; W71-S79 VanDerWaalsContact O-C 3.26Å; W71-S79 WeakPolarHBondContact O-CA 3.49Å; W71-S79 VanDerWaalsContact O-CB 3.28Å; W71-S79 WeakPolarHBondContact O-CB 2.82Å; W71-A80 HydrophobicContact CB-CB 4.5Å; W71-A80 HydrophobicContact CD2-CB 4.49Å; W71-A80 HydrophobicContact CE3-CB 3.62Å; W71-A80 HydrophobicContact CZ3-CB 4.24Å; W71-A80 PolarHBondContact O-N 3.48Å; W71-A80 VanDerWaalsContact O-N 3.16Å; W71-G81 PolarHBondContact O-N 2.89Å; W71-M93 HydrophobicContact CB-SD 3.67Å; W71-M93 HydrophobicContact CG-SD 4.35Å; W71-V147 HydrophobicContact CH2-CG1 4.33Å; W71-H149 HydrophobicContact CH2-CB 3.82Å; W71-H149 HydrophobicContact CZ2-CB 4.11Å; W71-L176 HydrophobicContact CH2-CD1 4.15Å; W71-L176 HydrophobicContact CZ3-CD1 4.18Å; W71-I327 HydrophobicContact CE3-CG2 4.1Å; W71-I327 HydrophobicContact CH2-CG2 3.82Å; W71-I327 HydrophobicContact CZ2-CG2 4.48Å; W71-I327 HydrophobicContact CZ3-CG2 3.59Å
72	I	93.1	Very high	90.6	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-129.8	9.1	-174.1	57.6	169.1	0	0	0	113.7	Q15 I18 I19 I44 I69 D70 N74 F82 M93	Q15-I72 HydrophobicContact CB-CD1 4.04Å; I18-I72 HydrophobicContact CB-CD1 4.21Å; I18-I72 HydrophobicContact CG2-CB 4.4Å; I18-I72 HydrophobicContact CG2-CD1 3.95Å; I18-I72 HydrophobicContact CG2-CG1 4.25Å; I19-I72 HydrophobicContact CD1-CD1 4.03Å; I19-I72 HydrophobicContact CG1-CD1 3.79Å; I19-I72 HydrophobicContact CG1-CG2 4.28Å; I44-I72 HydrophobicContact CD1-CG2 3.97Å; I69-I72 VanDerWaalsContact O-CG1 3.28Å; I69-I72 WeakPolarHBondContact O-CG1 3.19Å; I69-I72 PolarHBondContact O-N 3.31Å; D70-I72 VanDerWaalsContact C-N 3.27Å; D70-I72 PolarHBondContact O-N 3.38Å; I72-N74 PolarHBondContact O-N 3.34Å; I72-F82 HydrophobicContact CB-CE1 4.38Å; I72-F82 HydrophobicContact CB-CE2 3.82Å; I72-F82 HydrophobicContact CB-CZ 3.69Å; I72-F82 HydrophobicContact CG2-CD1 4.45Å; I72-F82 HydrophobicContact CG2-CE1 3.99Å; I72-F82 HydrophobicContact CG2-CE2 4.16Å; I72-F82 HydrophobicContact CG2-CZ 3.81Å; I72-F82 WeakPolarHBondContact O-CE2 3.42Å; I72-M93 HydrophobicContact CG2-CE 3.95Å; I72-M93 HydrophobicContact CG2-SD 3.89Å
73	N	84.3	Confident	90.7	Very high	16 Å²	16	14.4 Å²	14.4	9%	0.086	9%	0.086	C	C	.	.	S	Bend	trans	-79.5	-16.1	-171.7	-96.7	-22	0	0	0	115.6	I69 R249	I69-N73 VanDerWaalsContact CG2-CG 3.4Å; I69-N73 VanDerWaalsContact CG2-ND2 3.32Å; I69-N73 WeakPolarHBondContact CG2-ND2 3.22Å; I69-N73 WeakPolarHBondContact CG2-OD1 3.45Å; I69-N73 PolarHBondContact O-N 3.43Å; I69-N73 PolarHBondContact O-ND2 2.95Å; N73-R249 WeakPolarHBondContact O-CD 3.4Å; N73-R249 PolarHBondContact O-NH1 3.2Å
74	N	88.4	Confident	91.1	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	9%	0.085	C	C	.	.	S	Bend	trans	-106.6	-174.1	-176.7	-77.7	-26	0	0	0	113	I72 Q78 S79 R249 R253 W328	I72-N74 PolarHBondContact O-N 3.34Å; N74-Q78 HydrophobicContact CB-CB 3.61Å; N74-S79 WeakPolarHBondContact CA-OG 2.97Å; N74-S79 WeakPolarHBondContact CB-OG 3.18Å; N74-S79 PolarHBondContact N-OG 2.96Å; N74-S79 PolarHBondContact O-OG 2.8Å; N74-R249 PolarHBondContact O-NH1 3.19Å; N74-R253 PolarHBondContact OD1-NH2 3.29Å; N74-W328 WeakPolarHBondContact ND2-CA 3.25Å; N74-W328 PolarHBondContact ND2-O 2.95Å
75	L	92.8	Very high	91.8	Very high	74 Å²	74	12.8 Å²	12.8	39%	0.387	8%	0.077	S	C	.	.			trans	-61.2	155.9	170.4	-68.3	168.1	0	0	0	109.2	W22 G77 Q78 S79 R249	W22-L75 HydrophobicContact CH2-CD2 3.61Å; W22-L75 HydrophobicContact CZ2-CD2 4.41Å; W22-L75 HydrophobicContact CZ3-CD2 4.09Å; L75-G77 VanDerWaalsContact C-N 3.31Å; L75-G77 PolarHBondContact O-N 3.45Å; L75-G77 VanDerWaalsContact O-N 3.16Å; L75-Q78 CarbonylContact O-C 3.49Å; L75-Q78 WeakPolarHBondContact O-CA 3.28Å; L75-Q78 PolarHBondContact O-N 2.94Å; L75-S79 PolarHBondContact O-N 3.44Å; L75-S79 VanDerWaalsContact O-N 3.07Å; L75-S79 PolarHBondContact O-OG 2.87Å; L75-R249 VanDerWaalsContact CG-NH2 3.35Å
76	P	94	Very high	92.8	Very high	29 Å²	29	15 Å²	15	19%	0.188	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-46.2	-48	-179.1	-34.5	38.5	0	0	0	115.2	W22 Y24 Q78 S79 F82 Y83	W22-P76 HydrophobicContact CD2-CG 4.09Å; W22-P76 HydrophobicContact CE3-CG 3.67Å; W22-P76 HydrophobicContact CG-CG 4.47Å; W22-P76 HydrophobicContact CZ3-CG 4.28Å; Y24-P76 HydrophobicContact CE2-CG 4.38Å; P76-Q78 PolarHBondContact O-N 2.89Å; P76-Q78 VanDerWaalsContact O-N 3.11Å; P76-S79 PolarHBondContact O-N 3.48Å; P76-F82 HydrophobicContact CB-CB 3.98Å; P76-Y83 PolarHBondContact O-N 2.8Å
77	G	93.8	Very high	93.5	Very high	45 Å²	45	15.7 Å²	15.7	46%	0.464	10%	0.095	S	C	.	.	G	3₁₀ helix	trans	-70.8	-3	177.9	0	0	0	0	0	116.2	L75 G333	L75-G77 VanDerWaalsContact C-N 3.31Å; L75-G77 PolarHBondContact O-N 3.45Å; L75-G77 VanDerWaalsContact O-N 3.16Å; G77-G333 WeakPolarHBondContact O-CA 3.2Å
78	Q	93.8	Very high	93.8	Very high	34 Å²	34	16 Å²	16	16%	0.159	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-122.8	-0.4	-177.3	-68.3	174.7	-23.8	0	0	112.5	N74 L75 P76 L330	N74-Q78 HydrophobicContact CB-CB 3.61Å; L75-Q78 CarbonylContact O-C 3.49Å; L75-Q78 WeakPolarHBondContact O-CA 3.28Å; L75-Q78 PolarHBondContact O-N 2.94Å; P76-Q78 PolarHBondContact O-N 2.89Å; P76-Q78 VanDerWaalsContact O-N 3.11Å; Q78-L330 PolarHBondContact NE2-O 3.13Å
79	S	95.4	Very high	94	Very high	1 Å²	1	16 Å²	16	1%	0.007	10%	0.098	C	C	.	.	S	Bend	trans	-113.9	114.7	-179.3	-76.2	0	0	0	0	107.7	W71 N74 L75 P76 G81 F82 Y83	W71-S79 CarbonylContact O-C 3.51Å; W71-S79 VanDerWaalsContact O-C 3.26Å; W71-S79 WeakPolarHBondContact O-CA 3.49Å; W71-S79 VanDerWaalsContact O-CB 3.28Å; W71-S79 WeakPolarHBondContact O-CB 2.82Å; N74-S79 WeakPolarHBondContact CA-OG 2.97Å; N74-S79 WeakPolarHBondContact CB-OG 3.18Å; N74-S79 PolarHBondContact N-OG 2.96Å; N74-S79 PolarHBondContact O-OG 2.8Å; L75-S79 PolarHBondContact O-N 3.44Å; L75-S79 VanDerWaalsContact O-N 3.07Å; L75-S79 PolarHBondContact O-OG 2.87Å; P76-S79 PolarHBondContact O-N 3.48Å; S79-G81 PolarHBondContact O-N 2.85Å; S79-G81 VanDerWaalsContact O-N 3.12Å; S79-F82 VanDerWaalsContact CB-CD2 3.45Å; S79-F82 PolarHBondContact O-N 3.1Å; S79-F82 VanDerWaalsContact O-N 3.08Å; S79-Y83 WeakPolarHBondContact O-CB 3.21Å; S79-Y83 PolarHBondContact O-N 2.87Å
80	A	97.7	Very high	94.3	Very high	1 Å²	1	16 Å²	16	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-51.3	-41.3	-176.1	0	0	0	0	0	112.5	L60 W71 F82 Y83 F84 Y337	L60-A80 HydrophobicContact CD1-CB 3.91Å; W71-A80 HydrophobicContact CB-CB 4.5Å; W71-A80 HydrophobicContact CD2-CB 4.49Å; W71-A80 HydrophobicContact CE3-CB 3.62Å; W71-A80 HydrophobicContact CZ3-CB 4.24Å; W71-A80 PolarHBondContact O-N 3.48Å; W71-A80 VanDerWaalsContact O-N 3.16Å; A80-F82 PolarHBondContact O-N 3.03Å; A80-Y83 PolarHBondContact O-N 3.44Å; A80-F84 HydrophobicContact CB-CD2 4.08Å; A80-F84 HydrophobicContact CB-CE2 3.91Å; A80-F84 WeakPolarHBondContact O-CB 3.35Å; A80-F84 WeakPolarHBondContact O-CD2 3.23Å; A80-F84 WeakPolarHBondContact O-CG 3.38Å; A80-F84 PolarHBondContact O-N 2.93Å; A80-Y337 HydrophobicContact CB-CD1 4.23Å; A80-Y337 HydrophobicContact CB-CD2 4.26Å; A80-Y337 HydrophobicContact CB-CE1 3.9Å; A80-Y337 HydrophobicContact CB-CE2 3.95Å; A80-Y337 HydrophobicContact CB-CG 4.43Å
81	G	97.1	Very high	94.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-40.8	-178.3	0	0	0	0	0	113.4	W71 S79 S85	W71-G81 PolarHBondContact O-N 2.89Å; S79-G81 PolarHBondContact O-N 2.85Å; S79-G81 VanDerWaalsContact O-N 3.12Å; G81-S85 WeakPolarHBondContact O-CB 3.48Å; G81-S85 PolarHBondContact O-N 3.34Å
82	F	96.5	Very high	94.9	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-78	-43.1	176.3	-59.9	-41.5	0	0	0	111.7	I18 I19 W22 Y24 I44 I72 P76 S79 A80 F84 S85 D86	I18-F82 HydrophobicContact CG2-CZ 4.41Å; I19-F82 HydrophobicContact CB-CE1 4.23Å; I19-F82 HydrophobicContact CG1-CE1 3.97Å; I19-F82 HydrophobicContact CG1-CZ 4.21Å; I19-F82 HydrophobicContact CG2-CE1 4.18Å; W22-F82 HydrophobicContact CB-CE1 4.32Å; W22-F82 HydrophobicContact CB-CE2 4.3Å; W22-F82 HydrophobicContact CB-CZ 4.08Å; W22-F82 AromaticContact CD1-CE2 3.38Å; W22-F82 AromaticContact CD1-CZ 3.48Å; W22-F82 VanDerWaalsContact CD1-CZ 3.48Å; W22-F82 AromaticContact CG-CE2 3.91Å; W22-F82 HydrophobicContact CG-CE2 3.91Å; W22-F82 HydrophobicContact CG-CZ 4.04Å; W22-F82 AromaticContact NE1-CE2 3.98Å; Y24-F82 HydrophobicContact CD1-CD1 4.19Å; Y24-F82 AromaticContact CD2-CD1 3.39Å; Y24-F82 HydrophobicContact CD2-CD1 3.39Å; Y24-F82 AromaticContact CD2-CE1 3.65Å; Y24-F82 HydrophobicContact CD2-CE1 3.65Å; Y24-F82 HydrophobicContact CD2-CG 4.19Å; Y24-F82 HydrophobicContact CE1-CB 4.38Å; Y24-F82 HydrophobicContact CE1-CD1 4.27Å; Y24-F82 HydrophobicContact CE2-CB 4.02Å; Y24-F82 AromaticContact CE2-CD1 3.49Å; Y24-F82 HydrophobicContact CE2-CD1 3.49Å; Y24-F82 VanDerWaalsContact CE2-CD1 3.49Å; Y24-F82 HydrophobicContact CE2-CE1 4.12Å; Y24-F82 AromaticContact CE2-CG 3.82Å; Y24-F82 HydrophobicContact CE2-CG 3.82Å; Y24-F82 AromaticContact CG-CD1 3.79Å; Y24-F82 HydrophobicContact CG-CD1 3.79Å; Y24-F82 HydrophobicContact CG-CE1 4.11Å; Y24-F82 AromaticContact CZ-CD1 3.95Å; I44-F82 HydrophobicContact CD1-CD1 4.18Å; I44-F82 HydrophobicContact CD1-CE1 4.11Å; I72-F82 HydrophobicContact CB-CE1 4.38Å; I72-F82 HydrophobicContact CB-CE2 3.82Å; I72-F82 HydrophobicContact CB-CZ 3.69Å; I72-F82 HydrophobicContact CG2-CD1 4.45Å; I72-F82 HydrophobicContact CG2-CE1 3.99Å; I72-F82 HydrophobicContact CG2-CE2 4.16Å; I72-F82 HydrophobicContact CG2-CZ 3.81Å; I72-F82 WeakPolarHBondContact O-CE2 3.42Å; P76-F82 HydrophobicContact CB-CB 3.98Å; S79-F82 VanDerWaalsContact CB-CD2 3.45Å; S79-F82 PolarHBondContact O-N 3.1Å; S79-F82 VanDerWaalsContact O-N 3.08Å; A80-F82 PolarHBondContact O-N 3.03Å; F82-F84 PolarHBondContact O-N 2.95Å; F82-S85 WeakPolarHBondContact O-CB 3.22Å; F82-S85 PolarHBondContact O-N 2.55Å; F82-D86 PolarHBondContact O-N 3.49Å
83	Y	97.2	Very high	95.1	Very high	42 Å²	42	15.8 Å²	15.8	17%	0.165	10%	0.098	C	C	.	.	H	α-helix	trans	-54.9	-51.7	178.9	-173.4	-80.5	0	0	0	111.4	P76 S79 A80 D86 A87 Y337 R338 E341	P76-Y83 PolarHBondContact O-N 2.8Å; S79-Y83 WeakPolarHBondContact O-CB 3.21Å; S79-Y83 PolarHBondContact O-N 2.87Å; A80-Y83 PolarHBondContact O-N 3.44Å; Y83-D86 PolarHBondContact O-N 3.18Å; Y83-A87 WeakPolarHBondContact O-CB 3.17Å; Y83-A87 PolarHBondContact O-N 3.42Å; Y83-Y337 HydrophobicContact CD2-CD2 4.5Å; Y83-Y337 HydrophobicContact CG-CD2 4.2Å; Y83-R338 WeakPolarHBondContact OH-CA 3.3Å; Y83-R338 WeakPolarHBondContact OH-CB 3.04Å; Y83-E341 HydrophobicContact CE1-CB 4.18Å; Y83-E341 HydrophobicContact CE1-CG 4.5Å; Y83-E341 PolarHBondContact OH-OE2 3.07Å
84	F	97.4	Very high	95.7	Very high	1 Å²	1	15 Å²	15	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-70.4	-33.1	-179.6	-66.7	-55.4	0	0	0	112.2	I58 L60 A80 F82 D86 A87 G88 F89 V91 Y337 V340 E341	I58-F84 HydrophobicContact CD1-CD1 3.98Å; I58-F84 HydrophobicContact CD1-CD2 3.7Å; I58-F84 HydrophobicContact CD1-CE1 3.94Å; I58-F84 HydrophobicContact CD1-CE2 3.65Å; I58-F84 HydrophobicContact CD1-CG 3.88Å; I58-F84 HydrophobicContact CD1-CZ 3.78Å; I58-F84 HydrophobicContact CG2-CB 4.06Å; I58-F84 HydrophobicContact CG2-CD2 4.45Å; I58-F84 HydrophobicContact CG2-CG 4.33Å; L60-F84 HydrophobicContact CD2-CD2 4.22Å; L60-F84 HydrophobicContact CD2-CE2 4.15Å; A80-F84 HydrophobicContact CB-CD2 4.08Å; A80-F84 HydrophobicContact CB-CE2 3.91Å; A80-F84 WeakPolarHBondContact O-CB 3.35Å; A80-F84 WeakPolarHBondContact O-CD2 3.23Å; A80-F84 WeakPolarHBondContact O-CG 3.38Å; A80-F84 PolarHBondContact O-N 2.93Å; F82-F84 PolarHBondContact O-N 2.95Å; F84-D86 PolarHBondContact O-N 2.95Å; F84-A87 CarbonylContact O-C 3.39Å; F84-A87 PolarHBondContact O-N 2.76Å; F84-G88 PolarHBondContact O-N 2.72Å; F84-F89 HydrophobicContact CB-CB 4.05Å; F84-F89 HydrophobicContact CB-CD2 4.13Å; F84-F89 HydrophobicContact CB-CG 4.09Å; F84-F89 HydrophobicContact CD1-CD2 4.23Å; F84-F89 HydrophobicContact CD1-CE2 4.18Å; F84-F89 HydrophobicContact CD1-CZ 4.4Å; F84-F89 VanDerWaalsContact O-CB 3.31Å; F84-F89 WeakPolarHBondContact O-CB 3.27Å; F84-F89 WeakPolarHBondContact O-CD2 3.34Å; F84-F89 PolarHBondContact O-N 3.23Å; F84-V91 HydrophobicContact CB-CG2 3.72Å; F84-Y337 HydrophobicContact CE2-CD1 4.5Å; F84-Y337 HydrophobicContact CZ-CD1 4.41Å; F84-Y337 HydrophobicContact CZ-CG 4.41Å; F84-V340 HydrophobicContact CE1-CB 4.36Å; F84-V340 HydrophobicContact CE1-CG1 4.01Å; F84-V340 HydrophobicContact CZ-CB 4.18Å; F84-V340 HydrophobicContact CZ-CG1 3.79Å; F84-E341 HydrophobicContact CE1-CB 4.24Å
85	S	96.4	Very high	96	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.7	-44.7	172	170.8	0	0	0	0	111.6	Y24 L45 P46 N47 G81 F82 A87 G88	Y24-S85 WeakPolarHBondContact CD1-OG 3.41Å; L45-S85 PolarHBondContact O-OG 2.98Å; P46-S85 WeakPolarHBondContact CA-O 3.5Å; N47-S85 PolarHBondContact N-O 2.94Å; N47-S85 VanDerWaalsContact N-O 3.11Å; N47-S85 PolarHBondContact N-OG 3.19Å; G81-S85 WeakPolarHBondContact O-CB 3.48Å; G81-S85 PolarHBondContact O-N 3.34Å; F82-S85 WeakPolarHBondContact O-CB 3.22Å; F82-S85 PolarHBondContact O-N 2.55Å; S85-A87 VanDerWaalsContact C-N 3.26Å; S85-A87 PolarHBondContact O-N 2.92Å; S85-G88 PolarHBondContact O-N 3.25Å; S85-G88 VanDerWaalsContact O-N 3.12Å
86	D	95.3	Very high	96.1	Very high	55 Å²	55	11.5 Å²	11.5	29%	0.294	8%	0.075	S	C	.	.	H	α-helix	trans	-68.8	-24	175.8	-75.5	-22.8	0	0	0	113.3	Y24 N47 K50 F82 Y83 F84 G88	Y24-D86 WeakPolarHBondContact CE1-OD1 3.43Å; Y24-D86 PolarHBondContact OH-OD1 3.12Å; Y24-D86 PolarHBondContact OH-OD2 3.39Å; N47-D86 PolarHBondContact ND2-OD1 3.11Å; K50-D86 WeakPolarHBondContact CG-O 3.38Å; F82-D86 PolarHBondContact O-N 3.49Å; Y83-D86 PolarHBondContact O-N 3.18Å; F84-D86 PolarHBondContact O-N 2.95Å; D86-G88 VanDerWaalsContact C-N 3.29Å
87	A	94.6	Very high	96	Very high	21 Å²	21	10.1 Å²	10.1	17%	0.174	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-3.7	173.6	0	0	0	0	0	113.7	Y83 F84 S85 F89 E341 H345	Y83-A87 WeakPolarHBondContact O-CB 3.17Å; Y83-A87 PolarHBondContact O-N 3.42Å; F84-A87 CarbonylContact O-C 3.39Å; F84-A87 PolarHBondContact O-N 2.76Å; S85-A87 VanDerWaalsContact C-N 3.26Å; S85-A87 PolarHBondContact O-N 2.92Å; A87-F89 HydrophobicContact CB-CD2 3.73Å; A87-F89 HydrophobicContact CB-CE2 3.64Å; A87-E341 HydrophobicContact CB-CG 3.7Å; A87-H345 PolarHBondContact O-CE1 2.83Å; A87-H345 PolarHBondContact O-NE2 2.78Å
88	G	95	Very high	95.6	Very high	9 Å²	9	8 Å²	8	9%	0.093	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	102	10.4	173.8	0	0	0	0	0	115.5	F84 S85 D86	F84-G88 PolarHBondContact O-N 2.72Å; S85-G88 PolarHBondContact O-N 3.25Å; S85-G88 VanDerWaalsContact O-N 3.12Å; D86-G88 VanDerWaalsContact C-N 3.29Å
89	F	96.5	Very high	95.2	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.037	C	C	.	.			trans	-84.8	150.5	-176.5	-65.3	-110.3	0	0	0	112.2	P46 P56 I58 F84 A87 V91 E341 I344 H345	P46-F89 WeakPolarHBondContact CD-O 2.75Å; P46-F89 WeakPolarHBondContact CG-O 3.34Å; P56-F89 HydrophobicContact CB-CD1 3.89Å; P56-F89 HydrophobicContact CB-CE1 4Å; P56-F89 HydrophobicContact CG-CD1 3.54Å; P56-F89 HydrophobicContact CG-CE1 3.67Å; P56-F89 HydrophobicContact CG-CG 4.06Å; P56-F89 HydrophobicContact CG-CZ 4.24Å; I58-F89 HydrophobicContact CB-CD1 3.95Å; I58-F89 HydrophobicContact CD1-CD1 4.4Å; I58-F89 HydrophobicContact CD1-CE1 4.49Å; I58-F89 HydrophobicContact CG2-CB 3.8Å; I58-F89 HydrophobicContact CG2-CD1 3.97Å; I58-F89 HydrophobicContact CG2-CG 4.2Å; F84-F89 HydrophobicContact CB-CB 4.05Å; F84-F89 HydrophobicContact CB-CD2 4.13Å; F84-F89 HydrophobicContact CB-CG 4.09Å; F84-F89 HydrophobicContact CD1-CD2 4.23Å; F84-F89 HydrophobicContact CD1-CE2 4.18Å; F84-F89 HydrophobicContact CD1-CZ 4.4Å; F84-F89 VanDerWaalsContact O-CB 3.31Å; F84-F89 WeakPolarHBondContact O-CB 3.27Å; F84-F89 WeakPolarHBondContact O-CD2 3.34Å; F84-F89 PolarHBondContact O-N 3.23Å; A87-F89 HydrophobicContact CB-CD2 3.73Å; A87-F89 HydrophobicContact CB-CE2 3.64Å; F89-V91 HydrophobicContact CB-CG2 4.13Å; F89-V91 PolarHBondContact O-N 2.87Å; F89-E341 HydrophobicContact CE2-CB 4.42Å; F89-E341 HydrophobicContact CE2-CG 3.76Å; F89-E341 HydrophobicContact CZ-CB 4.42Å; F89-E341 HydrophobicContact CZ-CG 4.1Å; F89-I344 HydrophobicContact CD1-CG2 4.45Å; F89-I344 HydrophobicContact CE1-CB 3.83Å; F89-I344 HydrophobicContact CE1-CD1 3.68Å; F89-I344 HydrophobicContact CE1-CG1 4.36Å; F89-I344 HydrophobicContact CE1-CG2 3.39Å; F89-I344 HydrophobicContact CZ-CB 3.99Å; F89-I344 HydrophobicContact CZ-CD1 4.3Å; F89-I344 HydrophobicContact CZ-CG2 3.88Å; F89-H345 AromaticContact CE2-CE1 3.78Å; F89-H345 AromaticContact CE2-NE2 3.37Å; F89-H345 WeakPolarHBondContact CE2-NE2 3.5Å; F89-H345 AromaticContact CZ-CD2 3.93Å; F89-H345 AromaticContact CZ-NE2 3.68Å
90	D	96.7	Very high	94.4	Very high	3 Å²	3	7.8 Å²	7.8	2%	0.016	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	101.2	160.8	-171	19.6	0	0	0	109.1	R43 R55 P56 V57 I58 W92 S139	R43-D90 IonicContact CZ-OD1 3.91Å; R43-D90 IonicContact CZ-OD2 3.06Å; R43-D90 IonicContact NE-OD1 3.99Å; R43-D90 PolarHBondContact NE-OD1 3.48Å; R43-D90 IonicContact NE-OD2 3.83Å; R43-D90 PolarHBondContact NE-OD2 2.81Å; R43-D90 VanDerWaalsContact NH2-CG 3.35Å; R43-D90 IonicContact NH2-OD1 3.88Å; R43-D90 PolarHBondContact NH2-OD1 2.97Å; R43-D90 IonicContact NH2-OD2 3.57Å; R43-D90 PolarHBondContact NH2-OD2 3.05Å; R55-D90 HydrophobicContact CG-CB 4.02Å; P56-D90 PolarHBondContact O-N 3.26Å; V57-D90 WeakPolarHBondContact CA-O 3.46Å; V57-D90 HydrophobicContact CG2-CB 4.11Å; I58-D90 PolarHBondContact N-O 2.73Å; D90-W92 PolarHBondContact OD2-NE1 3.03Å; D90-S139 WeakPolarHBondContact OD2-CB 3.41Å
91	V	98.2	Very high	93.8	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	127.2	-171.5	-177.8	0	0	0	0	110.2	R43 I44 I58 L60 F84 F89 M93	R43-V91 CarbonylContact C-O 3.56Å; R43-V91 WeakPolarHBondContact CA-O 3.43Å; I44-V91 HydrophobicContact CB-CB 4.23Å; I44-V91 PolarHBondContact N-O 3.38Å; I44-V91 PolarHBondContact O-N 3.02Å; I58-V91 HydrophobicContact CG2-CB 4.24Å; I58-V91 HydrophobicContact CG2-CG1 4.34Å; I58-V91 HydrophobicContact CG2-CG2 3.85Å; L60-V91 HydrophobicContact CD1-CG1 3.88Å; L60-V91 HydrophobicContact CG-CG1 4.33Å; F84-V91 HydrophobicContact CB-CG2 3.72Å; F89-V91 HydrophobicContact CB-CG2 4.13Å; F89-V91 PolarHBondContact O-N 2.87Å; V91-M93 HydrophobicContact CG1-CG 4.19Å
92	W	98.5	Very high	93.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	138.9	172.3	-71.1	79	0	0	0	110.1	Y29 L41 I42 R43 I58 F59 L60 D90 A135 V138	Y29-W92 AromaticContact CD2-CH2 3.6Å; Y29-W92 HydrophobicContact CD2-CH2 3.6Å; Y29-W92 AromaticContact CD2-CZ3 3.6Å; Y29-W92 HydrophobicContact CD2-CZ3 3.6Å; Y29-W92 AromaticContact CE2-CH2 3.74Å; Y29-W92 HydrophobicContact CE2-CH2 3.74Å; Y29-W92 HydrophobicContact CE2-CZ3 4.17Å; Y29-W92 HydrophobicContact CG-CH2 4.14Å; Y29-W92 HydrophobicContact CG-CZ3 4.12Å; L41-W92 HydrophobicContact CB-CE3 4.27Å; L41-W92 HydrophobicContact CB-CZ3 4.41Å; L41-W92 HydrophobicContact CD2-CE3 4.17Å; I42-W92 CarbonylContact O-C 3.6Å; I42-W92 WeakPolarHBondContact O-CA 3.31Å; R43-W92 HydrophobicContact CB-CD2 4.11Å; R43-W92 HydrophobicContact CB-CE3 4.1Å; R43-W92 HydrophobicContact CB-CH2 4.26Å; R43-W92 HydrophobicContact CB-CZ2 4.27Å; R43-W92 HydrophobicContact CB-CZ3 4.17Å; R43-W92 VanDerWaalsContact CD-CZ2 3.41Å; R43-W92 HydrophobicContact CG-CD2 4.13Å; R43-W92 HydrophobicContact CG-CH2 4.43Å; R43-W92 HydrophobicContact CG-CZ2 3.96Å; I58-W92 PolarHBondContact O-N 3.2Å; F59-W92 CarbonylContact C-O 3.44Å; F59-W92 WeakPolarHBondContact CA-O 3.37Å; F59-W92 HydrophobicContact CD2-CB 3.74Å; F59-W92 HydrophobicContact CE2-CB 4.25Å; F59-W92 HydrophobicContact CG-CB 4.48Å; L60-W92 PolarHBondContact N-O 3.1Å; D90-W92 PolarHBondContact OD2-NE1 3.03Å; W92-A135 HydrophobicContact CB-CB 4.22Å; W92-A135 HydrophobicContact CD2-CB 3.58Å; W92-A135 HydrophobicContact CE3-CB 3.87Å; W92-A135 HydrophobicContact CG-CB 3.74Å; W92-A135 HydrophobicContact CZ3-CB 4.48Å; W92-V138 HydrophobicContact CH2-CB 3.59Å; W92-V138 HydrophobicContact CH2-CG1 3.67Å; W92-V138 HydrophobicContact CH2-CG2 4.1Å; W92-V138 HydrophobicContact CZ2-CB 3.75Å; W92-V138 HydrophobicContact CZ2-CG1 3.77Å
93	M	97.9	Very high	93.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	118.3	179.6	-52.9	-177.5	-68.7	0	0	109.2	I19 L41 I42 I44 L60 C68 W71 I72 V91	I19-M93 HydrophobicContact CD1-CE 4.03Å; L41-M93 WeakPolarHBondContact CA-O 3.29Å; I42-M93 HydrophobicContact CB-CE 3.74Å; I42-M93 HydrophobicContact CG2-CE 3.47Å; I42-M93 VanDerWaalsContact CG2-CE 3.47Å; I42-M93 PolarHBondContact N-O 2.94Å; I42-M93 PolarHBondContact O-N 2.97Å; I44-M93 HydrophobicContact CD1-CE 3.78Å; I44-M93 HydrophobicContact CD1-SD 4.46Å; I44-M93 HydrophobicContact CG1-CE 4.1Å; L60-M93 HydrophobicContact CB-CG 4.24Å; L60-M93 HydrophobicContact CD1-CG 4.12Å; L60-M93 HydrophobicContact CD1-SD 4.47Å; L60-M93 HydrophobicContact CG-CG 4.46Å; L60-M93 WeakPolarHBondContact O-CA 3.34Å; C68-M93 HydrophobicContact CB-CB 3.63Å; W71-M93 HydrophobicContact CB-SD 3.67Å; W71-M93 HydrophobicContact CG-SD 4.35Å; I72-M93 HydrophobicContact CG2-CE 3.95Å; I72-M93 HydrophobicContact CG2-SD 3.89Å; V91-M93 HydrophobicContact CG1-CG 4.19Å
94	G	97	Very high	92.9	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	158.2	-177.7	0	0	0	0	0	113	L60 H62	L60-G94 PolarHBondContact O-N 3.4Å; H62-G94 PolarHBondContact CD2-O 3.25Å; H62-G94 VanDerWaalsContact CD2-O 3.31Å
95	N	94.5	Very high	92.9	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.064	C	C	.	.			trans	-132.8	130.8	170.1	-75.9	-61.6	0	0	0	109.3	T40 S67 C68 N99 Y101	T40-N95 WeakPolarHBondContact O-CB 3.49Å; T40-N95 PolarHBondContact O-ND2 3.07Å; S67-N95 WeakPolarHBondContact CA-OD1 3.32Å; S67-N95 WeakPolarHBondContact CB-OD1 3.24Å; C68-N95 PolarHBondContact N-OD1 3.33Å; C68-N95 PolarHBondContact SG-ND2 2.99Å; N95-N99 PolarHBondContact OD1-ND2 2.93Å; N95-Y101 WeakPolarHBondContact ND2-CB 3.44Å; N95-Y101 WeakPolarHBondContact ND2-CD2 3.26Å; N95-Y101 WeakPolarHBondContact OD1-CD2 3.48Å
96	F	93.5	Very high	92.9	Very high	1 Å²	1	21.7 Å²	21.7	0%	0.004	10%	0.097	C	C	.	.			trans	-80.2	156.2	174.5	-71.1	-46.2	0	0	0	112.2	Q61 H62 N99 M123 D127 L131 T155	Q61-F96 HydrophobicContact CG-CE1 4.26Å; Q61-F96 HydrophobicContact CG-CE2 3.65Å; Q61-F96 HydrophobicContact CG-CZ 3.43Å; Q61-F96 VanDerWaalsContact CG-CZ 3.43Å; Q61-F96 VanDerWaalsContact NE2-CE2 3.27Å; H62-F96 AromaticContact CE1-CD2 3.87Å; H62-F96 PolarHBondContact NE2-N 2.66Å; F96-N99 PolarHBondContact O-N 2.8Å; F96-N99 PolarHBondContact O-OD1 2.97Å; F96-M123 HydrophobicContact CB-CE 4.09Å; F96-M123 HydrophobicContact CB-CG 4.12Å; F96-M123 HydrophobicContact CB-SD 3.73Å; F96-M123 HydrophobicContact CD1-CB 3.84Å; F96-M123 HydrophobicContact CD1-CG 4.06Å; F96-M123 HydrophobicContact CD1-SD 4.25Å; F96-M123 HydrophobicContact CD2-SD 3.72Å; F96-M123 HydrophobicContact CE1-CB 4Å; F96-M123 HydrophobicContact CE2-SD 4.38Å; F96-M123 HydrophobicContact CG-CB 4.22Å; F96-M123 HydrophobicContact CG-CG 4.02Å; F96-M123 HydrophobicContact CG-SD 3.65Å; F96-M123 HydrophobicContact CZ-CB 4.47Å; F96-D127 HydrophobicContact CD1-CB 3.64Å; F96-D127 HydrophobicContact CE1-CB 4.01Å; F96-L131 HydrophobicContact CD1-CD1 4.21Å; F96-L131 HydrophobicContact CE1-CD1 4.18Å; F96-T155 HydrophobicContact CE2-CG2 4.22Å; F96-T155 HydrophobicContact CZ-CG2 3.95Å; F96-T155 WeakPolarHBondContact CZ-OG1 3.32Å
97	R	93.4	Very high	93	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	144.4	170.2	64.3	-176.7	63.2	-154.2	-8.7	111.1	D35 Y37 L39 N99 F118 M123 Y126 D127	D35-R97 IonicContact OD1-CZ 3.61Å; D35-R97 IonicContact OD1-NH1 3.42Å; D35-R97 IonicContact OD1-NH2 3.55Å; D35-R97 PolarHBondContact OD1-NH2 2.89Å; D35-R97 IonicContact OD2-CZ 3.48Å; D35-R97 IonicContact OD2-NH1 3.49Å; D35-R97 PolarHBondContact OD2-NH1 2.68Å; D35-R97 IonicContact OD2-NH2 2.65Å; D35-R97 PolarHBondContact OD2-NH2 3.02Å; Y37-R97 HydrophobicContact CD1-CB 3.65Å; Y37-R97 VanDerWaalsContact CD2-CZ 3.49Å; Y37-R97 VanDerWaalsContact CD2-NH1 3.29Å; Y37-R97 HydrophobicContact CE1-CB 4.13Å; Y37-R97 HydrophobicContact CG-CB 4Å; L39-R97 HydrophobicContact CD2-CB 4.02Å; R97-N99 VanDerWaalsContact C-N 3.34Å; R97-N99 PolarHBondContact O-N 3.18Å; R97-F118 HydrophobicContact CB-CE1 4.47Å; R97-F118 HydrophobicContact CB-CZ 4.42Å; R97-F118 VanDerWaalsContact CD-CD2 3.47Å; R97-F118 HydrophobicContact CG-CD1 4.12Å; R97-F118 HydrophobicContact CG-CD2 3.65Å; R97-F118 HydrophobicContact CG-CE1 4.07Å; R97-F118 HydrophobicContact CG-CE2 3.63Å; R97-F118 HydrophobicContact CG-CG 3.91Å; R97-F118 HydrophobicContact CG-CZ 3.83Å; R97-M123 HydrophobicContact CG-CE 4.18Å; R97-M123 HydrophobicContact CG-CG 4.05Å; R97-Y126 VanDerWaalsContact NH2-CB 3.33Å; R97-D127 WeakPolarHBondContact CB-OD2 3.32Å; R97-D127 VanDerWaalsContact CG-OD2 3.28Å; R97-D127 WeakPolarHBondContact CG-OD2 3.44Å; R97-D127 IonicContact CZ-OD1 3.09Å; R97-D127 PolarHBondContact N-OD2 2.86Å; R97-D127 VanDerWaalsContact NE-CG 3.33Å; R97-D127 IonicContact NE-OD1 2.72Å; R97-D127 PolarHBondContact NE-OD1 3.42Å; R97-D127 IonicContact NE-OD2 3.32Å; R97-D127 PolarHBondContact NE-OD2 2.9Å; R97-D127 IonicContact NH2-OD1 3.45Å; R97-D127 PolarHBondContact NH2-OD1 3.17Å
98	G	85.1	Confident	93	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	-35.7	179.1	0	0	0	0	0	115	G102 R103 H260	G98-G102 PolarHBondContact N-O 2.97Å; G98-R103 WeakPolarHBondContact O-CG 3.48Å; G98-R103 PolarHBondContact O-NE 2.66Å; G98-R103 PolarHBondContact O-NH2 2.9Å; G98-H260 CarbonylContact C-O 3.23Å; G98-H260 VanDerWaalsContact C-O 3.23Å
