A0A087WR86_MOUSE Loading...

Sulfatase 1

AlphaFold DB , UniProt , Accession A0A087WR86, Species MOUSE (Mus musculus, Mouse), Gene Sulf1, Length 372 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	N	53.9	Low	67	Low	104 Å²	104	121.9 Å²	121.9	56%	0.556	64%	0.635	S	S	*	*				0	29.3	0	-81.5	-1.3	0	0	0	114.3	H3 W10 G13	N1-H3 PolarHBondContact O-N 3.34Å; N1-W10 PolarHBondContact ND2-O 3.28Å; N1-G13 PolarHBondContact ND2-O 3.35Å
2	N	58.4	Low	67.4	Low	159 Å²	159	123.3 Å²	123.3	85%	0.85	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	14.5	177.8	-66.1	3.6	0	0	0	113.8	W4	N2-W4 VanDerWaalsContact C-N 3.31Å
3	H	65.3	Low	67.8	Low	141 Å²	141	116.7 Å²	116.7	65%	0.653	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-33.7	-179.6	-179.2	57.7	0	0	0	111.9	N1	N1-H3 PolarHBondContact O-N 3.34Å
4	W	65.5	Low	67.9	Low	95 Å²	95	117.3 Å²	117.3	36%	0.36	64%	0.64	S	S	.	*			trans	-95.2	111.1	-179.4	-47.5	92.1	0	0	0	108.3	N2 T6 F9 F15	N2-W4 VanDerWaalsContact C-N 3.31Å; W4-T6 VanDerWaalsContact C-N 3.35Å; W4-F9 HydrophobicContact CB-CD1 4.3Å; W4-F9 VanDerWaalsContact O-CD1 3.3Å; W4-F9 WeakPolarHBondContact O-CD1 3.35Å; W4-F9 VanDerWaalsContact O-CE1 3.29Å; W4-F9 WeakPolarHBondContact O-CE1 3.22Å; W4-F15 HydrophobicContact CH2-CE1 4.26Å; W4-F15 HydrophobicContact CH2-CZ 4.4Å; W4-F15 HydrophobicContact CZ2-CD1 4.04Å; W4-F15 AromaticContact CZ2-CE1 3.58Å; W4-F15 HydrophobicContact CZ2-CE1 3.58Å; W4-F15 AromaticContact CZ2-CZ 3.94Å; W4-F15 HydrophobicContact CZ2-CZ 3.94Å
5	Q	67.9	Low	67.6	Low	181 Å²	181	115.4 Å²	115.4	85%	0.846	62%	0.624	S	S	*	*	S	Bend	trans	-83.9	-15	177.8	-68.3	-178.5	-6.7	0	0	112.5
6	T	65.9	Low	67.4	Low	111 Å²	111	114.8 Å²	114.8	68%	0.681	63%	0.629	S	S	*	*	S	Bend	trans	-124.1	141.1	-179.7	51.1	0	0	0	0	111.2	W4	W4-T6 VanDerWaalsContact C-N 3.35Å
7	A	71.5	Confident	66.9	Low	74 Å²	74	111.7 Å²	111.7	61%	0.612	62%	0.622	S	S	*	*	S	Bend	trans	-64.8	151.3	177.7	0	0	0	0	0	111.9	F9	A7-F9 HydrophobicContact CB-CD2 4.39Å; A7-F9 HydrophobicContact CB-CE2 4.12Å; A7-F9 HydrophobicContact CB-CZ 4.43Å
8	P	71.8	Confident	66.6	Low	124 Å²	124	111.4 Å²	111.4	81%	0.805	63%	0.628	S	S	*	*	S	Bend	cis	-78.5	133.4	2.4	31	-33.5	0	0	0	112.9
9	F	72.1	Confident	66.2	Low	125 Å²	125	111 Å²	111	55%	0.548	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-75.8	137.2	177.3	-55.7	-68.5	0	0	0	110.9	W4 A7 N11	W4-F9 HydrophobicContact CB-CD1 4.3Å; W4-F9 VanDerWaalsContact O-CD1 3.3Å; W4-F9 WeakPolarHBondContact O-CD1 3.35Å; W4-F9 VanDerWaalsContact O-CE1 3.29Å; W4-F9 WeakPolarHBondContact O-CE1 3.22Å; A7-F9 HydrophobicContact CB-CD2 4.39Å; A7-F9 HydrophobicContact CB-CE2 4.12Å; A7-F9 HydrophobicContact CB-CZ 4.43Å; F9-N11 PolarHBondContact O-N 3.15Å
10	W	72	Confident	65.7	Low	93 Å²	93	110.3 Å²	110.3	35%	0.352	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-71.1	120.5	175.1	-179.2	-97.2	0	0	0	111.8	N1 L12 G13 F15	N1-W10 PolarHBondContact ND2-O 3.28Å; W10-L12 HydrophobicContact CH2-CB 4.13Å; W10-L12 HydrophobicContact CH2-CD1 4.19Å; W10-L12 HydrophobicContact CZ2-CB 3.73Å; W10-L12 HydrophobicContact CZ3-CD1 4.42Å; W10-G13 PolarHBondContact NE1-O 3.48Å; W10-F15 HydrophobicContact CD2-CD2 4.42Å; W10-F15 HydrophobicContact CG-CB 4.44Å; W10-F15 HydrophobicContact CZ2-CD2 4.34Å
11	N	72.9	Confident	65.6	Low	134 Å²	134	107.7 Å²	107.7	72%	0.717	62%	0.619	S	S	*	*			trans	-122.3	2.4	-176.5	62.4	-7.9	0	0	0	114.7	F9 G13	F9-N11 PolarHBondContact O-N 3.15Å; N11-G13 VanDerWaalsContact C-N 3.34Å; N11-G13 PolarHBondContact O-N 2.84Å
12	L	71.6	Confident	65.9	Low	139 Å²	139	108.5 Å²	108.5	73%	0.728	62%	0.623	S	S	*	*	S	Bend	trans	-92.6	28.9	-174.6	-62.8	174.1	0	0	0	114.4	W10	W10-L12 HydrophobicContact CH2-CB 4.13Å; W10-L12 HydrophobicContact CH2-CD1 4.19Å; W10-L12 HydrophobicContact CZ2-CB 3.73Å; W10-L12 HydrophobicContact CZ3-CD1 4.42Å
13	G	72.5	Confident	66.3	Low	37 Å²	37	105.7 Å²	105.7	38%	0.381	61%	0.608	S	S	.	*	S	Bend	trans	107.1	-168.1	175.4	0	0	0	0	0	115.2	N1 W10 N11 F15	N1-G13 PolarHBondContact ND2-O 3.35Å; W10-G13 PolarHBondContact NE1-O 3.48Å; N11-G13 VanDerWaalsContact C-N 3.34Å; N11-G13 PolarHBondContact O-N 2.84Å; G13-F15 PolarHBondContact O-N 3.31Å
