A0AA82N859_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N859, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 278 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.9	Low	70.9	Confident	216 Å²	216	113.2 Å²	113.2	100%	1.064	60%	0.602	S	S	*	*				0	126.5	0	-76.4	172.5	-178.5	0	0	107.5	L217	M1-L217 HydrophobicContact CE-CD2 4.09Å
2	T	54.4	Low	71	Confident	146 Å²	146	112.6 Å²	112.6	90%	0.896	60%	0.598	S	S	*	*			trans	-86.8	111.2	165.3	42.4	0	0	0	0	106.9
3	I	72.8	Confident	71.1	Confident	102 Å²	102	112.1 Å²	112.1	52%	0.523	59%	0.59	S	S	.	*			trans	-64.6	141.7	167.7	55.4	-179.9	0	0	0	108.6	A8	I3-A8 HydrophobicContact CD1-CB 3.62Å; I3-A8 HydrophobicContact CG1-CB 4.21Å
4	S	78.5	Confident	71.4	Confident	59 Å²	59	110.6 Å²	110.6	41%	0.413	58%	0.578	S	S	.	*			trans	-62.9	149.9	168.6	178	0	0	0	0	109.2	E6 Q7 A8	S4-E6 PolarHBondContact O-N 3.44Å; S4-Q7 PolarHBondContact O-N 2.91Å; S4-Q7 VanDerWaalsContact O-N 3.08Å; S4-A8 PolarHBondContact O-N 2.77Å
5	L	77.6	Confident	71	Confident	141 Å²	141	111.7 Å²	111.7	74%	0.738	57%	0.572	S	S	*	*	H	α-helix	trans	-56.8	-35.3	175.7	-175.1	127.2	0	0	0	111.4	A8 L9	L5-A8 PolarHBondContact O-N 3.22Å; L5-L9 WeakPolarHBondContact O-CB 3.22Å; L5-L9 PolarHBondContact O-N 2.77Å
6	E	80.2	Confident	71	Confident	144 Å²	144	110.9 Å²	110.9	67%	0.673	57%	0.565	S	S	*	*	H	α-helix	trans	-64.8	-43.2	175.5	-63.8	-175.1	171.1	0	0	112.2	S4 A8 L9 I10	S4-E6 PolarHBondContact O-N 3.44Å; E6-A8 VanDerWaalsContact C-N 3.34Å; E6-A8 PolarHBondContact O-N 3.05Å; E6-L9 PolarHBondContact O-N 2.84Å; E6-I10 WeakPolarHBondContact O-CG1 3.48Å; E6-I10 PolarHBondContact O-N 2.97Å
7	Q	74.2	Confident	71.2	Confident	107 Å²	107	111.4 Å²	111.4	50%	0.5	57%	0.565	S	S	.	*	H	α-helix	trans	-64.9	-39.6	176.5	-70.2	179.8	-29.6	0	0	111.6	S4 L9 I10 I11	S4-Q7 PolarHBondContact O-N 2.91Å; S4-Q7 VanDerWaalsContact O-N 3.08Å; Q7-L9 VanDerWaalsContact C-N 3.31Å; Q7-L9 PolarHBondContact O-N 3.03Å; Q7-I10 PolarHBondContact O-N 3.31Å; Q7-I11 WeakPolarHBondContact O-CD1 3.17Å; Q7-I11 VanDerWaalsContact O-CG1 3.22Å; Q7-I11 WeakPolarHBondContact O-CG1 3.19Å; Q7-I11 PolarHBondContact O-N 3.34Å
8	A	70.5	Confident	71.1	Confident	36 Å²	36	108.3 Å²	108.3	30%	0.298	55%	0.547	S	S	.	.	H	α-helix	trans	-61.8	-40.5	175.9	0	0	0	0	0	111.8	I3 S4 L5 E6 I11 L12	I3-A8 HydrophobicContact CD1-CB 3.62Å; I3-A8 HydrophobicContact CG1-CB 4.21Å; S4-A8 PolarHBondContact O-N 2.77Å; L5-A8 PolarHBondContact O-N 3.22Å; E6-A8 VanDerWaalsContact C-N 3.34Å; E6-A8 PolarHBondContact O-N 3.05Å; A8-I11 PolarHBondContact O-N 3.44Å; A8-L12 WeakPolarHBondContact O-CB 3.11Å; A8-L12 PolarHBondContact O-N 2.83Å
9	L	73.7	Confident	70.9	Confident	99 Å²	99	105.2 Å²	105.2	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-44.8	178.9	-165.8	148.2	0	0	0	111.5	L5 E6 Q7 I11 L12 E13	L5-L9 WeakPolarHBondContact O-CB 3.22Å; L5-L9 PolarHBondContact O-N 2.77Å; E6-L9 PolarHBondContact O-N 2.84Å; Q7-L9 VanDerWaalsContact C-N 3.31Å; Q7-L9 PolarHBondContact O-N 3.03Å; L9-I11 PolarHBondContact O-N 3.41Å; L9-L12 PolarHBondContact O-N 3.47Å; L9-E13 WeakPolarHBondContact O-CB 3.49Å; L9-E13 PolarHBondContact O-N 3.46Å
10	I	76.5	Confident	70.8	Confident	110 Å²	110	105.1 Å²	105.1	56%	0.564	53%	0.532	S	S	*	.	H	α-helix	trans	-60	-45.1	175.5	-66.8	164.9	0	0	0	111	E6 Q7 L12 E13 H14	E6-I10 WeakPolarHBondContact O-CG1 3.48Å; E6-I10 PolarHBondContact O-N 2.97Å; Q7-I10 PolarHBondContact O-N 3.31Å; I10-L12 VanDerWaalsContact C-N 3.31Å; I10-L12 PolarHBondContact O-N 3.32Å; I10-E13 PolarHBondContact O-N 3.33Å; I10-H14 VanDerWaalsContact O-CB 3.29Å; I10-H14 WeakPolarHBondContact O-CB 3.46Å; I10-H14 PolarHBondContact O-N 3.49Å
11	I	71.2	Confident	70.9	Confident	85 Å²	85	102.7 Å²	102.7	44%	0.436	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-42	177.5	-69.3	164.8	0	0	0	110.7	Q7 A8 L9 R15	Q7-I11 WeakPolarHBondContact O-CD1 3.17Å; Q7-I11 VanDerWaalsContact O-CG1 3.22Å; Q7-I11 WeakPolarHBondContact O-CG1 3.19Å; Q7-I11 PolarHBondContact O-N 3.34Å; A8-I11 PolarHBondContact O-N 3.44Å; L9-I11 PolarHBondContact O-N 3.41Å; I11-R15 WeakPolarHBondContact O-CB 3.28Å; I11-R15 VanDerWaalsContact O-CG 3.31Å; I11-R15 WeakPolarHBondContact O-CG 3.36Å; I11-R15 PolarHBondContact O-N 3.38Å
12	L	71.2	Confident	71.9	Confident	106 Å²	106	93.9 Å²	93.9	56%	0.555	48%	0.484	S	S	*	.	H	α-helix	trans	-65.9	-46.5	179.1	-177.1	62.7	0	0	0	111.3	A8 L9 I10 R15 Q16	A8-L12 WeakPolarHBondContact O-CB 3.11Å; A8-L12 PolarHBondContact O-N 2.83Å; L9-L12 PolarHBondContact O-N 3.47Å; I10-L12 VanDerWaalsContact C-N 3.31Å; I10-L12 PolarHBondContact O-N 3.32Å; L12-R15 PolarHBondContact O-N 3.3Å; L12-Q16 WeakPolarHBondContact O-CG 3.22Å; L12-Q16 PolarHBondContact O-N 3.22Å
13	E	73.1	Confident	72.5	Confident	106 Å²	106	87.6 Å²	87.6	50%	0.495	45%	0.445	S	S	.	.	H	α-helix	trans	-62	-47.2	179	-173.7	176	-178.5	0	0	111.6	L9 I10 R15 Q16 Q17	L9-E13 WeakPolarHBondContact O-CB 3.49Å; L9-E13 PolarHBondContact O-N 3.46Å; I10-E13 PolarHBondContact O-N 3.33Å; E13-R15 VanDerWaalsContact C-N 3.3Å; E13-R15 PolarHBondContact O-N 3.1Å; E13-Q16 WeakPolarHBondContact O-CB 3.41Å; E13-Q16 PolarHBondContact O-N 3.42Å; E13-Q16 VanDerWaalsContact O-N 3.11Å; E13-Q17 PolarHBondContact O-N 3.38Å
14	H	74.4	Confident	72.6	Confident	92 Å²	92	87.8 Å²	87.8	43%	0.426	44%	0.443	S	S	.	.	H	α-helix	trans	-57.1	-43.9	174.8	-178.3	-90.3	0	0	0	111.5	I10 Q16 Q17 Q18	I10-H14 VanDerWaalsContact O-CB 3.29Å; I10-H14 WeakPolarHBondContact O-CB 3.46Å; I10-H14 PolarHBondContact O-N 3.49Å; H14-Q16 PolarHBondContact O-N 3.12Å; H14-Q17 PolarHBondContact O-N 2.82Å; H14-Q18 PolarHBondContact CE1-NE2 2.8Å; H14-Q18 PolarHBondContact ND1-OE1 2.89Å; H14-Q18 WeakPolarHBondContact O-CG 3.27Å; H14-Q18 PolarHBondContact O-N 3.42Å
15	R	66.3	Low	72.3	Confident	127 Å²	127	89.1 Å²	89.1	48%	0.479	44%	0.443	S	S	.	.	H	α-helix	trans	-65.2	-36.5	176.5	-77.5	-171	-172.4	-92.9	3.1	112.9	I11 L12 E13 M19	I11-R15 WeakPolarHBondContact O-CB 3.28Å; I11-R15 VanDerWaalsContact O-CG 3.31Å; I11-R15 WeakPolarHBondContact O-CG 3.36Å; I11-R15 PolarHBondContact O-N 3.38Å; L12-R15 PolarHBondContact O-N 3.3Å; E13-R15 VanDerWaalsContact C-N 3.3Å; E13-R15 PolarHBondContact O-N 3.1Å; R15-M19 WeakPolarHBondContact O-CB 3.28Å; R15-M19 PolarHBondContact O-N 2.68Å
16	Q	69.9	Low	72.2	Confident	98 Å²	98	82.6 Å²	82.6	46%	0.458	41%	0.409	S	S	.	.	H	α-helix	trans	-66.1	-41.5	175.2	-70.5	-65.1	-42.2	0	0	111.3	L12 E13 H14 M19 L20	L12-Q16 WeakPolarHBondContact O-CG 3.22Å; L12-Q16 PolarHBondContact O-N 3.22Å; E13-Q16 WeakPolarHBondContact O-CB 3.41Å; E13-Q16 PolarHBondContact O-N 3.42Å; E13-Q16 VanDerWaalsContact O-N 3.11Å; H14-Q16 PolarHBondContact O-N 3.12Å; Q16-M19 WeakPolarHBondContact O-CB 3.48Å; Q16-M19 PolarHBondContact O-N 3.38Å; Q16-L20 WeakPolarHBondContact O-CB 3.33Å; Q16-L20 PolarHBondContact O-N 2.99Å
17	Q	75.6	Confident	71.9	Confident	120 Å²	120	78 Å²	78	56%	0.561	39%	0.388	S	S	*	.	H	α-helix	trans	-63.6	-45.7	175.4	-73.5	-177.9	-4	0	0	112	E13 H14 M19 L20 A21	E13-Q17 PolarHBondContact O-N 3.38Å; H14-Q17 PolarHBondContact O-N 2.82Å; Q17-M19 VanDerWaalsContact C-N 3.29Å; Q17-M19 PolarHBondContact O-N 3.09Å; Q17-L20 PolarHBondContact O-N 3.38Å; Q17-A21 WeakPolarHBondContact O-CB 3.25Å; Q17-A21 PolarHBondContact O-N 3.41Å
18	Q	68.2	Low	71.9	Confident	55 Å²	55	79.2 Å²	79.2	26%	0.257	39%	0.394	S	S	.	.	H	α-helix	trans	-59.2	-42.2	174.5	-74	-175.4	-48.8	0	0	111.8	H14 A21 F22 E160	H14-Q18 PolarHBondContact CE1-NE2 2.8Å; H14-Q18 PolarHBondContact ND1-OE1 2.89Å; H14-Q18 WeakPolarHBondContact O-CG 3.27Å; H14-Q18 PolarHBondContact O-N 3.42Å; Q18-A21 PolarHBondContact O-N 2.81Å; Q18-F22 WeakPolarHBondContact O-CB 3.32Å; Q18-F22 PolarHBondContact O-N 3.11Å; Q18-E160 PolarHBondContact NE2-OE1 3.32Å
19	M	67.5	Low	72.1	Confident	49 Å²	49	79.2 Å²	79.2	24%	0.241	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-46.3	176.1	-171.6	-169.6	-48.8	0	0	111.1	R15 Q16 Q17 F22 Q23 W250	R15-M19 WeakPolarHBondContact O-CB 3.28Å; R15-M19 PolarHBondContact O-N 2.68Å; Q16-M19 WeakPolarHBondContact O-CB 3.48Å; Q16-M19 PolarHBondContact O-N 3.38Å; Q17-M19 VanDerWaalsContact C-N 3.29Å; Q17-M19 PolarHBondContact O-N 3.09Å; M19-F22 PolarHBondContact O-N 3.32Å; M19-Q23 WeakPolarHBondContact O-CG 3.34Å; M19-Q23 PolarHBondContact O-N 3.19Å; M19-W250 HydrophobicContact SD-CZ3 4.34Å
20	L	70.4	Confident	71.9	Confident	104 Å²	104	75.4 Å²	75.4	55%	0.545	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-44.7	179.2	-175.2	67.3	0	0	0	111.9	Q16 Q17 Q23 Q24	Q16-L20 WeakPolarHBondContact O-CB 3.33Å; Q16-L20 PolarHBondContact O-N 2.99Å; Q17-L20 PolarHBondContact O-N 3.38Å; L20-Q23 PolarHBondContact O-N 3Å; L20-Q24 WeakPolarHBondContact O-CG 3.28Å; L20-Q24 PolarHBondContact O-N 3.39Å
21	A	72.8	Confident	71.8	Confident	55 Å²	55	73.4 Å²	73.4	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-44.4	176.8	0	0	0	0	0	111.5	Q17 Q18 Q23 Q24 Q25	Q17-A21 WeakPolarHBondContact O-CB 3.25Å; Q17-A21 PolarHBondContact O-N 3.41Å; Q18-A21 PolarHBondContact O-N 2.81Å; A21-Q23 PolarHBondContact O-N 3.29Å; A21-Q24 PolarHBondContact O-N 2.99Å; A21-Q25 WeakPolarHBondContact O-CB 3.42Å; A21-Q25 PolarHBondContact O-N 3.25Å
22	F	70.5	Confident	71.9	Confident	31 Å²	31	73.7 Å²	73.7	14%	0.136	36%	0.364	C	S	.	.	H	α-helix	trans	-61.8	-41.9	175.8	179.4	-95.7	0	0	0	112.1	Q18 M19 Q25 L26 I153 H156 I228	Q18-F22 WeakPolarHBondContact O-CB 3.32Å; Q18-F22 PolarHBondContact O-N 3.11Å; M19-F22 PolarHBondContact O-N 3.32Å; F22-Q25 PolarHBondContact O-N 3.1Å; F22-L26 HydrophobicContact CE1-CD2 4.36Å; F22-L26 VanDerWaalsContact O-CB 3.28Å; F22-L26 WeakPolarHBondContact O-CB 3.45Å; F22-L26 PolarHBondContact O-N 2.72Å; F22-I153 HydrophobicContact CZ-CG1 4.18Å; F22-H156 HydrophobicContact CD2-CB 4.37Å; F22-H156 HydrophobicContact CE2-CB 3.85Å; F22-H156 AromaticContact CE2-CD2 3.81Å; F22-H156 AromaticContact CE2-CG 3.96Å; F22-I228 HydrophobicContact CD1-CD1 4.38Å; F22-I228 HydrophobicContact CE1-CD1 3.71Å; F22-I228 HydrophobicContact CE1-CG2 4.16Å; F22-I228 HydrophobicContact CE2-CD1 4.21Å; F22-I228 HydrophobicContact CZ-CD1 3.6Å; F22-I228 HydrophobicContact CZ-CG2 4.48Å
23	Q	67.9	Low	71.9	Confident	14 Å²	14	72.1 Å²	72.1	7%	0.065	35%	0.352	C	S	.	.	H	α-helix	trans	-61.9	-46.6	176.4	-69.7	-73	-30	0	0	111.4	M19 L20 A21 L26 I27	M19-Q23 WeakPolarHBondContact O-CG 3.34Å; M19-Q23 PolarHBondContact O-N 3.19Å; L20-Q23 PolarHBondContact O-N 3Å; A21-Q23 PolarHBondContact O-N 3.29Å; Q23-L26 PolarHBondContact O-N 2.73Å; Q23-I27 VanDerWaalsContact O-CG1 3.27Å; Q23-I27 WeakPolarHBondContact O-CG1 3.27Å; Q23-I27 PolarHBondContact O-N 2.97Å
24	Q	73.6	Confident	71.4	Confident	106 Å²	106	69.5 Å²	69.5	50%	0.495	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-48.1	177.1	-72.6	176.9	22.3	0	0	111.2	L20 A21 L26 I27 E28	L20-Q24 WeakPolarHBondContact O-CG 3.28Å; L20-Q24 PolarHBondContact O-N 3.39Å; A21-Q24 PolarHBondContact O-N 2.99Å; Q24-L26 VanDerWaalsContact C-N 3.31Å; Q24-L26 PolarHBondContact O-N 3.47Å; Q24-I27 PolarHBondContact O-N 3.08Å; Q24-E28 WeakPolarHBondContact O-CG 3.42Å; Q24-E28 PolarHBondContact O-N 2.97Å