99	N	84.4	Confident	92.8	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.021	14%	0.141	C	C	.	.	S	Bend	trans	-67.4	172.7	178	87.6	7.1	0	0	0	111.8	H62 S66 N95 F96 R97 Y101 G102 R103	H62-N99 PolarHBondContact NE2-ND2 3.46Å; S66-N99 PolarHBondContact O-ND2 3.37Å; N95-N99 PolarHBondContact OD1-ND2 2.93Å; F96-N99 PolarHBondContact O-N 2.8Å; F96-N99 PolarHBondContact O-OD1 2.97Å; R97-N99 VanDerWaalsContact C-N 3.34Å; R97-N99 PolarHBondContact O-N 3.18Å; N99-Y101 PolarHBondContact O-N 2.97Å; N99-Y101 WeakPolarHBondContact OD1-CA 3.18Å; N99-Y101 WeakPolarHBondContact OD1-CB 3.45Å; N99-Y101 PolarHBondContact OD1-N 3.3Å; N99-G102 CarbonylContact O-C 3.58Å; N99-G102 PolarHBondContact O-N 2.73Å; N99-G102 PolarHBondContact OD1-N 3.29Å; N99-G102 VanDerWaalsContact OD1-N 3.13Å; N99-R103 WeakPolarHBondContact O-CG 3.46Å; N99-R103 PolarHBondContact O-N 3.38Å
100	I	79.1	Confident	92.2	Very high	27 Å²	27	33.4 Å²	33.4	14%	0.138	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.7	-176.1	58.4	172.8	0	0	0	114.7	T11 H260	T11-I100 HydrophobicContact CG2-CB 4.36Å; I100-H260 HydrophobicContact CG2-CB 4.34Å; I100-H260 WeakPolarHBondContact CG2-CD2 3.45Å; I100-H260 WeakPolarHBondContact CG2-NE2 3.46Å
101	Y	86.3	Confident	91.6	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.016	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	0.9	179.5	-53.8	-58.5	0	0	0	113.9	T11 Q15 T40 I69 N95 N99	T11-Y101 WeakPolarHBondContact O-CE1 3.31Å; Q15-Y101 VanDerWaalsContact CD-CZ 3.46Å; Q15-Y101 HydrophobicContact CG-CE1 4.32Å; Q15-Y101 PolarHBondContact OE1-OH 2.75Å; T40-Y101 PolarHBondContact N-O 3.09Å; I69-Y101 HydrophobicContact CD1-CE2 4.26Å; I69-Y101 WeakPolarHBondContact CD1-OH 3.42Å; I69-Y101 HydrophobicContact CG1-CE2 4.24Å; N95-Y101 WeakPolarHBondContact ND2-CB 3.44Å; N95-Y101 WeakPolarHBondContact ND2-CD2 3.26Å; N95-Y101 WeakPolarHBondContact OD1-CD2 3.48Å; N99-Y101 PolarHBondContact O-N 2.97Å; N99-Y101 WeakPolarHBondContact OD1-CA 3.18Å; N99-Y101 WeakPolarHBondContact OD1-CB 3.45Å; N99-Y101 PolarHBondContact OD1-N 3.3Å
102	G	89.6	Confident	90.9	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-128	26.8	-178.5	0	0	0	0	0	112.9	G98 N99	G98-G102 PolarHBondContact N-O 2.97Å; N99-G102 CarbonylContact O-C 3.58Å; N99-G102 PolarHBondContact O-N 2.73Å; N99-G102 PolarHBondContact OD1-N 3.29Å; N99-G102 VanDerWaalsContact OD1-N 3.13Å
103	R	87.7	Confident	90.1	Very high	53 Å²	53	47 Å²	47	20%	0.2	22%	0.222	C	C	.	.			trans	-94.6	17.7	-176.3	-88.4	172.4	-170.9	-138.6	-8.7	115.3	G98 N99 P110 W116 H260	G98-R103 WeakPolarHBondContact O-CG 3.48Å; G98-R103 PolarHBondContact O-NE 2.66Å; G98-R103 PolarHBondContact O-NH2 2.9Å; N99-R103 WeakPolarHBondContact O-CG 3.46Å; N99-R103 PolarHBondContact O-N 3.38Å; R103-P110 HydrophobicContact CB-CG 4.28Å; R103-P110 WeakPolarHBondContact O-CG 3.44Å; R103-W116 HydrophobicContact CG-CH2 4.4Å; R103-H260 VanDerWaalsContact NH2-CA 3.26Å; R103-H260 PolarHBondContact NH2-CD2 3.01Å; R103-H260 PolarHBondContact NH2-O 2.66Å
104	R	93.4	Very high	89.6	Confident	70 Å²	70	52.3 Å²	52.3	26%	0.264	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	146.5	-179.7	-69.1	-179.6	-64	125.7	1.8	109.7	D30 Y37 I38 T40	D30-R104 IonicContact OD1-CZ 3.84Å; D30-R104 IonicContact OD1-NH2 2.75Å; D30-R104 PolarHBondContact OD1-NH2 3.08Å; D30-R104 IonicContact OD2-CZ 3.25Å; D30-R104 VanDerWaalsContact OD2-CZ 3.25Å; D30-R104 IonicContact OD2-NH1 2.75Å; D30-R104 PolarHBondContact OD2-NH1 3.46Å; D30-R104 IonicContact OD2-NH2 2.87Å; D30-R104 PolarHBondContact OD2-NH2 3.26Å; Y37-R104 WeakPolarHBondContact CA-O 3.17Å; I38-R104 HydrophobicContact CB-CB 3.9Å; I38-R104 HydrophobicContact CD1-CB 4.29Å; I38-R104 HydrophobicContact CG1-CB 4.38Å; I38-R104 VanDerWaalsContact CG2-NH1 3.34Å; I38-R104 PolarHBondContact N-O 2.95Å; T40-R104 PolarHBondContact OG1-NH2 3.4Å
105	H	96.8	Very high	89.1	Confident	28 Å²	28	52.3 Å²	52.3	13%	0.13	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.3	175.4	-161.1	-84.6	0	0	0	109.3	D35 G36 Y37 T107 L108 F115	D35-H105 PolarHBondContact O-CE1 3Å; D35-H105 VanDerWaalsContact O-CE1 3.23Å; D35-H105 PolarHBondContact O-NE2 2.92Å; G36-H105 VanDerWaalsContact C-CD2 3.42Å; G36-H105 CarbonylContact O-C 3.55Å; G36-H105 VanDerWaalsContact O-CA 3.32Å; G36-H105 WeakPolarHBondContact O-CA 3.1Å; Y37-H105 AromaticContact CD1-CD2 3.9Å; Y37-H105 AromaticContact CD2-CD2 3.56Å; Y37-H105 AromaticContact CD2-NE2 3.77Å; Y37-H105 AromaticContact CE1-CD2 3.99Å; Y37-H105 AromaticContact CE2-CD2 3.62Å; Y37-H105 AromaticContact CE2-NE2 3.69Å; Y37-H105 AromaticContact CG-CD2 3.69Å; Y37-H105 AromaticContact CZ-CD2 3.84Å; Y37-H105 PolarHBondContact N-CD2 2.99Å; H105-T107 PolarHBondContact CE1-OG1 2.72Å; H105-T107 PolarHBondContact ND1-N 2.84Å; H105-T107 PolarHBondContact ND1-OG1 3.49Å; H105-T107 VanDerWaalsContact ND1-OG1 3.14Å; H105-T107 PolarHBondContact O-N 3.38Å; H105-L108 HydrophobicContact CB-CB 4Å; H105-L108 WeakPolarHBondContact CB-O 3.42Å; H105-L108 PolarHBondContact ND1-N 3.31Å; H105-F115 HydrophobicContact CB-CD2 4.07Å; H105-F115 HydrophobicContact CB-CE2 3.96Å
106	R	97.3	Very high	88.6	Confident	180 Å²	180	52.6 Å²	52.6	68%	0.679	25%	0.248	S	C	*	.	S	Bend	trans	-62.7	-21.7	176.4	-71.4	-173.9	178.6	-148.1	1.7	114.6	V32 G36	V32-R106 HydrophobicContact CG1-CG 4.17Å; G36-R106 PolarHBondContact O-N 3.43Å
107	T	97.2	Very high	88.2	Confident	112 Å²	112	61.3 Å²	61.3	69%	0.687	28%	0.281	S	S	*	.	S	Bend	trans	-146	-43.6	-165.9	50.8	0	0	0	0	112.5	H105	H105-T107 PolarHBondContact CE1-OG1 2.72Å; H105-T107 PolarHBondContact ND1-N 2.84Å; H105-T107 PolarHBondContact ND1-OG1 3.49Å; H105-T107 VanDerWaalsContact ND1-OG1 3.14Å; H105-T107 PolarHBondContact O-N 3.38Å
108	L	94.2	Very high	87.7	Confident	48 Å²	48	61.3 Å²	61.3	25%	0.251	28%	0.281	S	S	.	.			trans	-80.3	154.6	178.5	-54.7	175.7	0	0	0	111.3	H105 E114 F115	H105-L108 HydrophobicContact CB-CB 4Å; H105-L108 WeakPolarHBondContact CB-O 3.42Å; H105-L108 PolarHBondContact ND1-N 3.31Å; L108-E114 HydrophobicContact CD1-CB 4.18Å; L108-E114 HydrophobicContact CD2-CB 4.03Å; L108-F115 HydrophobicContact CB-CB 4.16Å; L108-F115 HydrophobicContact CB-CD2 4.08Å
109	K	91.2	Very high	87.6	Confident	129 Å²	129	61.9 Å²	61.9	56%	0.561	29%	0.285	S	S	*	.			trans	-114.8	156.4	171.7	-55.2	178.1	179.3	174.1	0	110.5	E111 D112 F115	K109-E111 WeakPolarHBondContact CB-OE2 3.3Å; K109-E111 PolarHBondContact O-N 3.43Å; K109-D112 PolarHBondContact N-OD2 3.38Å; K109-D112 WeakPolarHBondContact O-CB 3.33Å; K109-D112 PolarHBondContact O-N 2.83Å; K109-F115 WeakPolarHBondContact O-CB 3.04Å
110	P	84.2	Confident	87.6	Confident	42 Å²	42	62.6 Å²	62.6	27%	0.273	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.5	174.7	-28.4	37.8	0	0	0	114.9	R103 D112 W116	R103-P110 HydrophobicContact CB-CG 4.28Å; R103-P110 WeakPolarHBondContact O-CG 3.44Å; P110-D112 VanDerWaalsContact C-N 3.34Å; P110-W116 HydrophobicContact CB-CZ2 4.41Å; P110-W116 PolarHBondContact O-NE1 2.85Å
111	E	83.6	Confident	87.9	Confident	147 Å²	147	64.7 Å²	64.7	69%	0.687	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-17.5	173.8	-58.4	76.5	-152.2	0	0	113.5	K109	K109-E111 WeakPolarHBondContact CB-OE2 3.3Å; K109-E111 PolarHBondContact O-N 3.43Å
112	D	84.8	Confident	88.1	Confident	58 Å²	58	67.1 Å²	67.1	31%	0.31	31%	0.31	S	S	.	.	S	Bend	trans	-81.6	134.9	-179	-58.7	-38.2	0	0	0	110.7	K109 P110 E114 F115	K109-D112 PolarHBondContact N-OD2 3.38Å; K109-D112 WeakPolarHBondContact O-CB 3.33Å; K109-D112 PolarHBondContact O-N 2.83Å; P110-D112 VanDerWaalsContact C-N 3.34Å; D112-E114 PolarHBondContact O-N 3.34Å; D112-F115 HydrophobicContact CB-CB 4.44Å; D112-F115 VanDerWaalsContact O-CB 3.26Å; D112-F115 WeakPolarHBondContact O-CB 3.49Å; D112-F115 PolarHBondContact O-N 2.64Å; D112-F115 VanDerWaalsContact O-N 3.11Å
113	N	81.8	Confident	88.3	Confident	84 Å²	84	67.1 Å²	67.1	45%	0.449	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-62.9	-32.2	177.1	-75.6	-33.8	0	0	0	112	F115 W116	N113-F115 PolarHBondContact O-N 2.97Å; N113-W116 CarbonylContact O-C 3.56Å; N113-W116 PolarHBondContact O-N 3.37Å
114	E	86.4	Confident	88.6	Confident	111 Å²	111	64.8 Å²	64.8	52%	0.519	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-62.4	-30.9	176.9	-70.6	71.6	-163.7	0	0	112.1	L108 D112 W116 R117	L108-E114 HydrophobicContact CD1-CB 4.18Å; L108-E114 HydrophobicContact CD2-CB 4.03Å; D112-E114 PolarHBondContact O-N 3.34Å; E114-W116 PolarHBondContact O-N 2.97Å; E114-R117 WeakPolarHBondContact O-CB 3.35Å; E114-R117 PolarHBondContact O-N 3.42Å
115	F	87.3	Confident	88.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-63	-28.7	174	-177.9	-81.7	0	0	0	111.6	Y37 H105 L108 K109 D112 N113 F118	Y37-F115 HydrophobicContact CD1-CE2 4.04Å; Y37-F115 HydrophobicContact CD1-CZ 4.01Å; Y37-F115 HydrophobicContact CE1-CD2 4.15Å; Y37-F115 HydrophobicContact CE1-CE1 4.18Å; Y37-F115 AromaticContact CE1-CE2 3.78Å; Y37-F115 HydrophobicContact CE1-CE2 3.78Å; Y37-F115 HydrophobicContact CE1-CG 4.46Å; Y37-F115 AromaticContact CE1-CZ 3.74Å; Y37-F115 HydrophobicContact CE1-CZ 3.74Å; Y37-F115 PolarHBondContact OH-O 3.2Å; H105-F115 HydrophobicContact CB-CD2 4.07Å; H105-F115 HydrophobicContact CB-CE2 3.96Å; L108-F115 HydrophobicContact CB-CB 4.16Å; L108-F115 HydrophobicContact CB-CD2 4.08Å; K109-F115 WeakPolarHBondContact O-CB 3.04Å; D112-F115 HydrophobicContact CB-CB 4.44Å; D112-F115 VanDerWaalsContact O-CB 3.26Å; D112-F115 WeakPolarHBondContact O-CB 3.49Å; D112-F115 PolarHBondContact O-N 2.64Å; D112-F115 VanDerWaalsContact O-N 3.11Å; N113-F115 PolarHBondContact O-N 2.97Å; F115-F118 VanDerWaalsContact O-CD1 3.32Å; F115-F118 WeakPolarHBondContact O-CD1 3.29Å; F115-F118 VanDerWaalsContact O-CE1 3.3Å; F115-F118 WeakPolarHBondContact O-CE1 3.24Å
116	W	83.8	Confident	88.7	Confident	7 Å²	7	68 Å²	68	3%	0.027	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-101.4	28.1	179.6	-56.5	99.3	0	0	0	111.4	R103 P110 N113 E114 F118 Q205 C262 Q264	R103-W116 HydrophobicContact CG-CH2 4.4Å; P110-W116 HydrophobicContact CB-CZ2 4.41Å; P110-W116 PolarHBondContact O-NE1 2.85Å; N113-W116 CarbonylContact O-C 3.56Å; N113-W116 PolarHBondContact O-N 3.37Å; E114-W116 PolarHBondContact O-N 2.97Å; W116-F118 HydrophobicContact CE3-CE1 4.07Å; W116-F118 HydrophobicContact CE3-CZ 4.09Å; W116-F118 HydrophobicContact CZ3-CZ 4.34Å; W116-Q205 HydrophobicContact CD2-CB 4.45Å; W116-Q205 HydrophobicContact CH2-CB 4.18Å; W116-Q205 HydrophobicContact CH2-CG 4.13Å; W116-Q205 HydrophobicContact CZ2-CB 3.94Å; W116-Q205 HydrophobicContact CZ2-CG 4.29Å; W116-C262 VanDerWaalsContact C-SG 3.59Å; W116-C262 HydrophobicContact CB-CB 4.48Å; W116-C262 HydrophobicContact CE3-CB 3.82Å; W116-C262 PolarHBondContact O-SG 3.07Å; W116-Q264 PolarHBondContact O-NE2 3.28Å
117	R	85.7	Confident	88.8	Confident	184 Å²	184	59.4 Å²	59.4	69%	0.694	28%	0.284	S	S	*	.			trans	-105.1	61	177.4	-158.6	-178.2	67.6	174.5	0	111.3	E114	E114-R117 WeakPolarHBondContact O-CB 3.35Å; E114-R117 PolarHBondContact O-N 3.42Å
118	F	82.7	Confident	88.8	Confident	0 Å²	0	54 Å²	54	0%	0	25%	0.252	C	S	.	.			trans	-142.1	160.1	175.9	65.5	-101.8	0	0	0	110.5	Y37 R97 F115 W116 E122 M123 C262 Q264	Y37-F118 HydrophobicContact CE1-CD1 4.07Å; Y37-F118 HydrophobicContact CE1-CE1 4.13Å; Y37-F118 AromaticContact CZ-CD1 3.91Å; Y37-F118 WeakPolarHBondContact OH-CD1 3.21Å; R97-F118 HydrophobicContact CB-CE1 4.47Å; R97-F118 HydrophobicContact CB-CZ 4.42Å; R97-F118 VanDerWaalsContact CD-CD2 3.47Å; R97-F118 HydrophobicContact CG-CD1 4.12Å; R97-F118 HydrophobicContact CG-CD2 3.65Å; R97-F118 HydrophobicContact CG-CE1 4.07Å; R97-F118 HydrophobicContact CG-CE2 3.63Å; R97-F118 HydrophobicContact CG-CG 3.91Å; R97-F118 HydrophobicContact CG-CZ 3.83Å; F115-F118 VanDerWaalsContact O-CD1 3.32Å; F115-F118 WeakPolarHBondContact O-CD1 3.29Å; F115-F118 VanDerWaalsContact O-CE1 3.3Å; F115-F118 WeakPolarHBondContact O-CE1 3.24Å; W116-F118 HydrophobicContact CE3-CE1 4.07Å; W116-F118 HydrophobicContact CE3-CZ 4.09Å; W116-F118 HydrophobicContact CZ3-CZ 4.34Å; F118-E122 WeakPolarHBondContact CA-OE2 3.44Å; F118-E122 HydrophobicContact CB-CB 3.98Å; F118-E122 HydrophobicContact CB-CG 4.1Å; F118-M123 HydrophobicContact CD2-CE 4.02Å; F118-M123 HydrophobicContact CE2-CE 3.65Å; F118-C262 HydrophobicContact CD1-CB 4.41Å; F118-C262 HydrophobicContact CD2-CB 4Å; F118-C262 HydrophobicContact CE1-CB 3.9Å; F118-C262 HydrophobicContact CE2-CB 3.39Å; F118-C262 HydrophobicContact CG-CB 4.46Å; F118-C262 HydrophobicContact CZ-CB 3.35Å; F118-Q264 WeakPolarHBondContact O-CB 3.45Å
119	T	81.9	Confident	89	Confident	12 Å²	12	52.4 Å²	52.4	7%	0.074	24%	0.244	C	C	.	.			trans	-129.5	-170.5	169.4	71.4	0	0	0	0	110.3	D121 E122 M123 Q264 D265	T119-D121 PolarHBondContact O-N 3.48Å; T119-D121 VanDerWaalsContact O-N 3.16Å; T119-D121 WeakPolarHBondContact OG1-CB 3.09Å; T119-D121 PolarHBondContact OG1-N 2.87Å; T119-D121 VanDerWaalsContact OG1-N 3.1Å; T119-D121 PolarHBondContact OG1-OD2 2.87Å; T119-E122 PolarHBondContact N-OE2 3.33Å; T119-E122 PolarHBondContact O-N 3.43Å; T119-E122 PolarHBondContact OG1-OE2 3.31Å; T119-M123 PolarHBondContact O-N 2.74Å; T119-Q264 HydrophobicContact CG2-CB 3.75Å; T119-Q264 WeakPolarHBondContact CG2-O 3.29Å; T119-D265 WeakPolarHBondContact CA-OD1 3.15Å
120	W	84.4	Confident	89.3	Confident	19 Å²	19	46.9 Å²	46.9	7%	0.072	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-21.6	169.6	68.8	-109	0	0	0	112.9	M123 A124 Q151 L154 T155 A158 D265 S268	W120-M123 WeakPolarHBondContact O-CB 3.37Å; W120-M123 PolarHBondContact O-N 2.65Å; W120-A124 PolarHBondContact O-N 3.11Å; W120-Q151 HydrophobicContact CB-CG 4.35Å; W120-L154 HydrophobicContact CD2-CD2 3.74Å; W120-L154 HydrophobicContact CD2-CG 4.07Å; W120-L154 HydrophobicContact CE3-CD2 4.33Å; W120-L154 HydrophobicContact CE3-CG 4.15Å; W120-L154 HydrophobicContact CG-CD2 3.81Å; W120-L154 HydrophobicContact CG-CG 4.5Å; W120-L154 HydrophobicContact CZ2-CD2 4.45Å; W120-T155 HydrophobicContact CB-CG2 4.21Å; W120-A158 HydrophobicContact CE3-CB 4.42Å; W120-A158 HydrophobicContact CZ3-CB 3.72Å; W120-D265 PolarHBondContact N-OD1 3.35Å; W120-D265 VanDerWaalsContact N-OD1 3.07Å; W120-S268 VanDerWaalsContact CZ2-OG 3.27Å; W120-S268 WeakPolarHBondContact CZ2-OG 3.33Å; W120-S268 PolarHBondContact NE1-O 2.87Å; W120-S268 PolarHBondContact NE1-OG 2.92Å
121	D	85.1	Confident	90	Very high	70 Å²	70	44.9 Å²	44.9	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-48.7	175.7	-71.3	-54.3	0	0	0	111	T119 M123 A124 K125 S268	T119-D121 PolarHBondContact O-N 3.48Å; T119-D121 VanDerWaalsContact O-N 3.16Å; T119-D121 WeakPolarHBondContact OG1-CB 3.09Å; T119-D121 PolarHBondContact OG1-N 2.87Å; T119-D121 VanDerWaalsContact OG1-N 3.1Å; T119-D121 PolarHBondContact OG1-OD2 2.87Å; D121-M123 VanDerWaalsContact C-N 3.32Å; D121-M123 PolarHBondContact O-N 3.47Å; D121-A124 PolarHBondContact O-N 2.77Å; D121-K125 VanDerWaalsContact O-CB 3.23Å; D121-K125 WeakPolarHBondContact O-CB 3.28Å; D121-K125 PolarHBondContact O-N 3.39Å; D121-S268 PolarHBondContact OD2-OG 2.85Å
122	E	92.1	Very high	90.7	Very high	55 Å²	55	37.9 Å²	37.9	26%	0.257	18%	0.177	S	C	.	.	H	α-helix	trans	-66.4	-34.2	174.9	-75.3	68.5	-138	0	0	112.1	F118 T119 K125 Y126 D127	F118-E122 WeakPolarHBondContact CA-OE2 3.44Å; F118-E122 HydrophobicContact CB-CB 3.98Å; F118-E122 HydrophobicContact CB-CG 4.1Å; T119-E122 PolarHBondContact N-OE2 3.33Å; T119-E122 PolarHBondContact O-N 3.43Å; T119-E122 PolarHBondContact OG1-OE2 3.31Å; E122-K125 PolarHBondContact O-N 3.45Å; E122-Y126 HydrophobicContact CB-CD2 4.11Å; E122-Y126 HydrophobicContact CG-CD2 4.18Å; E122-Y126 HydrophobicContact CG-CE2 4.24Å; E122-Y126 WeakPolarHBondContact O-CB 3.28Å; E122-Y126 PolarHBondContact O-N 3.23Å; E122-D127 PolarHBondContact O-N 2.73Å
123	M	93.7	Very high	91.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.178	C	C	.	.	I	π-helix	trans	-62.4	-44	173.9	-62.2	176.6	-173.3	0	0	111.5	F96 R97 F118 T119 W120 D121 D127 L128 Q151 T155 L261 D265	F96-M123 HydrophobicContact CB-CE 4.09Å; F96-M123 HydrophobicContact CB-CG 4.12Å; F96-M123 HydrophobicContact CB-SD 3.73Å; F96-M123 HydrophobicContact CD1-CB 3.84Å; F96-M123 HydrophobicContact CD1-CG 4.06Å; F96-M123 HydrophobicContact CD1-SD 4.25Å; F96-M123 HydrophobicContact CD2-SD 3.72Å; F96-M123 HydrophobicContact CE1-CB 4Å; F96-M123 HydrophobicContact CE2-SD 4.38Å; F96-M123 HydrophobicContact CG-CB 4.22Å; F96-M123 HydrophobicContact CG-CG 4.02Å; F96-M123 HydrophobicContact CG-SD 3.65Å; F96-M123 HydrophobicContact CZ-CB 4.47Å; R97-M123 HydrophobicContact CG-CE 4.18Å; R97-M123 HydrophobicContact CG-CG 4.05Å; F118-M123 HydrophobicContact CD2-CE 4.02Å; F118-M123 HydrophobicContact CE2-CE 3.65Å; T119-M123 PolarHBondContact O-N 2.74Å; W120-M123 WeakPolarHBondContact O-CB 3.37Å; W120-M123 PolarHBondContact O-N 2.65Å; D121-M123 VanDerWaalsContact C-N 3.32Å; D121-M123 PolarHBondContact O-N 3.47Å; M123-D127 HydrophobicContact CB-CB 4.45Å; M123-D127 WeakPolarHBondContact O-CB 3Å; M123-D127 PolarHBondContact O-N 3.49Å; M123-L128 PolarHBondContact O-N 3.19Å; M123-Q151 PolarHBondContact SD-NE2 2.64Å; M123-T155 HydrophobicContact CB-CG2 3.86Å; M123-L261 HydrophobicContact CE-CD2 3.97Å; M123-D265 WeakPolarHBondContact CE-OD1 3.09Å; M123-D265 VanDerWaalsContact CE-OD2 3.29Å; M123-D265 WeakPolarHBondContact CE-OD2 3.04Å
124	A	92.8	Very high	92.2	Very high	5 Å²	5	35.9 Å²	35.9	4%	0.041	16%	0.164	C	C	.	.	I	π-helix	trans	-66.2	-42.4	175.8	0	0	0	0	0	111.7	W120 D121 P129 T155 A158 K159	W120-A124 PolarHBondContact O-N 3.11Å; D121-A124 PolarHBondContact O-N 2.77Å; A124-P129 WeakPolarHBondContact O-CD 3.19Å; A124-T155 HydrophobicContact CB-CG2 4.34Å; A124-T155 WeakPolarHBondContact CB-O 3.2Å; A124-A158 HydrophobicContact CB-CB 3.84Å; A124-K159 WeakPolarHBondContact O-CD 3.47Å
125	K	94.9	Very high	92.8	Very high	119 Å²	119	30.6 Å²	30.6	52%	0.517	14%	0.139	S	C	.	.	I	π-helix	trans	-74.1	-40.9	-174.3	-172.6	177.9	179.5	-167.5	0	113.3	D121 E122 P129	D121-K125 VanDerWaalsContact O-CB 3.23Å; D121-K125 WeakPolarHBondContact O-CB 3.28Å; D121-K125 PolarHBondContact O-N 3.39Å; E122-K125 PolarHBondContact O-N 3.45Å; K125-P129 WeakPolarHBondContact O-CG 3.34Å
126	Y	97.9	Very high	93.3	Very high	45 Å²	45	31.4 Å²	31.4	18%	0.176	14%	0.143	C	C	.	.	I	π-helix	trans	-120.2	-46	-168.1	-61.2	-58.9	0	0	0	113.5	E34 D35 R97 E122 A130	E34-Y126 HydrophobicContact CB-CD1 3.88Å; E34-Y126 HydrophobicContact CB-CE1 4.09Å; E34-Y126 HydrophobicContact CG-CD1 4.41Å; D35-Y126 HydrophobicContact CB-CD2 4.32Å; D35-Y126 HydrophobicContact CB-CE2 4.28Å; R97-Y126 VanDerWaalsContact NH2-CB 3.33Å; E122-Y126 HydrophobicContact CB-CD2 4.11Å; E122-Y126 HydrophobicContact CG-CD2 4.18Å; E122-Y126 HydrophobicContact CG-CE2 4.24Å; E122-Y126 WeakPolarHBondContact O-CB 3.28Å; E122-Y126 PolarHBondContact O-N 3.23Å; Y126-A130 WeakPolarHBondContact O-CB 3.27Å; Y126-A130 PolarHBondContact O-N 2.98Å; Y126-A130 VanDerWaalsContact O-N 3.16Å
127	D	98.2	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.17	C	C	.	.	I	π-helix	trans	-67.4	-53.8	-176.9	-65.8	6	0	0	0	110.7	T33 L39 F96 R97 E122 M123 A130 L131	T33-D127 WeakPolarHBondContact CG2-OD1 3.4Å; L39-D127 HydrophobicContact CD1-CB 3.65Å; L39-D127 VanDerWaalsContact CD1-CG 3.46Å; F96-D127 HydrophobicContact CD1-CB 3.64Å; F96-D127 HydrophobicContact CE1-CB 4.01Å; R97-D127 WeakPolarHBondContact CB-OD2 3.32Å; R97-D127 VanDerWaalsContact CG-OD2 3.28Å; R97-D127 WeakPolarHBondContact CG-OD2 3.44Å; R97-D127 IonicContact CZ-OD1 3.09Å; R97-D127 PolarHBondContact N-OD2 2.86Å; R97-D127 VanDerWaalsContact NE-CG 3.33Å; R97-D127 IonicContact NE-OD1 2.72Å; R97-D127 PolarHBondContact NE-OD1 3.42Å; R97-D127 IonicContact NE-OD2 3.32Å; R97-D127 PolarHBondContact NE-OD2 2.9Å; R97-D127 IonicContact NH2-OD1 3.45Å; R97-D127 PolarHBondContact NH2-OD1 3.17Å; E122-D127 PolarHBondContact O-N 2.73Å; M123-D127 HydrophobicContact CB-CB 4.45Å; M123-D127 WeakPolarHBondContact O-CB 3Å; M123-D127 PolarHBondContact O-N 3.49Å; D127-A130 PolarHBondContact O-N 2.58Å; D127-L131 HydrophobicContact CB-CD1 4.16Å; D127-L131 WeakPolarHBondContact O-CB 3.44Å; D127-L131 WeakPolarHBondContact O-CG 3.49Å; D127-L131 PolarHBondContact O-N 2.84Å
128	L	97.4	Very high	94.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-44.2	-174.8	-174.5	65.9	0	0	0	112	M123 L131 I132 Y146 A156 K159 F160 F166	M123-L128 PolarHBondContact O-N 3.19Å; L128-L131 PolarHBondContact O-N 3.01Å; L128-I132 HydrophobicContact CD1-CD1 3.67Å; L128-I132 HydrophobicContact CD1-CG1 4.12Å; L128-I132 HydrophobicContact CG-CD1 3.94Å; L128-I132 WeakPolarHBondContact O-CB 3.4Å; L128-I132 PolarHBondContact O-N 2.78Å; L128-Y146 HydrophobicContact CD1-CE2 3.51Å; L128-Y146 WeakPolarHBondContact CD1-OH 3.46Å; L128-A156 HydrophobicContact CD2-CB 4.36Å; L128-K159 HydrophobicContact CD2-CB 3.75Å; L128-K159 HydrophobicContact CD2-CG 4.14Å; L128-F160 HydrophobicContact CD2-CE1 4.25Å; L128-F160 HydrophobicContact CD2-CZ 4.3Å; L128-F166 HydrophobicContact CG-CE1 4.49Å
129	P	98.3	Very high	95.1	Very high	14 Å²	14	31.3 Å²	31.3	9%	0.091	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-47.7	169.1	-29.1	39.6	0	0	0	115.1	A124 K125 L131 N133 K159 F166	A124-P129 WeakPolarHBondContact O-CD 3.19Å; K125-P129 WeakPolarHBondContact O-CG 3.34Å; P129-L131 VanDerWaalsContact C-N 3.29Å; P129-L131 PolarHBondContact O-N 3Å; P129-N133 WeakPolarHBondContact O-CB 3.43Å; P129-N133 PolarHBondContact O-N 3.37Å; P129-N133 PolarHBondContact O-ND2 3.07Å; P129-N133 VanDerWaalsContact O-ND2 3.07Å; P129-K159 HydrophobicContact CG-CD 4Å; P129-F166 VanDerWaalsContact CA-CZ 3.45Å; P129-F166 HydrophobicContact CB-CD2 4.47Å; P129-F166 HydrophobicContact CB-CE2 3.85Å; P129-F166 HydrophobicContact CB-CZ 4.08Å; P129-F166 HydrophobicContact CG-CE1 4.47Å; P129-F166 HydrophobicContact CG-CE2 4.2Å; P129-F166 HydrophobicContact CG-CZ 4.12Å
130	A	98.7	Very high	95.8	Very high	13 Å²	13	39.8 Å²	39.8	11%	0.107	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-37.9	-178.8	0	0	0	0	0	112.1	T31 T33 Y126 D127 K134	T31-A130 HydrophobicContact CG2-CB 3.9Å; T31-A130 PolarHBondContact OG1-O 3.03Å; T33-A130 HydrophobicContact CG2-CB 3.95Å; Y126-A130 WeakPolarHBondContact O-CB 3.27Å; Y126-A130 PolarHBondContact O-N 2.98Å; Y126-A130 VanDerWaalsContact O-N 3.16Å; D127-A130 PolarHBondContact O-N 2.58Å; A130-K134 WeakPolarHBondContact O-CB 3.46Å; A130-K134 PolarHBondContact O-N 3.03Å
131	L	98.7	Very high	96.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-71.5	-53.4	-179.3	-67.4	169.1	0	0	0	111.9	T31 L39 L41 F59 F96 D127 L128 P129 K134 A135	T31-L131 HydrophobicContact CG2-CD2 4.08Å; L39-L131 HydrophobicContact CB-CD2 4.04Å; L39-L131 HydrophobicContact CD1-CD1 4.34Å; L39-L131 HydrophobicContact CD1-CD2 4.02Å; L39-L131 HydrophobicContact CD1-CG 4.05Å; L41-L131 HydrophobicContact CD1-CD2 3.58Å; L41-L131 HydrophobicContact CD2-CB 4.05Å; L41-L131 HydrophobicContact CD2-CD2 3.7Å; L41-L131 HydrophobicContact CD2-CG 4.5Å; L41-L131 WeakPolarHBondContact CD2-O 3.47Å; L41-L131 HydrophobicContact CG-CD2 3.45Å; L41-L131 VanDerWaalsContact CG-CD2 3.45Å; F59-L131 HydrophobicContact CE2-CB 4.19Å; F59-L131 HydrophobicContact CZ-CB 3.75Å; F59-L131 HydrophobicContact CZ-CD1 4.47Å; F96-L131 HydrophobicContact CD1-CD1 4.21Å; F96-L131 HydrophobicContact CE1-CD1 4.18Å; D127-L131 HydrophobicContact CB-CD1 4.16Å; D127-L131 WeakPolarHBondContact O-CB 3.44Å; D127-L131 WeakPolarHBondContact O-CG 3.49Å; D127-L131 PolarHBondContact O-N 2.84Å; L128-L131 PolarHBondContact O-N 3.01Å; P129-L131 VanDerWaalsContact C-N 3.29Å; P129-L131 PolarHBondContact O-N 3Å; L131-K134 PolarHBondContact O-N 2.88Å; L131-A135 PolarHBondContact O-N 2.79Å; L131-A135 VanDerWaalsContact O-N 3.08Å
132	I	98.6	Very high	96.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-44	-179.6	-72.9	176.9	0	0	0	110.7	L128 K134 A135 L136 L144 Y146 F160 F166 V170	L128-I132 HydrophobicContact CD1-CD1 3.67Å; L128-I132 HydrophobicContact CD1-CG1 4.12Å; L128-I132 HydrophobicContact CG-CD1 3.94Å; L128-I132 WeakPolarHBondContact O-CB 3.4Å; L128-I132 PolarHBondContact O-N 2.78Å; I132-K134 VanDerWaalsContact C-N 3.29Å; I132-K134 PolarHBondContact O-N 2.81Å; I132-A135 PolarHBondContact O-N 3.44Å; I132-L136 HydrophobicContact CG2-CD1 3.73Å; I132-L136 HydrophobicContact CG2-CG 4.3Å; I132-L136 WeakPolarHBondContact O-CG 3.41Å; I132-L136 PolarHBondContact O-N 3.41Å; I132-L144 HydrophobicContact CG1-CD2 4.48Å; I132-L144 HydrophobicContact CG2-CD2 4.02Å; I132-Y146 HydrophobicContact CD1-CD2 4.01Å; I132-Y146 HydrophobicContact CD1-CE2 4.18Å; I132-F160 HydrophobicContact CD1-CE1 4.38Å; I132-F160 HydrophobicContact CD1-CZ 4.3Å; I132-F166 HydrophobicContact CB-CZ 3.87Å; I132-F166 HydrophobicContact CD1-CE1 3.96Å; I132-F166 HydrophobicContact CD1-CZ 3.9Å; I132-F166 HydrophobicContact CG1-CZ 4.4Å; I132-F166 HydrophobicContact CG2-CE2 4.42Å; I132-F166 HydrophobicContact CG2-CZ 3.97Å; I132-V170 HydrophobicContact CD1-CG2 4.31Å
133	N	98.6	Very high	96.9	Very high	62 Å²	62	45.5 Å²	45.5	33%	0.332	22%	0.221	S	C	.	.	H	α-helix	trans	-61.2	-39.8	178.5	-72.4	-27.2	0	0	0	111.4	P129 L136 E137 K169	P129-N133 WeakPolarHBondContact O-CB 3.43Å; P129-N133 PolarHBondContact O-N 3.37Å; P129-N133 PolarHBondContact O-ND2 3.07Å; P129-N133 VanDerWaalsContact O-ND2 3.07Å; N133-L136 PolarHBondContact O-N 3.41Å; N133-E137 WeakPolarHBondContact O-CB 3.34Å; N133-E137 PolarHBondContact O-N 3.37Å; N133-K169 PolarHBondContact OD1-NZ 3.15Å