14	S	69.3	Low	66.7	Low	125 Å²	125	104.4 Å²	104.4	87%	0.874	61%	0.606	S	S	*	*			trans	-63.4	117.4	177.4	55.7	0	0	0	0	110.3
15	F	64.1	Low	67.6	Low	89 Å²	89	102.3 Å²	102.3	39%	0.39	60%	0.604	S	S	.	*			trans	-94.9	129.8	178.8	178.5	-106.5	0	0	0	110.2	W4 W10 G13 A17	W4-F15 HydrophobicContact CH2-CE1 4.26Å; W4-F15 HydrophobicContact CH2-CZ 4.4Å; W4-F15 HydrophobicContact CZ2-CD1 4.04Å; W4-F15 AromaticContact CZ2-CE1 3.58Å; W4-F15 HydrophobicContact CZ2-CE1 3.58Å; W4-F15 AromaticContact CZ2-CZ 3.94Å; W4-F15 HydrophobicContact CZ2-CZ 3.94Å; W10-F15 HydrophobicContact CD2-CD2 4.42Å; W10-F15 HydrophobicContact CG-CB 4.44Å; W10-F15 HydrophobicContact CZ2-CD2 4.34Å; G13-F15 PolarHBondContact O-N 3.31Å; F15-A17 HydrophobicContact CD1-CB 4.17Å; F15-A17 HydrophobicContact CE1-CB 3.19Å; F15-A17 HydrophobicContact CZ-CB 3.44Å; F15-A17 VanDerWaalsContact CZ-CB 3.44Å
16	C	64.2	Low	68.7	Low	106 Å²	106	100 Å²	100	72%	0.716	59%	0.589	S	S	*	*			trans	-117.4	105.7	164.6	-175.1	0	0	0	0	107.2	C18	C16-C18 PolarHBondContact O-N 3.24Å
17	A	58.1	Low	70	Confident	62 Å²	62	99.4 Å²	99.4	51%	0.512	57%	0.574	S	S	.	*			trans	-84.7	101.6	162.9	0	0	0	0	0	108	F15	F15-A17 HydrophobicContact CD1-CB 4.17Å; F15-A17 HydrophobicContact CE1-CB 3.19Å; F15-A17 HydrophobicContact CZ-CB 3.44Å; F15-A17 VanDerWaalsContact CZ-CB 3.44Å
18	C	61.2	Low	71.1	Confident	106 Å²	106	98.3 Å²	98.3	72%	0.716	56%	0.561	S	S	*	*			trans	-92.1	94.5	148	-63.9	0	0	0	0	105.2	C16 S20	C16-C18 PolarHBondContact O-N 3.24Å; C18-S20 PolarHBondContact O-N 3.18Å
19	T	59.1	Low	72.1	Confident	104 Å²	104	93.2 Å²	93.2	64%	0.638	53%	0.527	S	S	*	.			trans	-49.1	137.3	153.7	48.4	0	0	0	0	106.2	S21	T19-S21 PolarHBondContact O-N 2.8Å; T19-S21 PolarHBondContact O-OG 3.18Å
20	S	57.6	Low	73.1	Confident	96 Å²	96	92 Å²	92	67%	0.671	52%	0.519	S	S	*	.			trans	-54.3	88.1	178.6	173.4	0	0	0	0	110.2	C18 N22	C18-S20 PolarHBondContact O-N 3.18Å; S20-N22 PolarHBondContact O-N 3.26Å
21	S	62.1	Low	74.1	Confident	57 Å²	57	89.4 Å²	89.4	40%	0.399	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-78	-8.3	-172	-62.3	0	0	0	0	111.3	T19 N23 N24 T25	T19-S21 PolarHBondContact O-N 2.8Å; T19-S21 PolarHBondContact O-OG 3.18Å; S21-N23 VanDerWaalsContact C-N 3.27Å; S21-N23 PolarHBondContact O-N 2.6Å; S21-N24 CarbonylContact O-C 3.34Å; S21-N24 PolarHBondContact O-N 3.05Å; S21-T25 WeakPolarHBondContact O-CB 3.37Å; S21-T25 PolarHBondContact O-N 3.29Å; S21-T25 PolarHBondContact O-OG1 3.17Å
22	N	61.3	Low	75	Confident	120 Å²	120	85.7 Å²	85.7	64%	0.642	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-62.5	-34.4	-176.7	-65.5	-4.1	0	0	0	112.1	S20 N24	S20-N22 PolarHBondContact O-N 3.26Å; N22-N24 VanDerWaalsContact C-N 3.29Å
23	N	66	Low	75.8	Confident	100 Å²	100	83.7 Å²	83.7	54%	0.535	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-82.1	-6.3	175.7	-161.1	22.1	0	0	0	113.6	S21	S21-N23 VanDerWaalsContact C-N 3.27Å; S21-N23 PolarHBondContact O-N 2.6Å
24	N	73.7	Confident	76.6	Confident	114 Å²	114	91.1 Å²	91.1	61%	0.61	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-118.9	9.7	178.3	-64.2	-21.8	0	0	0	112	S21 N22	S21-N24 CarbonylContact O-C 3.34Å; S21-N24 PolarHBondContact O-N 3.05Å; N22-N24 VanDerWaalsContact C-N 3.29Å
25	T	84.8	Confident	77.4	Confident	52 Å²	52	90 Å²	90	32%	0.319	50%	0.499	S	S	.	.			trans	-95.3	120.4	178.1	-61.1	0	0	0	0	108.4	S21 F43 A44	S21-T25 WeakPolarHBondContact O-CB 3.37Å; S21-T25 PolarHBondContact O-N 3.29Å; S21-T25 PolarHBondContact O-OG1 3.17Å; T25-F43 WeakPolarHBondContact O-CA 2.9Å; T25-A44 HydrophobicContact CG2-CB 4.39Å; T25-A44 PolarHBondContact O-N 3.06Å
26	Y	91.8	Very high	78.6	Confident	133 Å²	133	90.7 Å²	90.7	52%	0.522	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.4	179.7	60.5	-94.5	0	0	0	111.1	C28 E42 F43	Y26-C28 WeakPolarHBondContact CD2-SG 3.33Å; Y26-C28 WeakPolarHBondContact CE2-SG 3.5Å; Y26-E42 CarbonylContact C-O 3.58Å; Y26-E42 VanDerWaalsContact CA-O 3.29Å; Y26-E42 WeakPolarHBondContact CA-O 3.4Å; Y26-F43 HydrophobicContact CD1-CD1 4.46Å; Y26-F43 AromaticContact CD1-CE1 3.89Å; Y26-F43 HydrophobicContact CD1-CE1 3.89Å; Y26-F43 HydrophobicContact CD1-CZ 4.11Å; Y26-F43 HydrophobicContact CG-CE1 4.32Å; Y26-F43 HydrophobicContact CG-CZ 4.32Å