25	Q	73.1	Confident	71.2	Confident	87 Å²	87	71 Å²	71	41%	0.407	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-37.5	179	-170	175.8	14.7	0	0	112.4	A21 F22 T29 H156	A21-Q25 WeakPolarHBondContact O-CB 3.42Å; A21-Q25 PolarHBondContact O-N 3.25Å; F22-Q25 PolarHBondContact O-N 3.1Å; Q25-T29 VanDerWaalsContact O-CB 3.25Å; Q25-T29 WeakPolarHBondContact O-CB 3.02Å; Q25-T29 PolarHBondContact O-N 3.24Å; Q25-T29 PolarHBondContact O-OG1 2.74Å; Q25-H156 PolarHBondContact NE2-CE1 2.96Å; Q25-H156 PolarHBondContact OE1-CE1 3.32Å
26	L	74.7	Confident	71.1	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-44.7	175.3	-174.5	68.3	0	0	0	110.8	F22 Q23 Q24 T29 V30 V152 L246 V248	F22-L26 HydrophobicContact CE1-CD2 4.36Å; F22-L26 VanDerWaalsContact O-CB 3.28Å; F22-L26 WeakPolarHBondContact O-CB 3.45Å; F22-L26 PolarHBondContact O-N 2.72Å; Q23-L26 PolarHBondContact O-N 2.73Å; Q24-L26 VanDerWaalsContact C-N 3.31Å; Q24-L26 PolarHBondContact O-N 3.47Å; L26-T29 PolarHBondContact O-N 2.96Å; L26-V30 WeakPolarHBondContact O-CB 3.5Å; L26-V30 WeakPolarHBondContact O-CG2 3.2Å; L26-V30 PolarHBondContact O-N 2.78Å; L26-V152 HydrophobicContact CD1-CG1 4.03Å; L26-L246 HydrophobicContact CD2-CD2 3.91Å; L26-L246 HydrophobicContact CG-CD2 4.29Å; L26-V248 HydrophobicContact CD2-CG2 3.93Å
27	I	74.6	Confident	70.5	Confident	47 Å²	47	69.2 Å²	69.2	24%	0.241	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-51.4	176	-68.5	163.7	0	0	0	109.9	Q23 Q24 T29 V30 L31 L246 I276	Q23-I27 VanDerWaalsContact O-CG1 3.27Å; Q23-I27 WeakPolarHBondContact O-CG1 3.27Å; Q23-I27 PolarHBondContact O-N 2.97Å; Q24-I27 PolarHBondContact O-N 3.08Å; I27-T29 VanDerWaalsContact C-N 3.33Å; I27-T29 PolarHBondContact O-N 3.34Å; I27-V30 PolarHBondContact O-N 3.46Å; I27-L31 HydrophobicContact CG2-CD1 3.74Å; I27-L31 HydrophobicContact CG2-CG 4.07Å; I27-L31 WeakPolarHBondContact O-CB 3.4Å; I27-L31 VanDerWaalsContact O-CG 3.27Å; I27-L31 WeakPolarHBondContact O-CG 3.1Å; I27-L31 PolarHBondContact O-N 3.35Å; I27-L246 HydrophobicContact CG1-CD2 4.15Å; I27-I276 HydrophobicContact CD1-CD1 3.95Å; I27-I276 HydrophobicContact CG1-CD1 4.03Å; I27-I276 HydrophobicContact CG2-CD1 4.27Å
28	E	73.9	Confident	69.1	Low	133 Å²	133	65.7 Å²	65.7	62%	0.621	34%	0.344	S	S	*	.	H	α-helix	trans	-57.1	-46	178.1	-74.2	-175.7	169.8	0	0	111.8	Q24 V30 L31 D32	Q24-E28 WeakPolarHBondContact O-CG 3.42Å; Q24-E28 PolarHBondContact O-N 2.97Å; E28-V30 VanDerWaalsContact C-N 3.33Å; E28-V30 PolarHBondContact O-N 2.79Å; E28-L31 PolarHBondContact O-N 2.91Å; E28-D32 WeakPolarHBondContact O-CB 3.43Å; E28-D32 PolarHBondContact O-N 3.18Å
29	T	74	Confident	67.9	Low	35 Å²	35	67.6 Å²	67.6	22%	0.215	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-39.8	179	-60.1	0	0	0	0	111.9	Q25 L26 I27 K33 V152	Q25-T29 VanDerWaalsContact O-CB 3.25Å; Q25-T29 WeakPolarHBondContact O-CB 3.02Å; Q25-T29 PolarHBondContact O-N 3.24Å; Q25-T29 PolarHBondContact O-OG1 2.74Å; L26-T29 PolarHBondContact O-N 2.96Å; I27-T29 VanDerWaalsContact C-N 3.33Å; I27-T29 PolarHBondContact O-N 3.34Å; T29-K33 HydrophobicContact CG2-CD 4.25Å; T29-K33 WeakPolarHBondContact O-CB 3.38Å; T29-K33 VanDerWaalsContact O-CG 3.28Å; T29-K33 WeakPolarHBondContact O-CG 3.47Å; T29-K33 PolarHBondContact O-N 3.23Å; T29-K33 VanDerWaalsContact O-N 3.1Å; T29-V152 HydrophobicContact CG2-CG2 4.11Å
30	V	70.1	Confident	66.7	Low	20 Å²	20	74.1 Å²	74.1	12%	0.121	40%	0.396	C	S	.	.	H	α-helix	trans	-67.2	-50.6	176.5	169.7	0	0	0	0	109.4	L26 I27 E28 D32 K33 F34	L26-V30 WeakPolarHBondContact O-CB 3.5Å; L26-V30 WeakPolarHBondContact O-CG2 3.2Å; L26-V30 PolarHBondContact O-N 2.78Å; I27-V30 PolarHBondContact O-N 3.46Å; E28-V30 VanDerWaalsContact C-N 3.33Å; E28-V30 PolarHBondContact O-N 2.79Å; V30-D32 PolarHBondContact O-N 3.42Å; V30-K33 CarbonylContact O-C 3.58Å; V30-K33 PolarHBondContact O-N 3.08Å; V30-F34 HydrophobicContact CG1-CD2 3.53Å; V30-F34 HydrophobicContact CG1-CE2 3.65Å; V30-F34 WeakPolarHBondContact O-CB 3.48Å; V30-F34 VanDerWaalsContact O-CD2 3.28Å; V30-F34 WeakPolarHBondContact O-CD2 3.41Å; V30-F34 PolarHBondContact O-N 2.98Å
31	L	75	Confident	65.3	Low	67 Å²	67	75.6 Å²	75.6	35%	0.351	40%	0.402	S	S	.	.	H	α-helix	trans	-60.5	-45	179.2	-67	-178.4	0	0	0	111.9	I27 E28 K33 F34 F35	I27-L31 HydrophobicContact CG2-CD1 3.74Å; I27-L31 HydrophobicContact CG2-CG 4.07Å; I27-L31 WeakPolarHBondContact O-CB 3.4Å; I27-L31 VanDerWaalsContact O-CG 3.27Å; I27-L31 WeakPolarHBondContact O-CG 3.1Å; I27-L31 PolarHBondContact O-N 3.35Å; E28-L31 PolarHBondContact O-N 2.91Å; L31-K33 VanDerWaalsContact C-N 3.33Å; L31-K33 PolarHBondContact O-N 3.23Å; L31-F34 PolarHBondContact O-N 2.94Å; L31-F34 VanDerWaalsContact O-N 3.11Å; L31-F35 HydrophobicContact CB-CD2 4.18Å; L31-F35 HydrophobicContact CB-CE2 4.33Å; L31-F35 HydrophobicContact CD2-CE2 3.93Å; L31-F35 WeakPolarHBondContact O-CB 3.08Å; L31-F35 VanDerWaalsContact O-CD2 3.22Å; L31-F35 WeakPolarHBondContact O-CD2 2.9Å; L31-F35 PolarHBondContact O-N 3.32Å
32	D	73.7	Confident	63.4	Low	92 Å²	92	77.2 Å²	77.2	49%	0.492	42%	0.415	S	S	.	.	H	α-helix	trans	-56.3	-48.6	175.6	-172.8	87.1	0	0	0	110.5	E28 V30 F34 N36	E28-D32 WeakPolarHBondContact O-CB 3.43Å; E28-D32 PolarHBondContact O-N 3.18Å; V30-D32 PolarHBondContact O-N 3.42Å; D32-F34 VanDerWaalsContact C-N 3.34Å; D32-F34 PolarHBondContact O-N 3.45Å; D32-N36 WeakPolarHBondContact O-CA 3.47Å; D32-N36 WeakPolarHBondContact O-CB 3.4Å; D32-N36 PolarHBondContact O-N 3.37Å; D32-N36 PolarHBondContact O-ND2 2.89Å; D32-N36 PolarHBondContact OD1-ND2 2.79Å; D32-N36 PolarHBondContact OD2-ND2 3.2Å; D32-N36 VanDerWaalsContact OD2-ND2 3.12Å
33	K	70.3	Confident	61.6	Low	72 Å²	72	81.7 Å²	81.7	31%	0.313	45%	0.445	S	S	.	.	H	α-helix	trans	-68.1	-30.9	176.8	-73	178	-178.3	178.7	0	113.2	T29 V30 L31 N37 I148	T29-K33 HydrophobicContact CG2-CD 4.25Å; T29-K33 WeakPolarHBondContact O-CB 3.38Å; T29-K33 VanDerWaalsContact O-CG 3.28Å; T29-K33 WeakPolarHBondContact O-CG 3.47Å; T29-K33 PolarHBondContact O-N 3.23Å; T29-K33 VanDerWaalsContact O-N 3.1Å; V30-K33 CarbonylContact O-C 3.58Å; V30-K33 PolarHBondContact O-N 3.08Å; L31-K33 VanDerWaalsContact C-N 3.33Å; L31-K33 PolarHBondContact O-N 3.23Å; K33-N37 WeakPolarHBondContact O-CB 3.2Å; K33-N37 VanDerWaalsContact O-CG 3.3Å; K33-N37 PolarHBondContact O-N 3.15Å; K33-N37 PolarHBondContact O-ND2 3.17Å; K33-I148 HydrophobicContact CD-CD1 4.09Å; K33-I148 HydrophobicContact CD-CG1 4.47Å; K33-I148 HydrophobicContact CD-CG2 3.81Å; K33-I148 VanDerWaalsContact NZ-CG2 3.32Å
34	F	63.8	Low	60.2	Low	51 Å²	51	86.7 Å²	86.7	22%	0.224	48%	0.479	C	S	.	.	H	α-helix	trans	-72.1	-49.4	176.8	-99	-91.4	0	0	0	111.3	V30 L31 D32 V145 F232 V234	V30-F34 HydrophobicContact CG1-CD2 3.53Å; V30-F34 HydrophobicContact CG1-CE2 3.65Å; V30-F34 WeakPolarHBondContact O-CB 3.48Å; V30-F34 VanDerWaalsContact O-CD2 3.28Å; V30-F34 WeakPolarHBondContact O-CD2 3.41Å; V30-F34 PolarHBondContact O-N 2.98Å; L31-F34 PolarHBondContact O-N 2.94Å; L31-F34 VanDerWaalsContact O-N 3.11Å; D32-F34 VanDerWaalsContact C-N 3.34Å; D32-F34 PolarHBondContact O-N 3.45Å; F34-V145 HydrophobicContact CE2-CG2 4.35Å; F34-F232 HydrophobicContact CZ-CD2 4.41Å; F34-F232 HydrophobicContact CZ-CE2 4.39Å; F34-V234 HydrophobicContact CE1-CG2 4.18Å; F34-V234 HydrophobicContact CZ-CG2 3.98Å
35	F	68.5	Low	58.2	Low	125 Å²	125	87.8 Å²	87.8	55%	0.548	48%	0.484	S	S	.	.	H	α-helix	trans	-80.6	-39.7	-175.3	-70.5	-66.2	0	0	0	112.7	L31 G38	L31-F35 HydrophobicContact CB-CD2 4.18Å; L31-F35 HydrophobicContact CB-CE2 4.33Å; L31-F35 HydrophobicContact CD2-CE2 3.93Å; L31-F35 WeakPolarHBondContact O-CB 3.08Å; L31-F35 VanDerWaalsContact O-CD2 3.22Å; L31-F35 WeakPolarHBondContact O-CD2 2.9Å; L31-F35 PolarHBondContact O-N 3.32Å; F35-G38 PolarHBondContact O-N 2.87Å
36	N	64.4	Low	56.1	Low	91 Å²	91	93.1 Å²	93.1	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-78.6	-28.7	-177.3	-63.6	-28.6	0	0	0	113.3	D32 G38 A39	D32-N36 WeakPolarHBondContact O-CA 3.47Å; D32-N36 WeakPolarHBondContact O-CB 3.4Å; D32-N36 PolarHBondContact O-N 3.37Å; D32-N36 PolarHBondContact O-ND2 2.89Å; D32-N36 PolarHBondContact OD1-ND2 2.79Å; D32-N36 PolarHBondContact OD2-ND2 3.2Å; D32-N36 VanDerWaalsContact OD2-ND2 3.12Å; N36-G38 VanDerWaalsContact C-N 3.27Å; N36-G38 PolarHBondContact O-N 3.19Å; N36-A39 PolarHBondContact O-N 3.23Å
37	N	58.3	Low	54	Low	95 Å²	95	101.3 Å²	101.3	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-75.7	-17.8	172.4	-68.2	-40.9	0	0	0	112.6	K33 A39 K40	K33-N37 WeakPolarHBondContact O-CB 3.2Å; K33-N37 VanDerWaalsContact O-CG 3.3Å; K33-N37 PolarHBondContact O-N 3.15Å; K33-N37 PolarHBondContact O-ND2 3.17Å; N37-A39 VanDerWaalsContact C-N 3.27Å; N37-A39 PolarHBondContact O-N 3.25Å; N37-K40 PolarHBondContact O-N 2.64Å
38	G	45.2	Very low	51.7	Low	47 Å²	47	108.6 Å²	108.6	49%	0.485	57%	0.572	S	S	.	*	H	α-helix	trans	-62.6	-32.7	170.4	0	0	0	0	0	112.9	F35 N36 K40	F35-G38 PolarHBondContact O-N 2.87Å; N36-G38 VanDerWaalsContact C-N 3.27Å; N36-G38 PolarHBondContact O-N 3.19Å; G38-K40 VanDerWaalsContact C-N 3.26Å; G38-K40 PolarHBondContact O-N 2.99Å
39	A	42.8	Very low	49.7	Very low	94 Å²	94	107.4 Å²	107.4	78%	0.777	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-10	179.5	0	0	0	0	0	114.3	N36 N37	N36-A39 PolarHBondContact O-N 3.23Å; N37-A39 VanDerWaalsContact C-N 3.27Å; N37-A39 PolarHBondContact O-N 3.25Å
40	K	44.1	Very low	47.5	Very low	186 Å²	186	115.2 Å²	115.2	81%	0.809	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-1.5	178.1	-96.8	-178.9	179.7	175.5	0	114.7	N37 G38 A42	N37-K40 PolarHBondContact O-N 2.64Å; G38-K40 VanDerWaalsContact C-N 3.26Å; G38-K40 PolarHBondContact O-N 2.99Å; K40-A42 VanDerWaalsContact C-N 3.34Å; K40-A42 PolarHBondContact O-N 3.3Å
41	M	39.5	Very low	45.3	Very low	135 Å²	135	117.8 Å²	117.8	67%	0.665	64%	0.638	S	S	*	*	S	Bend	trans	-76.8	93.1	169.8	-72.7	-141.2	-131.1	0	0	109.3	V43 W141	M41-V43 PolarHBondContact O-N 3.31Å; M41-W141 HydrophobicContact CE-CZ2 4.29Å
42	A	33.4	Very low	43.1	Very low	89 Å²	89	119.2 Å²	119.2	74%	0.736	65%	0.654	S	S	*	*			trans	-42	129	167.9	0	0	0	0	0	110.4	K40	K40-A42 VanDerWaalsContact C-N 3.34Å; K40-A42 PolarHBondContact O-N 3.3Å
43	V	32.3	Very low	40.8	Very low	125 Å²	125	122.7 Å²	122.7	76%	0.758	67%	0.671	S	S	*	*			trans	-31.4	119.9	165.4	178.2	0	0	0	0	109.4	M41 E45	M41-V43 PolarHBondContact O-N 3.31Å; V43-E45 VanDerWaalsContact C-N 3.28Å; V43-E45 PolarHBondContact O-N 3.06Å
44	P	39.9	Very low	38.9	Very low	120 Å²	120	124.3 Å²	124.3	78%	0.779	69%	0.689	S	S	*	*			trans	-66.5	99.7	167.1	26.6	-29	0	0	0	106.3	Q46	P44-Q46 PolarHBondContact O-N 2.81Å