134	K	98.6	Very high	97.1	Very high	38 Å²	38	45.5 Å²	45.5	17%	0.165	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-44.1	176.1	-178	56.7	63.3	-159.7	0	111.7	D30 L41 A130 L131 I132 E137 V138	D30-K134 WeakPolarHBondContact O-CE 3.35Å; L41-K134 HydrophobicContact CD1-CB 4.48Å; L41-K134 HydrophobicContact CD1-CG 4.25Å; A130-K134 WeakPolarHBondContact O-CB 3.46Å; A130-K134 PolarHBondContact O-N 3.03Å; L131-K134 PolarHBondContact O-N 2.88Å; I132-K134 VanDerWaalsContact C-N 3.29Å; I132-K134 PolarHBondContact O-N 2.81Å; K134-E137 IonicContact NZ-OE1 2.68Å; K134-E137 PolarHBondContact NZ-OE1 3.42Å; K134-E137 IonicContact NZ-OE2 2.79Å; K134-E137 PolarHBondContact NZ-OE2 3.45Å; K134-E137 PolarHBondContact O-N 3.2Å; K134-V138 HydrophobicContact CD-CG2 3.84Å; K134-V138 WeakPolarHBondContact O-CG2 3.46Å; K134-V138 PolarHBondContact O-N 3.18Å; K134-V138 VanDerWaalsContact O-N 3.08Å
135	A	98.4	Very high	97.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-45.6	177.4	0	0	0	0	0	111.9	F59 W92 L131 I132 S139 L144	F59-A135 HydrophobicContact CD2-CB 3.96Å; F59-A135 HydrophobicContact CE2-CB 4.21Å; W92-A135 HydrophobicContact CB-CB 4.22Å; W92-A135 HydrophobicContact CD2-CB 3.58Å; W92-A135 HydrophobicContact CE3-CB 3.87Å; W92-A135 HydrophobicContact CG-CB 3.74Å; W92-A135 HydrophobicContact CZ3-CB 4.48Å; L131-A135 PolarHBondContact O-N 2.79Å; L131-A135 VanDerWaalsContact O-N 3.08Å; I132-A135 PolarHBondContact O-N 3.44Å; A135-S139 WeakPolarHBondContact O-CB 3.45Å; A135-S139 PolarHBondContact O-N 2.87Å; A135-S139 PolarHBondContact O-OG 3.12Å; A135-L144 HydrophobicContact CB-CD2 4.26Å
136	L	98.3	Very high	97.5	Very high	16 Å²	16	39.8 Å²	39.8	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-67.2	-42.7	178.2	-65.3	171.3	0	0	0	112.4	I132 N133 V138 S139 K140 A141 L144 K169	I132-L136 HydrophobicContact CG2-CD1 3.73Å; I132-L136 HydrophobicContact CG2-CG 4.3Å; I132-L136 WeakPolarHBondContact O-CG 3.41Å; I132-L136 PolarHBondContact O-N 3.41Å; N133-L136 PolarHBondContact O-N 3.41Å; L136-V138 PolarHBondContact O-N 2.94Å; L136-S139 PolarHBondContact O-OG 2.67Å; L136-K140 VanDerWaalsContact O-CA 3.28Å; L136-K140 WeakPolarHBondContact O-CA 3.14Å; L136-K140 PolarHBondContact O-N 3.4Å; L136-A141 HydrophobicContact CD2-CB 4.16Å; L136-A141 WeakPolarHBondContact CD2-O 3.41Å; L136-A141 PolarHBondContact O-N 3.3Å; L136-L144 HydrophobicContact CD2-CB 4.03Å; L136-L144 HydrophobicContact CD2-CD2 3.96Å; L136-L144 HydrophobicContact CD2-CG 4.07Å; L136-L144 HydrophobicContact CG-CD2 4.09Å; L136-K169 HydrophobicContact CD1-CB 3.85Å; L136-K169 HydrophobicContact CD1-CD 3.99Å; L136-K169 HydrophobicContact CD1-CG 4.17Å
137	E	98	Very high	97.5	Very high	126 Å²	126	37.9 Å²	37.9	59%	0.589	19%	0.188	S	C	*	.	H	α-helix	trans	-57.3	-49.9	177	-178.8	-162.4	152.6	0	0	111.5	N133 K134	N133-E137 WeakPolarHBondContact O-CB 3.34Å; N133-E137 PolarHBondContact O-N 3.37Å; K134-E137 IonicContact NZ-OE1 2.68Å; K134-E137 PolarHBondContact NZ-OE1 3.42Å; K134-E137 IonicContact NZ-OE2 2.79Å; K134-E137 PolarHBondContact NZ-OE2 3.45Å; K134-E137 PolarHBondContact O-N 3.2Å
138	V	97.2	Very high	97.5	Very high	39 Å²	39	37.9 Å²	37.9	24%	0.236	19%	0.188	C	C	.	.	H	α-helix	trans	-76.6	-38.1	-175.3	175.4	0	0	0	0	112	Y29 W92 K134 L136 K140	Y29-V138 HydrophobicContact CD1-CG1 4.49Å; Y29-V138 HydrophobicContact CD1-CG2 4.17Å; Y29-V138 HydrophobicContact CE1-CG1 3.8Å; Y29-V138 HydrophobicContact CE1-CG2 4.16Å; Y29-V138 HydrophobicContact CE2-CG1 4.27Å; W92-V138 HydrophobicContact CH2-CB 3.59Å; W92-V138 HydrophobicContact CH2-CG1 3.67Å; W92-V138 HydrophobicContact CH2-CG2 4.1Å; W92-V138 HydrophobicContact CZ2-CB 3.75Å; W92-V138 HydrophobicContact CZ2-CG1 3.77Å; K134-V138 HydrophobicContact CD-CG2 3.84Å; K134-V138 WeakPolarHBondContact O-CG2 3.46Å; K134-V138 PolarHBondContact O-N 3.18Å; K134-V138 VanDerWaalsContact O-N 3.08Å; L136-V138 PolarHBondContact O-N 2.94Å; V138-K140 VanDerWaalsContact C-N 3.29Å
139	S	95.6	Very high	97.4	Very high	25 Å²	25	38.1 Å²	38.1	18%	0.175	19%	0.189	C	C	.	.	H	α-helix	trans	-75.3	-20	176.9	63.5	0	0	0	0	113.1	D90 A135 L136 A141	D90-S139 WeakPolarHBondContact OD2-CB 3.41Å; A135-S139 WeakPolarHBondContact O-CB 3.45Å; A135-S139 PolarHBondContact O-N 2.87Å; A135-S139 PolarHBondContact O-OG 3.12Å; L136-S139 PolarHBondContact O-OG 2.67Å; S139-A141 PolarHBondContact O-N 3.11Å; S139-A141 PolarHBondContact OG-N 3.28Å
140	K	95.7	Very high	97.2	Very high	189 Å²	189	37.7 Å²	37.7	82%	0.822	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	18	-170.4	-51.7	177.6	179.4	179.9	0	113.7	L136 V138	L136-K140 VanDerWaalsContact O-CA 3.28Å; L136-K140 WeakPolarHBondContact O-CA 3.14Å; L136-K140 PolarHBondContact O-N 3.4Å; V138-K140 VanDerWaalsContact C-N 3.29Å
141	A	94.9	Very high	96.8	Very high	27 Å²	27	37.3 Å²	37.3	22%	0.223	18%	0.183	C	C	.	.			trans	-78.4	144	173.6	0	0	0	0	0	110.5	V57 L136 S139	V57-A141 HydrophobicContact CB-CB 4.38Å; V57-A141 HydrophobicContact CG2-CB 3.54Å; L136-A141 HydrophobicContact CD2-CB 4.16Å; L136-A141 WeakPolarHBondContact CD2-O 3.41Å; L136-A141 PolarHBondContact O-N 3.3Å; S139-A141 PolarHBondContact O-N 3.11Å; S139-A141 PolarHBondContact OG-N 3.28Å
142	E	94.5	Very high	96.6	Very high	159 Å²	159	37.3 Å²	37.3	74%	0.743	18%	0.183	S	C	*	.	S	Bend	trans	-74	-37.7	172.8	-170.8	-169.6	143.5	0	0	111.4
143	K	95.9	Very high	96.3	Very high	78 Å²	78	37.3 Å²	37.3	34%	0.339	18%	0.183	S	C	.	.			trans	-138.7	157.4	-177.4	-54.8	-173	-179.1	-160.9	0	111.1	E168 K169 R171	K143-E168 WeakPolarHBondContact CD-O 3.47Å; K143-E168 WeakPolarHBondContact CE-O 3.44Å; K143-E168 PolarHBondContact NZ-O 3.29Å; K143-K169 CarbonylContact C-O 3.56Å; K143-K169 WeakPolarHBondContact CA-O 3.36Å; K143-R171 HydrophobicContact CB-CB 4.27Å
144	L	97.7	Very high	95.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	165.1	174.4	61.3	74.7	0	0	0	112.4	V57 F59 I132 A135 L136 K169 V170 R171	V57-L144 HydrophobicContact CB-CB 3.92Å; V57-L144 HydrophobicContact CG1-CB 3.79Å; V57-L144 HydrophobicContact CG1-CD2 4.39Å; F59-L144 HydrophobicContact CB-CD1 3.78Å; F59-L144 HydrophobicContact CB-CD2 3.95Å; F59-L144 HydrophobicContact CB-CG 4.45Å; F59-L144 HydrophobicContact CD2-CD2 4.25Å; F59-L144 HydrophobicContact CG-CD2 4.41Å; I132-L144 HydrophobicContact CG1-CD2 4.48Å; I132-L144 HydrophobicContact CG2-CD2 4.02Å; A135-L144 HydrophobicContact CB-CD2 4.26Å; L136-L144 HydrophobicContact CD2-CB 4.03Å; L136-L144 HydrophobicContact CD2-CD2 3.96Å; L136-L144 HydrophobicContact CD2-CG 4.07Å; L136-L144 HydrophobicContact CG-CD2 4.09Å; L144-K169 PolarHBondContact N-O 3.36Å; L144-V170 HydrophobicContact CD1-CG2 4.24Å; L144-V170 CarbonylContact O-C 3.53Å; L144-V170 WeakPolarHBondContact O-CA 3.33Å; L144-R171 PolarHBondContact O-N 2.84Å
145	Y	98	Very high	95.4	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.7	166.9	-64.4	-84.8	0	0	0	109.1	P56 V57 I58 F59 R171 F174 I344 D347 Y348	P56-Y145 HydrophobicContact CB-CD2 4.05Å; P56-Y145 HydrophobicContact CB-CE2 3.84Å; V57-Y145 PolarHBondContact O-N 2.76Å; I58-Y145 CarbonylContact C-O 3.6Å; I58-Y145 WeakPolarHBondContact CA-O 3.38Å; F59-Y145 PolarHBondContact N-O 3.32Å; Y145-R171 HydrophobicContact CD1-CB 4.4Å; Y145-R171 HydrophobicContact CE1-CB 4.16Å; Y145-R171 HydrophobicContact CE1-CG 4.02Å; Y145-R171 WeakPolarHBondContact OH-CD 3.42Å; Y145-F174 HydrophobicContact CD1-CE2 4.14Å; Y145-I344 HydrophobicContact CD1-CB 4.45Å; Y145-I344 HydrophobicContact CD1-CD1 3.98Å; Y145-I344 HydrophobicContact CD1-CG1 3.61Å; Y145-I344 HydrophobicContact CD1-CG2 4.24Å; Y145-I344 HydrophobicContact CD2-CD1 4.24Å; Y145-I344 HydrophobicContact CD2-CG1 4.27Å; Y145-I344 HydrophobicContact CD2-CG2 3.58Å; Y145-I344 HydrophobicContact CE1-CB 4.26Å; Y145-I344 HydrophobicContact CE1-CG1 3.81Å; Y145-I344 HydrophobicContact CE1-CG2 3.97Å; Y145-I344 HydrophobicContact CE2-CB 4.36Å; Y145-I344 HydrophobicContact CE2-CG1 4.45Å; Y145-I344 HydrophobicContact CE2-CG2 3.25Å; Y145-I344 HydrophobicContact CG-CD1 3.74Å; Y145-I344 HydrophobicContact CG-CG1 3.83Å; Y145-I344 HydrophobicContact CG-CG2 4.05Å; Y145-I344 VanDerWaalsContact CZ-CG2 3.44Å; Y145-D347 VanDerWaalsContact CE1-OD2 3.31Å; Y145-D347 WeakPolarHBondContact CE1-OD2 3.23Å; Y145-D347 PolarHBondContact OH-OD2 3.28Å; Y145-Y348 HydrophobicContact CE2-CD2 4.03Å; Y145-Y348 WeakPolarHBondContact OH-CB 3.43Å; Y145-Y348 PolarHBondContact OH-N 3.1Å
146	Y	98.1	Very high	95.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.2	-177.4	-173.6	-86.3	0	0	0	110.4	F59 Q61 L128 I132 G152 A156 T172 F173 F174	F59-Y146 HydrophobicContact CB-CD2 4.23Å; F59-Y146 AromaticContact CD1-CD2 3.69Å; F59-Y146 HydrophobicContact CD1-CD2 3.69Å; F59-Y146 AromaticContact CD1-CE2 3.56Å; F59-Y146 HydrophobicContact CD1-CE2 3.56Å; F59-Y146 AromaticContact CE1-CE2 3.99Å; F59-Y146 HydrophobicContact CE1-CE2 3.99Å; F59-Y146 HydrophobicContact CG-CD2 4.26Å; Q61-Y146 HydrophobicContact CB-CE1 4.37Å; Q61-Y146 HydrophobicContact CB-CE2 4.01Å; Q61-Y146 WeakPolarHBondContact CB-OH 3.4Å; Q61-Y146 VanDerWaalsContact CG-OH 3.26Å; Q61-Y146 WeakPolarHBondContact CG-OH 3.48Å; L128-Y146 HydrophobicContact CD1-CE2 3.51Å; L128-Y146 WeakPolarHBondContact CD1-OH 3.46Å; I132-Y146 HydrophobicContact CD1-CD2 4.01Å; I132-Y146 HydrophobicContact CD1-CE2 4.18Å; Y146-G152 PolarHBondContact OH-O 3.15Å; Y146-A156 HydrophobicContact CD1-CB 4.28Å; Y146-A156 HydrophobicContact CE1-CB 3.57Å; Y146-T172 PolarHBondContact N-O 3.36Å; Y146-F173 AromaticContact CD1-CD2 3.49Å; Y146-F173 HydrophobicContact CD1-CD2 3.49Å; Y146-F173 VanDerWaalsContact CD1-CD2 3.49Å; Y146-F173 AromaticContact CD1-CE2 3.61Å; Y146-F173 HydrophobicContact CD1-CE2 3.61Å; Y146-F173 HydrophobicContact CD1-CG 4.37Å; Y146-F173 HydrophobicContact CE1-CD2 4.16Å; Y146-F173 AromaticContact CE1-CE2 3.8Å; Y146-F173 HydrophobicContact CE1-CE2 3.8Å; Y146-F173 HydrophobicContact CE1-CZ 4.48Å; Y146-F173 HydrophobicContact CG-CD2 4.48Å; Y146-F173 CarbonylContact O-C 3.51Å; Y146-F173 WeakPolarHBondContact O-CA 3.45Å; Y146-F174 PolarHBondContact O-N 3.01Å
147	V	98.4	Very high	94.7	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.03	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	112.4	172.5	-173.9	0	0	0	0	107.8	I58 F59 L60 Q61 W71 F174 L176	I58-V147 HydrophobicContact CD1-CG2 3.79Å; I58-V147 HydrophobicContact CG1-CG2 3.94Å; F59-V147 PolarHBondContact O-N 3.21Å; L60-V147 WeakPolarHBondContact CA-O 3.38Å; L60-V147 HydrophobicContact CD2-CB 3.71Å; L60-V147 HydrophobicContact CD2-CG1 4.36Å; L60-V147 HydrophobicContact CD2-CG2 3.86Å; Q61-V147 PolarHBondContact N-O 3.28Å; W71-V147 HydrophobicContact CH2-CG1 4.33Å; V147-F174 WeakPolarHBondContact CA-O 3.36Å; V147-F174 HydrophobicContact CG1-CB 4.37Å; V147-F174 HydrophobicContact CG2-CB 4.16Å; V147-F174 HydrophobicContact CG2-CD2 4.07Å; V147-F174 HydrophobicContact CG2-CG 4.46Å; V147-L176 HydrophobicContact CG1-CD1 3.66Å; V147-L176 HydrophobicContact CG1-CD2 4.49Å; V147-L176 HydrophobicContact CG1-CG 3.89Å
148	G	97.7	Very high	94.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.8	176.2	0	0	0	0	0	110.5	T153 F174 L176	G148-T153 VanDerWaalsContact C-CG2 3.47Å; G148-T153 WeakPolarHBondContact O-CG2 3.44Å; G148-F174 PolarHBondContact N-O 3.04Å; G148-L176 WeakPolarHBondContact O-CB 3.03Å; G148-L176 PolarHBondContact O-N 2.85Å
149	H	96.3	Very high	93.8	Very high	5 Å²	5	26.3 Å²	26.3	2%	0.023	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.5	167.8	171.8	-106.2	0	0	0	110.7	Q61 G63 W71 Q151 G152 L176 H323 I327	Q61-H149 PolarHBondContact O-N 2.93Å; G63-H149 VanDerWaalsContact CA-O 3.29Å; G63-H149 WeakPolarHBondContact CA-O 3.44Å; G63-H149 PolarHBondContact N-O 3.35Å; W71-H149 HydrophobicContact CH2-CB 3.82Å; W71-H149 HydrophobicContact CZ2-CB 4.11Å; H149-Q151 PolarHBondContact O-N 3.38Å; H149-G152 WeakPolarHBondContact O-CA 3.5Å; H149-G152 PolarHBondContact O-N 2.9Å; H149-L176 WeakPolarHBondContact CA-O 3.41Å; H149-L176 HydrophobicContact CB-CB 4.38Å; H149-H323 AromaticContact CE1-NE2 3.89Å; H149-H323 AromaticContact NE2-NE2 3.93Å; H149-H323 PolarHBondContact NE2-O 3.16Å; H149-I327 HydrophobicContact CB-CG2 4.08Å
150	S	93.3	Very high	93.5	Very high	5 Å²	5	25.2 Å²	25.2	4%	0.035	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-122.2	170.7	-171.1	0	0	0	0	112.5	G152 T153 L154 L176 A177 H323	S150-G152 PolarHBondContact O-N 2.83Å; S150-G152 VanDerWaalsContact O-N 3.15Å; S150-T153 WeakPolarHBondContact O-CA 3.34Å; S150-T153 WeakPolarHBondContact O-CB 3.32Å; S150-T153 PolarHBondContact O-N 3.1Å; S150-T153 PolarHBondContact O-OG1 2.79Å; S150-L154 PolarHBondContact O-N 3.27Å; S150-L176 PolarHBondContact N-O 2.79Å; S150-A177 WeakPolarHBondContact CA-O 3.26Å; S150-H323 WeakPolarHBondContact CB-NE2 3.42Å; S150-H323 PolarHBondContact OG-CE1 3.08Å; S150-H323 PolarHBondContact OG-NE2 3.07Å
151	Q	90.1	Very high	93	Very high	5 Å²	5	17 Å²	17	2%	0.023	9%	0.088	C	C	.	.	H	α-helix	trans	-55.6	-28	174.9	-178	173.7	-34	0	0	114.1	L64 W120 M123 H149 T153 L154 T155	L64-Q151 HydrophobicContact CB-CB 4.21Å; W120-Q151 HydrophobicContact CB-CG 4.35Å; M123-Q151 PolarHBondContact SD-NE2 2.64Å; H149-Q151 PolarHBondContact O-N 3.38Å; Q151-T153 PolarHBondContact O-N 3.46Å; Q151-L154 WeakPolarHBondContact O-CB 3.35Å; Q151-L154 PolarHBondContact O-N 3.16Å; Q151-L154 VanDerWaalsContact O-N 3.14Å; Q151-T155 HydrophobicContact CG-CG2 4.48Å; Q151-T155 PolarHBondContact O-N 3.1Å; Q151-T155 PolarHBondContact O-OG1 3.33Å
152	G	93.6	Very high	92.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-22.2	171.7	0	0	0	0	0	113.3	H62 Y146 H149 S150 T155 A156	H62-G152 WeakPolarHBondContact O-CA 3.42Å; H62-G152 PolarHBondContact O-N 3.33Å; Y146-G152 PolarHBondContact OH-O 3.15Å; H149-G152 WeakPolarHBondContact O-CA 3.5Å; H149-G152 PolarHBondContact O-N 2.9Å; S150-G152 PolarHBondContact O-N 2.83Å; S150-G152 VanDerWaalsContact O-N 3.15Å; G152-T155 PolarHBondContact O-OG1 3.11Å; G152-A156 WeakPolarHBondContact O-CB 3.33Å
153	T	92.6	Very high	92.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-81	-40.8	169.6	71.5	0	0	0	0	112.2	G148 S150 Q151 T155 A156 F157 F173 A175 P178 V179	G148-T153 VanDerWaalsContact C-CG2 3.47Å; G148-T153 WeakPolarHBondContact O-CG2 3.44Å; S150-T153 WeakPolarHBondContact O-CA 3.34Å; S150-T153 WeakPolarHBondContact O-CB 3.32Å; S150-T153 PolarHBondContact O-N 3.1Å; S150-T153 PolarHBondContact O-OG1 2.79Å; Q151-T153 PolarHBondContact O-N 3.46Å; T153-T155 PolarHBondContact O-N 3.25Å; T153-A156 WeakPolarHBondContact O-CB 3.38Å; T153-A156 PolarHBondContact O-N 2.83Å; T153-F157 WeakPolarHBondContact O-CD2 3.43Å; T153-F157 WeakPolarHBondContact O-CG 3.41Å; T153-F157 PolarHBondContact O-N 3.07Å; T153-F173 HydrophobicContact CG2-CE2 4.39Å; T153-F173 HydrophobicContact CG2-CZ 4.17Å; T153-A175 HydrophobicContact CG2-CB 3.9Å; T153-P178 WeakPolarHBondContact OG1-CA 3.43Å; T153-V179 PolarHBondContact OG1-N 2.87Å
154	L	88.8	Confident	91.8	Very high	5 Å²	5	14.8 Å²	14.8	3%	0.026	8%	0.083	C	C	.	.	H	α-helix	trans	-57.7	-48.1	178.7	175.6	59.9	0	0	0	111.4	W120 S150 Q151 A156 F157 A158 V179	W120-L154 HydrophobicContact CD2-CD2 3.74Å; W120-L154 HydrophobicContact CD2-CG 4.07Å; W120-L154 HydrophobicContact CE3-CD2 4.33Å; W120-L154 HydrophobicContact CE3-CG 4.15Å; W120-L154 HydrophobicContact CG-CD2 3.81Å; W120-L154 HydrophobicContact CG-CG 4.5Å; W120-L154 HydrophobicContact CZ2-CD2 4.45Å; S150-L154 PolarHBondContact O-N 3.27Å; Q151-L154 WeakPolarHBondContact O-CB 3.35Å; Q151-L154 PolarHBondContact O-N 3.16Å; Q151-L154 VanDerWaalsContact O-N 3.14Å; L154-A156 VanDerWaalsContact C-N 3.33Å; L154-A156 PolarHBondContact O-N 2.77Å; L154-F157 PolarHBondContact O-N 3.03Å; L154-A158 WeakPolarHBondContact O-CB 3.43Å; L154-A158 PolarHBondContact O-N 2.99Å; L154-V179 WeakPolarHBondContact CA-O 3.29Å; L154-V179 WeakPolarHBondContact CB-O 3.41Å
155	T	91.2	Very high	91.6	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-38.8	179	53.9	0	0	0	0	112	F96 W120 M123 A124 Q151 G152 T153 A158 K159	F96-T155 HydrophobicContact CE2-CG2 4.22Å; F96-T155 HydrophobicContact CZ-CG2 3.95Å; F96-T155 WeakPolarHBondContact CZ-OG1 3.32Å; W120-T155 HydrophobicContact CB-CG2 4.21Å; M123-T155 HydrophobicContact CB-CG2 3.86Å; A124-T155 HydrophobicContact CB-CG2 4.34Å; A124-T155 WeakPolarHBondContact CB-O 3.2Å; Q151-T155 HydrophobicContact CG-CG2 4.48Å; Q151-T155 PolarHBondContact O-N 3.1Å; Q151-T155 PolarHBondContact O-OG1 3.33Å; G152-T155 PolarHBondContact O-OG1 3.11Å; T153-T155 PolarHBondContact O-N 3.25Å; T155-A158 PolarHBondContact O-N 3.4Å; T155-K159 WeakPolarHBondContact O-CB 3.19Å; T155-K159 PolarHBondContact O-N 3.4Å
156	A	92.2	Very high	91.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-49.8	174.1	0	0	0	0	0	112	L128 Y146 G152 T153 L154 A158 K159 F160 F173	L128-A156 HydrophobicContact CD2-CB 4.36Å; Y146-A156 HydrophobicContact CD1-CB 4.28Å; Y146-A156 HydrophobicContact CE1-CB 3.57Å; G152-A156 WeakPolarHBondContact O-CB 3.33Å; T153-A156 WeakPolarHBondContact O-CB 3.38Å; T153-A156 PolarHBondContact O-N 2.83Å; L154-A156 VanDerWaalsContact C-N 3.33Å; L154-A156 PolarHBondContact O-N 2.77Å; A156-A158 VanDerWaalsContact C-N 3.31Å; A156-A158 PolarHBondContact O-N 2.74Å; A156-K159 PolarHBondContact O-N 3.16Å; A156-F160 HydrophobicContact CB-CD2 4.01Å; A156-F160 HydrophobicContact CB-CE2 3.57Å; A156-F160 HydrophobicContact CB-CZ 4.12Å; A156-F160 VanDerWaalsContact O-CB 3.28Å; A156-F160 WeakPolarHBondContact O-CB 3.43Å; A156-F160 WeakPolarHBondContact O-CD2 3.4Å; A156-F160 WeakPolarHBondContact O-CG 3.45Å; A156-F160 PolarHBondContact O-N 3.47Å; A156-F173 HydrophobicContact CB-CE1 3.84Å; A156-F173 HydrophobicContact CB-CE2 4.17Å; A156-F173 HydrophobicContact CB-CZ 3.64Å
157	F	88.2	Confident	91.1	Very high	7 Å²	7	22.6 Å²	22.6	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-55.9	-48.1	174.3	-69.3	-55.1	0	0	0	110.7	T153 L154 K159 F160 S161 F173 A175 P178 V180 Y278 I285 Y287 L309	T153-F157 WeakPolarHBondContact O-CD2 3.43Å; T153-F157 WeakPolarHBondContact O-CG 3.41Å; T153-F157 PolarHBondContact O-N 3.07Å; L154-F157 PolarHBondContact O-N 3.03Å; F157-K159 PolarHBondContact O-N 3.16Å; F157-F160 PolarHBondContact O-N 2.94Å; F157-S161 VanDerWaalsContact O-CB 3.29Å; F157-S161 WeakPolarHBondContact O-CB 3.17Å; F157-S161 PolarHBondContact O-N 3.22Å; F157-S161 PolarHBondContact O-OG 3.08Å; F157-F173 AromaticContact CD1-CE1 3.72Å; F157-F173 HydrophobicContact CD1-CE1 3.72Å; F157-F173 HydrophobicContact CE1-CD1 4.17Å; F157-F173 AromaticContact CE1-CE1 3.46Å; F157-F173 HydrophobicContact CE1-CE1 3.46Å; F157-F173 VanDerWaalsContact CE1-CE1 3.46Å; F157-F173 HydrophobicContact CE1-CZ 4.29Å; F157-F173 HydrophobicContact CE2-CE1 4.28Å; F157-F173 HydrophobicContact CE2-CZ 4.38Å; F157-F173 HydrophobicContact CG-CE1 4.23Å; F157-F173 AromaticContact CZ-CE1 3.75Å; F157-F173 HydrophobicContact CZ-CE1 3.75Å; F157-F173 HydrophobicContact CZ-CZ 4.13Å; F157-A175 HydrophobicContact CE2-CB 4.47Å; F157-A175 HydrophobicContact CZ-CB 3.91Å; F157-P178 HydrophobicContact CE2-CB 3.93Å; F157-P178 HydrophobicContact CZ-CB 4.2Å; F157-V180 HydrophobicContact CD2-CG2 3.63Å; F157-V180 HydrophobicContact CE2-CG2 3.82Å; F157-V180 HydrophobicContact CG-CG2 4.32Å; F157-Y278 VanDerWaalsContact C-CD1 3.45Å; F157-Y278 VanDerWaalsContact C-CE1 3.46Å; F157-Y278 HydrophobicContact CB-CD1 3.66Å; F157-Y278 HydrophobicContact CB-CE1 3.65Å; F157-Y278 VanDerWaalsContact O-CD1 3.24Å; F157-Y278 WeakPolarHBondContact O-CD1 3.28Å; F157-I285 HydrophobicContact CE1-CD1 4.09Å; F157-I285 HydrophobicContact CE1-CG2 4.35Å; F157-Y287 AromaticContact CE1-CE1 3.91Å; F157-Y287 HydrophobicContact CE1-CE1 3.91Å; F157-Y287 HydrophobicContact CZ-CD1 4.32Å; F157-Y287 AromaticContact CZ-CE1 3.63Å; F157-Y287 HydrophobicContact CZ-CE1 3.63Å; F157-L309 HydrophobicContact CE1-CD1 4.41Å
158	A	86.1	Confident	90.8	Very high	13 Å²	13	27.8 Å²	27.8	11%	0.107	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-45.4	-178.2	0	0	0	0	0	112	W120 A124 L154 T155 A156 S161 T162 Y278	W120-A158 HydrophobicContact CE3-CB 4.42Å; W120-A158 HydrophobicContact CZ3-CB 3.72Å; A124-A158 HydrophobicContact CB-CB 3.84Å; L154-A158 WeakPolarHBondContact O-CB 3.43Å; L154-A158 PolarHBondContact O-N 2.99Å; T155-A158 PolarHBondContact O-N 3.4Å; A156-A158 VanDerWaalsContact C-N 3.31Å; A156-A158 PolarHBondContact O-N 2.74Å; A158-S161 PolarHBondContact O-OG 3.3Å; A158-S161 VanDerWaalsContact O-OG 3.09Å; A158-T162 WeakPolarHBondContact O-CG2 3.43Å; A158-T162 PolarHBondContact O-N 3.5Å; A158-T162 PolarHBondContact O-OG1 3.4Å; A158-Y278 HydrophobicContact CB-CE1 4.3Å
159	K	91.4	Very high	90.8	Very high	25 Å²	25	30.9 Å²	30.9	11%	0.109	16%	0.157	C	C	.	.	H	α-helix	trans	-70.5	-47.5	179	-179.2	60.7	-167.8	178.4	0	112.5	A124 L128 P129 T155 A156 F157 S161 T162 D163 F166	A124-K159 WeakPolarHBondContact O-CD 3.47Å; L128-K159 HydrophobicContact CD2-CB 3.75Å; L128-K159 HydrophobicContact CD2-CG 4.14Å; P129-K159 HydrophobicContact CG-CD 4Å; T155-K159 WeakPolarHBondContact O-CB 3.19Å; T155-K159 PolarHBondContact O-N 3.4Å; A156-K159 PolarHBondContact O-N 3.16Å; F157-K159 PolarHBondContact O-N 3.16Å; K159-S161 VanDerWaalsContact C-N 3.28Å; K159-S161 PolarHBondContact O-N 3.01Å; K159-T162 PolarHBondContact O-N 2.83Å; K159-T162 PolarHBondContact O-OG1 2.68Å; K159-D163 HydrophobicContact CD-CB 4.28Å; K159-D163 VanDerWaalsContact CE-OD2 3.3Å; K159-D163 WeakPolarHBondContact CE-OD2 3.39Å; K159-D163 IonicContact NZ-OD2 3.4Å; K159-D163 PolarHBondContact NZ-OD2 3.14Å; K159-D163 PolarHBondContact O-N 3.08Å; K159-F166 HydrophobicContact CD-CD1 4.09Å; K159-F166 HydrophobicContact CD-CE1 4.48Å; K159-F166 VanDerWaalsContact CE-CG 3.43Å; K159-F166 HydrophobicContact CG-CD1 3.5Å; K159-F166 HydrophobicContact CG-CE1 3.71Å; K159-F166 HydrophobicContact CG-CG 4.41Å
160	F	89.3	Confident	90.7	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-73.4	-20.5	-174	-57	-27.3	0	0	0	113.3	L128 I132 A156 F157 Q164 F166 A167 V170 F173 L283	L128-F160 HydrophobicContact CD2-CE1 4.25Å; L128-F160 HydrophobicContact CD2-CZ 4.3Å; I132-F160 HydrophobicContact CD1-CE1 4.38Å; I132-F160 HydrophobicContact CD1-CZ 4.3Å; A156-F160 HydrophobicContact CB-CD2 4.01Å; A156-F160 HydrophobicContact CB-CE2 3.57Å; A156-F160 HydrophobicContact CB-CZ 4.12Å; A156-F160 VanDerWaalsContact O-CB 3.28Å; A156-F160 WeakPolarHBondContact O-CB 3.43Å; A156-F160 WeakPolarHBondContact O-CD2 3.4Å; A156-F160 WeakPolarHBondContact O-CG 3.45Å; A156-F160 PolarHBondContact O-N 3.47Å; F157-F160 PolarHBondContact O-N 2.94Å; F160-Q164 PolarHBondContact O-NE2 3.27Å; F160-F166 HydrophobicContact CD1-CD1 4.1Å; F160-F166 HydrophobicContact CD1-CE1 4.36Å; F160-F166 AromaticContact CE1-CD1 3.96Å; F160-F166 HydrophobicContact CE1-CD1 3.96Å; F160-F166 AromaticContact CE1-CE1 3.79Å; F160-F166 HydrophobicContact CE1-CE1 3.79Å; F160-A167 HydrophobicContact CB-CB 3.91Å; F160-A167 HydrophobicContact CD1-CB 4.12Å; F160-A167 HydrophobicContact CG-CB 4.24Å; F160-V170 HydrophobicContact CE1-CG2 3.81Å; F160-V170 HydrophobicContact CE2-CG2 4.25Å; F160-V170 HydrophobicContact CZ-CB 4.39Å; F160-V170 HydrophobicContact CZ-CG2 3.55Å; F160-F173 HydrophobicContact CD2-CD1 4.18Å; F160-F173 HydrophobicContact CE2-CD1 4.23Å; F160-F173 HydrophobicContact CE2-CG 4.38Å; F160-L283 HydrophobicContact CB-CD2 3.98Å; F160-L283 HydrophobicContact CD2-CD2 3.36Å; F160-L283 HydrophobicContact CE2-CD2 4.08Å; F160-L283 HydrophobicContact CG-CD2 3.9Å
161	S	83.8	Confident	90.7	Very high	18 Å²	18	33.5 Å²	33.5	13%	0.126	17%	0.167	C	C	.	.	H	α-helix	trans	-79.8	-36.2	171.3	56.7	0	0	0	0	113	F157 A158 K159 Q164 Y278	F157-S161 VanDerWaalsContact O-CB 3.29Å; F157-S161 WeakPolarHBondContact O-CB 3.17Å; F157-S161 PolarHBondContact O-N 3.22Å; F157-S161 PolarHBondContact O-OG 3.08Å; A158-S161 PolarHBondContact O-OG 3.3Å; A158-S161 VanDerWaalsContact O-OG 3.09Å; K159-S161 VanDerWaalsContact C-N 3.28Å; K159-S161 PolarHBondContact O-N 3.01Å; S161-Q164 PolarHBondContact O-NE2 3.07Å; S161-Y278 VanDerWaalsContact CB-CA 3.47Å; S161-Y278 WeakPolarHBondContact OG-CD1 3.2Å
162	T	85	Confident	90.9	Very high	106 Å²	106	33.2 Å²	33.2	65%	0.65	17%	0.166	S	C	*	.	H	α-helix	trans	-89.3	-18.3	-175	56.1	0	0	0	0	113.7	A158 K159	A158-T162 WeakPolarHBondContact O-CG2 3.43Å; A158-T162 PolarHBondContact O-N 3.5Å; A158-T162 PolarHBondContact O-OG1 3.4Å; K159-T162 PolarHBondContact O-N 2.83Å; K159-T162 PolarHBondContact O-OG1 2.68Å
163	D	90.1	Very high	90.9	Very high	49 Å²	49	33.2 Å²	33.2	26%	0.262	17%	0.166	S	C	.	.			trans	-138.9	87.6	-179.2	-173.7	-13.4	0	0	0	110.7	K159 Q165 F166 A167	K159-D163 HydrophobicContact CD-CB 4.28Å; K159-D163 VanDerWaalsContact CE-OD2 3.3Å; K159-D163 WeakPolarHBondContact CE-OD2 3.39Å; K159-D163 IonicContact NZ-OD2 3.4Å; K159-D163 PolarHBondContact NZ-OD2 3.14Å; K159-D163 PolarHBondContact O-N 3.08Å; D163-Q165 VanDerWaalsContact C-N 3.3Å; D163-Q165 PolarHBondContact O-N 3.27Å; D163-Q165 PolarHBondContact OD1-N 2.83Å; D163-F166 HydrophobicContact CB-CB 4.01Å; D163-F166 PolarHBondContact O-N 3.23Å; D163-F166 WeakPolarHBondContact OD1-CB 3.34Å; D163-F166 PolarHBondContact OD1-N 3.38Å; D163-F166 WeakPolarHBondContact OD2-CB 3.47Å; D163-A167 PolarHBondContact O-N 2.92Å
164	Q	87	Confident	91.1	Very high	61 Å²	61	33.3 Å²	33.3	29%	0.285	17%	0.166	S	C	.	.	H	α-helix	trans	-64.8	-33.8	-179.5	-64	-54.4	-53.7	0	0	112.4	F160 S161 F166 A167 E168 Q279	F160-Q164 PolarHBondContact O-NE2 3.27Å; S161-Q164 PolarHBondContact O-NE2 3.07Å; Q164-F166 VanDerWaalsContact C-N 3.31Å; Q164-F166 PolarHBondContact O-N 3.28Å; Q164-A167 WeakPolarHBondContact O-CB 3.49Å; Q164-A167 PolarHBondContact O-N 2.82Å; Q164-A167 VanDerWaalsContact O-N 3.14Å; Q164-E168 PolarHBondContact O-N 3.42Å; Q164-E168 VanDerWaalsContact O-N 3.1Å; Q164-Q279 PolarHBondContact NE2-O 3.13Å
165	Q	91.5	Very high	91.3	Very high	154 Å²	154	33.1 Å²	33.1	72%	0.72	17%	0.165	S	C	*	.	H	α-helix	trans	-64.7	-39	177.4	-173.8	-177.8	11.6	0	0	110.8	D163	D163-Q165 VanDerWaalsContact C-N 3.3Å; D163-Q165 PolarHBondContact O-N 3.27Å; D163-Q165 PolarHBondContact OD1-N 2.83Å