27	W	92.9	Very high	80	Confident	98 Å²	98	87.2 Å²	87.2	37%	0.371	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.5	169	-61.1	-82.6	0	0	0	108.7	C41 E42 A44 L79	W27-C41 CarbonylContact O-C 3.58Å; W27-C41 WeakPolarHBondContact O-CA 3.34Å; W27-E42 PolarHBondContact N-O 2.86Å; W27-E42 PolarHBondContact O-N 3.37Å; W27-A44 HydrophobicContact CH2-CB 4.42Å; W27-A44 HydrophobicContact CZ3-CB 4.22Å; W27-L79 HydrophobicContact CB-CD1 3.94Å; W27-L79 HydrophobicContact CB-CD2 4.06Å; W27-L79 HydrophobicContact CB-CG 4.21Å
28	C	94.5	Very high	81.8	Confident	51 Å²	51	84.9 Å²	84.9	35%	0.345	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.7	179.7	-58.5	0	0	0	0	112.4	Y26 L39 F40 C41	Y26-C28 WeakPolarHBondContact CD2-SG 3.33Å; Y26-C28 WeakPolarHBondContact CE2-SG 3.5Å; C28-L39 HydrophobicContact CB-CD1 3.78Å; C28-F40 CarbonylContact C-O 3.45Å; C28-F40 WeakPolarHBondContact CA-O 3.35Å; C28-C41 HydrophobicContact CB-CB 4.13Å; C28-C41 WeakPolarHBondContact CB-SG 3.27Å; C28-C41 WeakPolarHBondContact SG-CB 3.21Å; C28-C41 CovalentContact SG-SG 2.04Å; C28-C41 PolarHBondContact SG-SG 2.98Å
29	L	93	Very high	83.5	Confident	17 Å²	17	80.9 Å²	80.9	9%	0.089	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.4	167.5	-179.9	60.3	0	0	0	108.8	F40 L75 Q78 L79 L82	L29-F40 HydrophobicContact CB-CD1 4.47Å; L29-F40 PolarHBondContact N-O 3.41Å; L29-F40 PolarHBondContact O-N 3.1Å; L29-L75 HydrophobicContact CD2-CB 4.5Å; L29-L75 HydrophobicContact CD2-CD2 3.79Å; L29-Q78 HydrophobicContact CD2-CB 3.99Å; L29-L79 HydrophobicContact CB-CD1 4.16Å; L29-L82 HydrophobicContact CD1-CD1 3.49Å; L29-L82 VanDerWaalsContact CD1-CD1 3.49Å
30	R	93.4	Very high	85.2	Confident	100 Å²	100	76 Å²	76	38%	0.377	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.5	174.1	-178.4	63.3	173.6	105.1	3	109.4	V32 N37 F38 L39	R30-V32 HydrophobicContact CG-CG2 4.33Å; R30-N37 PolarHBondContact NH1-OD1 3.19Å; R30-N37 PolarHBondContact NH2-OD1 3.24Å; R30-F38 WeakPolarHBondContact CD-O 3.36Å; R30-F38 VanDerWaalsContact NH1-N 3.12Å; R30-F38 PolarHBondContact NH1-O 2.66Å; R30-L39 HydrophobicContact CB-CD1 4.08Å
31	T	92.1	Very high	87	Confident	38 Å²	38	71.7 Å²	71.7	23%	0.233	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.1	173.1	-56.4	0	0	0	0	109.3	H36 N37 F38	T31-H36 HydrophobicContact CG2-CB 4.4Å; T31-N37 WeakPolarHBondContact O-CA 3.28Å; T31-F38 HydrophobicContact CG2-CE1 4.13Å; T31-F38 HydrophobicContact CG2-CZ 4.2Å; T31-F38 PolarHBondContact N-O 2.88Å; T31-F38 PolarHBondContact O-N 2.94Å; T31-F38 WeakPolarHBondContact OG1-CZ 3.49Å
32	V	92.8	Very high	88.5	Confident	56 Å²	56	69.2 Å²	69.2	34%	0.339	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.7	166.5	-174.8	0	0	0	0	105.9	R30 H36 W237	R30-V32 HydrophobicContact CG-CG2 4.33Å; V32-H36 CarbonylContact C-O 3.44Å; V32-W237 HydrophobicContact CB-CH2 3.64Å; V32-W237 HydrophobicContact CB-CZ2 3.54Å; V32-W237 HydrophobicContact CG1-CH2 4.43Å; V32-W237 HydrophobicContact CG1-CZ2 3.83Å; V32-W237 WeakPolarHBondContact O-CH2 3.49Å; V32-W237 WeakPolarHBondContact O-CZ2 3.45Å
33	N	88.1	Confident	90	Very high	96 Å²	96	64.9 Å²	64.9	51%	0.513	32%	0.324	S	S	.	.			trans	-153.9	170.7	174.5	-162.4	-9.3	0	0	0	106.8	T35 H36	N33-T35 PolarHBondContact O-N 2.72Å; N33-T35 VanDerWaalsContact O-N 3.17Å; N33-H36 PolarHBondContact N-O 3.06Å
34	E	87.9	Confident	91	Very high	193 Å²	193	62.6 Å²	62.6	90%	0.902	32%	0.319	S	S	*	.	S	Bend	trans	-56.7	-32.1	177	-62.5	-178	175	0	0	112.3
35	T	86.4	Confident	91.6	Very high	103 Å²	103	61 Å²	61	63%	0.632	31%	0.313	S	S	*	.	S	Bend	trans	-107	-24.7	-174.8	52.1	0	0	0	0	114.1	N33	N33-T35 PolarHBondContact O-N 2.72Å; N33-T35 VanDerWaalsContact O-N 3.17Å