45	E	31.6	Very low	37.2	Very low	129 Å²	129	132 Å²	132	60%	0.603	72%	0.722	S	S	*	*			trans	-53.7	112.3	171.9	-158.9	-174.6	-164	0	0	106.8	V43 R47	V43-E45 VanDerWaalsContact C-N 3.28Å; V43-E45 PolarHBondContact O-N 3.06Å; E45-R47 HydrophobicContact CB-CG 4.42Å; E45-R47 HydrophobicContact CG-CG 4.02Å; E45-R47 PolarHBondContact O-N 3.29Å; E45-R47 IonicContact OE1-CZ 3.39Å; E45-R47 IonicContact OE1-NE 3.22Å; E45-R47 PolarHBondContact OE1-NE 3.09Å; E45-R47 IonicContact OE1-NH2 2.77Å; E45-R47 PolarHBondContact OE1-NH2 2.95Å; E45-R47 IonicContact OE2-CZ 3.63Å; E45-R47 IonicContact OE2-NE 2.91Å; E45-R47 PolarHBondContact OE2-NE 3.34Å; E45-R47 IonicContact OE2-NH2 3.44Å; E45-R47 PolarHBondContact OE2-NH2 3.43Å
46	Q	27.3	Very low	35	Very low	198 Å²	198	133.2 Å²	133.2	93%	0.925	73%	0.733	S	S	*	*			trans	-64.9	84.2	171	-87.5	-176.6	-1.7	0	0	108.2	P44	P44-Q46 PolarHBondContact O-N 2.81Å
47	R	32.4	Very low	33.4	Very low	177 Å²	177	134.6 Å²	134.6	67%	0.668	75%	0.75	S	S	*	*			trans	-96.6	106.3	164.1	-63.6	-125.7	-171.8	-158.4	-5.3	107.2	E45 V49	E45-R47 HydrophobicContact CB-CG 4.42Å; E45-R47 HydrophobicContact CG-CG 4.02Å; E45-R47 PolarHBondContact O-N 3.29Å; E45-R47 IonicContact OE1-CZ 3.39Å; E45-R47 IonicContact OE1-NE 3.22Å; E45-R47 PolarHBondContact OE1-NE 3.09Å; E45-R47 IonicContact OE1-NH2 2.77Å; E45-R47 PolarHBondContact OE1-NH2 2.95Å; E45-R47 IonicContact OE2-CZ 3.63Å; E45-R47 IonicContact OE2-NE 2.91Å; E45-R47 PolarHBondContact OE2-NE 3.34Å; E45-R47 IonicContact OE2-NH2 3.44Å; E45-R47 PolarHBondContact OE2-NH2 3.43Å; R47-V49 PolarHBondContact O-N 2.94Å
48	Q	25.8	Very low	31.9	Very low	199 Å²	199	136.9 Å²	136.9	93%	0.93	76%	0.762	S	S	*	*			trans	-57.4	109.3	162	-73.5	-174.9	-49.3	0	0	107.6
49	V	31.1	Very low	31.2	Very low	109 Å²	109	137.8 Å²	137.8	66%	0.661	77%	0.771	S	S	*	*			trans	-125.6	103.1	165.5	176.6	0	0	0	0	107.3	R47	R47-V49 PolarHBondContact O-N 2.94Å
50	E	28.4	Very low	30.4	Very low	199 Å²	199	142.2 Å²	142.2	93%	0.93	77%	0.773	S	S	*	*	S	Bend	trans	-52.7	126.7	165.6	-163.4	126.5	-163.5	0	0	109.7
51	G	24.7	Very low	29.7	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	78%	0.776	S	S	*	*			trans	99.2	65.7	173.9	0	0	0	0	0	114.8
52	S	28	Very low	29.4	Very low	97 Å²	97	142 Å²	142	68%	0.678	78%	0.783	S	S	*	*			trans	-116.2	120.7	159.6	-69.8	0	0	0	0	109.3	P54	S52-P54 VanDerWaalsContact O-CD 3.22Å; S52-P54 WeakPolarHBondContact O-CD 3.35Å
53	I	25.3	Very low	29.1	Very low	165 Å²	165	145.5 Å²	145.5	85%	0.846	79%	0.788	S	S	*	*			trans	-77	112.5	161.1	-61.5	168.7	0	0	0	106
54	P	30.2	Very low	29.1	Very low	107 Å²	107	145.3 Å²	145.3	70%	0.695	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-94.2	132.1	173.1	2	20.6	0	0	0	109.5	S52	S52-P54 VanDerWaalsContact O-CD 3.22Å; S52-P54 WeakPolarHBondContact O-CD 3.35Å
55	F	27.4	Very low	28.5	Very low	212 Å²	212	148.8 Å²	148.8	93%	0.93	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-50.4	134.3	178.5	-75	-100	0	0	0	113.2
56	I	23.7	Very low	28.4	Very low	150 Å²	150	150.7 Å²	150.7	77%	0.769	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.5	119.3	173.6	-56.2	168.9	0	0	0	108.1	D58	I56-D58 HydrophobicContact CG2-CB 3.91Å
57	S	31.1	Very low	28.5	Very low	121 Å²	121	146.3 Å²	146.3	85%	0.846	80%	0.8	S	S	*	*			trans	-102.3	92.2	158	162.7	0	0	0	0	107.7
58	D	26.3	Very low	28.3	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	81%	0.807	S	S	*	*			trans	-88.6	107.1	175.8	-131.7	-16.9	0	0	0	108.7	I56	I56-D58 HydrophobicContact CG2-CB 3.91Å
59	G	30.7	Very low	28.6	Very low	66 Å²	66	137.5 Å²	137.5	68%	0.68	80%	0.801	S	S	*	*			trans	-154.5	64.4	-176.3	0	0	0	0	0	111.5	C61	G59-C61 PolarHBondContact O-N 2.92Å; G59-C61 VanDerWaalsContact O-N 3.15Å
60	K	26.4	Very low	28.7	Very low	187 Å²	187	140.6 Å²	140.6	81%	0.813	81%	0.808	S	S	*	*			trans	-45.2	110.4	174.8	-86.2	165.4	168.9	157.4	0	112.9
61	C	29.2	Very low	28.9	Very low	129 Å²	129	137.8 Å²	137.8	87%	0.872	80%	0.795	S	S	*	*			trans	-115.7	121.5	152.5	-100.7	0	0	0	0	109.7	G59	G59-C61 PolarHBondContact O-N 2.92Å; G59-C61 VanDerWaalsContact O-N 3.15Å
62	K	31.4	Very low	29.5	Very low	187 Å²	187	142 Å²	142	81%	0.813	80%	0.8	S	S	*	*			trans	-78.3	124.8	-171	-61.8	173.7	-179.1	178.1	0	109.5	V64	K62-V64 PolarHBondContact O-N 3.33Å; K62-V64 VanDerWaalsContact O-N 3.1Å
63	I	29	Very low	29.8	Very low	162 Å²	162	143.2 Å²	143.2	83%	0.831	80%	0.799	S	S	*	*			trans	-63.2	107.8	168.5	-66.6	165.8	0	0	0	108	K65	I63-K65 PolarHBondContact O-N 2.89Å
64	V	30.8	Very low	30.4	Very low	121 Å²	121	143.2 Å²	143.2	73%	0.733	80%	0.799	S	S	*	*			trans	-80.3	113.8	166.7	170.6	0	0	0	0	107.5	K62 L66	K62-V64 PolarHBondContact O-N 3.33Å; K62-V64 VanDerWaalsContact O-N 3.1Å; V64-L66 PolarHBondContact O-N 3Å
65	K	27	Very low	30.5	Very low	193 Å²	193	145 Å²	145	84%	0.839	80%	0.802	S	S	*	*			trans	-63.5	123	167.9	-70.8	173.1	172.8	178.2	0	109.2	I63	I63-K65 PolarHBondContact O-N 2.89Å
66	L	31.3	Very low	30.8	Very low	170 Å²	170	140.9 Å²	140.9	89%	0.89	80%	0.796	S	S	*	*			trans	-121.5	126	154.1	-78.2	174.4	0	0	0	108.2	V64	V64-L66 PolarHBondContact O-N 3Å
67	A	28.3	Very low	31.3	Very low	105 Å²	105	140.6 Å²	140.6	87%	0.868	80%	0.796	S	S	*	*			trans	-97.2	151.7	-166.8	0	0	0	0	0	111.7
68	G	27.6	Very low	31.3	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	79%	0.787	S	S	*	*			trans	111.4	98.4	137.3	0	0	0	0	0	117.6
69	S	33.9	Very low	31.8	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	79%	0.79	S	S	*	*				177.4	90.6	124.1	60.2	0	0	0	0	107.6
70	E	33	Very low	32.2	Very low	173 Å²	173	145.3 Å²	145.3	81%	0.808	80%	0.796	S	S	*	*				76.8	93.2	99.5	-159.9	164.1	154.5	0	0	112.1
71	Q	31.3	Very low	32.6	Very low	140 Å²	140	142.3 Å²	142.3	65%	0.654	79%	0.793	S	S	*	*				66.7	115.8	116.9	-71.7	-177.5	-6.9	0	0	112.6
72	D	37.2	Very low	33.1	Very low	161 Å²	161	141.7 Å²	141.7	86%	0.861	79%	0.785	S	S	*	*				-140.5	136.7	74.6	-79.2	-41.9	0	0	0	115.4
73	N	33.8	Very low	33.5	Very low	123 Å²	123	138.5 Å²	138.5	66%	0.658	78%	0.782	S	S	*	*			trans	-76	149.1	176.1	-47.6	-66.5	0	0	0	110.1
74	I	37.9	Very low	34	Very low	165 Å²	165	136.6 Å²	136.6	85%	0.846	78%	0.777	S	S	*	*				-176.6	108.8	124.2	-83.2	145.1	0	0	0	107
75	L	33.1	Very low	34.6	Very low	146 Å²	146	135.3 Å²	135.3	76%	0.764	77%	0.774	S	S	*	*			trans	-75.6	157.4	169.8	-164.7	76.7	0	0	0	109.1	N77	L75-N77 HydrophobicContact CD2-CB 4.17Å
76	P	32.9	Very low	35.4	Very low	124 Å²	124	132.4 Å²	132.4	81%	0.805	77%	0.767	S	S	*	*				-136.1	132.2	121.3	28.7	-12.6	0	0	0	113.3
77	N	34.8	Very low	35.9	Very low	145 Å²	145	132.4 Å²	132.4	78%	0.775	76%	0.762	S	S	*	*			trans	-71.3	138.7	171.2	-164.5	22.3	0	0	0	109.6	L75	L75-N77 HydrophobicContact CD2-CB 4.17Å
78	A	32	Very low	36.8	Very low	78 Å²	78	135.8 Å²	135.8	65%	0.645	76%	0.76	S	S	*	*			trans	-93.1	128.4	172.9	0	0	0	0	0	110
79	H	36	Very low	37.5	Very low	182 Å²	182	140.3 Å²	140.3	84%	0.843	76%	0.761	S	S	*	*				175.3	146.9	123.9	-117.7	-99.1	0	0	0	112.8
80	E	39.6	Very low	38.1	Very low	169 Å²	169	144.4 Å²	144.4	79%	0.79	76%	0.764	S	S	*	*			trans	101.6	85.2	146.2	-147.4	163.7	-171.4	0	0	120.4
81	T	34.3	Very low	38.5	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	77%	0.768	S	S	*	*				24.4	137.5	128.3	15.8	0	0	0	0	124.2
82	V	40.3	Very low	38.9	Very low	115 Å²	115	141.8 Å²	141.8	70%	0.697	77%	0.771	S	S	*	*			trans	113.9	104.1	134.4	163.8	0	0	0	0	118.7
83	T	39.8	Very low	39	Very low	121 Å²	121	139.6 Å²	139.6	74%	0.742	77%	0.768	S	S	*	*			trans	62.2	145.5	139.8	62.3	0	0	0	0	120.3
84	V	38.9	Very low	39.5	Very low	121 Å²	121	137.5 Å²	137.5	73%	0.733	77%	0.767	S	S	*	*			cis	-173	151.6	5.7	132.4	0	0	0	0	108
85	S	44.7	Very low	39.8	Very low	95 Å²	95	137.8 Å²	137.8	66%	0.664	77%	0.771	S	S	*	*			trans	66	148.4	158.1	-75.6	0	0	0	0	120.1
86	D	43.5	Very low	40.3	Very low	132 Å²	132	138.4 Å²	138.4	71%	0.706	78%	0.775	S	S	*	*			cis	-158.1	146.9	3.4	-105.2	-10.1	0	0	0	110
87	E	41.5	Very low	40.7	Very low	169 Å²	169	137.4 Å²	137.4	79%	0.79	77%	0.768	S	S	*	*			trans	11	129.7	146.3	-52.6	-179.2	157.8	0	0	121.8
88	Q	45.9	Very low	41	Very low	176 Å²	176	138.6 Å²	138.6	82%	0.822	77%	0.774	S	S	*	*				-178.7	132	101	-103.1	-163.6	21.1	0	0	114.8
89	E	43.3	Very low	41.2	Very low	173 Å²	173	140 Å²	140	81%	0.808	78%	0.779	S	S	*	*			trans	-8.3	142.4	155.1	-56.1	-178.4	149.5	0	0	121.2
90	K	46	Very low	41.8	Very low	201 Å²	201	136.9 Å²	136.9	87%	0.874	78%	0.775	S	S	*	*				-169	141.4	103.1	-129.4	177.2	-179.8	176.4	0	115.2
91	E	41.4	Very low	41.6	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	78%	0.775	S	S	*	*			trans	-69.7	167.6	-175.9	-59.4	169.7	120.4	0	0	115.9
92	G	39.8	Very low	42.1	Very low	70 Å²	70	134.8 Å²	134.8	72%	0.722	77%	0.765	S	S	*	*			trans	174.7	88.3	147.4	0	0	0	0	0	116.8
93	S	39.9	Very low	42	Very low	114 Å²	114	136.2 Å²	136.2	80%	0.797	77%	0.769	S	S	*	*			trans	64.6	108.8	136	-161.4	0	0	0	0	119.9
94	A	43.9	Very low	42.1	Very low	79 Å²	79	138.7 Å²	138.7	65%	0.653	77%	0.772	S	S	*	*				73.7	111.9	71.1	0	0	0	0	0	114.6
95	D	45.1	Very low	41.9	Very low	171 Å²	171	138.8 Å²	138.8	91%	0.914	77%	0.773	S	S	*	*				-170.8	127.6	119.5	-88	-26.8	0	0	0	112.8
96	N	42.3	Very low	41.5	Very low	160 Å²	160	139.7 Å²	139.7	86%	0.856	78%	0.777	S	S	*	*			trans	-82.4	-161.8	-179.2	-96.9	-30.7	0	0	0	111.4
97	P	41.8	Very low	41.2	Very low	102 Å²	102	141.2 Å²	141.2	66%	0.662	78%	0.783	S	S	*	*				-132.4	177.8	-55.7	37.3	-21.1	0	0	0	111.5
98	L	42.1	Very low	40.8	Very low	170 Å²	170	138.5 Å²	138.5	89%	0.89	78%	0.783	S	S	*	*			trans	171.4	121.8	134.8	-109.6	107.3	0	0	0	112.3
99	S	34.4	Very low	40.4	Very low	107 Å²	107	135.7 Å²	135.7	75%	0.748	78%	0.78	S	S	*	*			trans	-99.5	-164.1	159.8	-41.4	0	0	0	0	109.2
100	P	48.6	Very low	40	Very low	117 Å²	117	133 Å²	133	76%	0.76	78%	0.777	S	S	*	*			cis	-135.3	-159.1	-22.7	33.3	-9.8	0	0	0	113.1
101	E	36.8	Very low	39.1	Very low	170 Å²	170	130.8 Å²	130.8	79%	0.794	77%	0.773	S	S	*	*			trans	84.8	144	162.7	-117.3	-176.2	97.5	0	0	117.1
102	S	43.6	Very low	38.9	Very low	80 Å²	80	126.6 Å²	126.6	56%	0.559	77%	0.765	S	S	*	*			cis	-167	136.4	11.4	-5.3	0	0	0	0	105.9
103	D	39.7	Very low	38.5	Very low	144 Å²	144	130.2 Å²	130.2	77%	0.77	77%	0.768	S	S	*	*				114.1	138.3	87.1	-81.3	-18.6	0	0	0	113.7
104	E	41.7	Very low	38.2	Very low	174 Å²	174	131.9 Å²	131.9	81%	0.813	77%	0.768	S	S	*	*			trans	78.9	105.7	147.3	-73	-167.8	159.7	0	0	124.9
105	T	33.6	Very low	37.6	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	78%	0.778	S	S	*	*				99.3	141.3	113.9	-57.3	0	0	0	0	119.5
106	P	36.4	Very low	36.8	Very low	114 Å²	114	137.7 Å²	137.7	74%	0.74	78%	0.778	S	S	*	*			trans	-106.4	148.5	-144.3	39.2	-31.1	0	0	0	114.9
107	I	37.3	Very low	36.1	Very low	164 Å²	164	136.3 Å²	136.3	84%	0.841	78%	0.775	S	S	*	*			trans	-145.6	105.6	171.3	-53.1	178.8	0	0	0	109.8
108	S	34	Very low	35.6	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	78%	0.78	S	S	*	*			trans	-81.7	153.9	148.3	-48.5	0	0	0	0	107.6
109	P	37.6	Very low	35	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	78%	0.777	S	S	*	*				-151.6	-158.9	53	37.2	-10.9	0	0	0	112