166	F	94	Very high	91.6	Very high	10 Å²	10	33.1 Å²	33.1	4%	0.044	17%	0.165	C	C	.	.	H	α-helix	trans	-69.1	-38.4	172.2	-175.3	-96.7	0	0	0	112.1	L128 P129 I132 K159 F160 D163 Q164 E168 K169	L128-F166 HydrophobicContact CG-CE1 4.49Å; P129-F166 VanDerWaalsContact CA-CZ 3.45Å; P129-F166 HydrophobicContact CB-CD2 4.47Å; P129-F166 HydrophobicContact CB-CE2 3.85Å; P129-F166 HydrophobicContact CB-CZ 4.08Å; P129-F166 HydrophobicContact CG-CE1 4.47Å; P129-F166 HydrophobicContact CG-CE2 4.2Å; P129-F166 HydrophobicContact CG-CZ 4.12Å; I132-F166 HydrophobicContact CB-CZ 3.87Å; I132-F166 HydrophobicContact CD1-CE1 3.96Å; I132-F166 HydrophobicContact CD1-CZ 3.9Å; I132-F166 HydrophobicContact CG1-CZ 4.4Å; I132-F166 HydrophobicContact CG2-CE2 4.42Å; I132-F166 HydrophobicContact CG2-CZ 3.97Å; K159-F166 HydrophobicContact CD-CD1 4.09Å; K159-F166 HydrophobicContact CD-CE1 4.48Å; K159-F166 VanDerWaalsContact CE-CG 3.43Å; K159-F166 HydrophobicContact CG-CD1 3.5Å; K159-F166 HydrophobicContact CG-CE1 3.71Å; K159-F166 HydrophobicContact CG-CG 4.41Å; F160-F166 HydrophobicContact CD1-CD1 4.1Å; F160-F166 HydrophobicContact CD1-CE1 4.36Å; F160-F166 AromaticContact CE1-CD1 3.96Å; F160-F166 HydrophobicContact CE1-CD1 3.96Å; F160-F166 AromaticContact CE1-CE1 3.79Å; F160-F166 HydrophobicContact CE1-CE1 3.79Å; D163-F166 HydrophobicContact CB-CB 4.01Å; D163-F166 PolarHBondContact O-N 3.23Å; D163-F166 WeakPolarHBondContact OD1-CB 3.34Å; D163-F166 PolarHBondContact OD1-N 3.38Å; D163-F166 WeakPolarHBondContact OD2-CB 3.47Å; Q164-F166 VanDerWaalsContact C-N 3.31Å; Q164-F166 PolarHBondContact O-N 3.28Å; F166-E168 PolarHBondContact O-N 3.04Å; F166-K169 HydrophobicContact CD2-CD 4.02Å; F166-K169 HydrophobicContact CE2-CD 4.13Å; F166-K169 VanDerWaalsContact O-CB 3.3Å; F166-K169 WeakPolarHBondContact O-CB 3.35Å; F166-K169 PolarHBondContact O-N 3.22Å; F166-K169 VanDerWaalsContact O-N 3.12Å
167	A	92.4	Very high	91.7	Very high	5 Å²	5	33.1 Å²	33.1	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-29.1	177.8	0	0	0	0	0	113	F160 D163 Q164 K169 V170	F160-A167 HydrophobicContact CB-CB 3.91Å; F160-A167 HydrophobicContact CD1-CB 4.12Å; F160-A167 HydrophobicContact CG-CB 4.24Å; D163-A167 PolarHBondContact O-N 2.92Å; Q164-A167 WeakPolarHBondContact O-CB 3.49Å; Q164-A167 PolarHBondContact O-N 2.82Å; Q164-A167 VanDerWaalsContact O-N 3.14Å; A167-K169 PolarHBondContact O-N 2.8Å; A167-K169 VanDerWaalsContact O-N 3.1Å; A167-V170 PolarHBondContact O-N 3.38Å
168	E	93.1	Very high	91.8	Very high	113 Å²	113	32.9 Å²	32.9	53%	0.528	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-20	176	-73	173.9	-179.3	0	0	114.1	K143 Q164 F166 V170	K143-E168 WeakPolarHBondContact CD-O 3.47Å; K143-E168 WeakPolarHBondContact CE-O 3.44Å; K143-E168 PolarHBondContact NZ-O 3.29Å; Q164-E168 PolarHBondContact O-N 3.42Å; Q164-E168 VanDerWaalsContact O-N 3.1Å; F166-E168 PolarHBondContact O-N 3.04Å; E168-V170 PolarHBondContact O-N 3.09Å
169	K	95.9	Very high	91.8	Very high	65 Å²	65	32.6 Å²	32.6	28%	0.283	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.3	174.5	-62.2	177.9	176	175.7	0	113.1	N133 L136 K143 L144 F166 A167	N133-K169 PolarHBondContact OD1-NZ 3.15Å; L136-K169 HydrophobicContact CD1-CB 3.85Å; L136-K169 HydrophobicContact CD1-CD 3.99Å; L136-K169 HydrophobicContact CD1-CG 4.17Å; K143-K169 CarbonylContact C-O 3.56Å; K143-K169 WeakPolarHBondContact CA-O 3.36Å; L144-K169 PolarHBondContact N-O 3.36Å; F166-K169 HydrophobicContact CD2-CD 4.02Å; F166-K169 HydrophobicContact CE2-CD 4.13Å; F166-K169 VanDerWaalsContact O-CB 3.3Å; F166-K169 WeakPolarHBondContact O-CB 3.35Å; F166-K169 PolarHBondContact O-N 3.22Å; F166-K169 VanDerWaalsContact O-N 3.12Å; A167-K169 PolarHBondContact O-N 2.8Å; A167-K169 VanDerWaalsContact O-N 3.1Å
170	V	95	Very high	91.1	Very high	6 Å²	6	32 Å²	32	4%	0.036	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.4	177.2	-177.9	0	0	0	0	109	I132 L144 F160 A167 E168 T172 F173 L283	I132-V170 HydrophobicContact CD1-CG2 4.31Å; L144-V170 HydrophobicContact CD1-CG2 4.24Å; L144-V170 CarbonylContact O-C 3.53Å; L144-V170 WeakPolarHBondContact O-CA 3.33Å; F160-V170 HydrophobicContact CE1-CG2 3.81Å; F160-V170 HydrophobicContact CE2-CG2 4.25Å; F160-V170 HydrophobicContact CZ-CB 4.39Å; F160-V170 HydrophobicContact CZ-CG2 3.55Å; A167-V170 PolarHBondContact O-N 3.38Å; E168-V170 PolarHBondContact O-N 3.09Å; V170-T172 WeakPolarHBondContact CG1-O 3.37Å; V170-F173 HydrophobicContact CG1-CB 4.43Å; V170-L283 HydrophobicContact CB-CD1 3.97Å; V170-L283 HydrophobicContact CG1-CD1 3.93Å; V170-L283 WeakPolarHBondContact O-CD1 3.17Å
171	R	93.4	Very high	90.4	Very high	59 Å²	59	33.4 Å²	33.4	22%	0.223	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-43.1	-179.2	-172.4	178.6	-82.3	-138.9	7.6	111.8	K143 L144 Y145 D347 E352	K143-R171 HydrophobicContact CB-CB 4.27Å; L144-R171 PolarHBondContact O-N 2.84Å; Y145-R171 HydrophobicContact CD1-CB 4.4Å; Y145-R171 HydrophobicContact CE1-CB 4.16Å; Y145-R171 HydrophobicContact CE1-CG 4.02Å; Y145-R171 WeakPolarHBondContact OH-CD 3.42Å; R171-D347 WeakPolarHBondContact CD-OD2 3.25Å; R171-D347 IonicContact NH1-OD2 3.97Å; R171-E352 IonicContact NH2-OE1 3.72Å
172	T	93.8	Very high	90	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	142.1	173.4	-50.8	0	0	0	0	109.3	Y146 V170 F174 H284 F343	Y146-T172 PolarHBondContact N-O 3.36Å; V170-T172 WeakPolarHBondContact CG1-O 3.37Å; T172-F174 HydrophobicContact CG2-CE1 4.25Å; T172-F174 HydrophobicContact CG2-CE2 3.93Å; T172-F174 HydrophobicContact CG2-CZ 3.77Å; T172-H284 WeakPolarHBondContact CA-O 3.43Å; T172-H284 HydrophobicContact CG2-CB 4.12Å; T172-H284 WeakPolarHBondContact CG2-O 3.45Å; T172-F343 HydrophobicContact CG2-CE1 3.92Å; T172-F343 HydrophobicContact CG2-CZ 4.35Å
173	F	94.3	Very high	89.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117	177	173.9	-158.2	0	0	0	110.6	Y146 T153 A156 F157 F160 V170 A175 L283 H284 I285 H286	Y146-F173 AromaticContact CD1-CD2 3.49Å; Y146-F173 HydrophobicContact CD1-CD2 3.49Å; Y146-F173 VanDerWaalsContact CD1-CD2 3.49Å; Y146-F173 AromaticContact CD1-CE2 3.61Å; Y146-F173 HydrophobicContact CD1-CE2 3.61Å; Y146-F173 HydrophobicContact CD1-CG 4.37Å; Y146-F173 HydrophobicContact CE1-CD2 4.16Å; Y146-F173 AromaticContact CE1-CE2 3.8Å; Y146-F173 HydrophobicContact CE1-CE2 3.8Å; Y146-F173 HydrophobicContact CE1-CZ 4.48Å; Y146-F173 HydrophobicContact CG-CD2 4.48Å; Y146-F173 CarbonylContact O-C 3.51Å; Y146-F173 WeakPolarHBondContact O-CA 3.45Å; T153-F173 HydrophobicContact CG2-CE2 4.39Å; T153-F173 HydrophobicContact CG2-CZ 4.17Å; A156-F173 HydrophobicContact CB-CE1 3.84Å; A156-F173 HydrophobicContact CB-CE2 4.17Å; A156-F173 HydrophobicContact CB-CZ 3.64Å; F157-F173 AromaticContact CD1-CE1 3.72Å; F157-F173 HydrophobicContact CD1-CE1 3.72Å; F157-F173 HydrophobicContact CE1-CD1 4.17Å; F157-F173 AromaticContact CE1-CE1 3.46Å; F157-F173 HydrophobicContact CE1-CE1 3.46Å; F157-F173 VanDerWaalsContact CE1-CE1 3.46Å; F157-F173 HydrophobicContact CE1-CZ 4.29Å; F157-F173 HydrophobicContact CE2-CE1 4.28Å; F157-F173 HydrophobicContact CE2-CZ 4.38Å; F157-F173 HydrophobicContact CG-CE1 4.23Å; F157-F173 AromaticContact CZ-CE1 3.75Å; F157-F173 HydrophobicContact CZ-CE1 3.75Å; F157-F173 HydrophobicContact CZ-CZ 4.13Å; F160-F173 HydrophobicContact CD2-CD1 4.18Å; F160-F173 HydrophobicContact CE2-CD1 4.23Å; F160-F173 HydrophobicContact CE2-CG 4.38Å; V170-F173 HydrophobicContact CG1-CB 4.43Å; F173-A175 HydrophobicContact CD2-CB 4.41Å; F173-A175 HydrophobicContact CE1-CB 4.18Å; F173-A175 HydrophobicContact CE2-CB 3.77Å; F173-A175 HydrophobicContact CZ-CB 3.63Å; F173-L283 HydrophobicContact CB-CD2 3.96Å; F173-L283 HydrophobicContact CB-CG 4.3Å; F173-L283 HydrophobicContact CD1-CD2 4.16Å; F173-H284 PolarHBondContact N-O 3.49Å; F173-I285 HydrophobicContact CB-CG1 4.3Å; F173-I285 HydrophobicContact CB-CG2 4.48Å; F173-I285 HydrophobicContact CD1-CD1 4.16Å; F173-I285 HydrophobicContact CD1-CG1 4.16Å; F173-I285 HydrophobicContact CD1-CG2 3.94Å; F173-I285 HydrophobicContact CE1-CG2 4.48Å; F173-I285 HydrophobicContact CG-CG2 4.3Å; F173-I285 CarbonylContact O-C 3.6Å; F173-I285 VanDerWaalsContact O-CA 3.28Å; F173-I285 WeakPolarHBondContact O-CA 3.44Å; F173-H286 PolarHBondContact O-N 3.46Å
174	F	95.9	Very high	89.3	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.009	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	109.5	170.2	-55.9	-86.4	0	0	0	109.6	Y145 Y146 V147 G148 T172 H286 V340 F343 I344	Y145-F174 HydrophobicContact CD1-CE2 4.14Å; Y146-F174 PolarHBondContact O-N 3.01Å; V147-F174 WeakPolarHBondContact CA-O 3.36Å; V147-F174 HydrophobicContact CG1-CB 4.37Å; V147-F174 HydrophobicContact CG2-CB 4.16Å; V147-F174 HydrophobicContact CG2-CD2 4.07Å; V147-F174 HydrophobicContact CG2-CG 4.46Å; G148-F174 PolarHBondContact N-O 3.04Å; T172-F174 HydrophobicContact CG2-CE1 4.25Å; T172-F174 HydrophobicContact CG2-CE2 3.93Å; T172-F174 HydrophobicContact CG2-CZ 3.77Å; F174-H286 HydrophobicContact CD1-CB 3.63Å; F174-H286 AromaticContact CD1-CG 3.9Å; F174-H286 HydrophobicContact CE1-CB 4.07Å; F174-H286 AromaticContact CE1-CD2 3.85Å; F174-H286 AromaticContact CE1-CG 3.79Å; F174-V340 HydrophobicContact CD1-CB 4.45Å; F174-V340 HydrophobicContact CD1-CG1 4.15Å; F174-V340 HydrophobicContact CD1-CG2 3.73Å; F174-V340 HydrophobicContact CD2-CG1 4.03Å; F174-V340 HydrophobicContact CE1-CB 4.42Å; F174-V340 HydrophobicContact CE1-CG1 4.1Å; F174-V340 HydrophobicContact CE1-CG2 4.08Å; F174-V340 HydrophobicContact CE2-CG1 3.98Å; F174-V340 HydrophobicContact CG-CG1 4.12Å; F174-V340 HydrophobicContact CG-CG2 4.16Å; F174-V340 HydrophobicContact CZ-CG1 4.01Å; F174-F343 HydrophobicContact CE1-CD1 4.18Å; F174-F343 HydrophobicContact CE1-CG 4.48Å; F174-F343 AromaticContact CZ-CD1 3.66Å; F174-F343 HydrophobicContact CZ-CD1 3.66Å; F174-F343 HydrophobicContact CZ-CE1 4.16Å; F174-F343 HydrophobicContact CZ-CG 4.35Å; F174-I344 HydrophobicContact CE2-CD1 3.79Å; F174-I344 HydrophobicContact CE2-CG1 3.87Å; F174-I344 HydrophobicContact CZ-CD1 4.2Å; F174-I344 HydrophobicContact CZ-CG1 3.87Å
175	A	94.6	Very high	89	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	100.4	-177.4	0	0	0	0	0	110.1	T153 F157 F173 P178 I285 H286 I288	T153-A175 HydrophobicContact CG2-CB 3.9Å; F157-A175 HydrophobicContact CE2-CB 4.47Å; F157-A175 HydrophobicContact CZ-CB 3.91Å; F173-A175 HydrophobicContact CD2-CB 4.41Å; F173-A175 HydrophobicContact CE1-CB 4.18Å; F173-A175 HydrophobicContact CE2-CB 3.77Å; F173-A175 HydrophobicContact CZ-CB 3.63Å; A175-P178 HydrophobicContact CB-CB 4.03Å; A175-I285 HydrophobicContact CB-CG2 4.42Å; A175-H286 PolarHBondContact N-O 3.34Å; A175-I288 PolarHBondContact O-N 2.77Å
176	L	96.3	Very high	88.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.8	178.3	-48.5	-173.7	0	0	0	109.9	W71 V147 G148 H149 S150 I288 F326 I336	W71-L176 HydrophobicContact CH2-CD1 4.15Å; W71-L176 HydrophobicContact CZ3-CD1 4.18Å; V147-L176 HydrophobicContact CG1-CD1 3.66Å; V147-L176 HydrophobicContact CG1-CD2 4.49Å; V147-L176 HydrophobicContact CG1-CG 3.89Å; G148-L176 WeakPolarHBondContact O-CB 3.03Å; G148-L176 PolarHBondContact O-N 2.85Å; H149-L176 WeakPolarHBondContact CA-O 3.41Å; H149-L176 HydrophobicContact CB-CB 4.38Å; S150-L176 PolarHBondContact N-O 2.79Å; L176-I288 HydrophobicContact CD2-CB 3.88Å; L176-I288 HydrophobicContact CD2-CD1 3.56Å; L176-I288 HydrophobicContact CD2-CG1 3.91Å; L176-I288 HydrophobicContact CD2-CG2 4.47Å; L176-F326 HydrophobicContact CB-CB 4.16Å; L176-F326 HydrophobicContact CB-CD1 3.89Å; L176-F326 HydrophobicContact CB-CG 4.26Å; L176-F326 HydrophobicContact CD1-CB 4.45Å; L176-I336 HydrophobicContact CD1-CG2 4.36Å; L176-I336 HydrophobicContact CD2-CG2 3.77Å
177	A	94.2	Very high	87.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	47.5	59.2	-174.4	0	0	0	0	0	112.2	S150 V179 I288 D293 A296 F326	S150-A177 WeakPolarHBondContact CA-O 3.26Å; A177-V179 PolarHBondContact O-N 2.8Å; A177-I288 PolarHBondContact N-O 3.17Å; A177-D293 WeakPolarHBondContact CB-OD2 3.41Å; A177-A296 HydrophobicContact CB-CB 4.09Å; A177-A296 WeakPolarHBondContact O-CB 3.14Å; A177-F326 HydrophobicContact CB-CD2 3.79Å; A177-F326 HydrophobicContact CB-CE2 3.75Å; A177-F326 HydrophobicContact CB-CG 4.27Å; A177-F326 HydrophobicContact CB-CZ 4.19Å
178	P	91.1	Very high	86.3	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.013	17%	0.174	C	C	.	.			trans	-64.2	129	-167.9	23.6	-31.6	0	0	0	112.3	T153 F157 A175 Y287 I288 A296 V301	T153-P178 WeakPolarHBondContact OG1-CA 3.43Å; F157-P178 HydrophobicContact CE2-CB 3.93Å; F157-P178 HydrophobicContact CZ-CB 4.2Å; A175-P178 HydrophobicContact CB-CB 4.03Å; P178-Y287 HydrophobicContact CB-CD1 4.37Å; P178-Y287 HydrophobicContact CG-CD1 4.14Å; P178-I288 WeakPolarHBondContact CD-O 3.16Å; P178-A296 WeakPolarHBondContact O-CB 3.34Å; P178-V301 HydrophobicContact CG-CB 4.44Å; P178-V301 HydrophobicContact CG-CG1 3.69Å; P178-V301 HydrophobicContact CG-CG2 3.9Å; P178-V301 WeakPolarHBondContact O-CG2 3.39Å
179	V	85.4	Confident	85.1	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.042	15%	0.153	C	C	.	.			trans	-111.9	120.6	177.6	179.8	0	0	0	0	109.2	T153 L154 A177 V182 A296	T153-V179 PolarHBondContact OG1-N 2.87Å; L154-V179 WeakPolarHBondContact CA-O 3.29Å; L154-V179 WeakPolarHBondContact CB-O 3.41Å; A177-V179 PolarHBondContact O-N 2.8Å; V179-V182 HydrophobicContact CG1-CG1 3.88Å; V179-A296 HydrophobicContact CG2-CB 3.96Å
180	V	77.6	Confident	83.8	Confident	13 Å²	13	34.1 Å²	34.1	8%	0.079	17%	0.166	C	C	.	.	S	Bend	trans	-130.6	-47.1	171.8	178.8	0	0	0	0	109.4	F157 A273 Y278 Q308	F157-V180 HydrophobicContact CD2-CG2 3.63Å; F157-V180 HydrophobicContact CE2-CG2 3.82Å; F157-V180 HydrophobicContact CG-CG2 4.32Å; V180-A273 WeakPolarHBondContact O-CB 3.46Å; V180-Y278 HydrophobicContact CG1-CD2 4.48Å; V180-Y278 HydrophobicContact CG1-CE2 3.94Å; V180-Q308 VanDerWaalsContact CG1-OE1 3.29Å
181	T	74.9	Confident	82.3	Confident	32 Å²	32	37.4 Å²	37.4	20%	0.196	18%	0.18	C	C	.	.			trans	-118.6	150.8	171.3	65.3	0	0	0	0	109.7	A273 D300	T181-A273 HydrophobicContact CG2-CB 3.75Å; T181-D300 WeakPolarHBondContact O-CB 3.37Å; T181-D300 PolarHBondContact OG1-OD1 3.4Å
182	V	75.4	Confident	80.8	Confident	47 Å²	47	36.8 Å²	36.8	29%	0.285	18%	0.181	S	C	.	.			trans	-121.4	30.8	175.9	-69.6	0	0	0	0	110.8	V179 V185 C269	V179-V182 HydrophobicContact CG1-CG1 3.88Å; V182-V185 HydrophobicContact CB-CG2 3.57Å; V182-V185 HydrophobicContact CG1-CG2 4Å; V182-V185 WeakPolarHBondContact O-CG2 3.18Å; V182-C269 VanDerWaalsContact CG2-O 3.28Å; V182-C269 WeakPolarHBondContact CG2-O 3.42Å
183	K	78.2	Confident	79.3	Confident	166 Å²	166	39.7 Å²	39.7	72%	0.722	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-30	-170.5	178.4	176	173.3	-176.8	0	112	D300	K183-D300 PolarHBondContact N-OD1 3.28Å; K183-D300 VanDerWaalsContact N-OD1 3.09Å; K183-D300 PolarHBondContact N-OD2 3.13Å
184	H	81.8	Confident	77.3	Confident	37 Å²	37	44.4 Å²	44.4	17%	0.171	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	17.5	-175	-45.8	90.2	0	0	0	112	K186 T297 E299 D300 R303	H184-K186 PolarHBondContact O-N 2.79Å; H184-T297 VanDerWaalsContact O-CG2 3.31Å; H184-T297 WeakPolarHBondContact O-CG2 3.25Å; H184-E299 HydrophobicContact CB-CB 4.35Å; H184-E299 HydrophobicContact CB-CG 4.39Å; H184-E299 IonicContact CD2-OE1 3.59Å; H184-E299 PolarHBondContact CD2-OE1 3.38Å; H184-E299 IonicContact CD2-OE2 3.41Å; H184-E299 IonicContact CG-OE2 2.73Å; H184-E299 IonicContact NE2-OE1 2.79Å; H184-E299 PolarHBondContact NE2-OE1 3.22Å; H184-D300 WeakPolarHBondContact CA-OD2 3.44Å; H184-D300 WeakPolarHBondContact CB-OD2 3.43Å; H184-D300 IonicContact CE1-OD1 3.18Å; H184-D300 IonicContact CG-OD1 3.33Å; H184-D300 PolarHBondContact N-OD1 2.81Å; H184-D300 PolarHBondContact N-OD2 2.84Å; H184-D300 IonicContact ND1-OD1 2.66Å; H184-D300 PolarHBondContact ND1-OD1 3.06Å; H184-D300 IonicContact ND1-OD2 2.68Å; H184-R303 PolarHBondContact CE1-NH1 3.24Å; H184-R303 PolarHBondContact NE2-NH1 3.25Å; H184-R303 VanDerWaalsContact NE2-NH1 3.11Å
185	V	80.7	Confident	75.2	Confident	23 Å²	23	48.9 Å²	48.9	14%	0.139	26%	0.255	C	S	.	.			trans	-49.1	133	175	168.4	0	0	0	0	111.4	V182 S189 I294 L295	V182-V185 HydrophobicContact CB-CG2 3.57Å; V182-V185 HydrophobicContact CG1-CG2 4Å; V182-V185 WeakPolarHBondContact O-CG2 3.18Å; V185-S189 WeakPolarHBondContact CG1-OG 3.31Å; V185-I294 WeakPolarHBondContact CA-O 3.3Å; V185-L295 HydrophobicContact CG1-CD1 4.1Å; V185-L295 HydrophobicContact CG2-CD1 4.07Å; V185-L295 WeakPolarHBondContact CG2-O 3.31Å
186	K	79.3	Confident	73.2	Confident	119 Å²	119	56 Å²	56	52%	0.517	29%	0.286	S	S	.	.			trans	-107.7	168.1	178	-61.1	176.2	-175.2	174.3	0	109.8	H184 S189 I294 T297	H184-K186 PolarHBondContact O-N 2.79Å; K186-S189 PolarHBondContact O-OG 3.2Å; K186-I294 HydrophobicContact CB-CB 3.9Å; K186-I294 HydrophobicContact CB-CG2 4.13Å; K186-I294 PolarHBondContact N-O 3.26Å; K186-T297 HydrophobicContact CG-CG2 4.31Å
187	G	74.5	Confident	70.8	Confident	29 Å²	29	57.9 Å²	57.9	30%	0.299	29%	0.294	S	S	.	.	S	Bend	trans	78.1	-166.5	178.3	0	0	0	0	0	114.9	S189 R190	G187-S189 VanDerWaalsContact C-N 3.29Å; G187-S189 PolarHBondContact O-N 2.82Å; G187-R190 WeakPolarHBondContact O-CD 3.42Å; G187-R190 WeakPolarHBondContact O-CG 3.49Å; G187-R190 PolarHBondContact O-N 3.11Å
188	P	67.2	Low	68.6	Low	17 Å²	17	65.9 Å²	65.9	11%	0.11	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-62.4	-31.8	-171	-24	34.5	0	0	0	114.1	R190 F191 F220	P188-R190 PolarHBondContact O-N 3.2Å; P188-R190 VanDerWaalsContact O-N 3.15Å; P188-F191 WeakPolarHBondContact O-CB 3.4Å; P188-F191 WeakPolarHBondContact O-CD2 3.41Å; P188-F191 PolarHBondContact O-N 3.13Å; P188-F220 HydrophobicContact CB-CD2 4.21Å; P188-F220 HydrophobicContact CB-CG 4.24Å; P188-F220 HydrophobicContact CG-CB 4.31Å; P188-F220 HydrophobicContact CG-CD1 4.44Å; P188-F220 HydrophobicContact CG-CG 4.21Å
189	S	67.2	Low	66.5	Low	14 Å²	14	71.1 Å²	71.1	10%	0.098	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-57.8	-28	178.2	50.5	0	0	0	0	113.4	V185 K186 G187 F191 L192	V185-S189 WeakPolarHBondContact CG1-OG 3.31Å; K186-S189 PolarHBondContact O-OG 3.2Å; G187-S189 VanDerWaalsContact C-N 3.29Å; G187-S189 PolarHBondContact O-N 2.82Å; S189-F191 PolarHBondContact O-N 2.89Å; S189-F191 VanDerWaalsContact O-N 3.15Å; S189-L192 WeakPolarHBondContact O-CB 3.33Å; S189-L192 PolarHBondContact O-N 3.18Å
190	R	69.4	Low	64.6	Low	143 Å²	143	71.1 Å²	71.1	54%	0.54	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-59.4	-26.7	174.3	86.6	-171.2	176	159.8	-6.6	112.9	G187 P188 L192 A193	G187-R190 WeakPolarHBondContact O-CD 3.42Å; G187-R190 WeakPolarHBondContact O-CG 3.49Å; G187-R190 PolarHBondContact O-N 3.11Å; P188-R190 PolarHBondContact O-N 3.2Å; P188-R190 VanDerWaalsContact O-N 3.15Å; R190-L192 VanDerWaalsContact C-N 3.3Å; R190-A193 WeakPolarHBondContact O-CB 3.35Å; R190-A193 PolarHBondContact O-N 3.19Å
191	F	62.9	Low	63.1	Low	76 Å²	76	70.7 Å²	70.7	33%	0.333	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-81	-13.4	178.9	-64	-83.2	0	0	0	112.6	P188 S189 P194 F195 F220	P188-F191 WeakPolarHBondContact O-CB 3.4Å; P188-F191 WeakPolarHBondContact O-CD2 3.41Å; P188-F191 PolarHBondContact O-N 3.13Å; S189-F191 PolarHBondContact O-N 2.89Å; S189-F191 VanDerWaalsContact O-N 3.15Å; F191-P194 WeakPolarHBondContact O-CD 3.22Å; F191-F195 WeakPolarHBondContact O-CD2 3.39Å; F191-F195 WeakPolarHBondContact O-CE2 3.4Å; F191-F220 HydrophobicContact CD1-CZ 4.28Å; F191-F220 AromaticContact CD2-CE1 3.88Å; F191-F220 HydrophobicContact CD2-CE1 3.88Å; F191-F220 AromaticContact CD2-CE2 3.74Å; F191-F220 HydrophobicContact CD2-CE2 3.74Å; F191-F220 AromaticContact CD2-CZ 3.2Å; F191-F220 HydrophobicContact CD2-CZ 3.2Å; F191-F220 HydrophobicContact CE1-CZ 4.11Å; F191-F220 HydrophobicContact CE2-CD1 4.5Å; F191-F220 AromaticContact CE2-CE1 3.29Å; F191-F220 HydrophobicContact CE2-CE1 3.29Å; F191-F220 AromaticContact CE2-CE2 3.99Å; F191-F220 HydrophobicContact CE2-CE2 3.99Å; F191-F220 AromaticContact CE2-CZ 2.99Å; F191-F220 HydrophobicContact CE2-CZ 2.99Å; F191-F220 HydrophobicContact CG-CE2 4.19Å; F191-F220 AromaticContact CG-CZ 3.85Å; F191-F220 HydrophobicContact CG-CZ 3.85Å; F191-F220 AromaticContact CZ-CE1 3.84Å; F191-F220 HydrophobicContact CZ-CE1 3.84Å; F191-F220 AromaticContact CZ-CZ 3.46Å; F191-F220 HydrophobicContact CZ-CZ 3.46Å; F191-F220 VanDerWaalsContact CZ-CZ 3.46Å
192	L	62	Low	61.7	Low	46 Å²	46	71 Å²	71	24%	0.241	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-75.9	-17.3	167.1	-60.7	174.3	0	0	0	110.9	S189 R190 P194 F195 I216 L237 K270	S189-L192 WeakPolarHBondContact O-CB 3.33Å; S189-L192 PolarHBondContact O-N 3.18Å; R190-L192 VanDerWaalsContact C-N 3.3Å; L192-P194 VanDerWaalsContact C-CD 3.47Å; L192-F195 PolarHBondContact O-N 3.39Å; L192-I216 HydrophobicContact CD2-CD1 3.79Å; L192-L237 HydrophobicContact CD1-CD2 3.5Å; L192-K270 VanDerWaalsContact O-CE 3.27Å; L192-K270 WeakPolarHBondContact O-CE 3.42Å; L192-K270 PolarHBondContact O-NZ 2.73Å
193	A	61.5	Low	60.6	Low	60 Å²	60	75.6 Å²	75.6	50%	0.496	38%	0.379	S	S	.	.	S	Bend	trans	-60.1	-31.9	-178.3	0	0	0	0	0	116.4	R190 K270	R190-A193 WeakPolarHBondContact O-CB 3.35Å; R190-A193 PolarHBondContact O-N 3.19Å; A193-K270 WeakPolarHBondContact O-CE 3.49Å; A193-K270 PolarHBondContact O-NZ 3.34Å
194	P	53.6	Low	59.6	Low	100 Å²	100	68.2 Å²	68.2	65%	0.649	35%	0.35	S	S	*	.	S	Bend	trans	-86.9	-28.1	179.8	-11.5	29.5	0	0	0	114.2	F191 L192	F191-P194 WeakPolarHBondContact O-CD 3.22Å; L192-P194 VanDerWaalsContact C-CD 3.47Å
195	F	51.3	Low	58.4	Low	96 Å²	96	69.2 Å²	69.2	42%	0.421	35%	0.354	S	S	.	.	S	Bend	trans	-72.7	140.7	-169.7	-66.1	-76.2	0	0	0	113	F191 L192 V200 K270	F191-F195 WeakPolarHBondContact O-CD2 3.39Å; F191-F195 WeakPolarHBondContact O-CE2 3.4Å; L192-F195 PolarHBondContact O-N 3.39Å; F195-V200 HydrophobicContact CB-CG2 3.34Å; F195-V200 HydrophobicContact CD1-CG2 4.19Å; F195-V200 HydrophobicContact CD2-CG2 4.28Å; F195-V200 HydrophobicContact CG-CG2 3.7Å; F195-K270 PolarHBondContact O-NZ 3.35Å
196	K	52	Low	57.3	Low	150 Å²	150	68.8 Å²	68.8	65%	0.652	35%	0.351	S	S	*	.			trans	-72.7	134.2	166.2	-70.1	-178.1	-178.1	173.2	0	108.5	K198 E199	K196-K198 PolarHBondContact O-N 3.01Å; K196-E199 HydrophobicContact CB-CG 4.16Å; K196-E199 VanDerWaalsContact O-CB 3.28Å; K196-E199 WeakPolarHBondContact O-CB 3.42Å; K196-E199 PolarHBondContact O-N 3.25Å
197	F	46.3	Very low	56.1	Low	38 Å²	38	67.6 Å²	67.6	17%	0.167	35%	0.35	C	S	.	.	H	α-helix	trans	-68.6	-34.3	-163.3	-172.3	-100.9	0	0	0	114	E199 V200 C201 F206 T263 A266 Y267	F197-E199 PolarHBondContact O-N 2.71Å; F197-V200 PolarHBondContact O-N 3.01Å; F197-C201 HydrophobicContact CD1-CB 4.34Å; F197-C201 HydrophobicContact CD2-CB 4.39Å; F197-C201 HydrophobicContact CE1-CB 3.59Å; F197-C201 HydrophobicContact CE2-CB 3.64Å; F197-C201 WeakPolarHBondContact CE2-SG 3.28Å; F197-C201 HydrophobicContact CZ-CB 3.09Å; F197-C201 WeakPolarHBondContact CZ-SG 3.39Å; F197-C201 PolarHBondContact O-N 2.83Å; F197-F206 HydrophobicContact CE2-CE2 4.14Å; F197-F206 HydrophobicContact CZ-CD2 4.41Å; F197-F206 HydrophobicContact CZ-CE2 4.3Å; F197-T263 HydrophobicContact CE1-CG2 4.47Å; F197-T263 WeakPolarHBondContact CE1-O 3.19Å; F197-T263 WeakPolarHBondContact CE2-O 3.46Å; F197-T263 VanDerWaalsContact CZ-CA 3.42Å; F197-T263 VanDerWaalsContact CZ-CB 3.46Å; F197-T263 HydrophobicContact CZ-CG2 4.27Å; F197-T263 WeakPolarHBondContact CZ-O 3.41Å; F197-A266 HydrophobicContact CD2-CB 4.24Å; F197-A266 HydrophobicContact CE2-CB 3.78Å; F197-Y267 HydrophobicContact CB-CD2 4.03Å
198	K	48.2	Very low	55.1	Low	168 Å²	168	67.2 Å²	67.2	73%	0.73	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-23.5	170.3	-71.9	-172.9	177.7	-177.9	0	113.9	K196 C201	K196-K198 PolarHBondContact O-N 3.01Å; K198-C201 CarbonylContact C-O 3.59Å
199	E	47.4	Very low	54.6	Low	112 Å²	112	71 Å²	71	52%	0.523	36%	0.356	S	S	.	.	H	α-helix	trans	-80	-33.2	-179	-62.9	169.3	-179.7	0	0	110.6	K196 F197 K209	K196-E199 HydrophobicContact CB-CG 4.16Å; K196-E199 VanDerWaalsContact O-CB 3.28Å; K196-E199 WeakPolarHBondContact O-CB 3.42Å; K196-E199 PolarHBondContact O-N 3.25Å; F197-E199 PolarHBondContact O-N 2.71Å; E199-K209 WeakPolarHBondContact O-CD 3.46Å; E199-K209 PolarHBondContact O-NZ 2.99Å
200	V	45	Very low	54.2	Low	8 Å²	8	78.8 Å²	78.8	5%	0.048	39%	0.391	C	S	.	.	H	α-helix	trans	-90.8	-35.5	-178.4	177.2	0	0	0	0	113	F195 F197 K209 V212	F195-V200 HydrophobicContact CB-CG2 3.34Å; F195-V200 HydrophobicContact CD1-CG2 4.19Å; F195-V200 HydrophobicContact CD2-CG2 4.28Å; F195-V200 HydrophobicContact CG-CG2 3.7Å; F197-V200 PolarHBondContact O-N 3.01Å; V200-K209 PolarHBondContact O-N 2.84Å; V200-V212 HydrophobicContact CB-CG2 4.34Å; V200-V212 HydrophobicContact CG1-CB 4.09Å; V200-V212 HydrophobicContact CG1-CG1 3.72Å; V200-V212 HydrophobicContact CG1-CG2 4.09Å; V200-V212 HydrophobicContact CG2-CG1 4.42Å; V200-V212 HydrophobicContact CG2-CG2 4.21Å
201	C	46.2	Very low	53.7	Low	3 Å²	3	76.2 Å²	76.2	2%	0.02	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-128.1	136.6	-170.4	-71	0	0	0	0	110.6	F197 K198 T263	F197-C201 HydrophobicContact CD1-CB 4.34Å; F197-C201 HydrophobicContact CD2-CB 4.39Å; F197-C201 HydrophobicContact CE1-CB 3.59Å; F197-C201 HydrophobicContact CE2-CB 3.64Å; F197-C201 WeakPolarHBondContact CE2-SG 3.28Å; F197-C201 HydrophobicContact CZ-CB 3.09Å; F197-C201 WeakPolarHBondContact CZ-SG 3.39Å; F197-C201 PolarHBondContact O-N 2.83Å; K198-C201 CarbonylContact C-O 3.59Å; C201-T263 HydrophobicContact CB-CG2 3.65Å
202	G	46.5	Very low	53.7	Low	40 Å²	40	73.5 Å²	73.5	41%	0.412	38%	0.381	S	S	.	.			trans	-65.5	177.5	175.4	0	0	0	0	0	112.7	T263	G202-T263 WeakPolarHBondContact O-CG2 2.88Å; G202-T263 PolarHBondContact O-OG1 2.89Å