36	H	89.8	Confident	91.6	Very high	102 Å²	102	59.8 Å²	59.8	47%	0.472	31%	0.311	S	S	.	.			trans	-130.1	124.8	-171.4	-68.1	85.6	0	0	0	110.2	T31 V32 N33 F38	T31-H36 HydrophobicContact CG2-CB 4.4Å; V32-H36 CarbonylContact C-O 3.44Å; N33-H36 PolarHBondContact N-O 3.06Å; H36-F38 HydrophobicContact CB-CD1 4.02Å; H36-F38 HydrophobicContact CB-CE1 3.88Å
37	N	94.6	Very high	91.5	Very high	34 Å²	34	58.7 Å²	58.7	18%	0.182	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	78.4	-178.1	-172.7	20.5	0	0	0	109	R30 T31 M53 N54	R30-N37 PolarHBondContact NH1-OD1 3.19Å; R30-N37 PolarHBondContact NH2-OD1 3.24Å; T31-N37 WeakPolarHBondContact O-CA 3.28Å; N37-M53 WeakPolarHBondContact O-CA 3.22Å; N37-M53 VanDerWaalsContact O-CB 3.31Å; N37-M53 WeakPolarHBondContact O-CB 3.26Å; N37-M53 PolarHBondContact O-N 3.16Å; N37-N54 WeakPolarHBondContact CB-ND2 3.41Å; N37-N54 VanDerWaalsContact CB-OD1 3.26Å; N37-N54 WeakPolarHBondContact CB-OD1 3.33Å; N37-N54 PolarHBondContact ND2-OD1 3.17Å
38	F	95.5	Very high	91.6	Very high	13 Å²	13	55.4 Å²	55.4	6%	0.057	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	161.1	-175.7	65.2	-97.3	0	0	0	112.4	R30 T31 H36 F40 Y50 F51 L75	R30-F38 WeakPolarHBondContact CD-O 3.36Å; R30-F38 VanDerWaalsContact NH1-N 3.12Å; R30-F38 PolarHBondContact NH1-O 2.66Å; T31-F38 HydrophobicContact CG2-CE1 4.13Å; T31-F38 HydrophobicContact CG2-CZ 4.2Å; T31-F38 PolarHBondContact N-O 2.88Å; T31-F38 PolarHBondContact O-N 2.94Å; T31-F38 WeakPolarHBondContact OG1-CZ 3.49Å; H36-F38 HydrophobicContact CB-CD1 4.02Å; H36-F38 HydrophobicContact CB-CE1 3.88Å; F38-F40 HydrophobicContact CD2-CB 4.42Å; F38-F40 HydrophobicContact CE2-CB 4.44Å; F38-Y50 HydrophobicContact CB-CE1 4.06Å; F38-Y50 HydrophobicContact CB-CE2 3.9Å; F38-Y50 VanDerWaalsContact CB-CZ 3.49Å; F38-Y50 VanDerWaalsContact CB-OH 3.27Å; F38-Y50 WeakPolarHBondContact CB-OH 3.3Å; F38-Y50 HydrophobicContact CD1-CE2 4.37Å; F38-Y50 WeakPolarHBondContact CD1-OH 3.49Å; F38-Y50 HydrophobicContact CD2-CD2 4.26Å; F38-Y50 AromaticContact CD2-CE2 3.46Å; F38-Y50 HydrophobicContact CD2-CE2 3.46Å; F38-Y50 VanDerWaalsContact CD2-CE2 3.46Å; F38-Y50 AromaticContact CD2-CZ 3.94Å; F38-Y50 HydrophobicContact CE2-CE2 4.09Å; F38-Y50 AromaticContact CG-CE2 3.65Å; F38-Y50 HydrophobicContact CG-CE2 3.65Å; F38-Y50 AromaticContact CG-CZ 3.6Å; F38-Y50 WeakPolarHBondContact CG-OH 3.49Å; F38-F51 CarbonylContact C-O 3.51Å; F38-F51 WeakPolarHBondContact CA-O 3.19Å; F38-F51 WeakPolarHBondContact CB-O 3.35Å; F38-L75 HydrophobicContact CE2-CD1 3.92Å; F38-L75 HydrophobicContact CE2-CD2 3.65Å; F38-L75 HydrophobicContact CE2-CG 4.47Å; F38-L75 HydrophobicContact CZ-CD1 4.33Å; F38-L75 HydrophobicContact CZ-CD2 3.61Å
39	L	95.9	Very high	91.6	Very high	22 Å²	22	55.1 Å²	55.1	12%	0.115	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123	170.9	178.3	68.4	0	0	0	108.5	C28 R30 Y50 F51 M53 Q59	C28-L39 HydrophobicContact CB-CD1 3.78Å; R30-L39 HydrophobicContact CB-CD1 4.08Å; L39-Y50 WeakPolarHBondContact O-CA 3.32Å; L39-F51 HydrophobicContact CB-CB 4.48Å; L39-F51 HydrophobicContact CD2-CD2 4.37Å; L39-F51 PolarHBondContact N-O 2.7Å; L39-F51 PolarHBondContact O-N 3.29Å; L39-M53 HydrophobicContact CB-CG 4.43Å; L39-M53 HydrophobicContact CB-SD 4.22Å; L39-Q59 HydrophobicContact CD2-CG 4.48Å
40	F	96.1	Very high	91.8	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.009	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.9	175	170.9	-108.1	0	0	0	109.2	C28 L29 F38 L48 E49 Y50 L72 L75 L79	C28-F40 CarbonylContact C-O 3.45Å; C28-F40 WeakPolarHBondContact CA-O 3.35Å; L29-F40 HydrophobicContact CB-CD1 4.47Å; L29-F40 PolarHBondContact N-O 3.41Å; L29-F40 PolarHBondContact O-N 3.1Å; F38-F40 HydrophobicContact CD2-CB 4.42Å; F38-F40 HydrophobicContact CE2-CB 4.44Å; F40-L48 HydrophobicContact CE2-CD2 4.37Å; F40-L48 HydrophobicContact CZ-CD2 4.1Å; F40-E49 CarbonylContact C-O 3.58Å; F40-E49 WeakPolarHBondContact CA-O 3.31Å; F40-E49 WeakPolarHBondContact CD2-O 3.47Å; F40-Y50 HydrophobicContact CB-CD2 4.2Å; F40-Y50 HydrophobicContact CD2-CD2 4.26Å; F40-L72 HydrophobicContact CD2-CD2 4.16Å; F40-L72 HydrophobicContact CE2-CD2 3.86Å; F40-L75 HydrophobicContact CB-CD1 4.15Å; F40-L75 HydrophobicContact CD1-CB 3.74Å; F40-L75 HydrophobicContact CD2-CD1 4.38Å; F40-L75 HydrophobicContact CE1-CB 3.95Å; F40-L75 HydrophobicContact CG-CB 4.14Å; F40-L75 HydrophobicContact CG-CD1 4.1Å; F40-L79 HydrophobicContact CD1-CD2 4.44Å; F40-L79 HydrophobicContact CE1-CD2 4.12Å