110	P	33.4	Very low	34.9	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	78%	0.781	S	S	*	*			cis	-124	164.1	-1.7	40.2	-22	0	0	0	116	S112	P110-S112 PolarHBondContact O-N 3.19Å
111	I	27.1	Very low	34	Very low	155 Å²	155	141.8 Å²	141.8	80%	0.795	78%	0.782	S	S	*	*			trans	-59.9	116	171.7	-39.9	167.5	0	0	0	107.3
112	S	38.7	Very low	33.6	Very low	101 Å²	101	144.1 Å²	144.1	71%	0.706	79%	0.785	S	S	*	*			trans	-97.2	108.7	169.3	61.7	0	0	0	0	108.8	P110 D114	P110-S112 PolarHBondContact O-N 3.19Å; S112-D114 VanDerWaalsContact C-N 3.33Å; S112-D114 PolarHBondContact O-N 3.08Å
113	D	31.1	Very low	32.8	Very low	145 Å²	145	144.4 Å²	144.4	78%	0.775	79%	0.787	S	S	*	*			trans	-63.2	86.7	168.5	-63.9	-46.9	0	0	0	110.1
114	D	33.4	Very low	32.7	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	77%	0.77	S	S	*	*			trans	-144.7	55.7	164.5	-85.3	-33.9	0	0	0	108.7	S112	S112-D114 VanDerWaalsContact C-N 3.33Å; S112-D114 PolarHBondContact O-N 3.08Å
115	K	31.6	Very low	32.3	Very low	198 Å²	198	142.9 Å²	142.9	86%	0.861	77%	0.769	S	S	*	*			trans	-141	83.7	177.7	-164.6	-177.6	-170.1	-173.4	0	105.7
116	L	28.1	Very low	32.3	Very low	175 Å²	175	144.7 Å²	144.7	92%	0.916	77%	0.773	S	S	*	*	S	Bend	trans	162.8	47.4	162.8	-87.4	169.6	0	0	0	112.6
117	T	26.6	Very low	32.3	Very low	131 Å²	131	145.9 Å²	145.9	80%	0.804	77%	0.772	S	S	*	*	S	Bend	trans	-146.9	7.7	179.5	50.1	0	0	0	0	118.3
118	S	31.7	Very low	31.9	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	76%	0.758	S	S	*	*	S	Bend	trans	-119.2	-3.1	-177.1	63.7	0	0	0	0	117.9	Q120	S118-Q120 PolarHBondContact O-N 3.49Å
119	E	29.7	Very low	32	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	18	-179.8	-82.1	-176.7	129.5	0	0	115.1
120	Q	31.3	Very low	31.7	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	11.6	-177.7	-73.4	-100.3	-57.2	0	0	114.6	S118	S118-Q120 PolarHBondContact O-N 3.49Å
121	N	29.7	Very low	31.8	Very low	145 Å²	145	148.6 Å²	148.6	78%	0.775	77%	0.768	S	S	*	*			trans	-149.4	45.4	-172.5	-88.4	-52.4	0	0	0	115.5	S123	N121-S123 PolarHBondContact O-N 3.47Å
122	Y	28.6	Very low	32.2	Very low	218 Å²	218	148.3 Å²	148.3	86%	0.855	76%	0.757	S	S	*	*			trans	-73.2	97.8	158.2	-86.4	-80.8	0	0	0	108.7	L124	Y122-L124 PolarHBondContact O-N 2.89Å
123	S	28.5	Very low	32.1	Very low	87 Å²	87	151.7 Å²	151.7	61%	0.608	76%	0.759	S	S	*	*			trans	-53.4	102.3	172.2	-85.5	0	0	0	0	110.3	N121 R125	N121-S123 PolarHBondContact O-N 3.47Å; S123-R125 PolarHBondContact O-N 3.37Å
124	L	36.2	Very low	32.6	Very low	79 Å²	79	151.9 Å²	151.9	41%	0.414	76%	0.76	S	S	.	*	G	3₁₀ helix	trans	-69.8	8.7	-180	-150.8	139.6	0	0	0	113.5	Y122 D126 I127 F273	Y122-L124 PolarHBondContact O-N 2.89Å; L124-D126 PolarHBondContact O-N 3.33Å; L124-D126 VanDerWaalsContact O-N 3.17Å; L124-I127 HydrophobicContact CD2-CB 4.45Å; L124-I127 HydrophobicContact CG-CB 4.41Å; L124-I127 PolarHBondContact O-N 2.96Å; L124-F273 HydrophobicContact CD1-CD2 4.07Å; L124-F273 HydrophobicContact CD1-CE1 4.38Å; L124-F273 HydrophobicContact CD1-CE2 3.27Å; L124-F273 HydrophobicContact CD1-CZ 3.47Å; L124-F273 VanDerWaalsContact CD1-CZ 3.47Å
125	R	34.2	Very low	33.2	Very low	207 Å²	207	148.5 Å²	148.5	78%	0.781	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-69	-14.8	-175.2	-55.7	-162.7	-151.7	-92	1.2	113.5	S123	S123-R125 PolarHBondContact O-N 3.37Å
126	D	33.7	Very low	33.5	Very low	159 Å²	159	141.2 Å²	141.2	85%	0.85	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-105.7	-1.8	178.4	-63.5	-28.9	0	0	0	114.2	L124 G128	L124-D126 PolarHBondContact O-N 3.33Å; L124-D126 VanDerWaalsContact O-N 3.17Å; D126-G128 PolarHBondContact O-N 3.18Å
127	I	35.4	Very low	34.3	Very low	140 Å²	140	138 Å²	138	72%	0.718	72%	0.715	S	S	*	*	S	Bend	trans	-98.6	28	173.4	-53.2	169.1	0	0	0	109.6	L124 Q129	L124-I127 HydrophobicContact CD2-CB 4.45Å; L124-I127 HydrophobicContact CG-CB 4.41Å; L124-I127 PolarHBondContact O-N 2.96Å; I127-Q129 PolarHBondContact O-N 3.23Å
128	G	29.4	Very low	35	Very low	53 Å²	53	141 Å²	141	55%	0.546	72%	0.721	S	S	.	*	S	Bend	trans	-82.9	111.2	173.7	0	0	0	0	0	110.9	D126 E130	D126-G128 PolarHBondContact O-N 3.18Å; G128-E130 PolarHBondContact O-N 3.44Å; G128-E130 VanDerWaalsContact O-N 3.08Å
129	Q	36.2	Very low	35.9	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	69%	0.694	S	S	*	*	S	Bend	trans	80.9	-28.1	145.9	-127.4	173.3	22	0	0	120.5	I127	I127-Q129 PolarHBondContact O-N 3.23Å
130	E	31.4	Very low	36.6	Very low	186 Å²	186	134.1 Å²	134.1	87%	0.869	68%	0.681	S	S	*	*	S	Bend	trans	-113.2	-14.8	-163.6	-119.9	172	-176.5	0	0	119.2	G128	G128-E130 PolarHBondContact O-N 3.44Å; G128-E130 VanDerWaalsContact O-N 3.08Å
131	N	35.3	Very low	37.3	Very low	145 Å²	145	131.4 Å²	131.4	78%	0.775	66%	0.663	S	S	*	*	S	Bend	trans	-118.8	-0.2	-168.4	-133.3	9.3	0	0	0	117.6
132	W	35	Very low	38.1	Very low	149 Å²	149	126.7 Å²	126.7	56%	0.564	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-90.3	-13.5	-172.9	74.6	-77.8	0	0	0	115.1	N134 A135	W132-N134 PolarHBondContact O-N 2.93Å; W132-N134 VanDerWaalsContact O-N 3.14Å; W132-A135 PolarHBondContact O-N 2.85Å
133	K	37.4	Very low	38.9	Very low	172 Å²	172	121 Å²	121	75%	0.748	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-65.2	-17.1	-176.8	-75.9	-174.9	176.7	179	0	114.4
134	N	42.1	Very low	39.6	Very low	149 Å²	149	119.9 Å²	119.9	80%	0.797	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-102.6	-6	-175	-60.8	-21.6	0	0	0	113.8	W132	W132-N134 PolarHBondContact O-N 2.93Å; W132-N134 VanDerWaalsContact O-N 3.14Å
135	A	45.2	Very low	40.1	Very low	79 Å²	79	116.8 Å²	116.8	65%	0.653	60%	0.596	S	S	*	*	S	Bend	trans	-93.9	-9.7	-171.2	0	0	0	0	0	114.7	W132	W132-A135 PolarHBondContact O-N 2.85Å
136	C	38.1	Very low	40.9	Very low	45 Å²	45	110.7 Å²	110.7	30%	0.304	58%	0.579	S	S	.	*	S	Bend	trans	-127.2	104.7	176.6	-88.3	0	0	0	0	109.4	E138	C136-E138 PolarHBondContact O-N 3.1Å
137	P	44.7	Very low	41.7	Very low	106 Å²	106	109.2 Å²	109.2	69%	0.688	57%	0.567	S	S	*	*			trans	-59.9	131.1	162.6	25.6	-30.2	0	0	0	107.7	N139	P137-N139 PolarHBondContact O-N 3.48Å
138	E	42.1	Very low	42.5	Very low	195 Å²	195	104.2 Å²	104.2	91%	0.911	54%	0.542	S	S	*	.			trans	-59.1	84.2	-179.2	-162.5	166.3	-154.2	0	0	109.7	C136	C136-E138 PolarHBondContact O-N 3.1Å
139	N	50.1	Low	43.3	Very low	37 Å²	37	102 Å²	102	20%	0.198	52%	0.518	C	S	.	.			trans	-88	147	-178	72.7	28.6	0	0	0	108.2	P137 W141 N142	P137-N139 PolarHBondContact O-N 3.48Å; N139-W141 HydrophobicContact CB-CE3 3.7Å; N139-W141 HydrophobicContact CB-CZ3 4.26Å; N139-W141 PolarHBondContact O-N 3.46Å; N139-W141 WeakPolarHBondContact OD1-CB 3.41Å; N139-W141 PolarHBondContact OD1-N 2.84Å; N139-N142 PolarHBondContact O-N 3.38Å; N139-N142 VanDerWaalsContact O-N 3.1Å; N139-N142 PolarHBondContact OD1-N 2.86Å
140	N	44.2	Very low	44	Very low	106 Å²	106	96.7 Å²	96.7	57%	0.567	50%	0.499	S	S	*	.	H	α-helix	trans	-47.1	-31.8	175.5	165.2	2.8	0	0	0	112.3	N142 N143 T144	N140-N142 PolarHBondContact O-N 3.14Å; N140-N143 VanDerWaalsContact O-CB 3.28Å; N140-N143 WeakPolarHBondContact O-CB 3.17Å; N140-N143 PolarHBondContact O-N 3.05Å; N140-T144 PolarHBondContact O-N 3.18Å
141	W	46.4	Very low	44.7	Very low	121 Å²	121	91.9 Å²	91.9	46%	0.458	48%	0.479	S	S	.	.	H	α-helix	trans	-66.9	-31.5	-176.2	-61.7	-106.4	0	0	0	113.5	M41 N139 N143 T144 V145	M41-W141 HydrophobicContact CE-CZ2 4.29Å; N139-W141 HydrophobicContact CB-CE3 3.7Å; N139-W141 HydrophobicContact CB-CZ3 4.26Å; N139-W141 PolarHBondContact O-N 3.46Å; N139-W141 WeakPolarHBondContact OD1-CB 3.41Å; N139-W141 PolarHBondContact OD1-N 2.84Å; W141-N143 PolarHBondContact O-N 3.09Å; W141-T144 PolarHBondContact O-N 3.4Å; W141-V145 PolarHBondContact O-N 2.77Å
142	N	45.1	Very low	45.2	Very low	47 Å²	47	85.7 Å²	85.7	25%	0.251	45%	0.446	S	S	.	.	H	α-helix	trans	-52.6	-42.3	168.4	-95.4	29.8	0	0	0	110.9	N139 N140 N146	N139-N142 PolarHBondContact O-N 3.38Å; N139-N142 VanDerWaalsContact O-N 3.1Å; N139-N142 PolarHBondContact OD1-N 2.86Å; N140-N142 PolarHBondContact O-N 3.14Å; N142-N146 WeakPolarHBondContact O-CB 3.27Å; N142-N146 PolarHBondContact O-N 2.92Å; N142-N146 PolarHBondContact O-ND2 2.68Å
143	N	46	Very low	45.8	Very low	97 Å²	97	79.6 Å²	79.6	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-67.1	-48.1	177.8	-169.3	-4.7	0	0	0	111.9	N140 W141 V145 N146 Q147	N140-N143 VanDerWaalsContact O-CB 3.28Å; N140-N143 WeakPolarHBondContact O-CB 3.17Å; N140-N143 PolarHBondContact O-N 3.05Å; W141-N143 PolarHBondContact O-N 3.09Å; N143-V145 PolarHBondContact O-N 2.79Å; N143-N146 PolarHBondContact O-N 2.73Å; N143-Q147 WeakPolarHBondContact O-CG 3.2Å; N143-Q147 PolarHBondContact O-N 2.8Å; N143-Q147 PolarHBondContact OD1-NE2 3.33Å; N143-Q147 VanDerWaalsContact OD1-NE2 3.09Å
144	T	43.5	Very low	46.4	Very low	64 Å²	64	78.2 Å²	78.2	39%	0.393	42%	0.415	S	S	.	.	H	α-helix	trans	-60.3	-45.7	-178.1	-59.5	0	0	0	0	112.4	N140 W141 Q147 I148	N140-T144 PolarHBondContact O-N 3.18Å; W141-T144 PolarHBondContact O-N 3.4Å; T144-Q147 WeakPolarHBondContact O-CB 2.93Å; T144-Q147 PolarHBondContact O-N 3.37Å; T144-I148 HydrophobicContact CG2-CD1 3.81Å; T144-I148 WeakPolarHBondContact O-CD1 3.33Å; T144-I148 VanDerWaalsContact O-CG1 3.27Å; T144-I148 WeakPolarHBondContact O-CG1 3.03Å; T144-I148 PolarHBondContact O-N 2.97Å
145	V	47.5	Very low	46.4	Very low	14 Å²	14	73.8 Å²	73.8	9%	0.085	40%	0.395	C	S	.	.	H	α-helix	trans	-79.3	-32.5	-178.5	177.8	0	0	0	0	111.4	F34 W141 N143 Q147 I148 V149 F232	F34-V145 HydrophobicContact CE2-CG2 4.35Å; W141-V145 PolarHBondContact O-N 2.77Å; N143-V145 PolarHBondContact O-N 2.79Å; V145-Q147 PolarHBondContact O-N 2.92Å; V145-I148 PolarHBondContact O-N 3.46Å; V145-I148 VanDerWaalsContact O-N 3.08Å; V145-V149 HydrophobicContact CG1-CG2 3.86Å; V145-V149 WeakPolarHBondContact O-CB 3.28Å; V145-V149 WeakPolarHBondContact O-CG2 3.4Å; V145-V149 PolarHBondContact O-N 3.27Å; V145-F232 HydrophobicContact CB-CD1 3.79Å; V145-F232 HydrophobicContact CB-CD2 4.45Å; V145-F232 HydrophobicContact CB-CE1 3.19Å; V145-F232 HydrophobicContact CB-CE2 3.91Å; V145-F232 HydrophobicContact CB-CG 4.4Å; V145-F232 HydrophobicContact CB-CZ 3.24Å; V145-F232 HydrophobicContact CG1-CD1 3.21Å; V145-F232 HydrophobicContact CG1-CD2 4.07Å; V145-F232 HydrophobicContact CG1-CE1 3.22Å; V145-F232 HydrophobicContact CG1-CE2 4.03Å; V145-F232 HydrophobicContact CG1-CG 3.69Å; V145-F232 HydrophobicContact CG1-CZ 3.64Å; V145-F232 HydrophobicContact CG2-CE1 4.08Å; V145-F232 HydrophobicContact CG2-CE2 3.85Å; V145-F232 HydrophobicContact CG2-CZ 3.61Å
146	N	49.9	Very low	46.5	Very low	79 Å²	79	72.6 Å²	72.6	42%	0.422	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-19.3	167.6	-72.5	-19.5	0	0	0	112.5	N142 N143 P150	N142-N146 WeakPolarHBondContact O-CB 3.27Å; N142-N146 PolarHBondContact O-N 2.92Å; N142-N146 PolarHBondContact O-ND2 2.68Å; N143-N146 PolarHBondContact O-N 2.73Å; N146-P150 WeakPolarHBondContact O-CD 2.92Å; N146-P150 WeakPolarHBondContact O-CG 3.47Å