203	Q	51.9	Low	53.8	Low	143 Å²	143	73.6 Å²	73.6	67%	0.668	38%	0.382	S	S	*	.	S	Bend	trans	-81.8	117.7	164	-65.7	-179.9	3	0	0	106.9
204	G	56.9	Low	53.8	Low	10 Å²	10	72.8 Å²	72.8	10%	0.103	37%	0.372	C	S	.	.	S	Bend	trans	135	-150.7	-178.1	0	0	0	0	0	114	T263	G204-T263 WeakPolarHBondContact O-CB 3.46Å; G204-T263 WeakPolarHBondContact O-CG2 3.27Å; G204-T263 PolarHBondContact O-N 2.98Å; G204-T263 VanDerWaalsContact O-N 3.16Å; G204-T263 PolarHBondContact O-OG1 3.43Å
205	Q	56.1	Low	54.4	Low	58 Å²	58	72.5 Å²	72.5	27%	0.271	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-58.6	141.6	175	-174.3	176.3	-12.3	0	0	111.5	W116 L207 N259 L261 T263	W116-Q205 HydrophobicContact CD2-CB 4.45Å; W116-Q205 HydrophobicContact CH2-CB 4.18Å; W116-Q205 HydrophobicContact CH2-CG 4.13Å; W116-Q205 HydrophobicContact CZ2-CB 3.94Å; W116-Q205 HydrophobicContact CZ2-CG 4.29Å; Q205-L207 VanDerWaalsContact C-N 3.32Å; Q205-L207 PolarHBondContact O-N 3Å; Q205-N259 PolarHBondContact NE2-O 2.79Å; Q205-L261 CarbonylContact C-O 3.59Å; Q205-T263 WeakPolarHBondContact O-CG2 3.34Å
206	F	57.8	Low	55	Low	15 Å²	15	68.7 Å²	68.7	7%	0.066	35%	0.348	C	S	.	.			trans	-62.9	92.9	178	-166.7	-77.8	0	0	0	108.7	E65 F197 P208 L233 L261 T263 A266	E65-F206 WeakPolarHBondContact OE1-CD1 3.32Å; E65-F206 WeakPolarHBondContact OE1-CG 3.27Å; F197-F206 HydrophobicContact CE2-CE2 4.14Å; F197-F206 HydrophobicContact CZ-CD2 4.41Å; F197-F206 HydrophobicContact CZ-CE2 4.3Å; F206-P208 HydrophobicContact CE1-CB 4.28Å; F206-P208 HydrophobicContact CE1-CG 3.96Å; F206-L233 HydrophobicContact CD1-CD2 3.38Å; F206-L233 HydrophobicContact CE1-CD1 3.86Å; F206-L233 HydrophobicContact CE1-CD2 3.08Å; F206-L233 HydrophobicContact CE1-CG 4.08Å; F206-L233 HydrophobicContact CG-CD2 4.49Å; F206-L233 HydrophobicContact CZ-CD1 4.31Å; F206-L233 HydrophobicContact CZ-CD2 3.99Å; F206-L261 WeakPolarHBondContact CA-O 3.36Å; F206-L261 HydrophobicContact CB-CB 4.49Å; F206-L261 WeakPolarHBondContact CB-O 3.38Å; F206-L261 PolarHBondContact N-O 3.31Å; F206-T263 HydrophobicContact CB-CG2 4.42Å; F206-A266 HydrophobicContact CE2-CB 4.24Å
207	L	54.4	Low	55.6	Low	94 Å²	94	63.6 Å²	63.6	49%	0.492	33%	0.33	S	S	.	.			trans	-123.2	105.1	162.5	-65.5	173.1	0	0	0	104.4	Q205 K209 N259	Q205-L207 VanDerWaalsContact C-N 3.32Å; Q205-L207 PolarHBondContact O-N 3Å; L207-K209 PolarHBondContact O-N 3.12Å; L207-N259 HydrophobicContact CD2-CB 4.32Å
208	P	53.3	Low	56.6	Low	21 Å²	21	68.4 Å²	68.4	14%	0.136	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-56.3	134.8	171.6	23.1	-25.8	0	0	0	106.4	F206 Q210 L213	F206-P208 HydrophobicContact CE1-CB 4.28Å; F206-P208 HydrophobicContact CE1-CG 3.96Å; P208-Q210 PolarHBondContact O-N 2.7Å; P208-L213 HydrophobicContact CB-CB 4.47Å; P208-L213 HydrophobicContact CG-CB 4.22Å; P208-L213 HydrophobicContact CG-CD1 4.27Å
209	K	55.9	Low	57.5	Low	96 Å²	96	63.7 Å²	63.7	42%	0.417	34%	0.338	S	S	.	.			trans	-49.3	135.3	175.7	-76.2	-178.3	-175	162.2	0	107.9	E199 V200 L207 T211 V212 L213	E199-K209 WeakPolarHBondContact O-CD 3.46Å; E199-K209 PolarHBondContact O-NZ 2.99Å; V200-K209 PolarHBondContact O-N 2.84Å; L207-K209 PolarHBondContact O-N 3.12Å; K209-T211 PolarHBondContact O-N 2.88Å; K209-V212 PolarHBondContact O-N 3.47Å; K209-L213 PolarHBondContact O-N 3.48Å; K209-L213 VanDerWaalsContact O-N 3.08Å
210	Q	59.1	Low	58.5	Low	177 Å²	177	60.3 Å²	60.3	83%	0.827	32%	0.322	S	S	*	.	H	α-helix	trans	-50	-32.6	-177.3	-73.8	-174.6	4.7	0	0	112.2	P208 S214	P208-Q210 PolarHBondContact O-N 2.7Å; Q210-S214 VanDerWaalsContact O-CB 3.22Å; Q210-S214 WeakPolarHBondContact O-CB 3.35Å; Q210-S214 PolarHBondContact O-N 3.21Å; Q210-S214 PolarHBondContact O-OG 2.92Å
211	T	58.6	Low	59.5	Low	90 Å²	90	60.6 Å²	60.6	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-64	-37	174.2	39.7	0	0	0	0	114.7	K209 S214 I215	K209-T211 PolarHBondContact O-N 2.88Å; T211-S214 WeakPolarHBondContact CA-OG 3.23Å; T211-S214 PolarHBondContact O-OG 3.37Å; T211-I215 WeakPolarHBondContact O-CD1 3.35Å; T211-I215 WeakPolarHBondContact O-CG1 3.39Å; T211-I215 PolarHBondContact O-N 2.88Å; T211-I215 VanDerWaalsContact O-N 3.15Å
212	V	63.1	Low	60.5	Low	18 Å²	18	63.3 Å²	63.3	11%	0.109	34%	0.341	C	S	.	.	H	α-helix	trans	-77.8	-41.8	176.6	-179.8	0	0	0	0	110.4	V200 K209 S214 I215 I216	V200-V212 HydrophobicContact CB-CG2 4.34Å; V200-V212 HydrophobicContact CG1-CB 4.09Å; V200-V212 HydrophobicContact CG1-CG1 3.72Å; V200-V212 HydrophobicContact CG1-CG2 4.09Å; V200-V212 HydrophobicContact CG2-CG1 4.42Å; V200-V212 HydrophobicContact CG2-CG2 4.21Å; K209-V212 PolarHBondContact O-N 3.47Å; V212-S214 VanDerWaalsContact C-N 3.28Å; V212-S214 PolarHBondContact O-N 2.82Å; V212-I215 PolarHBondContact O-N 3.25Å; V212-I216 HydrophobicContact CG1-CD1 3.94Å; V212-I216 HydrophobicContact CG1-CG1 4.47Å; V212-I216 WeakPolarHBondContact O-CG1 3.43Å; V212-I216 PolarHBondContact O-N 3.32Å
213	L	63.7	Low	61.3	Low	49 Å²	49	71.1 Å²	71.1	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-59.8	-42.6	174.1	-172.6	63.4	0	0	0	110.5	P208 K209 I216 V217 L236	P208-L213 HydrophobicContact CB-CB 4.47Å; P208-L213 HydrophobicContact CG-CB 4.22Å; P208-L213 HydrophobicContact CG-CD1 4.27Å; K209-L213 PolarHBondContact O-N 3.48Å; K209-L213 VanDerWaalsContact O-N 3.08Å; L213-I216 PolarHBondContact O-N 3.29Å; L213-V217 HydrophobicContact CD1-CG2 4.29Å; L213-V217 HydrophobicContact CG-CG2 4.26Å; L213-V217 VanDerWaalsContact O-CB 3.24Å; L213-V217 WeakPolarHBondContact O-CB 3.36Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 3.23Å; L213-L236 HydrophobicContact CD1-CD1 3.92Å
214	S	61.8	Low	61.8	Low	42 Å²	42	65.8 Å²	65.8	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-41.9	177.2	70.9	0	0	0	0	112	Q210 T211 V212 I216 V217 E218	Q210-S214 VanDerWaalsContact O-CB 3.22Å; Q210-S214 WeakPolarHBondContact O-CB 3.35Å; Q210-S214 PolarHBondContact O-N 3.21Å; Q210-S214 PolarHBondContact O-OG 2.92Å; T211-S214 WeakPolarHBondContact CA-OG 3.23Å; T211-S214 PolarHBondContact O-OG 3.37Å; V212-S214 VanDerWaalsContact C-N 3.28Å; V212-S214 PolarHBondContact O-N 2.82Å; S214-I216 PolarHBondContact O-N 2.86Å; S214-V217 PolarHBondContact O-N 3.1Å; S214-E218 VanDerWaalsContact O-CB 3.25Å; S214-E218 WeakPolarHBondContact O-CB 3.27Å; S214-E218 VanDerWaalsContact O-CG 3.23Å; S214-E218 WeakPolarHBondContact O-CG 3.42Å; S214-E218 PolarHBondContact O-N 2.88Å
215	I	66	Low	61.9	Low	94 Å²	94	74.6 Å²	74.6	48%	0.482	37%	0.371	S	S	.	.	H	α-helix	trans	-60.5	-46.2	175.1	-70.8	163.5	0	0	0	111	T211 V212 T219	T211-I215 WeakPolarHBondContact O-CD1 3.35Å; T211-I215 WeakPolarHBondContact O-CG1 3.39Å; T211-I215 PolarHBondContact O-N 2.88Å; T211-I215 VanDerWaalsContact O-N 3.15Å; V212-I215 PolarHBondContact O-N 3.25Å; I215-T219 WeakPolarHBondContact O-CB 3.46Å; I215-T219 PolarHBondContact O-N 3.01Å; I215-T219 PolarHBondContact O-OG1 3.21Å
216	I	64.4	Low	62.2	Low	17 Å²	17	72.2 Å²	72.2	9%	0.087	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-45.4	179.2	-65.7	167.8	0	0	0	109.9	L192 V212 L213 S214 F220 L236	L192-I216 HydrophobicContact CD2-CD1 3.79Å; V212-I216 HydrophobicContact CG1-CD1 3.94Å; V212-I216 HydrophobicContact CG1-CG1 4.47Å; V212-I216 WeakPolarHBondContact O-CG1 3.43Å; V212-I216 PolarHBondContact O-N 3.32Å; L213-I216 PolarHBondContact O-N 3.29Å; S214-I216 PolarHBondContact O-N 2.86Å; I216-F220 HydrophobicContact CG2-CD2 4.13Å; I216-F220 WeakPolarHBondContact O-CB 3.15Å; I216-F220 VanDerWaalsContact O-CD2 3.31Å; I216-F220 WeakPolarHBondContact O-CD2 3.46Å; I216-F220 PolarHBondContact O-N 3.29Å; I216-L236 HydrophobicContact CG2-CD1 3.86Å; I216-L236 HydrophobicContact CG2-CD2 3.71Å; I216-L236 HydrophobicContact CG2-CG 4.34Å
217	V	64.4	Low	62.3	Low	43 Å²	43	79.3 Å²	79.3	26%	0.261	39%	0.388	S	S	.	.	H	α-helix	trans	-61.7	-52.7	179	162.1	0	0	0	0	110.5	L213 S214 T219 C221	L213-V217 HydrophobicContact CD1-CG2 4.29Å; L213-V217 HydrophobicContact CG-CG2 4.26Å; L213-V217 VanDerWaalsContact O-CB 3.24Å; L213-V217 WeakPolarHBondContact O-CB 3.36Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 3.23Å; S214-V217 PolarHBondContact O-N 3.1Å; V217-T219 VanDerWaalsContact C-N 3.34Å; V217-T219 PolarHBondContact O-N 2.87Å; V217-C221 VanDerWaalsContact C-SG 3.51Å; V217-C221 WeakPolarHBondContact CA-SG 3.28Å; V217-C221 WeakPolarHBondContact CG1-SG 3.46Å; V217-C221 WeakPolarHBondContact O-CA 3.39Å; V217-C221 WeakPolarHBondContact O-CB 3.49Å; V217-C221 PolarHBondContact O-N 3.2Å; V217-C221 PolarHBondContact O-SG 3.16Å
218	E	67.7	Low	62.6	Low	139 Å²	139	80 Å²	80	65%	0.65	39%	0.392	S	S	*	.	H	α-helix	trans	-65.5	-35.3	-178.3	-72	170.9	-165.8	0	0	112.8	S214 P222	S214-E218 VanDerWaalsContact O-CB 3.25Å; S214-E218 WeakPolarHBondContact O-CB 3.27Å; S214-E218 VanDerWaalsContact O-CG 3.23Å; S214-E218 WeakPolarHBondContact O-CG 3.42Å; S214-E218 PolarHBondContact O-N 2.88Å; E218-P222 WeakPolarHBondContact O-CD 3.4Å; E218-P222 WeakPolarHBondContact O-CG 3.46Å
219	T	67.9	Low	63	Low	68 Å²	68	79 Å²	79	42%	0.417	39%	0.386	S	S	.	.	H	α-helix	trans	-78.4	-40.4	-178.2	-53.7	0	0	0	0	112	I215 V217 Y223	I215-T219 WeakPolarHBondContact O-CB 3.46Å; I215-T219 PolarHBondContact O-N 3.01Å; I215-T219 PolarHBondContact O-OG1 3.21Å; V217-T219 VanDerWaalsContact C-N 3.34Å; V217-T219 PolarHBondContact O-N 2.87Å; T219-Y223 VanDerWaalsContact O-CD2 3.25Å; T219-Y223 WeakPolarHBondContact O-CD2 3.34Å; T219-Y223 VanDerWaalsContact O-CE2 3.28Å; T219-Y223 WeakPolarHBondContact O-CE2 3.45Å
220	F	66.9	Low	63.2	Low	42 Å²	42	74.5 Å²	74.5	18%	0.184	37%	0.366	C	S	.	.	H	α-helix	trans	-109.2	-32.2	-169.8	-60.8	-75.2	0	0	0	114	P188 F191 I216 P222 Y223 M224	P188-F220 HydrophobicContact CB-CD2 4.21Å; P188-F220 HydrophobicContact CB-CG 4.24Å; P188-F220 HydrophobicContact CG-CB 4.31Å; P188-F220 HydrophobicContact CG-CD1 4.44Å; P188-F220 HydrophobicContact CG-CG 4.21Å; F191-F220 HydrophobicContact CD1-CZ 4.28Å; F191-F220 AromaticContact CD2-CE1 3.88Å; F191-F220 HydrophobicContact CD2-CE1 3.88Å; F191-F220 AromaticContact CD2-CE2 3.74Å; F191-F220 HydrophobicContact CD2-CE2 3.74Å; F191-F220 AromaticContact CD2-CZ 3.2Å; F191-F220 HydrophobicContact CD2-CZ 3.2Å; F191-F220 HydrophobicContact CE1-CZ 4.11Å; F191-F220 HydrophobicContact CE2-CD1 4.5Å; F191-F220 AromaticContact CE2-CE1 3.29Å; F191-F220 HydrophobicContact CE2-CE1 3.29Å; F191-F220 AromaticContact CE2-CE2 3.99Å; F191-F220 HydrophobicContact CE2-CE2 3.99Å; F191-F220 AromaticContact CE2-CZ 2.99Å; F191-F220 HydrophobicContact CE2-CZ 2.99Å; F191-F220 HydrophobicContact CG-CE2 4.19Å; F191-F220 AromaticContact CG-CZ 3.85Å; F191-F220 HydrophobicContact CG-CZ 3.85Å; F191-F220 AromaticContact CZ-CE1 3.84Å; F191-F220 HydrophobicContact CZ-CE1 3.84Å; F191-F220 AromaticContact CZ-CZ 3.46Å; F191-F220 HydrophobicContact CZ-CZ 3.46Å; F191-F220 VanDerWaalsContact CZ-CZ 3.46Å; I216-F220 HydrophobicContact CG2-CD2 4.13Å; I216-F220 WeakPolarHBondContact O-CB 3.15Å; I216-F220 VanDerWaalsContact O-CD2 3.31Å; I216-F220 WeakPolarHBondContact O-CD2 3.46Å; I216-F220 PolarHBondContact O-N 3.29Å; F220-P222 VanDerWaalsContact C-N 3.32Å; F220-Y223 PolarHBondContact O-N 3.35Å; F220-Y223 VanDerWaalsContact O-N 3.13Å; F220-M224 HydrophobicContact CB-CE 3.72Å; F220-M224 PolarHBondContact O-N 2.91Å
221	C	67.1	Low	63	Low	14 Å²	14	70 Å²	70	10%	0.095	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-57.3	-37.1	178.9	-58.8	0	0	0	0	113.8	V217 Y223 M224 C230	V217-C221 VanDerWaalsContact C-SG 3.51Å; V217-C221 WeakPolarHBondContact CA-SG 3.28Å; V217-C221 WeakPolarHBondContact CG1-SG 3.46Å; V217-C221 WeakPolarHBondContact O-CA 3.39Å; V217-C221 WeakPolarHBondContact O-CB 3.49Å; V217-C221 PolarHBondContact O-N 3.2Å; V217-C221 PolarHBondContact O-SG 3.16Å; C221-Y223 PolarHBondContact O-N 2.92Å; C221-Y223 VanDerWaalsContact O-N 3.15Å; C221-M224 PolarHBondContact O-N 3.17Å; C221-M224 VanDerWaalsContact O-N 3.11Å; C221-C230 WeakPolarHBondContact CA-SG 3.43Å; C221-C230 HydrophobicContact CB-CB 3.72Å; C221-C230 WeakPolarHBondContact CB-SG 3.47Å; C221-C230 WeakPolarHBondContact SG-CB 3.4Å; C221-C230 CovalentContact SG-SG 1.98Å; C221-C230 PolarHBondContact SG-SG 3.31Å
222	P	66.6	Low	63.5	Low	60 Å²	60	66 Å²	66	39%	0.39	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-58.8	-29.7	-180	-27.6	36.5	0	0	0	113.5	E218 F220 R227	E218-P222 WeakPolarHBondContact O-CD 3.4Å; E218-P222 WeakPolarHBondContact O-CG 3.46Å; F220-P222 VanDerWaalsContact C-N 3.32Å; P222-R227 PolarHBondContact O-NH2 2.92Å
223	Y	63.5	Low	63.6	Low	203 Å²	203	66.1 Å²	66.1	80%	0.796	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-94.5	-9.8	-178.8	-55.5	-75.7	0	0	0	113.6	T219 F220 C221	T219-Y223 VanDerWaalsContact O-CD2 3.25Å; T219-Y223 WeakPolarHBondContact O-CD2 3.34Å; T219-Y223 VanDerWaalsContact O-CE2 3.28Å; T219-Y223 WeakPolarHBondContact O-CE2 3.45Å; F220-Y223 PolarHBondContact O-N 3.35Å; F220-Y223 VanDerWaalsContact O-N 3.13Å; C221-Y223 PolarHBondContact O-N 2.92Å; C221-Y223 VanDerWaalsContact O-N 3.15Å
224	M	62.9	Low	63.9	Low	32 Å²	32	64.4 Å²	64.4	16%	0.158	32%	0.32	C	S	.	.			trans	-88.4	137.7	-178.8	-83.2	-170.3	-69.2	0	0	111.8	F220 C221 A226 C230 L236 Q240	F220-M224 HydrophobicContact CB-CE 3.72Å; F220-M224 PolarHBondContact O-N 2.91Å; C221-M224 PolarHBondContact O-N 3.17Å; C221-M224 VanDerWaalsContact O-N 3.11Å; M224-A226 VanDerWaalsContact C-N 3.35Å; M224-A226 PolarHBondContact O-N 3.29Å; M224-C230 HydrophobicContact CE-CB 3.94Å; M224-C230 WeakPolarHBondContact CE-SG 3.43Å; M224-L236 HydrophobicContact CE-CD2 3.83Å; M224-Q240 HydrophobicContact SD-CG 3.68Å; M224-Q240 PolarHBondContact SD-NE2 3.37Å
225	F	59.7	Low	64.4	Low	194 Å²	194	62.5 Å²	62.5	85%	0.851	31%	0.307	S	S	*	.	S	Bend	trans	-62.6	-40.4	-174.1	-177	-101.1	0	0	0	112.3
226	A	60.8	Low	64.5	Low	8 Å²	8	58.2 Å²	58.2	7%	0.066	29%	0.285	C	S	.	.			trans	-108.9	76.4	-179.1	0	0	0	0	0	110.9	M224 N228 L229 C230 Q240 L242	M224-A226 VanDerWaalsContact C-N 3.35Å; M224-A226 PolarHBondContact O-N 3.29Å; A226-N228 PolarHBondContact O-N 2.87Å; A226-N228 VanDerWaalsContact O-N 3.08Å; A226-L229 HydrophobicContact CB-CB 4.25Å; A226-L229 HydrophobicContact CB-CD1 3.64Å; A226-L229 HydrophobicContact CB-CG 3.94Å; A226-L229 PolarHBondContact O-N 2.94Å; A226-C230 PolarHBondContact O-N 3.18Å; A226-Q240 PolarHBondContact O-OE1 3.06Å; A226-L242 HydrophobicContact CB-CD1 3.52Å; A226-L242 HydrophobicContact CB-CG 4.35Å
227	R	59.5	Low	64.9	Low	165 Å²	165	58.3 Å²	58.3	62%	0.623	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-52.9	-33.7	-176.8	-67.4	-170.4	173.1	-174.2	-1	113.9	P222 L229 C230	P222-R227 PolarHBondContact O-NH2 2.92Å; R227-L229 VanDerWaalsContact C-N 3.27Å; R227-L229 PolarHBondContact O-N 2.78Å; R227-C230 VanDerWaalsContact O-CB 3.26Å; R227-C230 WeakPolarHBondContact O-CB 3.47Å; R227-C230 PolarHBondContact O-N 3.42Å
228	N	61.8	Low	65.4	Low	107 Å²	107	56.3 Å²	56.3	57%	0.572	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-67.2	-22.9	177.4	60.9	-36.7	0	0	0	113.9	A226	A226-N228 PolarHBondContact O-N 2.87Å; A226-N228 VanDerWaalsContact O-N 3.08Å
229	L	61.8	Low	65.6	Low	2 Å²	2	50 Å²	50	1%	0.01	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-91.1	-9.9	176.6	-56.4	178.1	0	0	0	112.3	A226 R227 S231 D232 F235 L242 L250 L254	A226-L229 HydrophobicContact CB-CB 4.25Å; A226-L229 HydrophobicContact CB-CD1 3.64Å; A226-L229 HydrophobicContact CB-CG 3.94Å; A226-L229 PolarHBondContact O-N 2.94Å; R227-L229 VanDerWaalsContact C-N 3.27Å; R227-L229 PolarHBondContact O-N 2.78Å; L229-S231 PolarHBondContact O-N 3.21Å; L229-D232 WeakPolarHBondContact O-CB 3.17Å; L229-D232 PolarHBondContact O-N 2.89Å; L229-F235 HydrophobicContact CB-CB 4.39Å; L229-F235 HydrophobicContact CB-CD2 4.19Å; L229-F235 HydrophobicContact CB-CG 4.1Å; L229-F235 HydrophobicContact CD1-CD1 4.32Å; L229-F235 HydrophobicContact CD1-CE1 4.14Å; L229-F235 HydrophobicContact CD1-CE2 4.49Å; L229-F235 HydrophobicContact CD1-CZ 4.25Å; L229-F235 HydrophobicContact CD2-CE2 4.33Å; L229-L242 HydrophobicContact CD1-CD1 3.67Å; L229-L242 HydrophobicContact CD1-CD2 3.61Å; L229-L242 HydrophobicContact CD1-CG 4.18Å; L229-L250 HydrophobicContact CD1-CD1 3.76Å; L229-L250 HydrophobicContact CD2-CD1 4.38Å; L229-L254 HydrophobicContact CD2-CD1 4.07Å; L229-L254 HydrophobicContact CD2-CD2 4.12Å; L229-L254 HydrophobicContact CD2-CG 4.47Å
230	C	60.1	Low	65.5	Low	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.1	-176.8	-177.4	0	0	0	0	114	C221 M224 A226 R227 D232 L236	C221-C230 WeakPolarHBondContact CA-SG 3.43Å; C221-C230 HydrophobicContact CB-CB 3.72Å; C221-C230 WeakPolarHBondContact CB-SG 3.47Å; C221-C230 WeakPolarHBondContact SG-CB 3.4Å; C221-C230 CovalentContact SG-SG 1.98Å; C221-C230 PolarHBondContact SG-SG 3.31Å; M224-C230 HydrophobicContact CE-CB 3.94Å; M224-C230 WeakPolarHBondContact CE-SG 3.43Å; A226-C230 PolarHBondContact O-N 3.18Å; R227-C230 VanDerWaalsContact O-CB 3.26Å; R227-C230 WeakPolarHBondContact O-CB 3.47Å; R227-C230 PolarHBondContact O-N 3.42Å; C230-D232 VanDerWaalsContact C-N 3.26Å; C230-L236 VanDerWaalsContact O-CD1 3.31Å; C230-L236 WeakPolarHBondContact O-CD1 3.37Å; C230-L236 WeakPolarHBondContact O-CD2 3.15Å; C230-L236 VanDerWaalsContact O-CG 3.25Å; C230-L236 WeakPolarHBondContact O-CG 3.28Å
231	S	55.4	Low	65.5	Low	84 Å²	84	50.8 Å²	50.8	59%	0.587	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-13.3	170.3	54.4	0	0	0	0	113.2	L229	L229-S231 PolarHBondContact O-N 3.21Å
232	D	67.6	Low	65.8	Low	4 Å²	4	51.4 Å²	51.4	2%	0.021	25%	0.248	C	C	.	.			trans	-84.9	121.2	177.9	-177.4	-74.3	0	0	0	110.1	L229 C230 L234 F235 L236 L254 T257	L229-D232 WeakPolarHBondContact O-CB 3.17Å; L229-D232 PolarHBondContact O-N 2.89Å; C230-D232 VanDerWaalsContact C-N 3.26Å; D232-L234 VanDerWaalsContact C-N 3.3Å; D232-L234 PolarHBondContact O-N 3.27Å; D232-L234 WeakPolarHBondContact OD1-CA 3.45Å; D232-L234 VanDerWaalsContact OD1-CB 3.25Å; D232-L234 WeakPolarHBondContact OD1-CB 3.31Å; D232-L234 PolarHBondContact OD1-N 3.04Å; D232-F235 HydrophobicContact CB-CB 4.37Å; D232-F235 HydrophobicContact CB-CD2 3.88Å; D232-F235 PolarHBondContact O-N 3.36Å; D232-F235 WeakPolarHBondContact OD1-CD2 3.18Å; D232-F235 PolarHBondContact OD1-N 2.81Å; D232-F235 VanDerWaalsContact OD1-N 3.09Å; D232-L236 WeakPolarHBondContact O-CG 3.04Å; D232-L236 PolarHBondContact O-N 2.5Å; D232-L254 HydrophobicContact CB-CD2 3.66Å; D232-L254 WeakPolarHBondContact OD2-CD2 3.22Å; D232-T257 PolarHBondContact OD2-OG1 3.3Å
233	L	66	Low	66.5	Low	22 Å²	22	53.1 Å²	53.1	12%	0.115	25%	0.25	C	S	.	.	H	α-helix	trans	-62.1	-37.2	-175.8	179.2	69.1	0	0	0	112.4	E65 F206 F235 L236 L237	E65-L233 HydrophobicContact CG-CD2 3.72Å; E65-L233 HydrophobicContact CG-CG 4.46Å; F206-L233 HydrophobicContact CD1-CD2 3.38Å; F206-L233 HydrophobicContact CE1-CD1 3.86Å; F206-L233 HydrophobicContact CE1-CD2 3.08Å; F206-L233 HydrophobicContact CE1-CG 4.08Å; F206-L233 HydrophobicContact CG-CD2 4.49Å; F206-L233 HydrophobicContact CZ-CD1 4.31Å; F206-L233 HydrophobicContact CZ-CD2 3.99Å; L233-F235 VanDerWaalsContact C-N 3.34Å; L233-L236 WeakPolarHBondContact O-CB 3.22Å; L233-L236 PolarHBondContact O-N 2.98Å; L233-L237 HydrophobicContact CD1-CD1 4.1Å; L233-L237 HydrophobicContact CD1-CG 4.17Å; L233-L237 HydrophobicContact CD2-CD1 4.49Å; L233-L237 HydrophobicContact CG-CD1 3.9Å; L233-L237 HydrophobicContact CG-CG 4.31Å; L233-L237 WeakPolarHBondContact O-CB 3.32Å; L233-L237 VanDerWaalsContact O-CG 3.24Å; L233-L237 WeakPolarHBondContact O-CG 3.01Å; L233-L237 PolarHBondContact O-N 3.11Å
234	L	70.2	Confident	67.4	Low	12 Å²	12	43.7 Å²	43.7	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-43.7	179.2	177.2	60.8	0	0	0	109.9	D232 L236 L237 A238 T257 L324 W328	D232-L234 VanDerWaalsContact C-N 3.3Å; D232-L234 PolarHBondContact O-N 3.27Å; D232-L234 WeakPolarHBondContact OD1-CA 3.45Å; D232-L234 VanDerWaalsContact OD1-CB 3.25Å; D232-L234 WeakPolarHBondContact OD1-CB 3.31Å; D232-L234 PolarHBondContact OD1-N 3.04Å; L234-L236 VanDerWaalsContact C-N 3.34Å; L234-L236 PolarHBondContact O-N 3.04Å; L234-L237 PolarHBondContact O-N 3.2Å; L234-A238 HydrophobicContact CD1-CB 4.24Å; L234-A238 WeakPolarHBondContact O-CB 3.28Å; L234-A238 PolarHBondContact O-N 3.17Å; L234-T257 HydrophobicContact CD2-CG2 4.14Å; L234-L324 HydrophobicContact CD1-CD2 4Å; L234-L324 HydrophobicContact CD2-CD2 4.11Å; L234-L324 HydrophobicContact CG-CD2 3.98Å; L234-W328 HydrophobicContact CD2-CH2 3.43Å; L234-W328 VanDerWaalsContact CD2-CH2 3.43Å; L234-W328 HydrophobicContact CD2-CZ2 4.03Å; L234-W328 HydrophobicContact CD2-CZ3 4.21Å
235	F	72.6	Confident	68.3	Low	2 Å²	2	42.5 Å²	42.5	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-33.6	173.8	-80.3	-73.7	0	0	0	113.5	L229 D232 L233 L237 G239 Q240 L242 I245 L250 L254 L324 W328	L229-F235 HydrophobicContact CB-CB 4.39Å; L229-F235 HydrophobicContact CB-CD2 4.19Å; L229-F235 HydrophobicContact CB-CG 4.1Å; L229-F235 HydrophobicContact CD1-CD1 4.32Å; L229-F235 HydrophobicContact CD1-CE1 4.14Å; L229-F235 HydrophobicContact CD1-CE2 4.49Å; L229-F235 HydrophobicContact CD1-CZ 4.25Å; L229-F235 HydrophobicContact CD2-CE2 4.33Å; D232-F235 HydrophobicContact CB-CB 4.37Å; D232-F235 HydrophobicContact CB-CD2 3.88Å; D232-F235 PolarHBondContact O-N 3.36Å; D232-F235 WeakPolarHBondContact OD1-CD2 3.18Å; D232-F235 PolarHBondContact OD1-N 2.81Å; D232-F235 VanDerWaalsContact OD1-N 3.09Å; L233-F235 VanDerWaalsContact C-N 3.34Å; F235-L237 VanDerWaalsContact C-N 3.34Å; F235-G239 CarbonylContact O-C 3.54Å; F235-G239 WeakPolarHBondContact O-CA 3.35Å; F235-G239 PolarHBondContact O-N 3Å; F235-Q240 HydrophobicContact CB-CG 4.14Å; F235-Q240 HydrophobicContact CD1-CG 4.41Å; F235-L242 HydrophobicContact CE1-CD2 3.97Å; F235-I245 HydrophobicContact CE1-CD1 4.15Å; F235-L250 HydrophobicContact CE1-CD2 4.46Å; F235-L250 HydrophobicContact CE2-CD2 4.12Å; F235-L250 HydrophobicContact CZ-CD2 3.5Å; F235-L250 VanDerWaalsContact CZ-CD2 3.5Å; F235-L254 HydrophobicContact CE2-CD2 4.4Å; F235-L324 HydrophobicContact CD1-CD1 3.85Å; F235-L324 HydrophobicContact CE1-CD1 3.63Å; F235-L324 HydrophobicContact CZ-CD1 4.14Å; F235-W328 HydrophobicContact CE1-CZ3 4.41Å; F235-W328 AromaticContact CE2-CZ3 3.99Å; F235-W328 HydrophobicContact CE2-CZ3 3.99Å; F235-W328 HydrophobicContact CZ-CE3 4.31Å; F235-W328 AromaticContact CZ-CZ3 3.64Å; F235-W328 HydrophobicContact CZ-CZ3 3.64Å
236	L	68.4	Low	69.4	Low	4 Å²	4	35.4 Å²	35.4	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-36.8	172.5	-73.8	174.8	0	0	0	112.7	L213 I216 M224 C230 D232 L233 L234	L213-L236 HydrophobicContact CD1-CD1 3.92Å; I216-L236 HydrophobicContact CG2-CD1 3.86Å; I216-L236 HydrophobicContact CG2-CD2 3.71Å; I216-L236 HydrophobicContact CG2-CG 4.34Å; M224-L236 HydrophobicContact CE-CD2 3.83Å; C230-L236 VanDerWaalsContact O-CD1 3.31Å; C230-L236 WeakPolarHBondContact O-CD1 3.37Å; C230-L236 WeakPolarHBondContact O-CD2 3.15Å; C230-L236 VanDerWaalsContact O-CG 3.25Å; C230-L236 WeakPolarHBondContact O-CG 3.28Å; D232-L236 WeakPolarHBondContact O-CG 3.04Å; D232-L236 PolarHBondContact O-N 2.5Å; L233-L236 WeakPolarHBondContact O-CB 3.22Å; L233-L236 PolarHBondContact O-N 2.98Å; L234-L236 VanDerWaalsContact C-N 3.34Å; L234-L236 PolarHBondContact O-N 3.04Å
237	L	71.7	Confident	70	Confident	19 Å²	19	38.8 Å²	38.8	10%	0.099	20%	0.199	C	C	.	.	H	α-helix	trans	-84.4	-44.3	-176.8	-67.3	176.6	0	0	0	112.9	L64 L192 L233 L234 F235	L64-L237 HydrophobicContact CD2-CD1 3.79Å; L192-L237 HydrophobicContact CD1-CD2 3.5Å; L233-L237 HydrophobicContact CD1-CD1 4.1Å; L233-L237 HydrophobicContact CD1-CG 4.17Å; L233-L237 HydrophobicContact CD2-CD1 4.49Å; L233-L237 HydrophobicContact CG-CD1 3.9Å; L233-L237 HydrophobicContact CG-CG 4.31Å; L233-L237 WeakPolarHBondContact O-CB 3.32Å; L233-L237 VanDerWaalsContact O-CG 3.24Å; L233-L237 WeakPolarHBondContact O-CG 3.01Å; L233-L237 PolarHBondContact O-N 3.11Å; L234-L237 PolarHBondContact O-N 3.2Å; F235-L237 VanDerWaalsContact C-N 3.34Å
238	A	75.6	Confident	70.7	Confident	1 Å²	1	36 Å²	36	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-93.1	-15.6	-171.5	0	0	0	0	0	113.8	L234 H323 L324	L234-A238 HydrophobicContact CD1-CB 4.24Å; L234-A238 WeakPolarHBondContact O-CB 3.28Å; L234-A238 PolarHBondContact O-N 3.17Å; A238-H323 HydrophobicContact CB-CB 4Å; A238-H323 WeakPolarHBondContact O-CB 3.35Å; A238-L324 HydrophobicContact CB-CD1 4.02Å; A238-L324 HydrophobicContact CB-CD2 3.83Å; A238-L324 HydrophobicContact CB-CG 3.71Å
239	G	71.2	Confident	71.3	Confident	8 Å²	8	32.8 Å²	32.8	8%	0.082	18%	0.179	C	C	.	.			trans	99.6	161.2	-177.1	0	0	0	0	0	113.3	F235 I294	F235-G239 CarbonylContact O-C 3.54Å; F235-G239 WeakPolarHBondContact O-CA 3.35Å; F235-G239 PolarHBondContact O-N 3Å; G239-I294 VanDerWaalsContact CA-CD1 3.46Å
240	Q	65.3	Low	71.6	Confident	18 Å²	18	33 Å²	33	8%	0.084	18%	0.181	C	C	.	.			trans	-111.8	21.9	-172.7	-60.6	-162.2	-1.2	0	0	114	M224 A226 F235 L242	M224-Q240 HydrophobicContact SD-CG 3.68Å; M224-Q240 PolarHBondContact SD-NE2 3.37Å; A226-Q240 PolarHBondContact O-OE1 3.06Å; F235-Q240 HydrophobicContact CB-CG 4.14Å; F235-Q240 HydrophobicContact CD1-CG 4.41Å; Q240-L242 WeakPolarHBondContact O-CG 3.33Å; Q240-L242 PolarHBondContact O-N 3.39Å
241	E	68.6	Low	71.7	Confident	107 Å²	107	40 Å²	40	50%	0.5	21%	0.213	S	C	.	.			trans	-67.4	104.4	178.8	-66.6	-59.4	152.6	0	0	109.5