41	C	95.1	Very high	91.9	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.027	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	142.1	-179.9	-59.5	0	0	0	0	111.6	W27 C28 E49	W27-C41 CarbonylContact O-C 3.58Å; W27-C41 WeakPolarHBondContact O-CA 3.34Å; C28-C41 HydrophobicContact CB-CB 4.13Å; C28-C41 WeakPolarHBondContact CB-SG 3.27Å; C28-C41 WeakPolarHBondContact SG-CB 3.21Å; C28-C41 CovalentContact SG-SG 2.04Å; C28-C41 PolarHBondContact SG-SG 2.98Å; C41-E49 HydrophobicContact CB-CB 4.33Å; C41-E49 PolarHBondContact N-O 2.75Å; C41-E49 PolarHBondContact O-N 3.32Å
42	E	93.8	Very high	92	Very high	5 Å²	5	52 Å²	52	2%	0.023	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120.6	174.2	177.2	164.5	-165.7	0	0	110.1	Y26 W27 L48 H76 L79 Y150	Y26-E42 CarbonylContact C-O 3.58Å; Y26-E42 VanDerWaalsContact CA-O 3.29Å; Y26-E42 WeakPolarHBondContact CA-O 3.4Å; W27-E42 PolarHBondContact N-O 2.86Å; W27-E42 PolarHBondContact O-N 3.37Å; E42-L48 HydrophobicContact CB-CD2 3.8Å; E42-L48 HydrophobicContact CG-CD2 3.66Å; E42-H76 IonicContact OE1-ND1 2.75Å; E42-H76 IonicContact OE2-CE1 3.42Å; E42-H76 PolarHBondContact OE2-CE1 2.93Å; E42-H76 IonicContact OE2-CG 3.94Å; E42-H76 IonicContact OE2-ND1 3.92Å; E42-H76 PolarHBondContact OE2-ND1 3.33Å; E42-L79 HydrophobicContact CB-CD2 3.89Å; E42-Y150 PolarHBondContact OE1-OH 3.46Å; E42-Y150 PolarHBondContact OE2-OH 2.79Å
43	F	91.1	Very high	92.1	Very high	29 Å²	29	50.8 Å²	50.8	13%	0.127	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	151.4	175.8	-73	-106.6	0	0	0	110.2	T25 Y26 T45 G46 F47 E49	T25-F43 WeakPolarHBondContact O-CA 2.9Å; Y26-F43 HydrophobicContact CD1-CD1 4.46Å; Y26-F43 AromaticContact CD1-CE1 3.89Å; Y26-F43 HydrophobicContact CD1-CE1 3.89Å; Y26-F43 HydrophobicContact CD1-CZ 4.11Å; Y26-F43 HydrophobicContact CG-CE1 4.32Å; Y26-F43 HydrophobicContact CG-CZ 4.32Å; F43-T45 WeakPolarHBondContact CB-OG1 2.96Å; F43-T45 PolarHBondContact O-N 3.35Å; F43-G46 PolarHBondContact O-N 2.82Å; F43-F47 HydrophobicContact CB-CB 4.13Å; F43-F47 HydrophobicContact CD2-CB 4.28Å; F43-F47 AromaticContact CD2-CD1 3.83Å; F43-F47 HydrophobicContact CD2-CD1 3.83Å; F43-F47 WeakPolarHBondContact CD2-O 3.32Å; F43-F47 HydrophobicContact CE2-CD1 4.01Å; F43-F47 HydrophobicContact CG-CB 4.36Å; F43-F47 HydrophobicContact CG-CD1 4.48Å; F43-F47 PolarHBondContact N-O 3.04Å; F43-E49 HydrophobicContact CE2-CG 3.9Å; F43-E49 WeakPolarHBondContact CE2-OE2 3.35Å
44	A	86.9	Confident	92.4	Very high	52 Å²	52	51.1 Å²	51.1	43%	0.43	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.7	173	0	0	0	0	0	112.8	T25 W27 G46	T25-A44 HydrophobicContact CG2-CB 4.39Å; T25-A44 PolarHBondContact O-N 3.06Å; W27-A44 HydrophobicContact CH2-CB 4.42Å; W27-A44 HydrophobicContact CZ3-CB 4.22Å; A44-G46 VanDerWaalsContact C-N 3.29Å
45	T	86.4	Confident	92.6	Very high	80 Å²	80	47 Å²	47	49%	0.491	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.9	173.2	56.6	0	0	0	0	113.9	F43	F43-T45 WeakPolarHBondContact CB-OG1 2.96Å; F43-T45 PolarHBondContact O-N 3.35Å
46	G	86.1	Confident	93	Very high	27 Å²	27	43 Å²	43	28%	0.278	24%	0.235	S	C	.	.	S	Bend	trans	85.7	7.4	-173.7	0	0	0	0	0	114.2	F43 A44	F43-G46 PolarHBondContact O-N 2.82Å; A44-G46 VanDerWaalsContact C-N 3.29Å
47	F	90.1	Very high	93.1	Very high	110 Å²	110	41.4 Å²	41.4	48%	0.482	23%	0.234	S	C	.	.			trans	-71.4	136.7	169.3	-175.4	-111.1	0	0	0	110.1	F43 E49	F43-F47 HydrophobicContact CB-CB 4.13Å; F43-F47 HydrophobicContact CD2-CB 4.28Å; F43-F47 AromaticContact CD2-CD1 3.83Å; F43-F47 HydrophobicContact CD2-CD1 3.83Å; F43-F47 WeakPolarHBondContact CD2-O 3.32Å; F43-F47 HydrophobicContact CE2-CD1 4.01Å; F43-F47 HydrophobicContact CG-CB 4.36Å; F43-F47 HydrophobicContact CG-CD1 4.48Å; F43-F47 PolarHBondContact N-O 3.04Å; F47-E49 HydrophobicContact CD1-CG 3.87Å; F47-E49 HydrophobicContact CE1-CG 3.42Å; F47-E49 VanDerWaalsContact CE1-CG 3.42Å; F47-E49 WeakPolarHBondContact CE1-OE1 3.45Å; F47-E49 HydrophobicContact CZ-CG 4.29Å