147	Q	51.6	Low	46.5	Very low	128 Å²	128	73.2 Å²	73.2	60%	0.598	39%	0.39	S	S	*	.	H	α-helix	trans	-87.2	-38	169	-73.3	-173	71.5	0	0	112.5	N143 T144 V145 N151	N143-Q147 WeakPolarHBondContact O-CG 3.2Å; N143-Q147 PolarHBondContact O-N 2.8Å; N143-Q147 PolarHBondContact OD1-NE2 3.33Å; N143-Q147 VanDerWaalsContact OD1-NE2 3.09Å; T144-Q147 WeakPolarHBondContact O-CB 2.93Å; T144-Q147 PolarHBondContact O-N 3.37Å; V145-Q147 PolarHBondContact O-N 2.92Å; Q147-N151 VanDerWaalsContact O-CB 3.32Å; Q147-N151 WeakPolarHBondContact O-CB 3.21Å; Q147-N151 PolarHBondContact O-N 3.43Å
148	I	50.4	Low	46.1	Very low	35 Å²	35	74.3 Å²	74.3	18%	0.179	39%	0.386	C	S	.	.	H	α-helix	trans	-67.6	-45.7	-179.1	-69.5	159.7	0	0	0	111.4	K33 T144 V145 N151 V152	K33-I148 HydrophobicContact CD-CD1 4.09Å; K33-I148 HydrophobicContact CD-CG1 4.47Å; K33-I148 HydrophobicContact CD-CG2 3.81Å; K33-I148 VanDerWaalsContact NZ-CG2 3.32Å; T144-I148 HydrophobicContact CG2-CD1 3.81Å; T144-I148 WeakPolarHBondContact O-CD1 3.33Å; T144-I148 VanDerWaalsContact O-CG1 3.27Å; T144-I148 WeakPolarHBondContact O-CG1 3.03Å; T144-I148 PolarHBondContact O-N 2.97Å; V145-I148 PolarHBondContact O-N 3.46Å; V145-I148 VanDerWaalsContact O-N 3.08Å; I148-N151 PolarHBondContact O-N 3.37Å; I148-V152 HydrophobicContact CG2-CG2 4Å; I148-V152 WeakPolarHBondContact O-CG2 3.33Å; I148-V152 PolarHBondContact O-N 3.49Å
149	V	47.3	Very low	45.8	Very low	7 Å²	7	70.3 Å²	70.3	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-61	-54	-173.4	158.1	0	0	0	0	112	V145 N151 V152 I153 S230	V145-V149 HydrophobicContact CG1-CG2 3.86Å; V145-V149 WeakPolarHBondContact O-CB 3.28Å; V145-V149 WeakPolarHBondContact O-CG2 3.4Å; V145-V149 PolarHBondContact O-N 3.27Å; V149-N151 PolarHBondContact O-N 2.91Å; V149-V152 PolarHBondContact O-N 3.02Å; V149-I153 HydrophobicContact CG1-CD1 3.52Å; V149-I153 WeakPolarHBondContact O-CB 3.23Å; V149-I153 WeakPolarHBondContact O-CD1 3.41Å; V149-I153 WeakPolarHBondContact O-CG1 3.32Å; V149-I153 PolarHBondContact O-N 2.81Å; V149-S230 WeakPolarHBondContact CG1-OG 3.31Å; V149-S230 WeakPolarHBondContact CG2-OG 3.32Å
150	P	50.2	Low	45.1	Very low	70 Å²	70	73.9 Å²	73.9	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-62.3	-30.1	176.5	-22.6	34.4	0	0	0	112.2	N146 R154	N146-P150 WeakPolarHBondContact O-CD 2.92Å; N146-P150 WeakPolarHBondContact O-CG 3.47Å; P150-R154 WeakPolarHBondContact O-CB 3.43Å; P150-R154 PolarHBondContact O-N 2.93Å
151	N	46.3	Very low	44.4	Very low	85 Å²	85	74.5 Å²	74.5	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-73.3	-40.7	-178.8	-146.2	24.2	0	0	0	112	Q147 I148 V149 R154 S155	Q147-N151 VanDerWaalsContact O-CB 3.32Å; Q147-N151 WeakPolarHBondContact O-CB 3.21Å; Q147-N151 PolarHBondContact O-N 3.43Å; I148-N151 PolarHBondContact O-N 3.37Å; V149-N151 PolarHBondContact O-N 2.91Å; N151-R154 PolarHBondContact OD1-NH2 2.87Å; N151-S155 WeakPolarHBondContact O-CB 3.47Å; N151-S155 PolarHBondContact O-N 3.45Å; N151-S155 PolarHBondContact O-OG 3.41Å; N151-S155 VanDerWaalsContact O-OG 3.09Å
152	V	45.8	Very low	43.7	Very low	14 Å²	14	76.4 Å²	76.4	9%	0.085	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-46.9	171.9	172.6	0	0	0	0	109.9	L26 T29 I148 V149 R154 S155 H156	L26-V152 HydrophobicContact CD1-CG1 4.03Å; T29-V152 HydrophobicContact CG2-CG2 4.11Å; I148-V152 HydrophobicContact CG2-CG2 4Å; I148-V152 WeakPolarHBondContact O-CG2 3.33Å; I148-V152 PolarHBondContact O-N 3.49Å; V149-V152 PolarHBondContact O-N 3.02Å; V152-R154 PolarHBondContact O-N 2.77Å; V152-S155 WeakPolarHBondContact CA-OG 3.43Å; V152-S155 PolarHBondContact O-N 3.37Å; V152-S155 PolarHBondContact O-OG 3.31Å; V152-H156 PolarHBondContact O-CD2 3.19Å; V152-H156 PolarHBondContact O-N 2.91Å
153	I	47.9	Very low	42.9	Very low	21 Å²	21	81 Å²	81	11%	0.108	43%	0.43	C	S	.	.	H	α-helix	trans	-59	-46.2	176.6	-71.5	165.3	0	0	0	111.4	F22 V149 H156 G157 I228	F22-I153 HydrophobicContact CZ-CG1 4.18Å; V149-I153 HydrophobicContact CG1-CD1 3.52Å; V149-I153 WeakPolarHBondContact O-CB 3.23Å; V149-I153 WeakPolarHBondContact O-CD1 3.41Å; V149-I153 WeakPolarHBondContact O-CG1 3.32Å; V149-I153 PolarHBondContact O-N 2.81Å; I153-H156 PolarHBondContact O-N 3.21Å; I153-G157 PolarHBondContact O-N 2.94Å; I153-I228 HydrophobicContact CD1-CB 3.99Å; I153-I228 HydrophobicContact CD1-CG2 3.75Å; I153-I228 HydrophobicContact CG1-CB 4.1Å; I153-I228 HydrophobicContact CG1-CG2 4Å; I153-I228 HydrophobicContact CG2-CB 3.7Å; I153-I228 HydrophobicContact CG2-CD1 4.37Å; I153-I228 HydrophobicContact CG2-CG1 4.31Å
154	R	49.7	Very low	42.1	Very low	143 Å²	143	84.1 Å²	84.1	54%	0.54	44%	0.444	S	S	.	.	H	α-helix	trans	-64.3	-44.2	178.7	179.7	174.3	60.1	152.1	0.5	111.7	P150 N151 V152 H156 G157 E158	P150-R154 WeakPolarHBondContact O-CB 3.43Å; P150-R154 PolarHBondContact O-N 2.93Å; N151-R154 PolarHBondContact OD1-NH2 2.87Å; V152-R154 PolarHBondContact O-N 2.77Å; R154-H156 PolarHBondContact O-N 2.89Å; R154-G157 PolarHBondContact O-N 2.77Å; R154-E158 WeakPolarHBondContact CD-OE1 3.46Å; R154-E158 HydrophobicContact CG-CG 4.33Å; R154-E158 WeakPolarHBondContact CG-OE1 3.17Å; R154-E158 WeakPolarHBondContact O-CB 3.42Å; R154-E158 WeakPolarHBondContact O-CG 3.33Å; R154-E158 PolarHBondContact O-N 3.26Å
155	S	42.4	Very low	41.3	Very low	56 Å²	56	83.4 Å²	83.4	39%	0.392	45%	0.45	S	S	.	.	H	α-helix	trans	-61.9	-33	177	55.3	0	0	0	0	112.3	N151 V152 T159	N151-S155 WeakPolarHBondContact O-CB 3.47Å; N151-S155 PolarHBondContact O-N 3.45Å; N151-S155 PolarHBondContact O-OG 3.41Å; N151-S155 VanDerWaalsContact O-OG 3.09Å; V152-S155 WeakPolarHBondContact CA-OG 3.43Å; V152-S155 PolarHBondContact O-N 3.37Å; V152-S155 PolarHBondContact O-OG 3.31Å; S155-T159 WeakPolarHBondContact O-CB 3.43Å; S155-T159 PolarHBondContact O-OG1 2.95Å
156	H	47.5	Very low	40.6	Very low	55 Å²	55	87.7 Å²	87.7	26%	0.255	48%	0.48	S	S	.	.	H	α-helix	trans	-80.5	-37.5	176.2	-69.5	-63.9	0	0	0	112.9	F22 Q25 V152 I153 R154 E158 T159	F22-H156 HydrophobicContact CD2-CB 4.37Å; F22-H156 HydrophobicContact CE2-CB 3.85Å; F22-H156 AromaticContact CE2-CD2 3.81Å; F22-H156 AromaticContact CE2-CG 3.96Å; Q25-H156 PolarHBondContact NE2-CE1 2.96Å; Q25-H156 PolarHBondContact OE1-CE1 3.32Å; V152-H156 PolarHBondContact O-CD2 3.19Å; V152-H156 PolarHBondContact O-N 2.91Å; I153-H156 PolarHBondContact O-N 3.21Å; R154-H156 PolarHBondContact O-N 2.89Å; H156-E158 VanDerWaalsContact C-N 3.34Å; H156-E158 PolarHBondContact O-N 3.48Å; H156-T159 PolarHBondContact O-N 3.08Å
157	G	37.4	Very low	39.9	Very low	57 Å²	57	93 Å²	93	59%	0.588	50%	0.502	S	S	*	.	H	α-helix	trans	-68.8	-27.3	177.4	0	0	0	0	0	114.4	I153 R154	I153-G157 PolarHBondContact O-N 2.94Å; R154-G157 PolarHBondContact O-N 2.77Å
158	E	36.5	Very low	39.1	Very low	129 Å²	129	93.9 Å²	93.9	60%	0.603	51%	0.506	S	S	*	.	H	α-helix	trans	-83.2	-18.1	173.8	-68.8	172.6	-176.2	0	0	112.6	R154 H156	R154-E158 WeakPolarHBondContact CD-OE1 3.46Å; R154-E158 HydrophobicContact CG-CG 4.33Å; R154-E158 WeakPolarHBondContact CG-OE1 3.17Å; R154-E158 WeakPolarHBondContact O-CB 3.42Å; R154-E158 WeakPolarHBondContact O-CG 3.33Å; R154-E158 PolarHBondContact O-N 3.26Å; H156-E158 VanDerWaalsContact C-N 3.34Å; H156-E158 PolarHBondContact O-N 3.48Å
159	T	35.9	Very low	38.4	Very low	112 Å²	112	101.9 Å²	101.9	69%	0.687	54%	0.539	S	S	*	.	H	α-helix	trans	-81.8	-14.6	-178.9	-59.6	0	0	0	0	112.7	S155 H156	S155-T159 WeakPolarHBondContact O-CB 3.43Å; S155-T159 PolarHBondContact O-OG1 2.95Å; H156-T159 PolarHBondContact O-N 3.08Å
160	E	35.3	Very low	37.9	Very low	112 Å²	112	108.2 Å²	108.2	52%	0.523	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.9	49	171.8	-63.2	-164.5	176.4	0	0	112.6	Q18 Y162	Q18-E160 PolarHBondContact NE2-OE1 3.32Å; E160-Y162 HydrophobicContact CB-CD2 4.48Å; E160-Y162 PolarHBondContact O-N 3.31Å
161	V	29	Very low	37.5	Very low	119 Å²	119	114.4 Å²	114.4	72%	0.721	59%	0.593	S	S	*	*			trans	-79.4	87.9	150.5	-176.9	0	0	0	0	106.2	N163	V161-N163 PolarHBondContact O-N 2.95Å
162	Y	32.7	Very low	37.2	Very low	161 Å²	161	115.6 Å²	115.6	63%	0.631	61%	0.605	S	S	*	*			trans	-61	97.6	160.5	-82.7	-87.1	0	0	0	106.8	E160 M164	E160-Y162 HydrophobicContact CB-CD2 4.48Å; E160-Y162 PolarHBondContact O-N 3.31Å; Y162-M164 PolarHBondContact O-N 2.9Å
163	N	28.9	Very low	36.8	Very low	142 Å²	142	121.3 Å²	121.3	76%	0.759	64%	0.64	S	S	*	*			trans	-59.8	83.3	154.9	-159.4	17.8	0	0	0	105.2	V161 G165	V161-N163 PolarHBondContact O-N 2.95Å; N163-G165 PolarHBondContact O-N 3.06Å
164	M	28.7	Very low	36.2	Very low	164 Å²	164	129.9 Å²	129.9	81%	0.808	68%	0.679	S	S	*	*			trans	-63.8	85.2	164.4	-78.6	-67	-71.6	0	0	104.7	Y162 S166	Y162-M164 PolarHBondContact O-N 2.9Å; M164-S166 PolarHBondContact O-N 3.03Å
165	G	27.1	Very low	35.9	Very low	49 Å²	49	128.5 Å²	128.5	51%	0.505	69%	0.692	S	S	.	*			trans	-51	108.4	-172	0	0	0	0	0	109	N163 H167	N163-G165 PolarHBondContact O-N 3.06Å; G165-H167 PolarHBondContact O-N 3.34Å
166	S	31.8	Very low	35.8	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	72%	0.719	S	S	*	*			trans	-59.4	93.2	147.3	54.9	0	0	0	0	105.6	M164 E168	M164-S166 PolarHBondContact O-N 3.03Å; S166-E168 PolarHBondContact O-N 3.04Å
167	H	35.7	Very low	35.6	Very low	190 Å²	190	135.3 Å²	135.3	88%	0.88	74%	0.743	S	S	*	*			trans	-65.5	73.5	161.8	-107.5	-74.9	0	0	0	107.3	G165 K169	G165-H167 PolarHBondContact O-N 3.34Å; H167-K169 PolarHBondContact O-N 3.11Å
168	E	34.1	Very low	35.9	Very low	147 Å²	147	140.4 Å²	140.4	69%	0.687	76%	0.757	S	S	*	*			trans	-75.1	108.2	163.6	-166.9	165.2	-171.8	0	0	106.1	S166 N170	S166-E168 PolarHBondContact O-N 3.04Å; E168-N170 PolarHBondContact O-N 2.93Å
169	K	35.5	Very low	36.1	Very low	203 Å²	203	143.8 Å²	143.8	88%	0.883	77%	0.773	S	S	*	*			trans	-58.2	89.7	170.1	-99.1	176.9	171	168.4	0	108.5	H167 K171	H167-K169 PolarHBondContact O-N 3.11Å; K169-K171 PolarHBondContact O-N 3.47Å; K169-K171 VanDerWaalsContact O-N 3.09Å
170	N	38.4	Very low	36.1	Very low	141 Å²	141	146.9 Å²	146.9	75%	0.754	78%	0.777	S	S	*	*			trans	-65.5	106	162.9	-71.5	-35.4	0	0	0	108.2	E168	E168-N170 PolarHBondContact O-N 2.93Å
171	K	39.9	Very low	36.7	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.865	79%	0.792	S	S	*	*			trans	-77.9	124.5	161.4	-141.2	-179	-167.7	-174.4	0	106.6	K169	K169-K171 PolarHBondContact O-N 3.47Å; K169-K171 VanDerWaalsContact O-N 3.09Å
172	P	41	Very low	37	Very low	110 Å²	110	148.3 Å²	148.3	71%	0.714	79%	0.793	S	S	*	*			trans	-83.3	137.5	-169	31.3	-32.3	0	0	0	112.6
173	V	37.4	Very low	37.3	Very low	134 Å²	134	144.8 Å²	144.8	81%	0.812	80%	0.797	S	S	*	*			trans	57.6	113.1	136.1	-178.2	0	0	0	0	118.7
174	E	34.8	Very low	37.7	Very low	201 Å²	201	146 Å²	146	94%	0.939	80%	0.802	S	S	*	*				-149.6	111.3	125.6	-105.2	175.9	-167.7	0	0	107.1
175	S	42.9	Very low	37.9	Very low	114 Å²	114	145.9 Å²	145.9	80%	0.797	80%	0.804	S	S	*	*			trans	-140.8	103.3	161.6	75.8	0	0	0	0	109