242	L	72	Confident	72.1	Confident	27 Å²	27	42.1 Å²	42.1	14%	0.141	21%	0.212	C	C	.	.			trans	-93.2	-0.2	-174.5	-59.9	-170.3	0	0	0	113.8	A226 L229 F235 Q240 Q244 I245 T247 L250	A226-L242 HydrophobicContact CB-CD1 3.52Å; A226-L242 HydrophobicContact CB-CG 4.35Å; L229-L242 HydrophobicContact CD1-CD1 3.67Å; L229-L242 HydrophobicContact CD1-CD2 3.61Å; L229-L242 HydrophobicContact CD1-CG 4.18Å; F235-L242 HydrophobicContact CE1-CD2 3.97Å; Q240-L242 WeakPolarHBondContact O-CG 3.33Å; Q240-L242 PolarHBondContact O-N 3.39Å; L242-Q244 PolarHBondContact O-N 3.42Å; L242-Q244 VanDerWaalsContact O-N 3.12Å; L242-I245 HydrophobicContact CD2-CB 4.4Å; L242-I245 HydrophobicContact CD2-CD1 4Å; L242-I245 PolarHBondContact O-N 3.07Å; L242-T247 HydrophobicContact CD1-CG2 4.19Å; L242-L250 HydrophobicContact CD1-CD1 4.19Å; L242-L250 HydrophobicContact CD2-CD1 3.98Å
243	H	81.3	Confident	72.1	Confident	96 Å²	96	42.1 Å²	42.1	44%	0.444	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.1	-171.3	73.4	-72.4	0	0	0	113.6	D320 D325	H243-D320 PolarHBondContact CE1-O 3.15Å; H243-D320 VanDerWaalsContact CE1-O 3.25Å; H243-D320 PolarHBondContact NE2-O 2.81Å; H243-D320 IonicContact NE2-OD1 3.43Å; H243-D320 PolarHBondContact NE2-OD1 3.19Å; H243-D325 IonicContact CE1-OD2 3.46Å
244	Q	83.1	Confident	71.7	Confident	5 Å²	5	43 Å²	43	2%	0.023	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	10.2	172.1	-63.9	-160.8	53.9	0	0	113.9	L242 D320 D325 G329 L330 R331	L242-Q244 PolarHBondContact O-N 3.42Å; L242-Q244 VanDerWaalsContact O-N 3.12Å; Q244-D320 PolarHBondContact NE2-OD1 3.16Å; Q244-D325 WeakPolarHBondContact CB-OD1 3.44Å; Q244-G329 CarbonylContact O-C 3.52Å; Q244-G329 VanDerWaalsContact O-CA 3.27Å; Q244-G329 WeakPolarHBondContact O-CA 3.34Å; Q244-L330 VanDerWaalsContact O-CG 3.32Å; Q244-L330 WeakPolarHBondContact O-CG 3.46Å; Q244-L330 PolarHBondContact O-N 3.05Å; Q244-R331 VanDerWaalsContact NE2-NH2 3.12Å
245	I	81.8	Confident	71.2	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.041	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-105.2	129.1	-176.9	-61.1	178.7	0	0	0	110.7	F235 L242 T247 L250 R253 L324 W328	F235-I245 HydrophobicContact CE1-CD1 4.15Å; L242-I245 HydrophobicContact CD2-CB 4.4Å; L242-I245 HydrophobicContact CD2-CD1 4Å; L242-I245 PolarHBondContact O-N 3.07Å; I245-T247 PolarHBondContact O-N 3.17Å; I245-L250 HydrophobicContact CG2-CD1 3.92Å; I245-L250 HydrophobicContact CG2-CD2 3.53Å; I245-L250 HydrophobicContact CG2-CG 3.72Å; I245-R253 VanDerWaalsContact CG2-NH1 3.3Å; I245-L324 HydrophobicContact CD1-CB 4.39Å; I245-W328 HydrophobicContact CD1-CE3 4.48Å
246	N	82.1	Confident	70.6	Confident	44 Å²	44	49 Å²	49	24%	0.235	25%	0.251	C	S	.	.			trans	-68.2	100.6	170.7	-170.7	-33.6	0	0	0	110.5	V248 R249 L250 L330	N246-V248 VanDerWaalsContact C-N 3.29Å; N246-V248 PolarHBondContact O-N 3.16Å; N246-V248 WeakPolarHBondContact OD1-CB 3.39Å; N246-V248 PolarHBondContact OD1-N 3.48Å; N246-V248 VanDerWaalsContact OD1-N 3.17Å; N246-R249 HydrophobicContact CB-CB 4.39Å; N246-R249 HydrophobicContact CB-CG 4.4Å; N246-R249 PolarHBondContact O-N 3.47Å; N246-L250 PolarHBondContact O-N 3.49Å; N246-L330 HydrophobicContact CB-CD2 4.1Å
247	T	73.2	Confident	69.9	Low	80 Å²	80	49 Å²	49	49%	0.491	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-29.9	-175.5	54.9	0	0	0	0	113.7	L242 I245 R249 L250	L242-T247 HydrophobicContact CD1-CG2 4.19Å; I245-T247 PolarHBondContact O-N 3.17Å; T247-R249 PolarHBondContact O-N 3.4Å; T247-L250 HydrophobicContact CG2-CD1 4.05Å; T247-L250 WeakPolarHBondContact O-CB 3.37Å; T247-L250 PolarHBondContact O-N 2.9Å; T247-L250 VanDerWaalsContact O-N 3.12Å
248	V	75.8	Confident	68.8	Low	105 Å²	105	49.7 Å²	49.7	64%	0.636	26%	0.257	S	S	*	.	H	α-helix	trans	-65.3	-26.1	174.9	-179.3	0	0	0	0	111.6	N246	N246-V248 VanDerWaalsContact C-N 3.29Å; N246-V248 PolarHBondContact O-N 3.16Å; N246-V248 WeakPolarHBondContact OD1-CB 3.39Å; N246-V248 PolarHBondContact OD1-N 3.48Å; N246-V248 VanDerWaalsContact OD1-N 3.17Å
249	R	74.3	Confident	67.6	Low	40 Å²	40	53.3 Å²	53.3	15%	0.151	28%	0.276	C	S	.	.	H	α-helix	trans	-86	-20.9	175.2	-69	-165.3	173.9	-137.8	6.9	113.2	N73 N74 L75 N246 T247 E251 K252 R253	N73-R249 WeakPolarHBondContact O-CD 3.4Å; N73-R249 PolarHBondContact O-NH1 3.2Å; N74-R249 PolarHBondContact O-NH1 3.19Å; L75-R249 VanDerWaalsContact CG-NH2 3.35Å; N246-R249 HydrophobicContact CB-CB 4.39Å; N246-R249 HydrophobicContact CB-CG 4.4Å; N246-R249 PolarHBondContact O-N 3.47Å; T247-R249 PolarHBondContact O-N 3.4Å; R249-E251 VanDerWaalsContact C-N 3.32Å; R249-E251 PolarHBondContact O-N 2.97Å; R249-K252 WeakPolarHBondContact O-CB 3.35Å; R249-K252 PolarHBondContact O-N 2.89Å; R249-R253 WeakPolarHBondContact O-CG 3.49Å; R249-R253 PolarHBondContact O-N 3.47Å
250	L	67.7	Low	66.7	Low	7 Å²	7	55 Å²	55	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-57.7	-43.1	-178.7	-74	174.9	0	0	0	112.7	L229 F235 L242 I245 N246 T247 K252 R253 L254	L229-L250 HydrophobicContact CD1-CD1 3.76Å; L229-L250 HydrophobicContact CD2-CD1 4.38Å; F235-L250 HydrophobicContact CE1-CD2 4.46Å; F235-L250 HydrophobicContact CE2-CD2 4.12Å; F235-L250 HydrophobicContact CZ-CD2 3.5Å; F235-L250 VanDerWaalsContact CZ-CD2 3.5Å; L242-L250 HydrophobicContact CD1-CD1 4.19Å; L242-L250 HydrophobicContact CD2-CD1 3.98Å; I245-L250 HydrophobicContact CG2-CD1 3.92Å; I245-L250 HydrophobicContact CG2-CD2 3.53Å; I245-L250 HydrophobicContact CG2-CG 3.72Å; N246-L250 PolarHBondContact O-N 3.49Å; T247-L250 HydrophobicContact CG2-CD1 4.05Å; T247-L250 WeakPolarHBondContact O-CB 3.37Å; T247-L250 PolarHBondContact O-N 2.9Å; T247-L250 VanDerWaalsContact O-N 3.12Å; L250-K252 PolarHBondContact O-N 3.12Å; L250-R253 WeakPolarHBondContact O-CA 3.35Å; L250-R253 WeakPolarHBondContact O-CB 3.4Å; L250-R253 PolarHBondContact O-N 3.39Å; L250-L254 PolarHBondContact O-N 2.79Å; L250-L254 VanDerWaalsContact O-N 3.13Å
251	E	62	Low	66	Low	147 Å²	147	54.4 Å²	54.4	69%	0.687	28%	0.279	S	S	*	.	H	α-helix	trans	-60.3	-30.7	178.2	-65.4	-177.9	168.2	0	0	112.6	R249	R249-E251 VanDerWaalsContact C-N 3.32Å; R249-E251 PolarHBondContact O-N 2.97Å
252	K	64.5	Low	65	Low	129 Å²	129	49.3 Å²	49.3	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-79.3	-18.9	175	-62.7	-179.1	-179.5	173.3	0	112.6	R249 L250 F256	R249-K252 WeakPolarHBondContact O-CB 3.35Å; R249-K252 PolarHBondContact O-N 2.89Å; L250-K252 PolarHBondContact O-N 3.12Å; K252-F256 WeakPolarHBondContact O-CD2 3.49Å; K252-F256 WeakPolarHBondContact O-CE2 3.12Å
253	R	66.9	Low	63.8	Low	3 Å²	3	48.2 Å²	48.2	1%	0.011	25%	0.25	C	C	.	.	H	α-helix	trans	-86.7	-40.9	-177.7	-67.9	175.3	-166.5	173.1	-0	112.7	N74 I245 R249 L250 P255 F256 T257 W328	N74-R253 PolarHBondContact OD1-NH2 3.29Å; I245-R253 VanDerWaalsContact CG2-NH1 3.3Å; R249-R253 WeakPolarHBondContact O-CG 3.49Å; R249-R253 PolarHBondContact O-N 3.47Å; L250-R253 WeakPolarHBondContact O-CA 3.35Å; L250-R253 WeakPolarHBondContact O-CB 3.4Å; L250-R253 PolarHBondContact O-N 3.39Å; R253-P255 VanDerWaalsContact C-N 3.31Å; R253-P255 VanDerWaalsContact O-N 3.15Å; R253-F256 WeakPolarHBondContact O-CA 2.91Å; R253-F256 WeakPolarHBondContact O-CB 3.28Å; R253-F256 PolarHBondContact O-N 2.94Å; R253-T257 PolarHBondContact O-N 3.27Å; R253-W328 VanDerWaalsContact NH1-CD2 3.27Å
254	L	58.6	Low	62.3	Low	42 Å²	42	46.9 Å²	46.9	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-48.7	-42.9	-172.7	-70.2	170.6	0	0	0	114.1	L229 D232 F235 L250 F256 T257 S258	L229-L254 HydrophobicContact CD2-CD1 4.07Å; L229-L254 HydrophobicContact CD2-CD2 4.12Å; L229-L254 HydrophobicContact CD2-CG 4.47Å; D232-L254 HydrophobicContact CB-CD2 3.66Å; D232-L254 WeakPolarHBondContact OD2-CD2 3.22Å; F235-L254 HydrophobicContact CE2-CD2 4.4Å; L250-L254 PolarHBondContact O-N 2.79Å; L250-L254 VanDerWaalsContact O-N 3.13Å; L254-F256 PolarHBondContact O-N 3.01Å; L254-F256 VanDerWaalsContact O-N 3.1Å; L254-T257 WeakPolarHBondContact CA-OG1 3.28Å; L254-T257 PolarHBondContact O-N 3.17Å; L254-T257 PolarHBondContact O-OG1 3.36Å; L254-S258 PolarHBondContact O-N 3.28Å; L254-S258 PolarHBondContact O-OG 3.43Å
255	P	59.5	Low	60.7	Low	84 Å²	84	46.7 Å²	46.7	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-21.9	177.8	-23.4	35.2	0	0	0	114.5	R253	R253-P255 VanDerWaalsContact C-N 3.31Å; R253-P255 VanDerWaalsContact O-N 3.15Å
256	F	59.5	Low	59	Low	55 Å²	55	48.2 Å²	48.2	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-101	-15.3	-175.6	-50.8	-58.4	0	0	0	113.3	I14 I69 K252 R253 L254	I14-F256 HydrophobicContact CD1-CD1 4.47Å; I14-F256 HydrophobicContact CD1-CE1 3.98Å; I14-F256 HydrophobicContact CG1-CE1 4.44Å; I14-F256 HydrophobicContact CG2-CD1 3.99Å; I14-F256 HydrophobicContact CG2-CE1 3.43Å; I14-F256 VanDerWaalsContact CG2-CE1 3.43Å; I14-F256 HydrophobicContact CG2-CZ 3.78Å; I69-F256 HydrophobicContact CD1-CB 4.08Å; I69-F256 HydrophobicContact CD1-CD1 4.16Å; I69-F256 HydrophobicContact CD1-CG 4.06Å; I69-F256 HydrophobicContact CG2-CB 4.41Å; K252-F256 WeakPolarHBondContact O-CD2 3.49Å; K252-F256 WeakPolarHBondContact O-CE2 3.12Å; R253-F256 WeakPolarHBondContact O-CA 2.91Å; R253-F256 WeakPolarHBondContact O-CB 3.28Å; R253-F256 PolarHBondContact O-N 2.94Å; L254-F256 PolarHBondContact O-N 3.01Å; L254-F256 VanDerWaalsContact O-N 3.1Å
257	T	54	Low	57	Low	5 Å²	5	51.5 Å²	51.5	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-97.7	-29.2	-178.8	53.9	0	0	0	0	112.4	D232 L234 R253 L254 W328	D232-T257 PolarHBondContact OD2-OG1 3.3Å; L234-T257 HydrophobicContact CD2-CG2 4.14Å; R253-T257 PolarHBondContact O-N 3.27Å; L254-T257 WeakPolarHBondContact CA-OG1 3.28Å; L254-T257 PolarHBondContact O-N 3.17Å; L254-T257 PolarHBondContact O-OG1 3.36Å; T257-W328 HydrophobicContact CG2-CH2 3.66Å; T257-W328 HydrophobicContact CG2-CZ2 3.78Å
258	S	48.8	Very low	55.6	Low	33 Å²	33	47.9 Å²	47.9	23%	0.231	25%	0.245	C	C	.	.	S	Bend	trans	-90.7	114.7	-174.6	55.7	0	0	0	0	113.1	L254 H260	L254-S258 PolarHBondContact O-N 3.28Å; L254-S258 PolarHBondContact O-OG 3.43Å; S258-H260 PolarHBondContact O-CE1 2.75Å; S258-H260 PolarHBondContact O-ND1 3.35Å; S258-H260 VanDerWaalsContact O-ND1 3.13Å
259	N	50.3	Low	53.9	Low	77 Å²	77	44.8 Å²	44.8	41%	0.412	23%	0.227	S	C	.	.	S	Bend	trans	126.3	13.8	143.1	-63.5	-34.3	0	0	0	118.6	Q205 L207	Q205-N259 PolarHBondContact NE2-O 2.79Å; L207-N259 HydrophobicContact CD2-CB 4.32Å
260	H	52.6	Low	52	Low	44 Å²	44	47 Å²	47	20%	0.204	24%	0.238	C	C	.	.			trans	-115	-3.1	-152.4	-61.2	82.3	0	0	0	119.8	E65 G98 I100 R103 S258	E65-H260 PolarHBondContact OE2-N 2.68Å; G98-H260 CarbonylContact C-O 3.23Å; G98-H260 VanDerWaalsContact C-O 3.23Å; I100-H260 HydrophobicContact CG2-CB 4.34Å; I100-H260 WeakPolarHBondContact CG2-CD2 3.45Å; I100-H260 WeakPolarHBondContact CG2-NE2 3.46Å; R103-H260 VanDerWaalsContact NH2-CA 3.26Å; R103-H260 PolarHBondContact NH2-CD2 3.01Å; R103-H260 PolarHBondContact NH2-O 2.66Å; S258-H260 PolarHBondContact O-CE1 2.75Å; S258-H260 PolarHBondContact O-ND1 3.35Å; S258-H260 VanDerWaalsContact O-ND1 3.13Å
261	L	50.1	Low	50.3	Low	4 Å²	4	51.1 Å²	51.1	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-88.7	172.4	-178.6	-76.9	173.5	0	0	0	115.8	L64 E65 M123 Q205 F206 D265	L64-L261 HydrophobicContact CD1-CD1 3.46Å; L64-L261 VanDerWaalsContact CD1-CD1 3.46Å; L64-L261 HydrophobicContact CG-CD1 4.28Å; E65-L261 HydrophobicContact CB-CD1 4.48Å; E65-L261 HydrophobicContact CG-CD1 4.09Å; M123-L261 HydrophobicContact CE-CD2 3.97Å; Q205-L261 CarbonylContact C-O 3.59Å; F206-L261 WeakPolarHBondContact CA-O 3.36Å; F206-L261 HydrophobicContact CB-CB 4.49Å; F206-L261 WeakPolarHBondContact CB-O 3.38Å; F206-L261 PolarHBondContact N-O 3.31Å; L261-D265 WeakPolarHBondContact CD2-OD2 3.36Å
262	C	47.4	Very low	49.3	Very low	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-71	141.5	166	176.9	0	0	0	0	109.2	W116 F118 Q264 D265	W116-C262 VanDerWaalsContact C-SG 3.59Å; W116-C262 HydrophobicContact CB-CB 4.48Å; W116-C262 HydrophobicContact CE3-CB 3.82Å; W116-C262 PolarHBondContact O-SG 3.07Å; F118-C262 HydrophobicContact CD1-CB 4.41Å; F118-C262 HydrophobicContact CD2-CB 4Å; F118-C262 HydrophobicContact CE1-CB 3.9Å; F118-C262 HydrophobicContact CE2-CB 3.39Å; F118-C262 HydrophobicContact CG-CB 4.46Å; F118-C262 HydrophobicContact CZ-CB 3.35Å; C262-Q264 PolarHBondContact O-N 3.48Å; C262-Q264 PolarHBondContact SG-N 2.83Å; C262-D265 PolarHBondContact O-N 2.98Å
263	T	46.9	Very low	48.2	Very low	4 Å²	4	43.2 Å²	43.2	3%	0.025	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-47.6	167.7	50.9	0	0	0	0	111.1	F197 C201 G202 G204 Q205 F206 D265 A266	F197-T263 HydrophobicContact CE1-CG2 4.47Å; F197-T263 WeakPolarHBondContact CE1-O 3.19Å; F197-T263 WeakPolarHBondContact CE2-O 3.46Å; F197-T263 VanDerWaalsContact CZ-CA 3.42Å; F197-T263 VanDerWaalsContact CZ-CB 3.46Å; F197-T263 HydrophobicContact CZ-CG2 4.27Å; F197-T263 WeakPolarHBondContact CZ-O 3.41Å; C201-T263 HydrophobicContact CB-CG2 3.65Å; G202-T263 WeakPolarHBondContact O-CG2 2.88Å; G202-T263 PolarHBondContact O-OG1 2.89Å; G204-T263 WeakPolarHBondContact O-CB 3.46Å; G204-T263 WeakPolarHBondContact O-CG2 3.27Å; G204-T263 PolarHBondContact O-N 2.98Å; G204-T263 VanDerWaalsContact O-N 3.16Å; G204-T263 PolarHBondContact O-OG1 3.43Å; Q205-T263 WeakPolarHBondContact O-CG2 3.34Å; F206-T263 HydrophobicContact CB-CG2 4.42Å; T263-D265 VanDerWaalsContact C-N 3.27Å; T263-D265 PolarHBondContact O-N 3.07Å; T263-A266 PolarHBondContact O-N 3.32Å
264	Q	49	Very low	46.8	Very low	69 Å²	69	52.3 Å²	52.3	32%	0.322	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.9	-170.9	-52.7	179.4	19.2	0	0	116.2	W116 F118 T119 C262 A266 Y267 S268	W116-Q264 PolarHBondContact O-NE2 3.28Å; F118-Q264 WeakPolarHBondContact O-CB 3.45Å; T119-Q264 HydrophobicContact CG2-CB 3.75Å; T119-Q264 WeakPolarHBondContact CG2-O 3.29Å; C262-Q264 PolarHBondContact O-N 3.48Å; C262-Q264 PolarHBondContact SG-N 2.83Å; Q264-A266 VanDerWaalsContact C-N 3.28Å; Q264-A266 PolarHBondContact O-N 3.46Å; Q264-Y267 VanDerWaalsContact O-CB 3.28Å; Q264-Y267 WeakPolarHBondContact O-CB 3.47Å; Q264-Y267 PolarHBondContact O-N 3.12Å; Q264-S268 PolarHBondContact O-N 2.84Å
265	D	49.5	Very low	45.9	Very low	1 Å²	1	58.7 Å²	58.7	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-37.7	178.9	-75.6	-39	0	0	0	112.7	L64 T119 W120 M123 L261 C262 T263 Y267 S268	L64-D265 HydrophobicContact CD1-CB 4.42Å; T119-D265 WeakPolarHBondContact CA-OD1 3.15Å; W120-D265 PolarHBondContact N-OD1 3.35Å; W120-D265 VanDerWaalsContact N-OD1 3.07Å; M123-D265 WeakPolarHBondContact CE-OD1 3.09Å; M123-D265 VanDerWaalsContact CE-OD2 3.29Å; M123-D265 WeakPolarHBondContact CE-OD2 3.04Å; L261-D265 WeakPolarHBondContact CD2-OD2 3.36Å; C262-D265 PolarHBondContact O-N 2.98Å; T263-D265 VanDerWaalsContact C-N 3.27Å; T263-D265 PolarHBondContact O-N 3.07Å; D265-Y267 VanDerWaalsContact C-N 3.27Å; D265-Y267 PolarHBondContact O-N 2.83Å; D265-S268 PolarHBondContact O-N 2.75Å
266	A	45.9	Very low	45.1	Very low	39 Å²	39	56.3 Å²	56.3	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-68.2	-25.3	176.6	0	0	0	0	0	113.1	F197 F206 T263 Q264	F197-A266 HydrophobicContact CD2-CB 4.24Å; F197-A266 HydrophobicContact CE2-CB 3.78Å; F206-A266 HydrophobicContact CE2-CB 4.24Å; T263-A266 PolarHBondContact O-N 3.32Å; Q264-A266 VanDerWaalsContact C-N 3.28Å; Q264-A266 PolarHBondContact O-N 3.46Å
267	Y	40.2	Very low	44.4	Very low	113 Å²	113	57.1 Å²	57.1	44%	0.443	30%	0.299	S	S	.	.	H	α-helix	trans	-70.4	-39.9	178.5	-175.6	-101.7	0	0	0	111.8	F197 Q264 D265 C269 K270 M271	F197-Y267 HydrophobicContact CB-CD2 4.03Å; Q264-Y267 VanDerWaalsContact O-CB 3.28Å; Q264-Y267 WeakPolarHBondContact O-CB 3.47Å; Q264-Y267 PolarHBondContact O-N 3.12Å; D265-Y267 VanDerWaalsContact C-N 3.27Å; D265-Y267 PolarHBondContact O-N 2.83Å; Y267-C269 VanDerWaalsContact C-N 3.34Å; Y267-C269 PolarHBondContact O-N 2.72Å; Y267-K270 WeakPolarHBondContact O-CB 3.41Å; Y267-K270 PolarHBondContact O-N 2.91Å; Y267-K270 VanDerWaalsContact O-N 3.12Å; Y267-M271 HydrophobicContact CD1-CG 3.85Å; Y267-M271 HydrophobicContact CE1-CB 4.42Å; Y267-M271 HydrophobicContact CE1-CE 3.95Å; Y267-M271 HydrophobicContact CE1-CG 3.44Å; Y267-M271 VanDerWaalsContact CE1-CG 3.44Å; Y267-M271 HydrophobicContact CE2-CE 3.99Å; Y267-M271 HydrophobicContact CE2-CG 4.32Å; Y267-M271 HydrophobicContact CG-CG 4.47Å; Y267-M271 PolarHBondContact O-N 3.46Å; Y267-M271 WeakPolarHBondContact OH-CE 3.24Å
268	S	43.8	Very low	44.4	Very low	5 Å²	5	57.5 Å²	57.5	4%	0.035	30%	0.3	C	S	.	.	H	α-helix	trans	-73.8	-26.2	-176	-167.7	0	0	0	0	112	W120 D121 Q264 D265 K270 M271	W120-S268 VanDerWaalsContact CZ2-OG 3.27Å; W120-S268 WeakPolarHBondContact CZ2-OG 3.33Å; W120-S268 PolarHBondContact NE1-O 2.87Å; W120-S268 PolarHBondContact NE1-OG 2.92Å; D121-S268 PolarHBondContact OD2-OG 2.85Å; Q264-S268 PolarHBondContact O-N 2.84Å; D265-S268 PolarHBondContact O-N 2.75Å; S268-K270 PolarHBondContact O-N 2.64Å; S268-M271 PolarHBondContact O-N 3.04Å
269	C	39.6	Very low	44.6	Very low	40 Å²	40	62 Å²	62	27%	0.27	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-30.9	168.5	-83	0	0	0	0	113.2	V182 Y267	V182-C269 VanDerWaalsContact CG2-O 3.28Å; V182-C269 WeakPolarHBondContact CG2-O 3.42Å; Y267-C269 VanDerWaalsContact C-N 3.34Å; Y267-C269 PolarHBondContact O-N 2.72Å
270	K	35.4	Very low	44.8	Very low	86 Å²	86	58.5 Å²	58.5	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-83.1	-35.2	174	-90	-176.4	-173	179.6	0	113.3	L192 A193 F195 Y267 S268 N272	L192-K270 VanDerWaalsContact O-CE 3.27Å; L192-K270 WeakPolarHBondContact O-CE 3.42Å; L192-K270 PolarHBondContact O-NZ 2.73Å; A193-K270 WeakPolarHBondContact O-CE 3.49Å; A193-K270 PolarHBondContact O-NZ 3.34Å; F195-K270 PolarHBondContact O-NZ 3.35Å; Y267-K270 WeakPolarHBondContact O-CB 3.41Å; Y267-K270 PolarHBondContact O-N 2.91Å; Y267-K270 VanDerWaalsContact O-N 3.12Å; S268-K270 PolarHBondContact O-N 2.64Å; K270-N272 PolarHBondContact O-N 3.3Å
271	M	32.7	Very low	45	Very low	94 Å²	94	59.1 Å²	59.1	46%	0.463	31%	0.312	S	S	.	.	S	Bend	trans	-80.6	67.4	-178.5	-77.2	-66.7	-166.5	0	0	110.7	Y267 S268	Y267-M271 HydrophobicContact CD1-CG 3.85Å; Y267-M271 HydrophobicContact CE1-CB 4.42Å; Y267-M271 HydrophobicContact CE1-CE 3.95Å; Y267-M271 HydrophobicContact CE1-CG 3.44Å; Y267-M271 VanDerWaalsContact CE1-CG 3.44Å; Y267-M271 HydrophobicContact CE2-CE 3.99Å; Y267-M271 HydrophobicContact CE2-CG 4.32Å; Y267-M271 HydrophobicContact CG-CG 4.47Å; Y267-M271 PolarHBondContact O-N 3.46Å; Y267-M271 WeakPolarHBondContact OH-CE 3.24Å; S268-M271 PolarHBondContact O-N 3.04Å
272	N	39.3	Very low	45.8	Very low	69 Å²	69	65.2 Å²	65.2	37%	0.369	34%	0.344	S	S	.	.			trans	62.1	92.1	148	-69	-45.5	0	0	0	115.4	K270 R274	K270-N272 PolarHBondContact O-N 3.3Å; N272-R274 HydrophobicContact CB-CB 3.75Å; N272-R274 HydrophobicContact CB-CG 3.76Å; N272-R274 PolarHBondContact O-N 3.36Å; N272-R274 WeakPolarHBondContact OD1-CD 3.42Å; N272-R274 WeakPolarHBondContact OD1-CG 3.25Å; N272-R274 PolarHBondContact OD1-NE 3.44Å
273	A	41.2	Very low	47.3	Very low	40 Å²	40	65.4 Å²	65.4	33%	0.331	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn		-38.5	30.6	126.4	0	0	0	0	0	116.3	V180 T181	V180-A273 WeakPolarHBondContact O-CB 3.46Å; T181-A273 HydrophobicContact CG2-CB 3.75Å
274	R	39.4	Very low	49.2	Very low	194 Å²	194	69.8 Å²	69.8	73%	0.732	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	4.2	179.1	-58.2	-174.7	169	163.7	-6	113.8	N272	N272-R274 HydrophobicContact CB-CB 3.75Å; N272-R274 HydrophobicContact CB-CG 3.76Å; N272-R274 PolarHBondContact O-N 3.36Å; N272-R274 WeakPolarHBondContact OD1-CD 3.42Å; N272-R274 WeakPolarHBondContact OD1-CG 3.25Å; N272-R274 PolarHBondContact OD1-NE 3.44Å
275	H	39.8	Very low	51.1	Low	177 Å²	177	66.5 Å²	66.5	82%	0.819	35%	0.35	S	S	*	.	S	Bend	trans	-136.8	61.8	178.7	-67.3	113	0	0	0	113.3
276	A	41	Very low	53.1	Low	34 Å²	34	66.7 Å²	66.7	28%	0.281	35%	0.351	S	S	.	.			trans	-175.5	120.8	141.2	0	0	0	0	0	105.4	Y278	A276-Y278 VanDerWaalsContact C-N 3.3Å; A276-Y278 WeakPolarHBondContact O-CD2 3.45Å; A276-Y278 WeakPolarHBondContact O-CE2 3.13Å; A276-Y278 PolarHBondContact O-N 2.92Å
277	A	46.3	Very low	55.3	Low	72 Å²	72	65 Å²	65	60%	0.595	34%	0.336	S	S	*	.			trans	-60.5	108.3	155	0	0	0	0	0	104.4	Q279	A277-Q279 HydrophobicContact CB-CG 4.23Å; A277-Q279 PolarHBondContact O-N 3.35Å
278	Y	54	Low	57.9	Low	12 Å²	12	60.1 Å²	60.1	5%	0.047	32%	0.317	C	S	.	.			trans	-72.1	70.3	-176	-67.7	-101.3	0	0	0	108.6	F157 A158 S161 V180 A276 S280 Q308 L309	F157-Y278 VanDerWaalsContact C-CD1 3.45Å; F157-Y278 VanDerWaalsContact C-CE1 3.46Å; F157-Y278 HydrophobicContact CB-CD1 3.66Å; F157-Y278 HydrophobicContact CB-CE1 3.65Å; F157-Y278 VanDerWaalsContact O-CD1 3.24Å; F157-Y278 WeakPolarHBondContact O-CD1 3.28Å; A158-Y278 HydrophobicContact CB-CE1 4.3Å; S161-Y278 VanDerWaalsContact CB-CA 3.47Å; S161-Y278 WeakPolarHBondContact OG-CD1 3.2Å; V180-Y278 HydrophobicContact CG1-CD2 4.48Å; V180-Y278 HydrophobicContact CG1-CE2 3.94Å; A276-Y278 VanDerWaalsContact C-N 3.3Å; A276-Y278 WeakPolarHBondContact O-CD2 3.45Å; A276-Y278 WeakPolarHBondContact O-CE2 3.13Å; A276-Y278 PolarHBondContact O-N 2.92Å; Y278-S280 PolarHBondContact O-N 3.03Å; Y278-Q308 HydrophobicContact CD2-CG 4.12Å; Y278-L309 WeakPolarHBondContact O-CD2 3.21Å; Y278-L309 WeakPolarHBondContact O-CG 2.96Å
279	Q	52	Low	60.2	Low	128 Å²	128	60.5 Å²	60.5	60%	0.598	32%	0.319	S	S	*	.			trans	-91.7	78.3	-178.8	-71.9	-179.1	-11	0	0	109.4	Q164 A277 A281	Q164-Q279 PolarHBondContact NE2-O 3.13Å; A277-Q279 HydrophobicContact CB-CG 4.23Å; A277-Q279 PolarHBondContact O-N 3.35Å; Q279-A281 PolarHBondContact O-N 2.75Å
280	S	55.4	Low	62.8	Low	4 Å²	4	58.6 Å²	58.6	3%	0.028	31%	0.306	C	S	.	.			trans	-82.5	91.1	163.3	67.7	0	0	0	0	109	Y278 N282 L309 N311	Y278-S280 PolarHBondContact O-N 3.03Å; S280-N282 PolarHBondContact O-N 2.75Å; S280-N282 VanDerWaalsContact O-N 3.08Å; S280-L309 WeakPolarHBondContact OG-CD2 3.37Å; S280-N311 PolarHBondContact O-ND2 3.43Å; S280-N311 VanDerWaalsContact O-ND2 3.08Å
281	A	55.9	Low	65.5	Low	56 Å²	56	57.4 Å²	57.4	46%	0.463	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.1	-172.1	0	0	0	0	0	113.9	Q279 N311	Q279-A281 PolarHBondContact O-N 2.75Å; A281-N311 WeakPolarHBondContact CA-ND2 3.04Å; A281-N311 PolarHBondContact O-ND2 2.85Å
282	N	68	Low	68.4	Low	132 Å²	132	56.6 Å²	56.6	71%	0.706	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	2.8	-170.2	-63.8	-27.7	0	0	0	115.1	S280	S280-N282 PolarHBondContact O-N 2.75Å; S280-N282 VanDerWaalsContact O-N 3.08Å
283	L	79	Confident	70.9	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.026	29%	0.293	C	S	.	.			trans	-91.1	126.2	-178.2	-172.4	63.5	0	0	0	110.8	F160 V170 F173 I285	F160-L283 HydrophobicContact CB-CD2 3.98Å; F160-L283 HydrophobicContact CD2-CD2 3.36Å; F160-L283 HydrophobicContact CE2-CD2 4.08Å; F160-L283 HydrophobicContact CG-CD2 3.9Å; V170-L283 HydrophobicContact CB-CD1 3.97Å; V170-L283 HydrophobicContact CG1-CD1 3.93Å; V170-L283 WeakPolarHBondContact O-CD1 3.17Å; F173-L283 HydrophobicContact CB-CD2 3.96Å; F173-L283 HydrophobicContact CB-CG 4.3Å; F173-L283 HydrophobicContact CD1-CD2 4.16Å; L283-I285 HydrophobicContact CB-CG1 4.37Å; L283-I285 HydrophobicContact CD2-CD1 4.21Å; L283-I285 HydrophobicContact CD2-CG1 4.13Å; L283-I285 HydrophobicContact CG-CD1 4.47Å; L283-I285 HydrophobicContact CG-CG1 4Å; L283-I285 PolarHBondContact O-N 3.2Å
284	H	86.9	Confident	73.1	Confident	95 Å²	95	53.3 Å²	53.3	44%	0.44	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	118.3	171.5	-74.1	-171.8	0	0	0	110	T172 F173 V313	T172-H284 WeakPolarHBondContact CA-O 3.43Å; T172-H284 HydrophobicContact CG2-CB 4.12Å; T172-H284 WeakPolarHBondContact CG2-O 3.45Å; F173-H284 PolarHBondContact N-O 3.49Å; H284-V313 HydrophobicContact CB-CG2 3.72Å
285	I	88.6	Confident	75.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.6	-176.5	-48.4	179.1	0	0	0	110.9	F157 F173 A175 L283 Y287 L309	F157-I285 HydrophobicContact CE1-CD1 4.09Å; F157-I285 HydrophobicContact CE1-CG2 4.35Å; F173-I285 HydrophobicContact CB-CG1 4.3Å; F173-I285 HydrophobicContact CB-CG2 4.48Å; F173-I285 HydrophobicContact CD1-CD1 4.16Å; F173-I285 HydrophobicContact CD1-CG1 4.16Å; F173-I285 HydrophobicContact CD1-CG2 3.94Å; F173-I285 HydrophobicContact CE1-CG2 4.48Å; F173-I285 HydrophobicContact CG-CG2 4.3Å; F173-I285 CarbonylContact O-C 3.6Å; F173-I285 VanDerWaalsContact O-CA 3.28Å; F173-I285 WeakPolarHBondContact O-CA 3.44Å; A175-I285 HydrophobicContact CB-CG2 4.42Å; L283-I285 HydrophobicContact CB-CG1 4.37Å; L283-I285 HydrophobicContact CD2-CD1 4.21Å; L283-I285 HydrophobicContact CD2-CG1 4.13Å; L283-I285 HydrophobicContact CG-CD1 4.47Å; L283-I285 HydrophobicContact CG-CG1 4Å; L283-I285 PolarHBondContact O-N 3.2Å; I285-Y287 HydrophobicContact CB-CE2 3.84Å; I285-Y287 HydrophobicContact CG2-CD1 4.4Å; I285-Y287 HydrophobicContact CG2-CD2 4.08Å; I285-Y287 HydrophobicContact CG2-CE1 3.99Å; I285-Y287 HydrophobicContact CG2-CE2 3.61Å; I285-Y287 HydrophobicContact CG2-CG 4.45Å; I285-L309 HydrophobicContact CD1-CD1 4.28Å
286	H	91.8	Very high	77.6	Confident	5 Å²	5	36.7 Å²	36.7	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.2	168.7	-73	-110.1	0	0	0	109.1	F173 F174 A175 E314 H316 F343	F173-H286 PolarHBondContact O-N 3.46Å; F174-H286 HydrophobicContact CD1-CB 3.63Å; F174-H286 AromaticContact CD1-CG 3.9Å; F174-H286 HydrophobicContact CE1-CB 4.07Å; F174-H286 AromaticContact CE1-CD2 3.85Å; F174-H286 AromaticContact CE1-CG 3.79Å; A175-H286 PolarHBondContact N-O 3.34Å; H286-E314 VanDerWaalsContact CE1-CD 3.49Å; H286-E314 IonicContact CE1-OE2 3.72Å; H286-E314 PolarHBondContact CE1-OE2 3.41Å; H286-E314 IonicContact ND1-OE2 2.86Å; H286-E314 PolarHBondContact ND1-OE2 3Å; H286-H316 AromaticContact ND1-CD2 3.95Å; H286-H316 AromaticContact ND1-NE2 3.34Å; H286-H316 PolarHBondContact ND1-NE2 2.87Å; H286-F343 AromaticContact CE1-CD2 3.6Å; H286-F343 AromaticContact CE1-CE2 3.54Å; H286-F343 AromaticContact NE2-CD2 3.7Å; H286-F343 AromaticContact NE2-CE1 4Å; H286-F343 AromaticContact NE2-CE2 3.24Å; H286-F343 WeakPolarHBondContact NE2-CE2 3.35Å; H286-F343 AromaticContact NE2-CZ 3.41Å; H286-F343 WeakPolarHBondContact NE2-CZ 3.35Å