48	L	94	Very high	93.1	Very high	29 Å²	29	48.7 Å²	48.7	15%	0.152	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.3	-176.1	-59.4	-178.7	0	0	0	110.4	F40 E42 N62 V64 F158	F40-L48 HydrophobicContact CE2-CD2 4.37Å; F40-L48 HydrophobicContact CZ-CD2 4.1Å; E42-L48 HydrophobicContact CB-CD2 3.8Å; E42-L48 HydrophobicContact CG-CD2 3.66Å; L48-N62 PolarHBondContact O-ND2 3.25Å; L48-V64 HydrophobicContact CB-CG2 3.87Å; L48-F158 HydrophobicContact CD1-CE1 4.4Å; L48-F158 HydrophobicContact CD1-CE2 4.27Å; L48-F158 HydrophobicContact CD1-CZ 3.62Å
49	E	94.9	Very high	93.1	Very high	46 Å²	46	52.1 Å²	52.1	22%	0.215	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.7	173.8	-57.9	-171.5	136.3	0	0	110.8	F40 C41 F43 F47 F51 N62	F40-E49 CarbonylContact C-O 3.58Å; F40-E49 WeakPolarHBondContact CA-O 3.31Å; F40-E49 WeakPolarHBondContact CD2-O 3.47Å; C41-E49 HydrophobicContact CB-CB 4.33Å; C41-E49 PolarHBondContact N-O 2.75Å; C41-E49 PolarHBondContact O-N 3.32Å; F43-E49 HydrophobicContact CE2-CG 3.9Å; F43-E49 WeakPolarHBondContact CE2-OE2 3.35Å; F47-E49 HydrophobicContact CD1-CG 3.87Å; F47-E49 HydrophobicContact CE1-CG 3.42Å; F47-E49 VanDerWaalsContact CE1-CG 3.42Å; F47-E49 WeakPolarHBondContact CE1-OE1 3.45Å; F47-E49 HydrophobicContact CZ-CG 4.29Å; E49-F51 HydrophobicContact CB-CD2 4.45Å; E49-F51 HydrophobicContact CB-CE2 3.67Å; E49-F51 HydrophobicContact CB-CZ 4.05Å; E49-F51 HydrophobicContact CG-CE2 4.43Å; E49-F51 HydrophobicContact CG-CZ 4.47Å; E49-N62 WeakPolarHBondContact CA-OD1 3.4Å
50	Y	96.6	Very high	93	Very high	28 Å²	28	57.7 Å²	57.7	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	128.7	171.9	-175.3	-83.3	0	0	0	108.8	F38 L39 F40 D52 N62 T63 V67 L75	F38-Y50 HydrophobicContact CB-CE1 4.06Å; F38-Y50 HydrophobicContact CB-CE2 3.9Å; F38-Y50 VanDerWaalsContact CB-CZ 3.49Å; F38-Y50 VanDerWaalsContact CB-OH 3.27Å; F38-Y50 WeakPolarHBondContact CB-OH 3.3Å; F38-Y50 HydrophobicContact CD1-CE2 4.37Å; F38-Y50 WeakPolarHBondContact CD1-OH 3.49Å; F38-Y50 HydrophobicContact CD2-CD2 4.26Å; F38-Y50 AromaticContact CD2-CE2 3.46Å; F38-Y50 HydrophobicContact CD2-CE2 3.46Å; F38-Y50 VanDerWaalsContact CD2-CE2 3.46Å; F38-Y50 AromaticContact CD2-CZ 3.94Å; F38-Y50 HydrophobicContact CE2-CE2 4.09Å; F38-Y50 AromaticContact CG-CE2 3.65Å; F38-Y50 HydrophobicContact CG-CE2 3.65Å; F38-Y50 AromaticContact CG-CZ 3.6Å; F38-Y50 WeakPolarHBondContact CG-OH 3.49Å; L39-Y50 WeakPolarHBondContact O-CA 3.32Å; F40-Y50 HydrophobicContact CB-CD2 4.2Å; F40-Y50 HydrophobicContact CD2-CD2 4.26Å; Y50-D52 HydrophobicContact CE1-CB 4.44Å; Y50-N62 PolarHBondContact N-OD1 2.83Å; Y50-N62 VanDerWaalsContact N-OD1 3.13Å; Y50-T63 PolarHBondContact O-N 2.8Å; Y50-T63 PolarHBondContact O-OG1 3.16Å; Y50-V67 HydrophobicContact CD1-CG2 3.5Å; Y50-V67 HydrophobicContact CD2-CG2 3.99Å; Y50-V67 HydrophobicContact CE1-CG2 3.67Å; Y50-V67 HydrophobicContact CE2-CG2 4.14Å; Y50-V67 HydrophobicContact CG-CG2 3.66Å; Y50-L75 HydrophobicContact CD2-CD1 4.28Å; Y50-L75 HydrophobicContact CE2-CD1 4.02Å
51	F	96.7	Very high	92.9	Very high	11 Å²	11	61.6 Å²	61.6	5%	0.048	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121	177.7	-56.1	-77.3	0	0	0	109.3	F38 L39 E49 M53 Q59 T61 N62	F38-F51 CarbonylContact C-O 3.51Å; F38-F51 WeakPolarHBondContact CA-O 3.19Å; F38-F51 WeakPolarHBondContact CB-O 3.35Å; L39-F51 HydrophobicContact CB-CB 4.48Å; L39-F51 HydrophobicContact CD2-CD2 4.37Å; L39-F51 PolarHBondContact N-O 2.7Å; L39-F51 PolarHBondContact O-N 3.29Å; E49-F51 HydrophobicContact CB-CD2 4.45Å; E49-F51 HydrophobicContact CB-CE2 3.67Å; E49-F51 HydrophobicContact CB-CZ 4.05Å; E49-F51 HydrophobicContact CG-CE2 4.43Å; E49-F51 HydrophobicContact CG-CZ 4.47Å; F51-M53 HydrophobicContact CB-SD 4.39Å; F51-M53 PolarHBondContact O-N 2.76Å; F51-Q59 HydrophobicContact CB-CB 4.49Å; F51-Q59 HydrophobicContact CB-CG 4.09Å; F51-Q59 HydrophobicContact CD1-CB 3.85Å; F51-Q59 HydrophobicContact CD1-CG 4.38Å; F51-Q59 HydrophobicContact CD2-CB 4.13Å; F51-Q59 HydrophobicContact CD2-CG 4.16Å; F51-Q59 HydrophobicContact CE1-CB 4.03Å; F51-Q59 VanDerWaalsContact CE1-O 3.31Å; F51-Q59 WeakPolarHBondContact CE1-O 3.17Å; F51-Q59 HydrophobicContact CE2-CB 4.3Å; F51-Q59 HydrophobicContact CG-CB 3.9Å; F51-Q59 HydrophobicContact CG-CG 3.96Å; F51-Q59 HydrophobicContact CZ-CB 4.25Å; F51-T61 WeakPolarHBondContact CD1-O 3.21Å; F51-N62 HydrophobicContact CE1-CB 4.2Å; F51-N62 HydrophobicContact CZ-CB 4.42Å