176	D	42.2	Very low	38.4	Very low	179 Å²	179	151.5 Å²	151.5	96%	0.957	82%	0.822	S	S	*	*			trans	-78.3	133.3	162.1	-81.2	-30.8	0	0	0	109.1
177	G	43	Very low	38.3	Very low	75 Å²	75	153.2 Å²	153.2	77%	0.773	82%	0.823	S	S	*	*			trans	161.3	75.9	174.6	0	0	0	0	0	113.4	Q179	G177-Q179 PolarHBondContact O-N 3.36Å
178	D	42.6	Very low	38.4	Very low	164 Å²	164	150.4 Å²	150.4	88%	0.877	82%	0.819	S	S	*	*			trans	-42.3	121.2	171.8	-62.7	-54.1	0	0	0	114
179	Q	41.7	Very low	38.3	Very low	201 Å²	201	150.7 Å²	150.7	94%	0.939	83%	0.825	S	S	*	*			trans	-159	123.1	136.7	-141.3	166.3	-59.5	0	0	113.5	G177	G177-Q179 PolarHBondContact O-N 3.36Å
180	K	35.9	Very low	38.7	Very low	177 Å²	177	146.4 Å²	146.4	77%	0.77	82%	0.818	S	S	*	*			trans	-89.2	137.2	-176.5	-176	178.6	-174.2	175.8	0	111.1
181	S	46.7	Very low	38.5	Very low	119 Å²	119	144.3 Å²	144.3	83%	0.832	81%	0.812	S	S	*	*			trans	-167.2	124	137.7	53.8	0	0	0	0	111.8
182	D	36.2	Very low	38	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	80%	0.804	S	S	*	*			trans	-66.2	148.3	179.8	-52.1	-69.3	0	0	0	113.7
183	A	38.3	Very low	37.6	Very low	87 Å²	87	144.3 Å²	144.3	72%	0.719	81%	0.809	S	S	*	*			trans	-171	105.8	140.9	0	0	0	0	0	114.2
184	I	37.5	Very low	37.2	Very low	167 Å²	167	145 Å²	145	86%	0.856	81%	0.808	S	S	*	*			trans	82.3	111.6	134.7	-51.3	165.4	0	0	0	119
185	L	34.3	Very low	37.1	Very low	163 Å²	163	143.5 Å²	143.5	85%	0.853	80%	0.803	S	S	*	*			trans	-82.2	143.3	168.2	-78.7	162	0	0	0	112.7
186	L	36.1	Very low	36.4	Very low	166 Å²	166	142.8 Å²	142.8	87%	0.869	80%	0.798	S	S	*	*			trans	-151.8	88.3	149.6	-82.9	171.5	0	0	0	105
187	D	30.5	Very low	35.8	Very low	140 Å²	140	139.6 Å²	139.6	75%	0.749	79%	0.79	S	S	*	*				38.8	96.3	89.4	-161.8	20.9	0	0	0	115.1
188	T	36.6	Very low	35.2	Very low	131 Å²	131	143.1 Å²	143.1	80%	0.804	79%	0.791	S	S	*	*			trans	-177.4	101.2	141.6	-65.2	0	0	0	0	108.1
189	D	33	Very low	34.7	Very low	152 Å²	152	143.4 Å²	143.4	81%	0.813	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-74.6	143.7	168	-75.2	-33.6	0	0	0	111.2
190	P	44.4	Very low	34.1	Very low	113 Å²	113	139.9 Å²	139.9	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-103.1	146.7	147.8	32.7	-22.2	0	0	0	110.4
191	P	34.1	Very low	34	Very low	97 Å²	97	140 Å²	140	63%	0.63	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.9	144.1	-158.6	29.7	-34.9	0	0	0	113.6	Y193	P191-Y193 HydrophobicContact CG-CE2 4.44Å; P191-Y193 PolarHBondContact O-N 3.26Å
192	S	29.7	Very low	33.4	Very low	99 Å²	99	140.6 Å²	140.6	69%	0.692	78%	0.776	S	S	*	*			trans	-51.5	115.3	164.2	55.3	0	0	0	0	112.2
193	Y	32.3	Very low	33.2	Very low	210 Å²	210	141 Å²	141	82%	0.824	77%	0.774	S	S	*	*			trans	-98.2	83.1	150.6	-64.6	-79.6	0	0	0	107.6	P191 M195	P191-Y193 HydrophobicContact CG-CE2 4.44Å; P191-Y193 PolarHBondContact O-N 3.26Å; Y193-M195 VanDerWaalsContact C-N 3.35Å; Y193-M195 PolarHBondContact O-N 2.92Å; Y193-M195 VanDerWaalsContact O-N 3.08Å
194	L	27.9	Very low	33.3	Very low	150 Å²	150	147.1 Å²	147.1	79%	0.785	79%	0.785	S	S	*	*			trans	-64	96.6	159.4	-78.9	161.9	0	0	0	107.3	S196	L194-S196 PolarHBondContact O-N 3.43Å
195	M	32.3	Very low	33	Very low	168 Å²	168	146.1 Å²	146.1	83%	0.828	78%	0.781	S	S	*	*			trans	-86.7	94.2	157.7	-81.6	-75.8	96	0	0	107.7	Y193 S197	Y193-M195 VanDerWaalsContact C-N 3.35Å; Y193-M195 PolarHBondContact O-N 2.92Å; Y193-M195 VanDerWaalsContact O-N 3.08Å; M195-S197 PolarHBondContact O-N 3.4Å
196	S	29.8	Very low	33.2	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	77%	0.772	S	S	*	*			trans	-42.4	115.6	170.2	-157.6	0	0	0	0	110.5	L194	L194-S196 PolarHBondContact O-N 3.43Å
197	S	29.9	Very low	33.1	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	77%	0.772	S	S	*	*			trans	-102.9	78.5	171.4	-59	0	0	0	0	107.9	M195	M195-S197 PolarHBondContact O-N 3.4Å
198	D	29	Very low	33.4	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	78%	0.776	S	S	*	*			trans	-141.5	80.5	171.2	-69.6	-44.4	0	0	0	108.8
199	E	33.5	Very low	33.4	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.794	78%	0.777	S	S	*	*			trans	-142.8	91.9	159.3	-161.3	151.1	-160.4	0	0	110.8
200	N	27.9	Very low	34	Very low	127 Å²	127	143.2 Å²	143.2	68%	0.679	78%	0.779	S	S	*	*			trans	19.6	105.6	150.3	63.9	14.2	0	0	0	120.5
201	L	33.4	Very low	33.5	Very low	179 Å²	179	144.3 Å²	144.3	94%	0.937	78%	0.778	S	S	*	*			trans	-123.5	83.2	144.6	-72.7	178.1	0	0	0	110.4
202	N	35.9	Very low	34	Very low	132 Å²	132	145.1 Å²	145.1	71%	0.706	78%	0.784	S	S	*	*			trans	9.5	111.7	142.2	-161	67.2	0	0	0	118.2
203	E	31.1	Very low	34.4	Very low	150 Å²	150	147 Å²	147	70%	0.701	79%	0.786	S	S	*	*			trans	42.3	92	136.7	-159.9	176	-169.5	0	0	117.8
204	F	39.3	Very low	35.1	Very low	216 Å²	216	142 Å²	142	95%	0.947	78%	0.781	S	S	*	*			trans	-117.3	89.4	145.7	-104.7	-84.5	0	0	0	108
205	D	33.2	Very low	35.9	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	78%	0.779	S	S	*	*			trans	-83.9	109.3	168	-144.1	9.6	0	0	0	107.2
206	G	38.2	Very low	36.2	Very low	64 Å²	64	141 Å²	141	66%	0.66	78%	0.78	S	S	*	*			trans	-152	82	-173.5	0	0	0	0	0	111	I208	G206-I208 PolarHBondContact O-N 2.87Å; G206-I208 VanDerWaalsContact O-N 3.14Å
207	D	32.9	Very low	36.6	Very low	163 Å²	163	143 Å²	143	87%	0.872	78%	0.782	S	S	*	*			trans	-57.1	106.4	173.1	-87.3	-34.7	0	0	0	111.8
208	I	37.2	Very low	36.9	Very low	163 Å²	163	147.4 Å²	147.4	84%	0.836	79%	0.788	S	S	*	*			trans	-134.4	98.3	151.6	-58.9	-178.4	0	0	0	108	G206	G206-I208 PolarHBondContact O-N 2.87Å; G206-I208 VanDerWaalsContact O-N 3.14Å
209	S	36.9	Very low	37.3	Very low	117 Å²	117	145 Å²	145	82%	0.818	78%	0.782	S	S	*	*			trans	-71.6	120.6	169	71.1	0	0	0	0	110.2
210	E	45.4	Very low	37.3	Very low	183 Å²	183	143.9 Å²	143.9	86%	0.855	78%	0.782	S	S	*	*			trans	-156.7	115	142	-139.8	171.1	-176.3	0	0	109.8	P212	E210-P212 VanDerWaalsContact O-CD 3.31Å; E210-P212 WeakPolarHBondContact O-CD 3.48Å
211	N	33	Very low	37.5	Very low	136 Å²	136	143.6 Å²	143.6	73%	0.727	78%	0.779	S	S	*	*			trans	-67.1	115.6	-176.8	179.1	50.3	0	0	0	111.6
212	P	44.6	Very low	37.7	Very low	114 Å²	114	138.2 Å²	138.2	74%	0.74	75%	0.753	S	S	*	*			trans	-94.1	115.1	166.7	31.6	-20.7	0	0	0	109.9	E210 S214	E210-P212 VanDerWaalsContact O-CD 3.31Å; E210-P212 WeakPolarHBondContact O-CD 3.48Å; P212-S214 PolarHBondContact O-N 3.41Å
213	N	39.8	Very low	37.8	Very low	139 Å²	139	140 Å²	140	74%	0.743	76%	0.757	S	S	*	*			trans	-42.8	125.6	-179.1	-49.6	-32.6	0	0	0	113.8	D215	N213-D215 VanDerWaalsContact C-N 3.33Å; N213-D215 PolarHBondContact O-N 3.31Å
214	S	45.8	Very low	38.2	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	75%	0.747	S	S	*	*	S	Bend	trans	-76.6	6.7	-168.3	52.2	0	0	0	0	117.3	P212	P212-S214 PolarHBondContact O-N 3.41Å
215	D	44.3	Very low	38.3	Very low	139 Å²	139	133.4 Å²	133.4	74%	0.743	73%	0.729	S	S	*	*	S	Bend	trans	-104.7	8	-157.7	-65.5	-6.6	0	0	0	115.7	N213	N213-D215 VanDerWaalsContact C-N 3.33Å; N213-D215 PolarHBondContact O-N 3.31Å
216	N	40.4	Very low	38.7	Very low	158 Å²	158	131.4 Å²	131.4	85%	0.845	72%	0.718	S	S	*	*			trans	-127.5	9.4	-175.4	-98.8	-2.5	0	0	0	116.4	K218	N216-K218 PolarHBondContact O-N 3.49Å; N216-K218 VanDerWaalsContact O-N 3.15Å
217	L	36.7	Very low	38.7	Very low	142 Å²	142	133.7 Å²	133.7	74%	0.743	71%	0.71	S	S	*	*			trans	-89.2	78.7	177.4	-63.6	179.6	0	0	0	111	M1 S219	M1-L217 HydrophobicContact CE-CD2 4.09Å; L217-S219 VanDerWaalsContact C-N 3.32Å; L217-S219 PolarHBondContact O-N 3.27Å
218	K	36	Very low	39.1	Very low	206 Å²	206	127.2 Å²	127.2	90%	0.896	68%	0.675	S	S	*	*			trans	-65.6	96.6	162	-134.7	170.5	-175.3	178.1	0	107.2	N216 N220	N216-K218 PolarHBondContact O-N 3.49Å; N216-K218 VanDerWaalsContact O-N 3.15Å; K218-N220 PolarHBondContact O-N 3.15Å
219	S	37.8	Very low	39.3	Very low	97 Å²	97	121.4 Å²	121.4	68%	0.678	65%	0.649	S	S	*	*			trans	-50.5	105.6	-180	179.5	0	0	0	0	110.7	L217 I221	L217-S219 VanDerWaalsContact C-N 3.32Å; L217-S219 PolarHBondContact O-N 3.27Å; S219-I221 PolarHBondContact O-N 3.27Å; S219-I221 WeakPolarHBondContact OG-CG1 3.36Å
220	N	33.1	Very low	39.7	Very low	147 Å²	147	116.2 Å²	116.2	79%	0.786	61%	0.612	S	S	*	*			trans	-91.9	91.1	164.9	-150	19.7	0	0	0	105.3	K218 V222	K218-N220 PolarHBondContact O-N 3.15Å; N220-V222 PolarHBondContact O-N 2.99Å
221	I	32.8	Very low	39.6	Very low	120 Å²	120	113.9 Å²	113.9	62%	0.615	60%	0.596	S	S	*	*			trans	-63.6	98.9	175.9	-62.4	171.9	0	0	0	106.8	S219 H223	S219-I221 PolarHBondContact O-N 3.27Å; S219-I221 WeakPolarHBondContact OG-CG1 3.36Å; I221-H223 PolarHBondContact O-N 2.95Å
222	V	38.4	Very low	40.2	Very low	66 Å²	66	108 Å²	108	40%	0.4	56%	0.564	S	S	.	*			trans	-80.4	104.6	171	-179.8	0	0	0	0	106.7	N220 H224	N220-V222 PolarHBondContact O-N 2.99Å; V222-H224 VanDerWaalsContact CG1-CE1 3.43Å; V222-H224 WeakPolarHBondContact CG1-CE1 2.94Å; V222-H224 PolarHBondContact O-N 2.88Å
223	H	37.6	Very low	40.3	Very low	170 Å²	170	104.8 Å²	104.8	79%	0.787	54%	0.543	S	S	*	.			trans	-68.2	100.6	171.5	-78.8	-85.7	0	0	0	108.9	I221 H225	I221-H223 PolarHBondContact O-N 2.95Å; H223-H225 PolarHBondContact O-N 3.48Å
224	H	39.3	Very low	40.9	Very low	105 Å²	105	98.8 Å²	98.8	49%	0.486	51%	0.512	S	S	.	.			trans	-79.4	104.6	170.8	-66.4	-57.6	0	0	0	109.2	V222 Y252	V222-H224 VanDerWaalsContact CG1-CE1 3.43Å; V222-H224 WeakPolarHBondContact CG1-CE1 2.94Å; V222-H224 PolarHBondContact O-N 2.88Å; H224-Y252 AromaticContact CE1-CZ 3.92Å; H224-Y252 PolarHBondContact CE1-OH 3Å; H224-Y252 AromaticContact ND1-CZ 3.55Å; H224-Y252 PolarHBondContact ND1-OH 3.21Å
225	H	41.6	Very low	41.1	Very low	123 Å²	123	99 Å²	99	57%	0.569	50%	0.501	S	S	*	.			trans	-89.2	110.9	167.6	-159.6	-38.9	0	0	0	108.1	H223 D253	H223-H225 PolarHBondContact O-N 3.48Å; H225-D253 IonicContact CG-OD2 3.97Å
226	L	41.1	Very low	41.3	Very low	104 Å²	104	98.1 Å²	98.1	55%	0.545	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.6	166.8	-177.5	62.4	0	0	0	107.2	I228 W250	L226-I228 HydrophobicContact CD2-CD1 4Å; L226-I228 HydrophobicContact CD2-CG1 4.13Å; L226-I228 HydrophobicContact CG-CD1 4.37Å; L226-I228 HydrophobicContact CG-CG1 3.96Å; L226-W250 HydrophobicContact CD1-CB 4.46Å
227	F	38.9	Very low	41.4	Very low	112 Å²	112	96.6 Å²	96.6	49%	0.491	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.2	172	-170.6	-98.9	0	0	0	109	W250 R251	F227-W250 WeakPolarHBondContact O-CA 3Å; F227-R251 PolarHBondContact O-N 2.98Å
228	I	39.8	Very low	41.7	Very low	27 Å²	27	99.3 Å²	99.3	14%	0.138	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127.1	172.3	-48	175.9	0	0	0	106.8	F22 I153 L226 V248 F249	F22-I228 HydrophobicContact CD1-CD1 4.38Å; F22-I228 HydrophobicContact CE1-CD1 3.71Å; F22-I228 HydrophobicContact CE1-CG2 4.16Å; F22-I228 HydrophobicContact CE2-CD1 4.21Å; F22-I228 HydrophobicContact CZ-CD1 3.6Å; F22-I228 HydrophobicContact CZ-CG2 4.48Å; I153-I228 HydrophobicContact CD1-CB 3.99Å; I153-I228 HydrophobicContact CD1-CG2 3.75Å; I153-I228 HydrophobicContact CG1-CB 4.1Å; I153-I228 HydrophobicContact CG1-CG2 4Å; I153-I228 HydrophobicContact CG2-CB 3.7Å; I153-I228 HydrophobicContact CG2-CD1 4.37Å; I153-I228 HydrophobicContact CG2-CG1 4.31Å; L226-I228 HydrophobicContact CD2-CD1 4Å; L226-I228 HydrophobicContact CD2-CG1 4.13Å; L226-I228 HydrophobicContact CG-CD1 4.37Å; L226-I228 HydrophobicContact CG-CG1 3.96Å; I228-V248 HydrophobicContact CG2-CG1 3.67Å; I228-F249 WeakPolarHBondContact CA-O 3.34Å