287	Y	90.7	Very high	79.9	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.9	177.3	-62.3	-92.6	0	0	0	109.4	F157 P178 I285 I305 L309 E314 H316	F157-Y287 AromaticContact CE1-CE1 3.91Å; F157-Y287 HydrophobicContact CE1-CE1 3.91Å; F157-Y287 HydrophobicContact CZ-CD1 4.32Å; F157-Y287 AromaticContact CZ-CE1 3.63Å; F157-Y287 HydrophobicContact CZ-CE1 3.63Å; P178-Y287 HydrophobicContact CB-CD1 4.37Å; P178-Y287 HydrophobicContact CG-CD1 4.14Å; I285-Y287 HydrophobicContact CB-CE2 3.84Å; I285-Y287 HydrophobicContact CG2-CD1 4.4Å; I285-Y287 HydrophobicContact CG2-CD2 4.08Å; I285-Y287 HydrophobicContact CG2-CE1 3.99Å; I285-Y287 HydrophobicContact CG2-CE2 3.61Å; I285-Y287 HydrophobicContact CG2-CG 4.45Å; Y287-I305 HydrophobicContact CD1-CD1 3.51Å; Y287-I305 HydrophobicContact CD1-CG1 3.77Å; Y287-I305 HydrophobicContact CD2-CD1 4.04Å; Y287-I305 HydrophobicContact CD2-CG1 4.47Å; Y287-I305 HydrophobicContact CE1-CD1 3.95Å; Y287-I305 HydrophobicContact CE1-CG1 3.65Å; Y287-I305 HydrophobicContact CE2-CD1 4.43Å; Y287-I305 HydrophobicContact CE2-CG1 4.39Å; Y287-I305 HydrophobicContact CG-CD1 3.55Å; Y287-I305 HydrophobicContact CG-CG1 4.18Å; Y287-L309 WeakPolarHBondContact OH-CD1 3.48Å; Y287-E314 PolarHBondContact N-O 3.12Å; Y287-H316 PolarHBondContact O-N 3.44Å
288	I	94.3	Very high	82	Confident	9 Å²	9	33.1 Å²	33.1	5%	0.046	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.6	179.3	-43	-166.8	0	0	0	108.1	A175 L176 A177 P178 H316 L318 F326 I336 V340	A175-I288 PolarHBondContact O-N 2.77Å; L176-I288 HydrophobicContact CD2-CB 3.88Å; L176-I288 HydrophobicContact CD2-CD1 3.56Å; L176-I288 HydrophobicContact CD2-CG1 3.91Å; L176-I288 HydrophobicContact CD2-CG2 4.47Å; A177-I288 PolarHBondContact N-O 3.17Å; P178-I288 WeakPolarHBondContact CD-O 3.16Å; I288-H316 WeakPolarHBondContact CA-O 3.08Å; I288-H316 HydrophobicContact CB-CB 4.31Å; I288-H316 HydrophobicContact CG1-CB 4.1Å; I288-H316 HydrophobicContact CG2-CB 4.03Å; I288-L318 HydrophobicContact CG2-CD1 3.8Å; I288-L318 HydrophobicContact CG2-CG 4.09Å; I288-F326 HydrophobicContact CB-CE1 4.35Å; I288-F326 HydrophobicContact CG2-CD1 4.44Å; I288-F326 HydrophobicContact CG2-CE1 3.93Å; I288-F326 VanDerWaalsContact O-CE1 3.26Å; I288-F326 WeakPolarHBondContact O-CE1 3.46Å; I288-I336 HydrophobicContact CD1-CG2 4.11Å; I288-V340 HydrophobicContact CD1-CG2 4.32Å
289	K	93.6	Very high	83.6	Confident	13 Å²	13	36.2 Å²	36.2	6%	0.057	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155.8	-175.7	69.7	166.2	-175.7	167.1	0	112.6	V301 E302 H316 N317 L318	K289-V301 HydrophobicContact CB-CG1 4.14Å; K289-V301 HydrophobicContact CB-CG2 4.45Å; K289-V301 HydrophobicContact CD-CB 4.23Å; K289-V301 HydrophobicContact CD-CG1 3.94Å; K289-E302 VanDerWaalsContact NZ-CG 3.26Å; K289-E302 IonicContact NZ-OE1 3.83Å; K289-E302 PolarHBondContact NZ-OE1 2.98Å; K289-H316 PolarHBondContact N-O 3.45Å; K289-N317 WeakPolarHBondContact CE-OD1 3.4Å; K289-N317 VanDerWaalsContact CG-OD1 3.29Å; K289-N317 WeakPolarHBondContact CG-OD1 3.08Å; K289-L318 PolarHBondContact O-N 3.14Å
290	G	93.9	Very high	85.2	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.5	-174.2	0	0	0	0	0	109.8	N292 D293 F321	G290-N292 PolarHBondContact O-N 3.15Å; G290-D293 WeakPolarHBondContact O-CB 3.46Å; G290-D293 PolarHBondContact O-N 2.97Å; G290-F321 CarbonylContact C-O 3.57Å; G290-F321 WeakPolarHBondContact CA-O 3.2Å
291	A	92.8	Very high	86.7	Confident	60 Å²	60	30.1 Å²	30.1	50%	0.496	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-29.3	-177.5	0	0	0	0	0	113.1	L318	A291-L318 PolarHBondContact N-O 3.33Å
292	N	92.2	Very high	88	Confident	77 Å²	77	31.6 Å²	31.6	41%	0.412	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	9.2	-177.9	-68.5	-10.1	0	0	0	112.8	G290 I294 D320 F321	G290-N292 PolarHBondContact O-N 3.15Å; N292-I294 PolarHBondContact O-N 3.15Å; N292-D320 WeakPolarHBondContact ND2-CA 3.37Å; N292-D320 PolarHBondContact ND2-O 2.73Å; N292-D320 VanDerWaalsContact ND2-O 3.1Å; N292-F321 CarbonylContact C-O 3.59Å; N292-F321 PolarHBondContact N-O 2.67Å; N292-F321 VanDerWaalsContact N-O 3.11Å
293	D	91.3	Very high	88.5	Confident	3 Å²	3	31 Å²	31	2%	0.016	16%	0.157	C	C	.	.			trans	-66.8	118.4	177.7	-163.7	-33.3	0	0	0	110.2	A177 G290 L295 A296 T297 F321 H323	A177-D293 WeakPolarHBondContact CB-OD2 3.41Å; G290-D293 WeakPolarHBondContact O-CB 3.46Å; G290-D293 PolarHBondContact O-N 2.97Å; D293-L295 PolarHBondContact OD1-N 3.31Å; D293-A296 PolarHBondContact OD1-N 3.22Å; D293-T297 WeakPolarHBondContact O-CA 3.21Å; D293-F321 PolarHBondContact N-O 2.98Å; D293-H323 VanDerWaalsContact CG-ND1 3.31Å; D293-H323 WeakPolarHBondContact OD1-CB 3Å; D293-H323 IonicContact OD1-CG 3.57Å; D293-H323 IonicContact OD1-ND1 2.66Å; D293-H323 PolarHBondContact OD1-ND1 2.98Å; D293-H323 WeakPolarHBondContact OD2-CA 3.11Å; D293-H323 IonicContact OD2-CE1 3.31Å; D293-H323 IonicContact OD2-CG 3.01Å; D293-H323 IonicContact OD2-ND1 2.74Å; D293-H323 PolarHBondContact OD2-ND1 3.32Å
294	I	88	Confident	88.1	Confident	38 Å²	38	31 Å²	31	20%	0.195	16%	0.157	C	C	.	.	S	Bend	trans	-91	-15.7	-179.5	64.3	168.3	0	0	0	112.7	V185 K186 G239 N292 T297	V185-I294 WeakPolarHBondContact CA-O 3.3Å; K186-I294 HydrophobicContact CB-CB 3.9Å; K186-I294 HydrophobicContact CB-CG2 4.13Å; K186-I294 PolarHBondContact N-O 3.26Å; G239-I294 VanDerWaalsContact CA-CD1 3.46Å; N292-I294 PolarHBondContact O-N 3.15Å; I294-T297 VanDerWaalsContact O-CG2 3.31Å; I294-T297 WeakPolarHBondContact O-CG2 3.07Å
295	L	86.2	Confident	87.4	Confident	21 Å²	21	26.7 Å²	26.7	11%	0.11	14%	0.137	C	C	.	.	S	Bend	trans	-101.2	-57.8	-178.4	-170.3	64.4	0	0	0	110.5	V185 D293 T297	V185-L295 HydrophobicContact CG1-CD1 4.1Å; V185-L295 HydrophobicContact CG2-CD1 4.07Å; V185-L295 WeakPolarHBondContact CG2-O 3.31Å; D293-L295 PolarHBondContact OD1-N 3.31Å; L295-T297 VanDerWaalsContact C-N 3.26Å; L295-T297 PolarHBondContact O-N 2.94Å
296	A	88.2	Confident	86.2	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.008	17%	0.174	C	C	.	.	S	Bend	trans	-89.4	65.6	169.3	0	0	0	0	0	109.5	A177 P178 V179 D293 V301	A177-A296 HydrophobicContact CB-CB 4.09Å; A177-A296 WeakPolarHBondContact O-CB 3.14Å; P178-A296 WeakPolarHBondContact O-CB 3.34Å; V179-A296 HydrophobicContact CG2-CB 3.96Å; D293-A296 PolarHBondContact OD1-N 3.22Å; A296-V301 HydrophobicContact CB-CG2 4.22Å; A296-V301 WeakPolarHBondContact O-CG2 3.42Å
297	T	89.7	Confident	84.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	20%	0.2	C	C	.	.			trans	-59	146.6	-171	69.3	0	0	0	0	112	H184 K186 D293 I294 L295 E299 D300 V301	H184-T297 VanDerWaalsContact O-CG2 3.31Å; H184-T297 WeakPolarHBondContact O-CG2 3.25Å; K186-T297 HydrophobicContact CG-CG2 4.31Å; D293-T297 WeakPolarHBondContact O-CA 3.21Å; I294-T297 VanDerWaalsContact O-CG2 3.31Å; I294-T297 WeakPolarHBondContact O-CG2 3.07Å; L295-T297 VanDerWaalsContact C-N 3.26Å; L295-T297 PolarHBondContact O-N 2.94Å; T297-E299 PolarHBondContact O-N 2.9Å; T297-D300 PolarHBondContact O-N 2.88Å; T297-D300 PolarHBondContact OG1-N 2.81Å; T297-D300 PolarHBondContact OG1-OD2 3.05Å; T297-D300 VanDerWaalsContact OG1-OD2 3.04Å; T297-V301 WeakPolarHBondContact O-CG2 3.49Å; T297-V301 PolarHBondContact O-N 2.72Å
298	P	89.2	Confident	83.2	Confident	30 Å²	30	38.2 Å²	38.2	20%	0.195	20%	0.204	C	C	.	.	H	α-helix	trans	-50.8	-34.2	176.3	-31	36	0	0	0	113.7	E302	P298-E302 WeakPolarHBondContact O-CB 3.45Å; P298-E302 VanDerWaalsContact O-CG 3.27Å; P298-E302 WeakPolarHBondContact O-CG 3.5Å; P298-E302 PolarHBondContact O-N 3.01Å
299	E	88.5	Confident	81.6	Confident	77 Å²	77	38.5 Å²	38.5	36%	0.36	21%	0.206	S	C	.	.	H	α-helix	trans	-70.2	-44.2	177.4	-175.6	172.9	-170.9	0	0	112.6	H184 T297 R303	H184-E299 HydrophobicContact CB-CB 4.35Å; H184-E299 HydrophobicContact CB-CG 4.39Å; H184-E299 IonicContact CD2-OE1 3.59Å; H184-E299 PolarHBondContact CD2-OE1 3.38Å; H184-E299 IonicContact CD2-OE2 3.41Å; H184-E299 IonicContact CG-OE2 2.73Å; H184-E299 IonicContact NE2-OE1 2.79Å; H184-E299 PolarHBondContact NE2-OE1 3.22Å; T297-E299 PolarHBondContact O-N 2.9Å; E299-R303 VanDerWaalsContact O-CB 3.23Å; E299-R303 WeakPolarHBondContact O-CB 3.32Å; E299-R303 WeakPolarHBondContact O-CG 3.44Å; E299-R303 PolarHBondContact O-N 3.09Å; E299-R303 IonicContact OE1-CZ 3.1Å; E299-R303 IonicContact OE1-NE 3.75Å; E299-R303 PolarHBondContact OE1-NE 2.87Å; E299-R303 IonicContact OE1-NH1 2.8Å; E299-R303 IonicContact OE1-NH2 2.66Å; E299-R303 PolarHBondContact OE1-NH2 3.3Å
300	D	86	Confident	79.7	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-40.8	174.5	-80.1	-51.5	0	0	0	111.7	T181 K183 H184 T297 S304	T181-D300 WeakPolarHBondContact O-CB 3.37Å; T181-D300 PolarHBondContact OG1-OD1 3.4Å; K183-D300 PolarHBondContact N-OD1 3.28Å; K183-D300 VanDerWaalsContact N-OD1 3.09Å; K183-D300 PolarHBondContact N-OD2 3.13Å; H184-D300 WeakPolarHBondContact CA-OD2 3.44Å; H184-D300 WeakPolarHBondContact CB-OD2 3.43Å; H184-D300 IonicContact CE1-OD1 3.18Å; H184-D300 IonicContact CG-OD1 3.33Å; H184-D300 PolarHBondContact N-OD1 2.81Å; H184-D300 PolarHBondContact N-OD2 2.84Å; H184-D300 IonicContact ND1-OD1 2.66Å; H184-D300 PolarHBondContact ND1-OD1 3.06Å; H184-D300 IonicContact ND1-OD2 2.68Å; T297-D300 PolarHBondContact O-N 2.88Å; T297-D300 PolarHBondContact OG1-N 2.81Å; T297-D300 PolarHBondContact OG1-OD2 3.05Å; T297-D300 VanDerWaalsContact OG1-OD2 3.04Å; D300-S304 VanDerWaalsContact O-CB 3.27Å; D300-S304 WeakPolarHBondContact O-CB 3.3Å; D300-S304 PolarHBondContact O-N 2.82Å; D300-S304 PolarHBondContact O-OG 3.38Å
301	V	85.2	Confident	78	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-50.8	178	176.2	0	0	0	0	111.1	P178 K289 A296 T297 R303 S304 I305	P178-V301 HydrophobicContact CG-CB 4.44Å; P178-V301 HydrophobicContact CG-CG1 3.69Å; P178-V301 HydrophobicContact CG-CG2 3.9Å; P178-V301 WeakPolarHBondContact O-CG2 3.39Å; K289-V301 HydrophobicContact CB-CG1 4.14Å; K289-V301 HydrophobicContact CB-CG2 4.45Å; K289-V301 HydrophobicContact CD-CB 4.23Å; K289-V301 HydrophobicContact CD-CG1 3.94Å; A296-V301 HydrophobicContact CB-CG2 4.22Å; A296-V301 WeakPolarHBondContact O-CG2 3.42Å; T297-V301 WeakPolarHBondContact O-CG2 3.49Å; T297-V301 PolarHBondContact O-N 2.72Å; V301-R303 PolarHBondContact O-N 3.26Å; V301-S304 PolarHBondContact O-N 2.97Å; V301-S304 PolarHBondContact O-OG 3.23Å; V301-I305 HydrophobicContact CG1-CD1 3.75Å; V301-I305 WeakPolarHBondContact O-CB 3.32Å; V301-I305 WeakPolarHBondContact O-CD1 3.37Å; V301-I305 WeakPolarHBondContact O-CG1 3.5Å; V301-I305 PolarHBondContact O-N 3.13Å; V301-I305 VanDerWaalsContact O-N 3.1Å
302	E	84.8	Confident	76.5	Confident	87 Å²	87	46.2 Å²	46.2	41%	0.407	24%	0.244	S	C	.	.	H	α-helix	trans	-63.7	-41.8	179.9	-75.3	174.4	-178.3	0	0	111.7	K289 P298 I305 L306	K289-E302 VanDerWaalsContact NZ-CG 3.26Å; K289-E302 IonicContact NZ-OE1 3.83Å; K289-E302 PolarHBondContact NZ-OE1 2.98Å; P298-E302 WeakPolarHBondContact O-CB 3.45Å; P298-E302 VanDerWaalsContact O-CG 3.27Å; P298-E302 WeakPolarHBondContact O-CG 3.5Å; P298-E302 PolarHBondContact O-N 3.01Å; E302-I305 PolarHBondContact O-N 3.47Å; E302-L306 WeakPolarHBondContact O-CB 3.49Å; E302-L306 WeakPolarHBondContact O-CG 3.31Å; E302-L306 PolarHBondContact O-N 3.25Å
303	R	78.4	Confident	75.1	Confident	120 Å²	120	45.1 Å²	45.1	45%	0.453	24%	0.24	S	C	.	.	H	α-helix	trans	-68.5	-41	179.7	-73	178.9	179.3	-161	3.3	112.4	H184 E299 V301 I305 L306 S307	H184-R303 PolarHBondContact CE1-NH1 3.24Å; H184-R303 PolarHBondContact NE2-NH1 3.25Å; H184-R303 VanDerWaalsContact NE2-NH1 3.11Å; E299-R303 VanDerWaalsContact O-CB 3.23Å; E299-R303 WeakPolarHBondContact O-CB 3.32Å; E299-R303 WeakPolarHBondContact O-CG 3.44Å; E299-R303 PolarHBondContact O-N 3.09Å; E299-R303 IonicContact OE1-CZ 3.1Å; E299-R303 IonicContact OE1-NE 3.75Å; E299-R303 PolarHBondContact OE1-NE 2.87Å; E299-R303 IonicContact OE1-NH1 2.8Å; E299-R303 IonicContact OE1-NH2 2.66Å; E299-R303 PolarHBondContact OE1-NH2 3.3Å; V301-R303 PolarHBondContact O-N 3.26Å; R303-I305 VanDerWaalsContact C-N 3.34Å; R303-L306 PolarHBondContact O-N 3.12Å; R303-S307 VanDerWaalsContact O-CB 3.22Å; R303-S307 WeakPolarHBondContact O-CB 2.62Å; R303-S307 PolarHBondContact O-N 3.3Å; R303-S307 PolarHBondContact O-OG 3.2Å
304	S	70.4	Confident	74.7	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.028	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-45.5	176.8	55.6	0	0	0	0	110.9	D300 V301 S307 Q308	D300-S304 VanDerWaalsContact O-CB 3.27Å; D300-S304 WeakPolarHBondContact O-CB 3.3Å; D300-S304 PolarHBondContact O-N 2.82Å; D300-S304 PolarHBondContact O-OG 3.38Å; V301-S304 PolarHBondContact O-N 2.97Å; V301-S304 PolarHBondContact O-OG 3.23Å; S304-S307 PolarHBondContact O-N 3.13Å; S304-S307 PolarHBondContact O-OG 3.2Å; S304-S307 VanDerWaalsContact O-OG 3.05Å; S304-Q308 VanDerWaalsContact O-CB 3.28Å; S304-Q308 WeakPolarHBondContact O-CB 3.34Å; S304-Q308 WeakPolarHBondContact O-CG 3.37Å; S304-Q308 PolarHBondContact O-N 3.05Å
305	I	70.7	Confident	74.6	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-54	175.7	-68	169	0	0	0	111.4	Y287 V301 E302 R303 S307 Q308 L309 I312 M315	Y287-I305 HydrophobicContact CD1-CD1 3.51Å; Y287-I305 HydrophobicContact CD1-CG1 3.77Å; Y287-I305 HydrophobicContact CD2-CD1 4.04Å; Y287-I305 HydrophobicContact CD2-CG1 4.47Å; Y287-I305 HydrophobicContact CE1-CD1 3.95Å; Y287-I305 HydrophobicContact CE1-CG1 3.65Å; Y287-I305 HydrophobicContact CE2-CD1 4.43Å; Y287-I305 HydrophobicContact CE2-CG1 4.39Å; Y287-I305 HydrophobicContact CG-CD1 3.55Å; Y287-I305 HydrophobicContact CG-CG1 4.18Å; V301-I305 HydrophobicContact CG1-CD1 3.75Å; V301-I305 WeakPolarHBondContact O-CB 3.32Å; V301-I305 WeakPolarHBondContact O-CD1 3.37Å; V301-I305 WeakPolarHBondContact O-CG1 3.5Å; V301-I305 PolarHBondContact O-N 3.13Å; V301-I305 VanDerWaalsContact O-N 3.1Å; E302-I305 PolarHBondContact O-N 3.47Å; R303-I305 VanDerWaalsContact C-N 3.34Å; I305-S307 PolarHBondContact O-N 2.88Å; I305-Q308 PolarHBondContact O-N 3.36Å; I305-L309 PolarHBondContact O-N 3.11Å; I305-I312 HydrophobicContact CG2-CD1 3.3Å; I305-I312 HydrophobicContact CG2-CG1 3.75Å; I305-M315 HydrophobicContact CD1-CE 3.57Å; I305-M315 HydrophobicContact CG2-CE 4.45Å
306	L	65.3	Low	74.9	Confident	147 Å²	147	52.1 Å²	52.1	77%	0.77	27%	0.272	S	S	*	.	H	α-helix	trans	-61.4	-28.1	-178.7	-71.8	172.9	0	0	0	112.9	E302 R303	E302-L306 WeakPolarHBondContact O-CB 3.49Å; E302-L306 WeakPolarHBondContact O-CG 3.31Å; E302-L306 PolarHBondContact O-N 3.25Å; R303-L306 PolarHBondContact O-N 3.12Å
307	S	60	Low	75.2	Confident	83 Å²	83	57 Å²	57	58%	0.58	30%	0.298	S	S	*	.	H	α-helix	trans	-88.9	-12.9	-178	65.2	0	0	0	0	114.6	R303 S304 I305	R303-S307 VanDerWaalsContact O-CB 3.22Å; R303-S307 WeakPolarHBondContact O-CB 2.62Å; R303-S307 PolarHBondContact O-N 3.3Å; R303-S307 PolarHBondContact O-OG 3.2Å; S304-S307 PolarHBondContact O-N 3.13Å; S304-S307 PolarHBondContact O-OG 3.2Å; S304-S307 VanDerWaalsContact O-OG 3.05Å; I305-S307 PolarHBondContact O-N 2.88Å
308	Q	57.5	Low	75.4	Confident	22 Å²	22	57.8 Å²	57.8	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-131.4	-26.4	-162.2	-69.5	172.3	17.8	0	0	117.4	V180 Y278 S304 I305	V180-Q308 VanDerWaalsContact CG1-OE1 3.29Å; Y278-Q308 HydrophobicContact CD2-CG 4.12Å; S304-Q308 VanDerWaalsContact O-CB 3.28Å; S304-Q308 WeakPolarHBondContact O-CB 3.34Å; S304-Q308 WeakPolarHBondContact O-CG 3.37Å; S304-Q308 PolarHBondContact O-N 3.05Å; I305-Q308 PolarHBondContact O-N 3.36Å
309	L	61.1	Low	75.5	Confident	16 Å²	16	60 Å²	60	8%	0.084	32%	0.318	C	S	.	.			trans	-137.4	111.7	-163	-78.2	157.8	0	0	0	113.4	F157 Y278 S280 I285 Y287 I305 N311	F157-L309 HydrophobicContact CE1-CD1 4.41Å; Y278-L309 WeakPolarHBondContact O-CD2 3.21Å; Y278-L309 WeakPolarHBondContact O-CG 2.96Å; S280-L309 WeakPolarHBondContact OG-CD2 3.37Å; I285-L309 HydrophobicContact CD1-CD1 4.28Å; Y287-L309 WeakPolarHBondContact OH-CD1 3.48Å; I305-L309 PolarHBondContact O-N 3.11Å; L309-N311 PolarHBondContact O-N 3.15Å
310	P	54.4	Low	75.6	Confident	102 Å²	102	58.8 Å²	58.8	66%	0.662	31%	0.314	S	S	*	.	S	Bend	trans	-70.4	-6.9	174.4	27.8	-32.9	0	0	0	113.9
311	N	59.1	Low	75.9	Confident	53 Å²	53	58.7 Å²	58.7	28%	0.283	31%	0.313	S	S	.	.			trans	-115.3	56.2	-170.8	-58.1	-43.2	0	0	0	113.1	S280 A281 L309 V313	S280-N311 PolarHBondContact O-ND2 3.43Å; S280-N311 VanDerWaalsContact O-ND2 3.08Å; A281-N311 WeakPolarHBondContact CA-ND2 3.04Å; A281-N311 PolarHBondContact O-ND2 2.85Å; L309-N311 PolarHBondContact O-N 3.15Å; N311-V313 PolarHBondContact O-N 3.08Å
312	I	59.3	Low	76.3	Confident	80 Å²	80	58.8 Å²	58.8	41%	0.41	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	115.9	169.4	-56.1	169.6	0	0	0	107.3	I305	I305-I312 HydrophobicContact CG2-CD1 3.3Å; I305-I312 HydrophobicContact CG2-CG1 3.75Å
313	V	64.2	Low	76.6	Confident	54 Å²	54	54.8 Å²	54.8	33%	0.327	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-59.9	167.3	-177.9	0	0	0	0	107.7	H284 N311	H284-V313 HydrophobicContact CB-CG2 3.72Å; N311-V313 PolarHBondContact O-N 3.08Å
314	E	83.3	Confident	77.2	Confident	79 Å²	79	49.1 Å²	49.1	37%	0.369	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	149.2	-177.9	-70.4	176.8	-170.6	0	0	113.2	H286 Y287 H316	H286-E314 VanDerWaalsContact CE1-CD 3.49Å; H286-E314 IonicContact CE1-OE2 3.72Å; H286-E314 PolarHBondContact CE1-OE2 3.41Å; H286-E314 IonicContact ND1-OE2 2.86Å; H286-E314 PolarHBondContact ND1-OE2 3Å; Y287-E314 PolarHBondContact N-O 3.12Å; E314-H316 WeakPolarHBondContact CB-NE2 3.33Å; E314-H316 IonicContact OE2-CE1 3.63Å; E314-H316 PolarHBondContact OE2-CE1 3.23Å; E314-H316 IonicContact OE2-NE2 3.52Å; E314-H316 PolarHBondContact OE2-NE2 2.9Å
315	M	86.2	Confident	78.3	Confident	69 Å²	69	48.9 Å²	48.9	34%	0.34	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.9	169.8	-175.4	-177.1	-59.8	0	0	109.7	I305	I305-M315 HydrophobicContact CD1-CE 3.57Å; I305-M315 HydrophobicContact CG2-CE 4.45Å
316	H	91.8	Very high	79.5	Confident	61 Å²	61	48.7 Å²	48.7	28%	0.282	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.4	-178.8	-64.9	-94	0	0	0	109	H286 Y287 I288 K289 E314	H286-H316 AromaticContact ND1-CD2 3.95Å; H286-H316 AromaticContact ND1-NE2 3.34Å; H286-H316 PolarHBondContact ND1-NE2 2.87Å; Y287-H316 PolarHBondContact O-N 3.44Å; I288-H316 WeakPolarHBondContact CA-O 3.08Å; I288-H316 HydrophobicContact CB-CB 4.31Å; I288-H316 HydrophobicContact CG1-CB 4.1Å; I288-H316 HydrophobicContact CG2-CB 4.03Å; K289-H316 PolarHBondContact N-O 3.45Å; E314-H316 WeakPolarHBondContact CB-NE2 3.33Å; E314-H316 IonicContact OE2-CE1 3.63Å; E314-H316 PolarHBondContact OE2-CE1 3.23Å; E314-H316 IonicContact OE2-NE2 3.52Å; E314-H316 PolarHBondContact OE2-NE2 2.9Å
317	N	93.2	Very high	80.8	Confident	104 Å²	104	41.7 Å²	41.7	56%	0.556	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	108.4	-176.3	-62.8	-36.6	0	0	0	109.5	K289	K289-N317 WeakPolarHBondContact CE-OD1 3.4Å; K289-N317 VanDerWaalsContact CG-OD1 3.29Å; K289-N317 WeakPolarHBondContact CG-OD1 3.08Å
318	L	94.7	Very high	82.3	Confident	18 Å²	18	37.8 Å²	37.8	9%	0.094	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.4	175.9	-59.2	177	0	0	0	109.3	I288 K289 A291 F321 F326 E335 I336	I288-L318 HydrophobicContact CG2-CD1 3.8Å; I288-L318 HydrophobicContact CG2-CG 4.09Å; K289-L318 PolarHBondContact O-N 3.14Å; A291-L318 PolarHBondContact N-O 3.33Å; L318-F321 HydrophobicContact CB-CB 3.84Å; L318-F321 HydrophobicContact CB-CD1 4.33Å; L318-F321 HydrophobicContact CB-CD2 3.6Å; L318-F321 HydrophobicContact CB-CE2 4.19Å; L318-F321 HydrophobicContact CB-CG 3.67Å; L318-F321 HydrophobicContact CD1-CB 4.4Å; L318-F321 HydrophobicContact CD1-CD1 3.5Å; L318-F321 VanDerWaalsContact CD1-CD1 3.5Å; L318-F321 HydrophobicContact CD1-CD2 4.06Å; L318-F321 HydrophobicContact CD1-CE1 3.65Å; L318-F321 HydrophobicContact CD1-CE2 4.15Å; L318-F321 HydrophobicContact CD1-CG 3.73Å; L318-F321 HydrophobicContact CD1-CZ 3.97Å; L318-F321 HydrophobicContact CG-CD2 4.37Å; L318-F321 HydrophobicContact CG-CG 4.35Å; L318-F326 HydrophobicContact CD1-CD1 4.36Å; L318-F326 HydrophobicContact CD1-CE1 3.88Å; L318-E335 HydrophobicContact CD2-CB 4.18Å; L318-I336 HydrophobicContact CD1-CD1 3.65Å; L318-I336 HydrophobicContact CD1-CG1 3.62Å
319	S	90.7	Very high	83.9	Confident	75 Å²	75	36.7 Å²	36.7	52%	0.524	20%	0.203	S	C	.	.	S	Bend	trans	-61.9	139	171	56.4	0	0	0	0	109	F321	S319-F321 PolarHBondContact O-N 3.4Å
320	D	90.7	Very high	85.4	Confident	53 Å²	53	39.4 Å²	39.4	28%	0.283	22%	0.217	S	C	.	.	S	Bend	trans	62.7	-10.5	174.3	75.9	41.3	0	0	0	119.3	H243 Q244 N292 S322 R331	H243-D320 PolarHBondContact CE1-O 3.15Å; H243-D320 VanDerWaalsContact CE1-O 3.25Å; H243-D320 PolarHBondContact NE2-O 2.81Å; H243-D320 IonicContact NE2-OD1 3.43Å; H243-D320 PolarHBondContact NE2-OD1 3.19Å; Q244-D320 PolarHBondContact NE2-OD1 3.16Å; N292-D320 WeakPolarHBondContact ND2-CA 3.37Å; N292-D320 PolarHBondContact ND2-O 2.73Å; N292-D320 VanDerWaalsContact ND2-O 3.1Å; D320-S322 PolarHBondContact O-N 3.44Å; D320-R331 IonicContact OD1-CZ 3.25Å; D320-R331 IonicContact OD1-NH2 3.17Å; D320-R331 PolarHBondContact OD1-NH2 2.68Å; D320-R331 IonicContact OD2-CZ 2.77Å; D320-R331 IonicContact OD2-NH2 2.55Å; D320-R331 PolarHBondContact OD2-NH2 3.33Å
321	F	94	Very high	87.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.			trans	-60.5	128.5	177.7	-88.6	-121.6	0	0	0	111.7	G290 N292 D293 L318 S319 D325 F326 R331 E335 I336	G290-F321 CarbonylContact C-O 3.57Å; G290-F321 WeakPolarHBondContact CA-O 3.2Å; N292-F321 CarbonylContact C-O 3.59Å; N292-F321 PolarHBondContact N-O 2.67Å; N292-F321 VanDerWaalsContact N-O 3.11Å; D293-F321 PolarHBondContact N-O 2.98Å; L318-F321 HydrophobicContact CB-CB 3.84Å; L318-F321 HydrophobicContact CB-CD1 4.33Å; L318-F321 HydrophobicContact CB-CD2 3.6Å; L318-F321 HydrophobicContact CB-CE2 4.19Å; L318-F321 HydrophobicContact CB-CG 3.67Å; L318-F321 HydrophobicContact CD1-CB 4.4Å; L318-F321 HydrophobicContact CD1-CD1 3.5Å; L318-F321 VanDerWaalsContact CD1-CD1 3.5Å; L318-F321 HydrophobicContact CD1-CD2 4.06Å; L318-F321 HydrophobicContact CD1-CE1 3.65Å; L318-F321 HydrophobicContact CD1-CE2 4.15Å; L318-F321 HydrophobicContact CD1-CG 3.73Å; L318-F321 HydrophobicContact CD1-CZ 3.97Å; L318-F321 HydrophobicContact CG-CD2 4.37Å; L318-F321 HydrophobicContact CG-CG 4.35Å; S319-F321 PolarHBondContact O-N 3.4Å; F321-D325 HydrophobicContact CB-CB 4.24Å; F321-D325 HydrophobicContact CD1-CB 3.41Å; F321-D325 VanDerWaalsContact CD1-CB 3.41Å; F321-D325 HydrophobicContact CE1-CB 3.89Å; F321-D325 HydrophobicContact CG-CB 3.89Å; F321-F326 HydrophobicContact CB-CE2 4.35Å; F321-F326 HydrophobicContact CB-CZ 4.37Å; F321-R331 HydrophobicContact CZ-CB 4.25Å; F321-E335 HydrophobicContact CZ-CB 4.33Å; F321-I336 HydrophobicContact CD1-CD1 4.28Å; F321-I336 HydrophobicContact CE1-CD1 3.68Å; F321-I336 HydrophobicContact CE1-CG1 4.38Å; F321-I336 HydrophobicContact CZ-CD1 4.48Å
322	S	92.3	Very high	89	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.021	19%	0.186	C	C	.	.			trans	-90.9	175	165.8	74.8	0	0	0	0	111.2	D320 L324 D325 F326	D320-S322 PolarHBondContact O-N 3.44Å; S322-L324 VanDerWaalsContact C-N 3.27Å; S322-L324 PolarHBondContact O-N 3.01Å; S322-D325 WeakPolarHBondContact CB-OD2 3.48Å; S322-D325 PolarHBondContact N-OD2 2.81Å; S322-D325 PolarHBondContact O-N 3.42Å; S322-D325 VanDerWaalsContact O-N 3.13Å; S322-D325 PolarHBondContact OG-OD2 3.15Å; S322-F326 WeakPolarHBondContact O-CD2 3.16Å; S322-F326 VanDerWaalsContact O-CE2 3.32Å; S322-F326 WeakPolarHBondContact O-CE2 3.44Å
323	H	92.3	Very high	90.8	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.009	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.6	-171.8	-162.4	69.8	0	0	0	114.3	H149 S150 A238 D293 F326	H149-H323 AromaticContact CE1-NE2 3.89Å; H149-H323 AromaticContact NE2-NE2 3.93Å; H149-H323 PolarHBondContact NE2-O 3.16Å; S150-H323 WeakPolarHBondContact CB-NE2 3.42Å; S150-H323 PolarHBondContact OG-CE1 3.08Å; S150-H323 PolarHBondContact OG-NE2 3.07Å; A238-H323 HydrophobicContact CB-CB 4Å; A238-H323 WeakPolarHBondContact O-CB 3.35Å; D293-H323 VanDerWaalsContact CG-ND1 3.31Å; D293-H323 WeakPolarHBondContact OD1-CB 3Å; D293-H323 IonicContact OD1-CG 3.57Å; D293-H323 IonicContact OD1-ND1 2.66Å; D293-H323 PolarHBondContact OD1-ND1 2.98Å; D293-H323 WeakPolarHBondContact OD2-CA 3.11Å; D293-H323 IonicContact OD2-CE1 3.31Å; D293-H323 IonicContact OD2-CG 3.01Å; D293-H323 IonicContact OD2-ND1 2.74Å; D293-H323 PolarHBondContact OD2-ND1 3.32Å; H323-F326 WeakPolarHBondContact O-CD2 3.31Å
324	L	90.8	Very high	92.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-14.1	-178.7	-62.6	173	0	0	0	113	L234 F235 A238 I245 S322 F326 I327 W328	L234-L324 HydrophobicContact CD1-CD2 4Å; L234-L324 HydrophobicContact CD2-CD2 4.11Å; L234-L324 HydrophobicContact CG-CD2 3.98Å; F235-L324 HydrophobicContact CD1-CD1 3.85Å; F235-L324 HydrophobicContact CE1-CD1 3.63Å; F235-L324 HydrophobicContact CZ-CD1 4.14Å; A238-L324 HydrophobicContact CB-CD1 4.02Å; A238-L324 HydrophobicContact CB-CD2 3.83Å; A238-L324 HydrophobicContact CB-CG 3.71Å; I245-L324 HydrophobicContact CD1-CB 4.39Å; S322-L324 VanDerWaalsContact C-N 3.27Å; S322-L324 PolarHBondContact O-N 3.01Å; L324-F326 PolarHBondContact O-N 2.94Å; L324-I327 HydrophobicContact CD2-CD1 4.24Å; L324-I327 WeakPolarHBondContact O-CG1 3.36Å; L324-I327 PolarHBondContact O-N 2.68Å; L324-W328 HydrophobicContact CB-CE3 4.01Å; L324-W328 HydrophobicContact CB-CZ3 4.5Å; L324-W328 HydrophobicContact CD1-CE3 4.04Å; L324-W328 HydrophobicContact CD1-CZ3 3.74Å; L324-W328 HydrophobicContact CD2-CE3 4.34Å; L324-W328 HydrophobicContact CD2-CZ3 4.16Å; L324-W328 HydrophobicContact CG-CE3 4.35Å; L324-W328 HydrophobicContact CG-CZ3 4.35Å; L324-W328 WeakPolarHBondContact O-CB 3.38Å; L324-W328 PolarHBondContact O-N 3.27Å