52	D	94.3	Very high	92.9	Very high	49 Å²	49	63.2 Å²	63.2	26%	0.262	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	108.5	165.5	-178.9	-4.6	0	0	0	108.6	Y50 N54 T55 D56	Y50-D52 HydrophobicContact CE1-CB 4.44Å; D52-N54 PolarHBondContact O-N 3.03Å; D52-N54 VanDerWaalsContact OD1-CB 3.28Å; D52-N54 WeakPolarHBondContact OD1-CB 3.45Å; D52-N54 PolarHBondContact OD1-N 3.09Å; D52-N54 PolarHBondContact OD1-ND2 3.4Å; D52-T55 WeakPolarHBondContact CB-OG1 3.26Å; D52-T55 PolarHBondContact O-N 3.46Å; D52-T55 PolarHBondContact O-OG1 3.24Å; D52-D56 WeakPolarHBondContact O-CA 3.41Å; D52-D56 PolarHBondContact O-N 2.92Å
53	M	94.8	Very high	92.9	Very high	31 Å²	31	64.5 Å²	64.5	15%	0.153	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.1	-175.9	-59.7	-63.9	-58.2	0	0	112.6	N37 L39 F51 P57 Q59	N37-M53 WeakPolarHBondContact O-CA 3.22Å; N37-M53 VanDerWaalsContact O-CB 3.31Å; N37-M53 WeakPolarHBondContact O-CB 3.26Å; N37-M53 PolarHBondContact O-N 3.16Å; L39-M53 HydrophobicContact CB-CG 4.43Å; L39-M53 HydrophobicContact CB-SD 4.22Å; F51-M53 HydrophobicContact CB-SD 4.39Å; F51-M53 PolarHBondContact O-N 2.76Å; M53-P57 WeakPolarHBondContact CE-O 3.39Å; M53-Q59 HydrophobicContact CE-CG 4.23Å; M53-Q59 HydrophobicContact SD-CG 3.71Å; M53-Q59 PolarHBondContact SD-NE2 2.75Å; M53-Q59 VanDerWaalsContact SD-NE2 3.43Å
54	N	92.9	Very high	93.1	Very high	103 Å²	103	64.4 Å²	64.4	55%	0.551	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-37.5	171.8	-64.2	-42.6	0	0	0	111.7	N37 D52	N37-N54 WeakPolarHBondContact CB-ND2 3.41Å; N37-N54 VanDerWaalsContact CB-OD1 3.26Å; N37-N54 WeakPolarHBondContact CB-OD1 3.33Å; N37-N54 PolarHBondContact ND2-OD1 3.17Å; D52-N54 PolarHBondContact O-N 3.03Å; D52-N54 VanDerWaalsContact OD1-CB 3.28Å; D52-N54 WeakPolarHBondContact OD1-CB 3.45Å; D52-N54 PolarHBondContact OD1-N 3.09Å; D52-N54 PolarHBondContact OD1-ND2 3.4Å
55	T	92.6	Very high	93.3	Very high	106 Å²	106	69.1 Å²	69.1	65%	0.65	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-33.1	-177.6	56.4	0	0	0	0	112.4	D52	D52-T55 WeakPolarHBondContact CB-OG1 3.26Å; D52-T55 PolarHBondContact O-N 3.46Å; D52-T55 PolarHBondContact O-OG1 3.24Å
56	D	94.6	Very high	93.6	Very high	19 Å²	19	70 Å²	70	10%	0.102	37%	0.367	C	S	.	.			trans	-129.5	74.7	-175.6	-173.9	15.7	0	0	0	110.8	D52 Y58 Q59 L60 T61	D52-D56 WeakPolarHBondContact O-CA 3.41Å; D52-D56 PolarHBondContact O-N 2.92Å; D56-Y58 PolarHBondContact O-N 3.1Å; D56-Y58 VanDerWaalsContact O-N 3.16Å; D56-Q59 PolarHBondContact O-N 3.27Å; D56-Q59 PolarHBondContact OD1-N 3.45Å; D56-Q59 VanDerWaalsContact OD2-C 3.27Å; D56-Q59 VanDerWaalsContact OD2-CA 3.3Å; D56-Q59 WeakPolarHBondContact OD2-CA 3.43Å; D56-L60 VanDerWaalsContact CG-N 3.31Å; D56-L60 PolarHBondContact OD1-N 3.42Å; D56-L60 VanDerWaalsContact OD1-N 3.09Å; D56-L60 PolarHBondContact OD2-N 2.98Å; D56-T61 PolarHBondContact OD2-N 3.08Å
57	P	93.1	Very high	93.9	Very high	70 Å²	70	70 Å²	70	46%	0.455	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.7	-179.1	27.4	-35	0	0	0	113.1	M53	M53-P57 WeakPolarHBondContact CE-O 3.39Å
58	Y	94.3	Very high	94	Very high	186 Å²	186	71 Å²	71	73%	0.729	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	4.6	-178	-58.4	-65.6	0	0	0	113.3	D56 L60	D56-Y58 PolarHBondContact O-N 3.1Å; D56-Y58 VanDerWaalsContact O-N 3.16Å; Y58-L60 PolarHBondContact O-N 3Å