229	S	41.3	Very low	42.4	Very low	41 Å²	41	96.2 Å²	96.2	29%	0.287	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.6	169.5	169.2	0	0	0	0	107.5	F249	S229-F249 PolarHBondContact N-O 3.03Å; S229-F249 PolarHBondContact O-N 3.47Å
230	S	47	Very low	42.6	Very low	8 Å²	8	95.9 Å²	95.9	6%	0.056	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.9	168.1	88.9	0	0	0	0	112.5	V149 I247	V149-S230 WeakPolarHBondContact CG1-OG 3.31Å; V149-S230 WeakPolarHBondContact CG2-OG 3.32Å; S230-I247 CarbonylContact C-O 3.47Å; S230-I247 WeakPolarHBondContact CA-O 3.01Å; S230-I247 WeakPolarHBondContact CB-O 3.3Å
231	R	43.6	Very low	43.6	Very low	133 Å²	133	91.4 Å²	91.4	50%	0.502	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.2	165.9	-81.5	-173	-174.2	166.2	4.6	107.7	I247	R231-I247 PolarHBondContact N-O 3.17Å; R231-I247 PolarHBondContact O-N 3.01Å
232	F	44.9	Very low	44.5	Very low	14 Å²	14	89.4 Å²	89.4	6%	0.061	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.6	175.7	76.8	-69.5	0	0	0	108.9	F34 V145 V234 I245	F34-F232 HydrophobicContact CZ-CD2 4.41Å; F34-F232 HydrophobicContact CZ-CE2 4.39Å; V145-F232 HydrophobicContact CB-CD1 3.79Å; V145-F232 HydrophobicContact CB-CD2 4.45Å; V145-F232 HydrophobicContact CB-CE1 3.19Å; V145-F232 HydrophobicContact CB-CE2 3.91Å; V145-F232 HydrophobicContact CB-CG 4.4Å; V145-F232 HydrophobicContact CB-CZ 3.24Å; V145-F232 HydrophobicContact CG1-CD1 3.21Å; V145-F232 HydrophobicContact CG1-CD2 4.07Å; V145-F232 HydrophobicContact CG1-CE1 3.22Å; V145-F232 HydrophobicContact CG1-CE2 4.03Å; V145-F232 HydrophobicContact CG1-CG 3.69Å; V145-F232 HydrophobicContact CG1-CZ 3.64Å; V145-F232 HydrophobicContact CG2-CE1 4.08Å; V145-F232 HydrophobicContact CG2-CE2 3.85Å; V145-F232 HydrophobicContact CG2-CZ 3.61Å; F232-V234 HydrophobicContact CD2-CG2 3.93Å; F232-V234 HydrophobicContact CE2-CG2 4.11Å; F232-I245 VanDerWaalsContact CA-O 3.23Å; F232-I245 WeakPolarHBondContact CA-O 3.42Å
233	C	47.1	Very low	45.1	Very low	45 Å²	45	87.7 Å²	87.7	30%	0.304	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.5	171.9	-65.8	0	0	0	0	107.7	I245	C233-I245 PolarHBondContact N-O 3.46Å; C233-I245 PolarHBondContact O-N 2.93Å
234	V	50.8	Low	45.8	Very low	14 Å²	14	80.4 Å²	80.4	9%	0.085	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119	176.6	-176.8	0	0	0	0	108.2	F34 F232 Y236 L241 V244	F34-V234 HydrophobicContact CE1-CG2 4.18Å; F34-V234 HydrophobicContact CZ-CG2 3.98Å; F232-V234 HydrophobicContact CD2-CG2 3.93Å; F232-V234 HydrophobicContact CE2-CG2 4.11Å; V234-Y236 HydrophobicContact CB-CE2 3.92Å; V234-Y236 HydrophobicContact CG1-CD2 3.98Å; V234-Y236 HydrophobicContact CG1-CE1 4.21Å; V234-Y236 HydrophobicContact CG1-CE2 3.39Å; V234-L241 HydrophobicContact CG1-CD2 3.14Å; V234-V244 HydrophobicContact CG1-CG2 4.48Å; V234-V244 HydrophobicContact CG2-CG2 4.43Å
235	Q	50.6	Low	46.7	Very low	109 Å²	109	78 Å²	78	51%	0.509	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122.7	174.7	-169.5	171.6	-8	0	0	109.7	N242 E243	Q235-N242 PolarHBondContact O-N 3.03Å; Q235-E243 HydrophobicContact CB-CB 4.46Å; Q235-E243 PolarHBondContact N-O 2.91Å; Q235-E243 VanDerWaalsContact N-O 3.08Å
236	Y	49.2	Very low	47.5	Very low	119 Å²	119	72.8 Å²	72.8	47%	0.467	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.8	174.9	-65.1	-89.9	0	0	0	109.4	V234 L241	V234-Y236 HydrophobicContact CB-CE2 3.92Å; V234-Y236 HydrophobicContact CG1-CD2 3.98Å; V234-Y236 HydrophobicContact CG1-CE1 4.21Å; V234-Y236 HydrophobicContact CG1-CE2 3.39Å; Y236-L241 HydrophobicContact CD1-CD2 3.9Å; Y236-L241 HydrophobicContact CD1-CG 4.43Å; Y236-L241 HydrophobicContact CE1-CD2 3.25Å; Y236-L241 HydrophobicContact CE1-CG 3.92Å; Y236-L241 HydrophobicContact CE2-CD2 4.43Å
237	E	42.1	Very low	48.2	Very low	127 Å²	127	69.5 Å²	69.5	59%	0.593	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.9	165.5	-166.1	165.4	-170.9	0	0	107.7	C239 V240	E237-C239 PolarHBondContact O-N 3.2Å; E237-V240 PolarHBondContact N-O 3.43Å; E237-V240 PolarHBondContact O-N 3.49Å
238	K	43.7	Very low	49	Very low	198 Å²	198	64.4 Å²	64.4	86%	0.861	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.3	75.8	-179.5	-97.6	-179.7	172	176.6	0	114.5	V240	K238-V240 PolarHBondContact O-N 2.99Å
239	C	49.9	Very low	49.5	Very low	141 Å²	141	66.5 Å²	66.5	95%	0.953	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	9.6	172.9	-56.9	0	0	0	0	116.5	E237	E237-C239 PolarHBondContact O-N 3.2Å
240	V	42.3	Very low	50	Low	90 Å²	90	67.5 Å²	67.5	55%	0.545	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.9	177.9	-178.8	0	0	0	0	108.5	E237 K238 N242	E237-V240 PolarHBondContact N-O 3.43Å; E237-V240 PolarHBondContact O-N 3.49Å; K238-V240 PolarHBondContact O-N 2.99Å; V240-N242 PolarHBondContact O-N 3.01Å
241	L	53.7	Low	49.9	Very low	53 Å²	53	75.2 Å²	75.2	28%	0.277	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	107.6	166.4	-75.7	166.9	0	0	0	107.1	V234 Y236 I278	V234-L241 HydrophobicContact CG1-CD2 3.14Å; Y236-L241 HydrophobicContact CD1-CD2 3.9Å; Y236-L241 HydrophobicContact CD1-CG 4.43Å; Y236-L241 HydrophobicContact CE1-CD2 3.25Å; Y236-L241 HydrophobicContact CE1-CG 3.92Å; Y236-L241 HydrophobicContact CE2-CD2 4.43Å; L241-I278 HydrophobicContact CB-CD1 4.24Å
242	N	51.8	Low	50.1	Low	79 Å²	79	73.4 Å²	73.4	42%	0.422	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-35	-175.9	-160.4	27	0	0	0	111.2	Q235 V240	Q235-N242 PolarHBondContact O-N 3.03Å; V240-N242 PolarHBondContact O-N 3.01Å
243	E	50.1	Low	50.3	Low	29 Å²	29	77.6 Å²	77.6	14%	0.136	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	136.3	-176.3	-163.3	175.6	150.3	0	0	111.7	Q235 I245 K275	Q235-E243 HydrophobicContact CB-CB 4.46Å; Q235-E243 PolarHBondContact N-O 2.91Å; Q235-E243 VanDerWaalsContact N-O 3.08Å; E243-I245 HydrophobicContact CG-CG1 4.07Å; E243-I245 VanDerWaalsContact OE1-CD1 3.32Å; E243-I245 WeakPolarHBondContact OE1-CD1 3.44Å; E243-I245 VanDerWaalsContact OE1-CG1 3.32Å; E243-I245 WeakPolarHBondContact OE1-CG1 3.5Å; E243-K275 WeakPolarHBondContact OE1-CD 3.29Å; E243-K275 WeakPolarHBondContact OE1-CE 3.31Å; E243-K275 WeakPolarHBondContact OE1-CG 3.31Å; E243-K275 IonicContact OE1-NZ 2.68Å; E243-K275 PolarHBondContact OE1-NZ 2.77Å; E243-K275 WeakPolarHBondContact OE2-CE 3.5Å; E243-K275 IonicContact OE2-NZ 2.77Å; E243-K275 PolarHBondContact OE2-NZ 2.93Å
244	V	52.8	Low	50.2	Low	18 Å²	18	77.7 Å²	77.7	11%	0.109	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.1	171.7	179.3	0	0	0	0	108.3	V234 I276 I278	V234-V244 HydrophobicContact CG1-CG2 4.48Å; V234-V244 HydrophobicContact CG2-CG2 4.43Å; V244-I276 PolarHBondContact N-O 3.08Å; V244-I276 PolarHBondContact O-N 3.46Å; V244-I278 HydrophobicContact CG2-CD1 3.75Å
245	I	57.7	Low	50	Low	55 Å²	55	82.2 Å²	82.2	28%	0.282	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	121.4	178.2	-53.7	176.2	0	0	0	108	F232 C233 E243 I247	F232-I245 VanDerWaalsContact CA-O 3.23Å; F232-I245 WeakPolarHBondContact CA-O 3.42Å; C233-I245 PolarHBondContact N-O 3.46Å; C233-I245 PolarHBondContact O-N 2.93Å; E243-I245 HydrophobicContact CG-CG1 4.07Å; E243-I245 VanDerWaalsContact OE1-CD1 3.32Å; E243-I245 WeakPolarHBondContact OE1-CD1 3.44Å; E243-I245 VanDerWaalsContact OE1-CG1 3.32Å; E243-I245 WeakPolarHBondContact OE1-CG1 3.5Å; I245-I247 HydrophobicContact CG2-CD1 4.42Å; I245-I247 HydrophobicContact CG2-CG1 3.92Å
246	L	58.4	Low	49.8	Very low	12 Å²	12	81.7 Å²	81.7	6%	0.063	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.1	172.5	178.6	63.6	0	0	0	109	L26 I27 V248 F274	L26-L246 HydrophobicContact CD2-CD2 3.91Å; L26-L246 HydrophobicContact CG-CD2 4.29Å; I27-L246 HydrophobicContact CG1-CD2 4.15Å; L246-V248 HydrophobicContact CD1-CG2 4.43Å; L246-V248 HydrophobicContact CD2-CG2 4.32Å; L246-V248 HydrophobicContact CG-CG2 4.05Å; L246-F274 VanDerWaalsContact O-O 3.09Å
247	I	56.2	Low	49.8	Very low	36 Å²	36	81.3 Å²	81.3	19%	0.185	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.7	178.5	-52.8	175.2	0	0	0	107.3	S230 R231 I245 F249 F273	S230-I247 CarbonylContact C-O 3.47Å; S230-I247 WeakPolarHBondContact CA-O 3.01Å; S230-I247 WeakPolarHBondContact CB-O 3.3Å; R231-I247 PolarHBondContact N-O 3.17Å; R231-I247 PolarHBondContact O-N 3.01Å; I245-I247 HydrophobicContact CG2-CD1 4.42Å; I245-I247 HydrophobicContact CG2-CG1 3.92Å; I247-F249 HydrophobicContact CB-CE2 4.34Å; I247-F249 HydrophobicContact CG2-CD2 4.12Å; I247-F249 HydrophobicContact CG2-CE1 3.94Å; I247-F249 HydrophobicContact CG2-CE2 3.43Å; I247-F249 VanDerWaalsContact CG2-CE2 3.43Å; I247-F249 HydrophobicContact CG2-CZ 3.33Å; I247-F273 HydrophobicContact CG1-CD1 4.34Å; I247-F273 HydrophobicContact CG2-CD1 3.8Å; I247-F273 HydrophobicContact CG2-CE1 3.76Å
248	V	55.3	Low	49.9	Very low	4 Å²	4	82.1 Å²	82.1	2%	0.024	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.7	176.9	-175.8	0	0	0	0	109.4	L26 I228 L246	L26-V248 HydrophobicContact CD2-CG2 3.93Å; I228-V248 HydrophobicContact CG2-CG1 3.67Å; L246-V248 HydrophobicContact CD1-CG2 4.43Å; L246-V248 HydrophobicContact CD2-CG2 4.32Å; L246-V248 HydrophobicContact CG-CG2 4.05Å
249	F	50.4	Low	50	Low	71 Å²	71	84.2 Å²	84.2	31%	0.311	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.3	172.8	-57	-79.7	0	0	0	109.4	I228 S229 I247	I228-F249 WeakPolarHBondContact CA-O 3.34Å; S229-F249 PolarHBondContact N-O 3.03Å; S229-F249 PolarHBondContact O-N 3.47Å; I247-F249 HydrophobicContact CB-CE2 4.34Å; I247-F249 HydrophobicContact CG2-CD2 4.12Å; I247-F249 HydrophobicContact CG2-CE1 3.94Å; I247-F249 HydrophobicContact CG2-CE2 3.43Å; I247-F249 VanDerWaalsContact CG2-CE2 3.43Å; I247-F249 HydrophobicContact CG2-CZ 3.33Å
250	W	53	Low	49.4	Very low	63 Å²	63	80.4 Å²	80.4	24%	0.239	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.2	161.3	63.4	84.3	0	0	0	110	M19 L226 F227 T270 N272	M19-W250 HydrophobicContact SD-CZ3 4.34Å; L226-W250 HydrophobicContact CD1-CB 4.46Å; F227-W250 WeakPolarHBondContact O-CA 3Å; W250-T270 WeakPolarHBondContact CH2-O 3.4Å; W250-T270 WeakPolarHBondContact CZ2-O 3.34Å; W250-N272 HydrophobicContact CH2-CB 3.47Å; W250-N272 VanDerWaalsContact CH2-CB 3.47Å; W250-N272 WeakPolarHBondContact CH2-ND2 3.43Å; W250-N272 HydrophobicContact CZ3-CB 3.61Å
251	R	43.8	Very low	49	Very low	170 Å²	170	80.6 Å²	80.6	64%	0.642	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	139.2	164.9	-76.7	-172.9	163.8	-169.8	-5.3	109.1	F227	F227-R251 PolarHBondContact O-N 2.98Å