325	D	93.5	Very high	92.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.6	-23.4	-177.2	-66.4	-32.9	0	0	0	112.3	H243 Q244 F321 S322 I327 G329	H243-D325 IonicContact CE1-OD2 3.46Å; Q244-D325 WeakPolarHBondContact CB-OD1 3.44Å; F321-D325 HydrophobicContact CB-CB 4.24Å; F321-D325 HydrophobicContact CD1-CB 3.41Å; F321-D325 VanDerWaalsContact CD1-CB 3.41Å; F321-D325 HydrophobicContact CE1-CB 3.89Å; F321-D325 HydrophobicContact CG-CB 3.89Å; S322-D325 WeakPolarHBondContact CB-OD2 3.48Å; S322-D325 PolarHBondContact N-OD2 2.81Å; S322-D325 PolarHBondContact O-N 3.42Å; S322-D325 VanDerWaalsContact O-N 3.13Å; S322-D325 PolarHBondContact OG-OD2 3.15Å; D325-I327 PolarHBondContact O-N 3.27Å; D325-G329 WeakPolarHBondContact O-CA 3.46Å; D325-G329 PolarHBondContact O-N 2.67Å
326	F	94.9	Very high	93.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-27.4	175.7	-66	-89.9	0	0	0	114.6	L176 A177 I288 L318 F321 S322 H323 L324 I336 Y337	L176-F326 HydrophobicContact CB-CB 4.16Å; L176-F326 HydrophobicContact CB-CD1 3.89Å; L176-F326 HydrophobicContact CB-CG 4.26Å; L176-F326 HydrophobicContact CD1-CB 4.45Å; A177-F326 HydrophobicContact CB-CD2 3.79Å; A177-F326 HydrophobicContact CB-CE2 3.75Å; A177-F326 HydrophobicContact CB-CG 4.27Å; A177-F326 HydrophobicContact CB-CZ 4.19Å; I288-F326 HydrophobicContact CB-CE1 4.35Å; I288-F326 HydrophobicContact CG2-CD1 4.44Å; I288-F326 HydrophobicContact CG2-CE1 3.93Å; I288-F326 VanDerWaalsContact O-CE1 3.26Å; I288-F326 WeakPolarHBondContact O-CE1 3.46Å; L318-F326 HydrophobicContact CD1-CD1 4.36Å; L318-F326 HydrophobicContact CD1-CE1 3.88Å; F321-F326 HydrophobicContact CB-CE2 4.35Å; F321-F326 HydrophobicContact CB-CZ 4.37Å; S322-F326 WeakPolarHBondContact O-CD2 3.16Å; S322-F326 VanDerWaalsContact O-CE2 3.32Å; S322-F326 WeakPolarHBondContact O-CE2 3.44Å; H323-F326 WeakPolarHBondContact O-CD2 3.31Å; L324-F326 PolarHBondContact O-N 2.94Å; F326-I336 HydrophobicContact CB-CD1 4.26Å; F326-I336 HydrophobicContact CD1-CD1 3.69Å; F326-I336 HydrophobicContact CE1-CD1 4.43Å; F326-I336 HydrophobicContact CG-CD1 4.3Å; F326-Y337 PolarHBondContact O-OH 3.18Å; F326-Y337 VanDerWaalsContact O-OH 3.1Å
327	I	92.8	Very high	93.8	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-113.6	-35	-177.2	52.5	171.9	0	0	0	111.3	D70 W71 H149 L324 D325 Y337	D70-I327 HydrophobicContact CB-CB 4.46Å; D70-I327 HydrophobicContact CB-CD1 4.02Å; D70-I327 WeakPolarHBondContact OD2-CD1 3.31Å; W71-I327 HydrophobicContact CE3-CG2 4.1Å; W71-I327 HydrophobicContact CH2-CG2 3.82Å; W71-I327 HydrophobicContact CZ2-CG2 4.48Å; W71-I327 HydrophobicContact CZ3-CG2 3.59Å; H149-I327 HydrophobicContact CB-CG2 4.08Å; L324-I327 HydrophobicContact CD2-CD1 4.24Å; L324-I327 WeakPolarHBondContact O-CG1 3.36Å; L324-I327 PolarHBondContact O-N 2.68Å; D325-I327 PolarHBondContact O-N 3.27Å; I327-Y337 PolarHBondContact O-OH 1.98Å
328	W	91.3	Very high	94	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-115.9	-6.1	-170.6	-65.6	-10.2	0	0	0	114.5	D70 N74 L234 F235 I245 R253 T257 L324	D70-W328 VanDerWaalsContact OD1-CZ2 3.22Å; D70-W328 WeakPolarHBondContact OD1-CZ2 3.3Å; D70-W328 PolarHBondContact OD1-NE1 3.18Å; D70-W328 VanDerWaalsContact OD1-NE1 3.11Å; N74-W328 WeakPolarHBondContact ND2-CA 3.25Å; N74-W328 PolarHBondContact ND2-O 2.95Å; L234-W328 HydrophobicContact CD2-CH2 3.43Å; L234-W328 VanDerWaalsContact CD2-CH2 3.43Å; L234-W328 HydrophobicContact CD2-CZ2 4.03Å; L234-W328 HydrophobicContact CD2-CZ3 4.21Å; F235-W328 HydrophobicContact CE1-CZ3 4.41Å; F235-W328 AromaticContact CE2-CZ3 3.99Å; F235-W328 HydrophobicContact CE2-CZ3 3.99Å; F235-W328 HydrophobicContact CZ-CE3 4.31Å; F235-W328 AromaticContact CZ-CZ3 3.64Å; F235-W328 HydrophobicContact CZ-CZ3 3.64Å; I245-W328 HydrophobicContact CD1-CE3 4.48Å; R253-W328 VanDerWaalsContact NH1-CD2 3.27Å; T257-W328 HydrophobicContact CG2-CH2 3.66Å; T257-W328 HydrophobicContact CG2-CZ2 3.78Å; L324-W328 HydrophobicContact CB-CE3 4.01Å; L324-W328 HydrophobicContact CB-CZ3 4.5Å; L324-W328 HydrophobicContact CD1-CE3 4.04Å; L324-W328 HydrophobicContact CD1-CZ3 3.74Å; L324-W328 HydrophobicContact CD2-CE3 4.34Å; L324-W328 HydrophobicContact CD2-CZ3 4.16Å; L324-W328 HydrophobicContact CG-CE3 4.35Å; L324-W328 HydrophobicContact CG-CZ3 4.35Å; L324-W328 WeakPolarHBondContact O-CB 3.38Å; L324-W328 PolarHBondContact O-N 3.27Å
329	G	91.8	Very high	94.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-65.1	137.5	-177.5	0	0	0	0	0	112.4	Q244 D325 R331 A332	Q244-G329 CarbonylContact O-C 3.52Å; Q244-G329 VanDerWaalsContact O-CA 3.27Å; Q244-G329 WeakPolarHBondContact O-CA 3.34Å; D325-G329 WeakPolarHBondContact O-CA 3.46Å; D325-G329 PolarHBondContact O-N 2.67Å; G329-R331 PolarHBondContact O-N 3.27Å; G329-R331 VanDerWaalsContact O-N 3.16Å; G329-A332 VanDerWaalsContact O-CB 3.32Å; G329-A332 WeakPolarHBondContact O-CB 3.28Å; G329-A332 PolarHBondContact O-N 2.83Å; G329-A332 VanDerWaalsContact O-N 3.1Å
330	L	92.2	Very high	94.4	Very high	73 Å²	73	27.6 Å²	27.6	38%	0.382	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.1	176.6	-71.7	171.8	0	0	0	112.3	Q78 Q244 N246	Q78-L330 PolarHBondContact NE2-O 3.13Å; Q244-L330 VanDerWaalsContact O-CG 3.32Å; Q244-L330 WeakPolarHBondContact O-CG 3.46Å; Q244-L330 PolarHBondContact O-N 3.05Å; N246-L330 HydrophobicContact CB-CD2 4.1Å
331	R	94.7	Very high	94.7	Very high	79 Å²	79	27 Å²	27	30%	0.298	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-6	179.8	-53.6	-170	-62.5	165.1	-14.9	114.2	Q244 D320 F321 G329 G333 Y334 E335	Q244-R331 VanDerWaalsContact NE2-NH2 3.12Å; D320-R331 IonicContact OD1-CZ 3.25Å; D320-R331 IonicContact OD1-NH2 3.17Å; D320-R331 PolarHBondContact OD1-NH2 2.68Å; D320-R331 IonicContact OD2-CZ 2.77Å; D320-R331 IonicContact OD2-NH2 2.55Å; D320-R331 PolarHBondContact OD2-NH2 3.33Å; F321-R331 HydrophobicContact CZ-CB 4.25Å; G329-R331 PolarHBondContact O-N 3.27Å; G329-R331 VanDerWaalsContact O-N 3.16Å; R331-G333 PolarHBondContact O-N 2.94Å; R331-G333 VanDerWaalsContact O-N 3.17Å; R331-Y334 PolarHBondContact O-N 2.98Å; R331-E335 HydrophobicContact CB-CG 4.25Å; R331-E335 WeakPolarHBondContact CD-OE1 3.41Å; R331-E335 IonicContact CZ-OE1 3.3Å; R331-E335 IonicContact CZ-OE2 3.2Å; R331-E335 IonicContact NE-OE1 3.62Å; R331-E335 PolarHBondContact NE-OE1 3.1Å; R331-E335 IonicContact NH1-OE1 2.74Å; R331-E335 PolarHBondContact NH1-OE1 2.84Å; R331-E335 IonicContact NH1-OE2 3.27Å; R331-E335 PolarHBondContact O-N 2.9Å
332	A	95.6	Very high	94.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.8	-37.9	-177	0	0	0	0	0	112.7	G329 Y334 I336 Y337	G329-A332 VanDerWaalsContact O-CB 3.32Å; G329-A332 WeakPolarHBondContact O-CB 3.28Å; G329-A332 PolarHBondContact O-N 2.83Å; G329-A332 VanDerWaalsContact O-N 3.1Å; A332-Y334 PolarHBondContact O-N 2.95Å; A332-I336 HydrophobicContact CB-CD1 4.35Å; A332-I336 WeakPolarHBondContact O-CA 3.32Å; A332-I336 VanDerWaalsContact O-CB 3.31Å; A332-I336 WeakPolarHBondContact O-CB 2.98Å; A332-I336 PolarHBondContact O-N 3.38Å; A332-Y337 HydrophobicContact CB-CE1 4.23Å; A332-Y337 HydrophobicContact CB-CE2 3.99Å; A332-Y337 PolarHBondContact O-N 3.03Å
333	G	96.3	Very high	94.9	Very high	5 Å²	5	32.3 Å²	32.3	5%	0.052	15%	0.145	C	C	.	.	I	π-helix	trans	-57.2	-43.7	175.1	0	0	0	0	0	114.3	G77 R331 Y337 R338	G77-G333 WeakPolarHBondContact O-CA 3.2Å; R331-G333 PolarHBondContact O-N 2.94Å; R331-G333 VanDerWaalsContact O-N 3.17Å; G333-Y337 VanDerWaalsContact CA-CD2 3.46Å; G333-R338 WeakPolarHBondContact O-CB 2.89Å; G333-R338 PolarHBondContact O-N 3.48Å
334	Y	95.7	Very high	95	Very high	157 Å²	157	32.2 Å²	32.2	62%	0.616	15%	0.145	S	C	*	.	I	π-helix	trans	-87.5	-38.3	-176.8	179.1	-91.9	0	0	0	112.8	R331 A332 P339	R331-Y334 PolarHBondContact O-N 2.98Å; A332-Y334 PolarHBondContact O-N 2.95Å; Y334-P339 WeakPolarHBondContact O-CD 3.26Å
335	E	96.6	Very high	95.1	Very high	49 Å²	49	34.2 Å²	34.2	23%	0.229	15%	0.154	C	C	.	.	I	π-helix	trans	-92.8	-16.8	-172.7	-65.2	-169.3	-144.9	0	0	113.9	L318 F321 R331	L318-E335 HydrophobicContact CD2-CB 4.18Å; F321-E335 HydrophobicContact CZ-CB 4.33Å; R331-E335 HydrophobicContact CB-CG 4.25Å; R331-E335 WeakPolarHBondContact CD-OE1 3.41Å; R331-E335 IonicContact CZ-OE1 3.3Å; R331-E335 IonicContact CZ-OE2 3.2Å; R331-E335 IonicContact NE-OE1 3.62Å; R331-E335 PolarHBondContact NE-OE1 3.1Å; R331-E335 IonicContact NH1-OE1 2.74Å; R331-E335 PolarHBondContact NH1-OE1 2.84Å; R331-E335 IonicContact NH1-OE2 3.27Å; R331-E335 PolarHBondContact O-N 2.9Å
336	I	97.5	Very high	95.1	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	18%	0.178	C	C	.	.	I	π-helix	trans	-122	-62.1	179.5	-56.4	173.5	0	0	0	110.6	L176 I288 L318 F321 F326 A332 R338 P339 V340	L176-I336 HydrophobicContact CD1-CG2 4.36Å; L176-I336 HydrophobicContact CD2-CG2 3.77Å; I288-I336 HydrophobicContact CD1-CG2 4.11Å; L318-I336 HydrophobicContact CD1-CD1 3.65Å; L318-I336 HydrophobicContact CD1-CG1 3.62Å; F321-I336 HydrophobicContact CD1-CD1 4.28Å; F321-I336 HydrophobicContact CE1-CD1 3.68Å; F321-I336 HydrophobicContact CE1-CG1 4.38Å; F321-I336 HydrophobicContact CZ-CD1 4.48Å; F326-I336 HydrophobicContact CB-CD1 4.26Å; F326-I336 HydrophobicContact CD1-CD1 3.69Å; F326-I336 HydrophobicContact CE1-CD1 4.43Å; F326-I336 HydrophobicContact CG-CD1 4.3Å; A332-I336 HydrophobicContact CB-CD1 4.35Å; A332-I336 WeakPolarHBondContact O-CA 3.32Å; A332-I336 VanDerWaalsContact O-CB 3.31Å; A332-I336 WeakPolarHBondContact O-CB 2.98Å; A332-I336 PolarHBondContact O-N 3.38Å; I336-R338 PolarHBondContact O-N 3.23Å; I336-P339 VanDerWaalsContact O-CD 3.31Å; I336-P339 WeakPolarHBondContact O-CD 3.38Å; I336-V340 HydrophobicContact CG2-CG2 4.4Å; I336-V340 VanDerWaalsContact O-CG2 3.24Å; I336-V340 WeakPolarHBondContact O-CG2 3.26Å; I336-V340 PolarHBondContact O-N 2.95Å; I336-V340 VanDerWaalsContact O-N 3.07Å
337	Y	97.9	Very high	95	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.012	19%	0.187	C	C	.	.	I	π-helix	trans	-67.6	-38.4	-167.4	-48.9	-25.3	0	0	0	111.7	A80 Y83 F84 F326 I327 A332 G333 V340 E341	A80-Y337 HydrophobicContact CB-CD1 4.23Å; A80-Y337 HydrophobicContact CB-CD2 4.26Å; A80-Y337 HydrophobicContact CB-CE1 3.9Å; A80-Y337 HydrophobicContact CB-CE2 3.95Å; A80-Y337 HydrophobicContact CB-CG 4.43Å; Y83-Y337 HydrophobicContact CD2-CD2 4.5Å; Y83-Y337 HydrophobicContact CG-CD2 4.2Å; F84-Y337 HydrophobicContact CE2-CD1 4.5Å; F84-Y337 HydrophobicContact CZ-CD1 4.41Å; F84-Y337 HydrophobicContact CZ-CG 4.41Å; F326-Y337 PolarHBondContact O-OH 3.18Å; F326-Y337 VanDerWaalsContact O-OH 3.1Å; I327-Y337 PolarHBondContact O-OH 1.98Å; A332-Y337 HydrophobicContact CB-CE1 4.23Å; A332-Y337 HydrophobicContact CB-CE2 3.99Å; A332-Y337 PolarHBondContact O-N 3.03Å; G333-Y337 VanDerWaalsContact CA-CD2 3.46Å; Y337-V340 PolarHBondContact O-N 3.33Å; Y337-E341 VanDerWaalsContact O-CB 3.27Å; Y337-E341 WeakPolarHBondContact O-CB 3.18Å; Y337-E341 PolarHBondContact O-N 3.28Å
338	R	97.4	Very high	94.9	Very high	98 Å²	98	43.6 Å²	43.6	37%	0.37	19%	0.192	S	C	.	.	H	α-helix	trans	-62.9	-51.9	175.2	-176.2	-176.1	-174	-160.4	2	113.3	Y83 G333 I336 V340 E341 Q342	Y83-R338 WeakPolarHBondContact OH-CA 3.3Å; Y83-R338 WeakPolarHBondContact OH-CB 3.04Å; G333-R338 WeakPolarHBondContact O-CB 2.89Å; G333-R338 PolarHBondContact O-N 3.48Å; I336-R338 PolarHBondContact O-N 3.23Å; R338-V340 VanDerWaalsContact C-N 3.31Å; R338-V340 PolarHBondContact O-N 3.22Å; R338-E341 WeakPolarHBondContact O-CB 3.37Å; R338-E341 PolarHBondContact O-N 3.22Å; R338-Q342 VanDerWaalsContact O-CG 3.31Å; R338-Q342 WeakPolarHBondContact O-CG 3.28Å; R338-Q342 PolarHBondContact O-N 3.39Å
339	P	96.8	Very high	94.6	Very high	50 Å²	50	45.1 Å²	45.1	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-56.6	-41.4	172.9	-29.4	34	0	0	0	114	Y334 I336 Q342 F343	Y334-P339 WeakPolarHBondContact O-CD 3.26Å; I336-P339 VanDerWaalsContact O-CD 3.31Å; I336-P339 WeakPolarHBondContact O-CD 3.38Å; P339-Q342 PolarHBondContact O-N 2.89Å; P339-F343 WeakPolarHBondContact O-CB 3.14Å; P339-F343 PolarHBondContact O-N 3.39Å
340	V	97.3	Very high	94.3	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-47.7	176.9	170.7	0	0	0	0	110.7	F84 F174 I288 I336 Y337 R338 Q342 F343 I344	F84-V340 HydrophobicContact CE1-CB 4.36Å; F84-V340 HydrophobicContact CE1-CG1 4.01Å; F84-V340 HydrophobicContact CZ-CB 4.18Å; F84-V340 HydrophobicContact CZ-CG1 3.79Å; F174-V340 HydrophobicContact CD1-CB 4.45Å; F174-V340 HydrophobicContact CD1-CG1 4.15Å; F174-V340 HydrophobicContact CD1-CG2 3.73Å; F174-V340 HydrophobicContact CD2-CG1 4.03Å; F174-V340 HydrophobicContact CE1-CB 4.42Å; F174-V340 HydrophobicContact CE1-CG1 4.1Å; F174-V340 HydrophobicContact CE1-CG2 4.08Å; F174-V340 HydrophobicContact CE2-CG1 3.98Å; F174-V340 HydrophobicContact CG-CG1 4.12Å; F174-V340 HydrophobicContact CG-CG2 4.16Å; F174-V340 HydrophobicContact CZ-CG1 4.01Å; I288-V340 HydrophobicContact CD1-CG2 4.32Å; I336-V340 HydrophobicContact CG2-CG2 4.4Å; I336-V340 VanDerWaalsContact O-CG2 3.24Å; I336-V340 WeakPolarHBondContact O-CG2 3.26Å; I336-V340 PolarHBondContact O-N 2.95Å; I336-V340 VanDerWaalsContact O-N 3.07Å; Y337-V340 PolarHBondContact O-N 3.33Å; R338-V340 VanDerWaalsContact C-N 3.31Å; R338-V340 PolarHBondContact O-N 3.22Å; V340-Q342 PolarHBondContact O-N 3.11Å; V340-F343 PolarHBondContact O-N 2.88Å; V340-I344 HydrophobicContact CG1-CD1 3.73Å; V340-I344 HydrophobicContact CG1-CG1 4.44Å; V340-I344 VanDerWaalsContact O-CG1 3.29Å; V340-I344 WeakPolarHBondContact O-CG1 3.2Å; V340-I344 PolarHBondContact O-N 3.18Å
341	E	96.5	Very high	93.6	Very high	39 Å²	39	47.3 Å²	47.3	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-56.1	-50.6	175.8	-179.7	-128.1	146.8	0	0	111.9	Y83 F84 A87 F89 Y337 R338 F343 I344 H345	Y83-E341 HydrophobicContact CE1-CB 4.18Å; Y83-E341 HydrophobicContact CE1-CG 4.5Å; Y83-E341 PolarHBondContact OH-OE2 3.07Å; F84-E341 HydrophobicContact CE1-CB 4.24Å; A87-E341 HydrophobicContact CB-CG 3.7Å; F89-E341 HydrophobicContact CE2-CB 4.42Å; F89-E341 HydrophobicContact CE2-CG 3.76Å; F89-E341 HydrophobicContact CZ-CB 4.42Å; F89-E341 HydrophobicContact CZ-CG 4.1Å; Y337-E341 VanDerWaalsContact O-CB 3.27Å; Y337-E341 WeakPolarHBondContact O-CB 3.18Å; Y337-E341 PolarHBondContact O-N 3.28Å; R338-E341 WeakPolarHBondContact O-CB 3.37Å; R338-E341 PolarHBondContact O-N 3.22Å; E341-F343 VanDerWaalsContact C-N 3.33Å; E341-F343 PolarHBondContact O-N 3.02Å; E341-I344 PolarHBondContact O-N 3.32Å; E341-H345 PolarHBondContact O-N 2.87Å; E341-H345 IonicContact OE1-CE1 3.99Å; E341-H345 PolarHBondContact OE1-CE1 3.28Å; E341-H345 VanDerWaalsContact OE1-CE1 3.3Å; E341-H345 IonicContact OE1-ND1 3.11Å; E341-H345 PolarHBondContact OE1-ND1 3.19Å
342	Q	95.5	Very high	92.5	Very high	92 Å²	92	46.9 Å²	46.9	43%	0.43	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-40.6	-179.8	-72.2	176.1	-16.6	0	0	112.4	R338 P339 V340 R346	R338-Q342 VanDerWaalsContact O-CG 3.31Å; R338-Q342 WeakPolarHBondContact O-CG 3.28Å; R338-Q342 PolarHBondContact O-N 3.39Å; P339-Q342 PolarHBondContact O-N 2.89Å; V340-Q342 PolarHBondContact O-N 3.11Å; Q342-R346 PolarHBondContact O-N 3.41Å
343	F	95.5	Very high	91	Very high	23 Å²	23	54.1 Å²	54.1	10%	0.101	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-52.3	174.2	178	-81.9	0	0	0	110.8	T172 F174 H286 P339 V340 E341 H345 R346 D347	T172-F343 HydrophobicContact CG2-CE1 3.92Å; T172-F343 HydrophobicContact CG2-CZ 4.35Å; F174-F343 HydrophobicContact CE1-CD1 4.18Å; F174-F343 HydrophobicContact CE1-CG 4.48Å; F174-F343 AromaticContact CZ-CD1 3.66Å; F174-F343 HydrophobicContact CZ-CD1 3.66Å; F174-F343 HydrophobicContact CZ-CE1 4.16Å; F174-F343 HydrophobicContact CZ-CG 4.35Å; H286-F343 AromaticContact CE1-CD2 3.6Å; H286-F343 AromaticContact CE1-CE2 3.54Å; H286-F343 AromaticContact NE2-CD2 3.7Å; H286-F343 AromaticContact NE2-CE1 4Å; H286-F343 AromaticContact NE2-CE2 3.24Å; H286-F343 WeakPolarHBondContact NE2-CE2 3.35Å; H286-F343 AromaticContact NE2-CZ 3.41Å; H286-F343 WeakPolarHBondContact NE2-CZ 3.35Å; P339-F343 WeakPolarHBondContact O-CB 3.14Å; P339-F343 PolarHBondContact O-N 3.39Å; V340-F343 PolarHBondContact O-N 2.88Å; E341-F343 VanDerWaalsContact C-N 3.33Å; E341-F343 PolarHBondContact O-N 3.02Å; F343-H345 PolarHBondContact O-N 2.93Å; F343-R346 PolarHBondContact O-N 2.94Å; F343-R346 VanDerWaalsContact O-N 3.15Å; F343-D347 HydrophobicContact CD1-CB 4.28Å; F343-D347 HydrophobicContact CE1-CB 3.91Å; F343-D347 HydrophobicContact CZ-CB 4.43Å; F343-D347 WeakPolarHBondContact O-CB 3.35Å; F343-D347 PolarHBondContact O-N 2.82Å
344	I	95.4	Very high	89.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-44.1	-175.7	-67.2	170.6	0	0	0	110.7	P56 I58 F89 Y145 F174 V340 E341 R346 D347 Y348	P56-I344 HydrophobicContact CB-CG2 3.79Å; P56-I344 HydrophobicContact CG-CG2 4.18Å; I58-I344 HydrophobicContact CD1-CD1 3.88Å; F89-I344 HydrophobicContact CD1-CG2 4.45Å; F89-I344 HydrophobicContact CE1-CB 3.83Å; F89-I344 HydrophobicContact CE1-CD1 3.68Å; F89-I344 HydrophobicContact CE1-CG1 4.36Å; F89-I344 HydrophobicContact CE1-CG2 3.39Å; F89-I344 HydrophobicContact CZ-CB 3.99Å; F89-I344 HydrophobicContact CZ-CD1 4.3Å; F89-I344 HydrophobicContact CZ-CG2 3.88Å; Y145-I344 HydrophobicContact CD1-CB 4.45Å; Y145-I344 HydrophobicContact CD1-CD1 3.98Å; Y145-I344 HydrophobicContact CD1-CG1 3.61Å; Y145-I344 HydrophobicContact CD1-CG2 4.24Å; Y145-I344 HydrophobicContact CD2-CD1 4.24Å; Y145-I344 HydrophobicContact CD2-CG1 4.27Å; Y145-I344 HydrophobicContact CD2-CG2 3.58Å; Y145-I344 HydrophobicContact CE1-CB 4.26Å; Y145-I344 HydrophobicContact CE1-CG1 3.81Å; Y145-I344 HydrophobicContact CE1-CG2 3.97Å; Y145-I344 HydrophobicContact CE2-CB 4.36Å; Y145-I344 HydrophobicContact CE2-CG1 4.45Å; Y145-I344 HydrophobicContact CE2-CG2 3.25Å; Y145-I344 HydrophobicContact CG-CD1 3.74Å; Y145-I344 HydrophobicContact CG-CG1 3.83Å; Y145-I344 HydrophobicContact CG-CG2 4.05Å; Y145-I344 VanDerWaalsContact CZ-CG2 3.44Å; F174-I344 HydrophobicContact CE2-CD1 3.79Å; F174-I344 HydrophobicContact CE2-CG1 3.87Å; F174-I344 HydrophobicContact CZ-CD1 4.2Å; F174-I344 HydrophobicContact CZ-CG1 3.87Å; V340-I344 HydrophobicContact CG1-CD1 3.73Å; V340-I344 HydrophobicContact CG1-CG1 4.44Å; V340-I344 VanDerWaalsContact O-CG1 3.29Å; V340-I344 WeakPolarHBondContact O-CG1 3.2Å; V340-I344 PolarHBondContact O-N 3.18Å; E341-I344 PolarHBondContact O-N 3.32Å; I344-R346 VanDerWaalsContact C-N 3.31Å; I344-R346 PolarHBondContact O-N 3.27Å; I344-D347 PolarHBondContact O-N 2.87Å; I344-Y348 WeakPolarHBondContact O-CB 3.41Å; I344-Y348 PolarHBondContact O-N 3.43Å
345	H	93.3	Very high	86.8	Confident	43 Å²	43	58.7 Å²	58.7	20%	0.199	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-43.9	176.8	-75	162.2	0	0	0	111.8	A87 F89 E341 F343 W349	A87-H345 PolarHBondContact O-CE1 2.83Å; A87-H345 PolarHBondContact O-NE2 2.78Å; F89-H345 AromaticContact CE2-CE1 3.78Å; F89-H345 AromaticContact CE2-NE2 3.37Å; F89-H345 WeakPolarHBondContact CE2-NE2 3.5Å; F89-H345 AromaticContact CZ-CD2 3.93Å; F89-H345 AromaticContact CZ-NE2 3.68Å; E341-H345 PolarHBondContact O-N 2.87Å; E341-H345 IonicContact OE1-CE1 3.99Å; E341-H345 PolarHBondContact OE1-CE1 3.28Å; E341-H345 VanDerWaalsContact OE1-CE1 3.3Å; E341-H345 IonicContact OE1-ND1 3.11Å; E341-H345 PolarHBondContact OE1-ND1 3.19Å; F343-H345 PolarHBondContact O-N 2.93Å; H345-W349 AromaticContact CD2-NE1 3.9Å; H345-W349 WeakPolarHBondContact O-CB 3.24Å; H345-W349 PolarHBondContact O-N 2.93Å; H345-W349 VanDerWaalsContact O-N 3.17Å
346	R	92.7	Very high	84.1	Confident	132 Å²	132	67.8 Å²	67.8	50%	0.498	33%	0.328	S	S	.	.	H	α-helix	trans	-63.2	-47.2	175.7	-179.8	177.1	57.5	-125.3	-3	111.8	Q342 F343 I344 T350	Q342-R346 PolarHBondContact O-N 3.41Å; F343-R346 PolarHBondContact O-N 2.94Å; F343-R346 VanDerWaalsContact O-N 3.15Å; I344-R346 VanDerWaalsContact C-N 3.31Å; I344-R346 PolarHBondContact O-N 3.27Å; R346-T350 VanDerWaalsContact O-CB 3.29Å; R346-T350 WeakPolarHBondContact O-CB 3.13Å; R346-T350 WeakPolarHBondContact O-CG2 3.41Å; R346-T350 PolarHBondContact O-N 3.08Å; R346-T350 PolarHBondContact O-OG1 3.47Å
347	D	91.8	Very high	83.4	Confident	38 Å²	38	71.1 Å²	71.1	20%	0.203	34%	0.343	C	S	.	.	H	α-helix	trans	-67.2	-42	-177.5	177.9	73.5	0	0	0	113	Y145 R171 F343 I344 T350 A351	Y145-D347 VanDerWaalsContact CE1-OD2 3.31Å; Y145-D347 WeakPolarHBondContact CE1-OD2 3.23Å; Y145-D347 PolarHBondContact OH-OD2 3.28Å; R171-D347 WeakPolarHBondContact CD-OD2 3.25Å; R171-D347 IonicContact NH1-OD2 3.97Å; F343-D347 HydrophobicContact CD1-CB 4.28Å; F343-D347 HydrophobicContact CE1-CB 3.91Å; F343-D347 HydrophobicContact CZ-CB 4.43Å; F343-D347 WeakPolarHBondContact O-CB 3.35Å; F343-D347 PolarHBondContact O-N 2.82Å; I344-D347 PolarHBondContact O-N 2.87Å; D347-T350 PolarHBondContact O-OG1 3.32Å; D347-T350 VanDerWaalsContact O-OG1 3.08Å; D347-A351 WeakPolarHBondContact O-CB 3.2Å; D347-A351 PolarHBondContact O-N 3Å
348	Y	90.8	Very high	82.7	Confident	28 Å²	28	74.7 Å²	74.7	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-69.2	-51.6	-178.9	-169.8	-94.1	0	0	0	112	R55 P56 Y145 I344 T350 A351 E352	R55-Y348 PolarHBondContact O-OH 2.78Å; P56-Y348 HydrophobicContact CB-CD2 3.95Å; P56-Y348 HydrophobicContact CB-CE2 4.28Å; P56-Y348 HydrophobicContact CB-CG 4.17Å; Y145-Y348 HydrophobicContact CE2-CD2 4.03Å; Y145-Y348 WeakPolarHBondContact OH-CB 3.43Å; Y145-Y348 PolarHBondContact OH-N 3.1Å; I344-Y348 WeakPolarHBondContact O-CB 3.41Å; I344-Y348 PolarHBondContact O-N 3.43Å; Y348-T350 PolarHBondContact O-N 2.94Å; Y348-A351 PolarHBondContact O-N 2.94Å; Y348-E352 HydrophobicContact CD1-CG 4.32Å; Y348-E352 HydrophobicContact CE1-CG 4Å; Y348-E352 WeakPolarHBondContact O-CG 3.16Å; Y348-E352 PolarHBondContact O-N 2.79Å; Y348-E352 VanDerWaalsContact O-N 3.14Å
349	W	85.9	Confident	81.9	Confident	33 Å²	33	73.4 Å²	73.4	13%	0.125	36%	0.36	C	S	.	.	H	α-helix	trans	-75.6	-25.1	-174	-60.8	121.3	0	0	0	113.2	K52 N54 H345 Q354	K52-W349 HydrophobicContact CD-CH2 3.69Å; K52-W349 HydrophobicContact CD-CZ2 3.85Å; N54-W349 WeakPolarHBondContact O-CH2 3.21Å; H345-W349 AromaticContact CD2-NE1 3.9Å; H345-W349 WeakPolarHBondContact O-CB 3.24Å; H345-W349 PolarHBondContact O-N 2.93Å; H345-W349 VanDerWaalsContact O-N 3.17Å; W349-Q354 HydrophobicContact CE3-CB 3.82Å; W349-Q354 HydrophobicContact CZ3-CB 4.32Å; W349-Q354 VanDerWaalsContact CZ3-OE1 3.25Å; W349-Q354 PolarHBondContact O-N 3.15Å; W349-Q354 VanDerWaalsContact O-N 3.12Å
350	T	84.5	Confident	81	Confident	63 Å²	63	74.8 Å²	74.8	39%	0.387	36%	0.362	S	S	.	.	H	α-helix	trans	-68.5	-44.7	169.8	51	0	0	0	0	111.8	R346 D347 Y348 E352 N353 W355	R346-T350 VanDerWaalsContact O-CB 3.29Å; R346-T350 WeakPolarHBondContact O-CB 3.13Å; R346-T350 WeakPolarHBondContact O-CG2 3.41Å; R346-T350 PolarHBondContact O-N 3.08Å; R346-T350 PolarHBondContact O-OG1 3.47Å; D347-T350 PolarHBondContact O-OG1 3.32Å; D347-T350 VanDerWaalsContact O-OG1 3.08Å; Y348-T350 PolarHBondContact O-N 2.94Å; T350-E352 VanDerWaalsContact C-N 3.33Å; T350-E352 PolarHBondContact O-N 3.22Å; T350-N353 PolarHBondContact O-N 2.99Å; T350-W355 HydrophobicContact CG2-CZ2 3.77Å
351	A	78.6	Confident	80	Confident	56 Å²	56	79.2 Å²	79.2	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-65.3	-34.4	179.2	0	0	0	0	0	113.3	D347 Y348 N353	D347-A351 WeakPolarHBondContact O-CB 3.2Å; D347-A351 PolarHBondContact O-N 3Å; Y348-A351 PolarHBondContact O-N 2.94Å; A351-N353 VanDerWaalsContact C-N 3.26Å; A351-N353 PolarHBondContact O-N 2.76Å
352	E	72	Confident	78.9	Confident	70 Å²	70	81.9 Å²	81.9	33%	0.327	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-0.7	-179.8	-68.2	-66.3	139.6	0	0	113.5	R171 Y348 T350 Q354	R171-E352 IonicContact NH2-OE1 3.72Å; Y348-E352 HydrophobicContact CD1-CG 4.32Å; Y348-E352 HydrophobicContact CE1-CG 4Å; Y348-E352 WeakPolarHBondContact O-CG 3.16Å; Y348-E352 PolarHBondContact O-N 2.79Å; Y348-E352 VanDerWaalsContact O-N 3.14Å; T350-E352 VanDerWaalsContact C-N 3.33Å; T350-E352 PolarHBondContact O-N 3.22Å; E352-Q354 HydrophobicContact CB-CB 4.12Å; E352-Q354 HydrophobicContact CB-CG 4.05Å; E352-Q354 WeakPolarHBondContact O-CG 3.22Å; E352-Q354 PolarHBondContact O-N 2.79Å; E352-Q354 VanDerWaalsContact O-N 3.16Å
353	N	62.9	Low	77.7	Confident	151 Å²	151	81.1 Å²	81.1	81%	0.807	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	29.2	-168.5	-66.1	-52.3	0	0	0	113	T350 A351	T350-N353 PolarHBondContact O-N 2.99Å; A351-N353 VanDerWaalsContact C-N 3.26Å; A351-N353 PolarHBondContact O-N 2.76Å
354	Q	56.6	Low	76.3	Confident	76 Å²	76	85.6 Å²	85.6	36%	0.355	42%	0.417	S	S	.	.			trans	-108	63.9	-176.6	-74.4	-175.5	21	0	0	109.8	N54 W349 E352	N54-Q354 PolarHBondContact ND2-NE2 3.22Å; W349-Q354 HydrophobicContact CE3-CB 3.82Å; W349-Q354 HydrophobicContact CZ3-CB 4.32Å; W349-Q354 VanDerWaalsContact CZ3-OE1 3.25Å; W349-Q354 PolarHBondContact O-N 3.15Å; W349-Q354 VanDerWaalsContact O-N 3.12Å; E352-Q354 HydrophobicContact CB-CB 4.12Å; E352-Q354 HydrophobicContact CB-CG 4.05Å; E352-Q354 WeakPolarHBondContact O-CG 3.22Å; E352-Q354 PolarHBondContact O-N 2.79Å; E352-Q354 VanDerWaalsContact O-N 3.16Å
355	W	47.4	Very low	74.7	Confident	183 Å²	183	92.8 Å²	92.8	69%	0.693	45%	0.452	S	S	*	.			trans	-90.6	97.8	152.4	-67.9	102.4	0	0	0	107	T350	T350-W355 HydrophobicContact CG2-CZ2 3.77Å
356	L	40.2	Very low	73	Confident	240 Å²	240	97.3 Å²	97.3	100%	1.257	48%	0.475	S	S	*	.			trans	-113.2	0	164.5	-81.5	173.1	0	0	0	108.6

Retrieved 356 of 356 residues in 159.9 ms (Link to these results)

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