252	Y	49.3	Very low	48	Very low	95 Å²	95	81 Å²	81	37%	0.373	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119	170.4	-160.4	-97.2	0	0	0	107.6	H224 D254 L257	H224-Y252 AromaticContact CE1-CZ 3.92Å; H224-Y252 PolarHBondContact CE1-OH 3Å; H224-Y252 AromaticContact ND1-CZ 3.55Å; H224-Y252 PolarHBondContact ND1-OH 3.21Å; Y252-D254 HydrophobicContact CD1-CB 4.33Å; Y252-D254 VanDerWaalsContact CD1-O 3.25Å; Y252-D254 WeakPolarHBondContact CD1-O 3.25Å; Y252-D254 HydrophobicContact CE1-CB 4.02Å; Y252-D254 WeakPolarHBondContact CE1-O 3.37Å; Y252-D254 PolarHBondContact O-N 3.26Å; Y252-L257 HydrophobicContact CE1-CD1 4.03Å; Y252-L257 WeakPolarHBondContact OH-CD1 3.33Å
253	D	48.1	Very low	47.2	Very low	102 Å²	102	85 Å²	85	55%	0.545	46%	0.462	S	S	.	.	S	Bend	trans	-75.1	-6.8	-172.9	-81.6	-23.6	0	0	0	114.1	H225	H225-D253 IonicContact CG-OD2 3.97Å
254	D	44.2	Very low	46.5	Very low	47 Å²	47	90.6 Å²	90.6	25%	0.251	50%	0.497	S	S	.	.			trans	-123	94.2	-178.7	-156.5	-11.4	0	0	0	114.2	Y252 T256	Y252-D254 HydrophobicContact CD1-CB 4.33Å; Y252-D254 VanDerWaalsContact CD1-O 3.25Å; Y252-D254 WeakPolarHBondContact CD1-O 3.25Å; Y252-D254 HydrophobicContact CE1-CB 4.02Å; Y252-D254 WeakPolarHBondContact CE1-O 3.37Å; Y252-D254 PolarHBondContact O-N 3.26Å; D254-T256 PolarHBondContact O-N 3.44Å; D254-T256 VanDerWaalsContact OD1-CB 3.31Å; D254-T256 WeakPolarHBondContact OD1-CB 3.44Å; D254-T256 WeakPolarHBondContact OD1-CG2 3.22Å; D254-T256 PolarHBondContact OD1-N 3.14Å; D254-T256 VanDerWaalsContact OD1-N 3.1Å; D254-T256 PolarHBondContact OD1-OG1 2.97Å; D254-T256 PolarHBondContact OD2-OG1 2.57Å
255	P	47.4	Very low	45.5	Very low	109 Å²	109	92.5 Å²	92.5	71%	0.708	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-72.5	-2	175.7	28.9	-33	0	0	0	113.4	L257	P255-L257 PolarHBondContact O-N 3.1Å
256	T	47.1	Very low	44.2	Very low	97 Å²	97	97.6 Å²	97.6	60%	0.595	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-74.3	-9.2	-173.6	62.5	0	0	0	0	114.7	D254 F258	D254-T256 PolarHBondContact O-N 3.44Å; D254-T256 VanDerWaalsContact OD1-CB 3.31Å; D254-T256 WeakPolarHBondContact OD1-CB 3.44Å; D254-T256 WeakPolarHBondContact OD1-CG2 3.22Å; D254-T256 PolarHBondContact OD1-N 3.14Å; D254-T256 VanDerWaalsContact OD1-N 3.1Å; D254-T256 PolarHBondContact OD1-OG1 2.97Å; D254-T256 PolarHBondContact OD2-OG1 2.57Å; T256-F258 VanDerWaalsContact C-N 3.29Å; T256-F258 PolarHBondContact O-N 3.3Å
257	L	49.4	Very low	43	Very low	111 Å²	111	104.3 Å²	104.3	58%	0.581	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-72.8	-10.3	-179.3	-91.9	164.6	0	0	0	115.6	Y252 P255	Y252-L257 HydrophobicContact CE1-CD1 4.03Å; Y252-L257 WeakPolarHBondContact OH-CD1 3.33Å; P255-L257 PolarHBondContact O-N 3.1Å
258	F	42.8	Very low	42	Very low	144 Å²	144	108.8 Å²	108.8	63%	0.632	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-107.3	21.6	177.4	-66.2	-75.2	0	0	0	114.4	T256 G260 F267	T256-F258 VanDerWaalsContact C-N 3.29Å; T256-F258 PolarHBondContact O-N 3.3Å; F258-G260 PolarHBondContact O-N 3.26Å; F258-F267 HydrophobicContact CD1-CE2 4.33Å; F258-F267 AromaticContact CD2-CD2 3.96Å; F258-F267 HydrophobicContact CD2-CD2 3.96Å; F258-F267 AromaticContact CD2-CE2 3.84Å; F258-F267 HydrophobicContact CD2-CE2 3.84Å; F258-F267 AromaticContact CE1-CE2 3.91Å; F258-F267 HydrophobicContact CE1-CE2 3.91Å; F258-F267 HydrophobicContact CE1-CZ 4.46Å; F258-F267 AromaticContact CE2-CD2 3.79Å; F258-F267 HydrophobicContact CE2-CD2 3.79Å; F258-F267 AromaticContact CE2-CE2 3.36Å; F258-F267 HydrophobicContact CE2-CE2 3.36Å; F258-F267 AromaticContact CE2-CZ 3.99Å; F258-F267 HydrophobicContact CE2-CZ 3.99Å; F258-F267 HydrophobicContact CG-CE2 4.3Å; F258-F267 HydrophobicContact CZ-CD2 4.3Å; F258-F267 AromaticContact CZ-CE2 3.41Å; F258-F267 HydrophobicContact CZ-CE2 3.41Å; F258-F267 VanDerWaalsContact CZ-CE2 3.41Å; F258-F267 AromaticContact CZ-CZ 3.77Å; F258-F267 HydrophobicContact CZ-CZ 3.77Å
259	R	45.5	Very low	41.2	Very low	242 Å²	242	112 Å²	112	91%	0.913	61%	0.614	S	S	*	*			trans	-80.2	46.9	173.7	-153.2	171.5	-169.1	-114.6	2.5	112.4
260	G	38.8	Very low	40.6	Very low	62 Å²	62	113 Å²	113	64%	0.639	63%	0.626	S	S	*	*	S	Bend	trans	-86.1	117.8	160	0	0	0	0	0	107.8	F258 G262	F258-G260 PolarHBondContact O-N 3.26Å; G260-G262 PolarHBondContact O-N 2.95Å; G260-G262 VanDerWaalsContact O-N 3.08Å
261	G	34	Very low	40	Very low	93 Å²	93	113.4 Å²	113.4	96%	0.959	63%	0.632	S	S	*	*	S	Bend	trans	-50.6	113.5	-170.2	0	0	0	0	0	114
262	G	31.5	Very low	40	Very low	61 Å²	61	108 Å²	108	63%	0.629	62%	0.616	S	S	*	*	S	Bend	trans	143.4	98.1	175.1	0	0	0	0	0	111.1	G260	G260-G262 PolarHBondContact O-N 2.95Å; G260-G262 VanDerWaalsContact O-N 3.08Å
263	N	36	Very low	39.6	Very low	164 Å²	164	107.8 Å²	107.8	88%	0.877	62%	0.617	S	S	*	*			trans	59.1	110	174	-52.6	-23.6	0	0	0	114.7	G265	N263-G265 VanDerWaalsContact C-N 3.26Å; N263-G265 PolarHBondContact O-N 2.97Å
264	V	34.8	Very low	39.5	Very low	146 Å²	146	107.5 Å²	107.5	89%	0.885	61%	0.611	S	S	*	*			trans	-59.8	92.5	166.9	177.5	0	0	0	0	107.5	E266	V264-E266 PolarHBondContact O-N 3.21Å
265	G	32.8	Very low	39.5	Very low	58 Å²	58	112.2 Å²	112.2	60%	0.598	63%	0.63	S	S	*	*			trans	-70.5	108	167.9	0	0	0	0	0	107	N263 F267	N263-G265 VanDerWaalsContact C-N 3.26Å; N263-G265 PolarHBondContact O-N 2.97Å; G265-F267 PolarHBondContact O-N 3.24Å
266	E	29.3	Very low	39.4	Very low	163 Å²	163	109.7 Å²	109.7	76%	0.762	61%	0.609	S	S	*	*			trans	-54.9	106	161.5	-73.3	-177.9	161.7	0	0	107.2	V264 Q268	V264-E266 PolarHBondContact O-N 3.21Å; E266-Q268 VanDerWaalsContact C-N 3.3Å; E266-Q268 PolarHBondContact O-N 3.08Å
267	F	33.8	Very low	39.1	Very low	152 Å²	152	107.6 Å²	107.6	67%	0.667	61%	0.608	S	S	*	*			trans	-66.1	100	161.9	-109.5	-90.5	0	0	0	105.9	F258 G265	F258-F267 HydrophobicContact CD1-CE2 4.33Å; F258-F267 AromaticContact CD2-CD2 3.96Å; F258-F267 HydrophobicContact CD2-CD2 3.96Å; F258-F267 AromaticContact CD2-CE2 3.84Å; F258-F267 HydrophobicContact CD2-CE2 3.84Å; F258-F267 AromaticContact CE1-CE2 3.91Å; F258-F267 HydrophobicContact CE1-CE2 3.91Å; F258-F267 HydrophobicContact CE1-CZ 4.46Å; F258-F267 AromaticContact CE2-CD2 3.79Å; F258-F267 HydrophobicContact CE2-CD2 3.79Å; F258-F267 AromaticContact CE2-CE2 3.36Å; F258-F267 HydrophobicContact CE2-CE2 3.36Å; F258-F267 AromaticContact CE2-CZ 3.99Å; F258-F267 HydrophobicContact CE2-CZ 3.99Å; F258-F267 HydrophobicContact CG-CE2 4.3Å; F258-F267 HydrophobicContact CZ-CD2 4.3Å; F258-F267 AromaticContact CZ-CE2 3.41Å; F258-F267 HydrophobicContact CZ-CE2 3.41Å; F258-F267 VanDerWaalsContact CZ-CE2 3.41Å; F258-F267 AromaticContact CZ-CZ 3.77Å; F258-F267 HydrophobicContact CZ-CZ 3.77Å; G265-F267 PolarHBondContact O-N 3.24Å
268	Q	34.9	Very low	38.5	Very low	130 Å²	130	108.6 Å²	108.6	61%	0.607	61%	0.612	S	S	*	*			trans	-65.3	133.3	165.3	-62.5	-144.8	-2.5	0	0	107	E266 T270	E266-Q268 VanDerWaalsContact C-N 3.3Å; E266-Q268 PolarHBondContact O-N 3.08Å; Q268-T270 PolarHBondContact O-N 3.39Å
269	P	37.5	Very low	38.3	Very low	73 Å²	73	106.9 Å²	106.9	47%	0.474	61%	0.611	S	S	.	*			trans	-53.4	112.2	166.9	-9.6	19.8	0	0	0	106.5	D271	P269-D271 VanDerWaalsContact C-N 3.26Å; P269-D271 PolarHBondContact O-N 3Å
270	T	39.1	Very low	37.9	Very low	92 Å²	92	99.7 Å²	99.7	56%	0.564	60%	0.595	S	S	*	*			trans	-69.9	97.7	163.6	25.2	0	0	0	0	105.1	W250 Q268 N272	W250-T270 WeakPolarHBondContact CH2-O 3.4Å; W250-T270 WeakPolarHBondContact CZ2-O 3.34Å; Q268-T270 PolarHBondContact O-N 3.39Å; T270-N272 PolarHBondContact O-N 3.47Å
271	D	40.7	Very low	37.9	Very low	70 Å²	70	101.8 Å²	101.8	37%	0.374	59%	0.593	S	S	.	*			trans	-66.5	101.9	170.1	-63.7	-38.4	0	0	0	107.1	P269 F273	P269-D271 VanDerWaalsContact C-N 3.26Å; P269-D271 PolarHBondContact O-N 3Å; D271-F273 HydrophobicContact CB-CD2 3.97Å; D271-F273 HydrophobicContact CB-CE1 4.28Å; D271-F273 HydrophobicContact CB-CE2 3.16Å; D271-F273 HydrophobicContact CB-CZ 3.35Å; D271-F273 VanDerWaalsContact O-CD2 3.3Å; D271-F273 WeakPolarHBondContact O-CD2 3.38Å; D271-F273 PolarHBondContact O-N 3.23Å
272	N	42.4	Very low	38.1	Very low	56 Å²	56	102.4 Å²	102.4	30%	0.299	57%	0.571	S	S	.	*			trans	-78.2	114.4	167.8	-70.8	-17.2	0	0	0	107.5	W250 T270 F274	W250-N272 HydrophobicContact CH2-CB 3.47Å; W250-N272 VanDerWaalsContact CH2-CB 3.47Å; W250-N272 WeakPolarHBondContact CH2-ND2 3.43Å; W250-N272 HydrophobicContact CZ3-CB 3.61Å; T270-N272 PolarHBondContact O-N 3.47Å; N272-F274 HydrophobicContact CB-CE2 3.95Å; N272-F274 HydrophobicContact CB-CZ 4.46Å
273	F	41.5	Very low	38.5	Very low	91 Å²	91	104.9 Å²	104.9	40%	0.399	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.9	134.7	170.3	-57.9	-83.9	0	0	0	109.2	L124 I247 D271	L124-F273 HydrophobicContact CD1-CD2 4.07Å; L124-F273 HydrophobicContact CD1-CE1 4.38Å; L124-F273 HydrophobicContact CD1-CE2 3.27Å; L124-F273 HydrophobicContact CD1-CZ 3.47Å; L124-F273 VanDerWaalsContact CD1-CZ 3.47Å; I247-F273 HydrophobicContact CG1-CD1 4.34Å; I247-F273 HydrophobicContact CG2-CD1 3.8Å; I247-F273 HydrophobicContact CG2-CE1 3.76Å; D271-F273 HydrophobicContact CB-CD2 3.97Å; D271-F273 HydrophobicContact CB-CE1 4.28Å; D271-F273 HydrophobicContact CB-CE2 3.16Å; D271-F273 HydrophobicContact CB-CZ 3.35Å; D271-F273 VanDerWaalsContact O-CD2 3.3Å; D271-F273 WeakPolarHBondContact O-CD2 3.38Å; D271-F273 PolarHBondContact O-N 3.23Å
274	F	46.6	Very low	38.7	Very low	97 Å²	97	101 Å²	101	43%	0.425	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	118.5	167.1	-64	-81	0	0	0	108.4	L246 N272	L246-F274 VanDerWaalsContact O-O 3.09Å; N272-F274 HydrophobicContact CB-CE2 3.95Å; N272-F274 HydrophobicContact CB-CZ 4.46Å
275	K	44.5	Very low	39	Very low	146 Å²	146	97.8 Å²	97.8	64%	0.635	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.8	169.6	173.8	170.1	165.4	134.8	0	107.4	E243	E243-K275 WeakPolarHBondContact OE1-CD 3.29Å; E243-K275 WeakPolarHBondContact OE1-CE 3.31Å; E243-K275 WeakPolarHBondContact OE1-CG 3.31Å; E243-K275 IonicContact OE1-NZ 2.68Å; E243-K275 PolarHBondContact OE1-NZ 2.77Å; E243-K275 WeakPolarHBondContact OE2-CE 3.5Å; E243-K275 IonicContact OE2-NZ 2.77Å; E243-K275 PolarHBondContact OE2-NZ 2.93Å
276	I	44.9	Very low	39.4	Very low	55 Å²	55	100.8 Å²	100.8	28%	0.282	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	105.1	173.2	-61.3	169.7	0	0	0	106.9	I27 V244	I27-I276 HydrophobicContact CD1-CD1 3.95Å; I27-I276 HydrophobicContact CG1-CD1 4.03Å; I27-I276 HydrophobicContact CG2-CD1 4.27Å; V244-I276 PolarHBondContact N-O 3.08Å; V244-I276 PolarHBondContact O-N 3.46Å
277	G	40.9	Very low	40.3	Very low	54 Å²	54	95.7 Å²	95.7	56%	0.557	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	136.8	163.5	0	0	0	0	0	109.1
278	I	36.6	Very low	40.9	Very low	132 Å²	132	90.5 Å²	90.5	68%	0.677	48%	0.481	S	S	*	.			trans	-93.2	0	170.8	-60.6	178.8	0	0	0	108.5	L241 V244	L241-I278 HydrophobicContact CB-CD1 4.24Å; V244-I278 HydrophobicContact CG2-CD1 3.75Å

Retrieved 278 of 278 residues in 205.3 ms (Link to these results)

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