59	Q	94.9	Very high	93.8	Very high	86 Å²	86	75.6 Å²	75.6	40%	0.402	38%	0.383	S	S	.	.			trans	55.4	38.6	173.4	-57.4	158.8	8.8	0	0	112.6	L39 F51 M53 D56	L39-Q59 HydrophobicContact CD2-CG 4.48Å; F51-Q59 HydrophobicContact CB-CB 4.49Å; F51-Q59 HydrophobicContact CB-CG 4.09Å; F51-Q59 HydrophobicContact CD1-CB 3.85Å; F51-Q59 HydrophobicContact CD1-CG 4.38Å; F51-Q59 HydrophobicContact CD2-CB 4.13Å; F51-Q59 HydrophobicContact CD2-CG 4.16Å; F51-Q59 HydrophobicContact CE1-CB 4.03Å; F51-Q59 VanDerWaalsContact CE1-O 3.31Å; F51-Q59 WeakPolarHBondContact CE1-O 3.17Å; F51-Q59 HydrophobicContact CE2-CB 4.3Å; F51-Q59 HydrophobicContact CG-CB 3.9Å; F51-Q59 HydrophobicContact CG-CG 3.96Å; F51-Q59 HydrophobicContact CZ-CB 4.25Å; M53-Q59 HydrophobicContact CE-CG 4.23Å; M53-Q59 HydrophobicContact SD-CG 3.71Å; M53-Q59 PolarHBondContact SD-NE2 2.75Å; M53-Q59 VanDerWaalsContact SD-NE2 3.43Å; D56-Q59 PolarHBondContact O-N 3.27Å; D56-Q59 PolarHBondContact OD1-N 3.45Å; D56-Q59 VanDerWaalsContact OD2-C 3.27Å; D56-Q59 VanDerWaalsContact OD2-CA 3.3Å; D56-Q59 WeakPolarHBondContact OD2-CA 3.43Å
60	L	94.6	Very high	93.6	Very high	138 Å²	138	75.6 Å²	75.6	72%	0.723	39%	0.388	S	S	*	.			trans	-81.5	-25.6	-176.8	-59.2	178.6	0	0	0	112.6	D56 Y58	D56-L60 VanDerWaalsContact CG-N 3.31Å; D56-L60 PolarHBondContact OD1-N 3.42Å; D56-L60 VanDerWaalsContact OD1-N 3.09Å; D56-L60 PolarHBondContact OD2-N 2.98Å; Y58-L60 PolarHBondContact O-N 3Å
61	T	93.8	Very high	93.4	Very high	85 Å²	85	77.4 Å²	77.4	52%	0.521	40%	0.398	S	S	.	.	S	Bend	trans	-127.3	113.1	-173	-54	0	0	0	0	110.9	F51 D56 T63	F51-T61 WeakPolarHBondContact CD1-O 3.21Å; D56-T61 PolarHBondContact OD2-N 3.08Å; T61-T63 HydrophobicContact CG2-CG2 4.3Å; T61-T63 PolarHBondContact O-N 2.93Å
62	N	94.7	Very high	93.3	Very high	37 Å²	37	77.3 Å²	77.3	20%	0.198	40%	0.398	C	S	.	.			trans	-71.8	113.1	173.6	-179.9	1.5	0	0	0	110.7	L48 E49 Y50 F51 V64	L48-N62 PolarHBondContact O-ND2 3.25Å; E49-N62 WeakPolarHBondContact CA-OD1 3.4Å; Y50-N62 PolarHBondContact N-OD1 2.83Å; Y50-N62 VanDerWaalsContact N-OD1 3.13Å; F51-N62 HydrophobicContact CE1-CB 4.2Å; F51-N62 HydrophobicContact CZ-CB 4.42Å; N62-V64 VanDerWaalsContact OD1-CB 3.25Å; N62-V64 WeakPolarHBondContact OD1-CB 3.29Å; N62-V64 VanDerWaalsContact OD1-CG1 3.32Å; N62-V64 WeakPolarHBondContact OD1-CG1 3.32Å; N62-V64 PolarHBondContact OD1-N 2.79Å
63	T	94.3	Very high	93.2	Very high	32 Å²	32	78.9 Å²	78.9	20%	0.196	41%	0.407	C	S	.	.			trans	-103.6	21.9	179.9	67.1	0	0	0	0	113.1	Y50 T61 H65 T66	Y50-T63 PolarHBondContact O-N 2.8Å; Y50-T63 PolarHBondContact O-OG1 3.16Å; T61-T63 HydrophobicContact CG2-CG2 4.3Å; T61-T63 PolarHBondContact O-N 2.93Å; T63-H65 PolarHBondContact O-N 3.26Å; T63-T66 PolarHBondContact O-N 2.96Å; T63-T66 PolarHBondContact O-OG1 3.05Å
64	V	94.7	Very high	93.1	Very high	28 Å²	28	82.5 Å²	82.5	17%	0.17	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-53.6	-32.3	-180	69.5	0	0	0	0	113.6	L48 N62 T66 V67 L72	L48-V64 HydrophobicContact CB-CG2 3.87Å; N62-V64 VanDerWaalsContact OD1-CB 3.25Å; N62-V64 WeakPolarHBondContact OD1-CB 3.29Å; N62-V64 VanDerWaalsContact OD1-CG1 3.32Å; N62-V64 WeakPolarHBondContact OD1-CG1 3.32Å; N62-V64 PolarHBondContact OD1-N 2.79Å; V64-T66 VanDerWaalsContact C-N 3.28Å; V64-T66 PolarHBondContact O-N 3.23Å; V64-V67 PolarHBondContact O-N 2.91Å; V64-L72 HydrophobicContact CG2-CD1 3.99Å; V64-L72 HydrophobicContact CG2-CD2 3.99Å
65	H	91.1	Very high	93.2	Very high	150 Å²	150	77.9 Å²	77.9	69%	0.694	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-70.8	-19.9	-179.3	63	-84.7	0	0	0	113.7	T63	T63-H65 PolarHBondContact O-N 3.26Å
66	T	92.1	Very high	93.2	Very high	100 Å²	100	74 Å²	74	61%	0.613	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-86.9	-13.8	178.1	68.3	0	0	0	0	112.3	T63 V64	T63-T66 PolarHBondContact O-N 2.96Å; T63-T66 PolarHBondContact O-OG1 3.05Å; V64-T66 VanDerWaalsContact C-N 3.28Å; V64-T66 PolarHBondContact O-N 3.23Å
67	V	92.3	Very high	93.1	Very high	26 Å²	26	77.7 Å²	77.7	16%	0.158	39%	0.392	C	S	.	.	S	Bend	trans	-85.7	138.1	-177	-174.2	0	0	0	0	110.1	Y50 V64 I71 L72	Y50-V67 HydrophobicContact CD1-CG2 3.5Å; Y50-V67 HydrophobicContact CD2-CG2 3.99Å; Y50-V67 HydrophobicContact CE1-CG2 3.67Å; Y50-V67 HydrophobicContact CE2-CG2 4.14Å; Y50-V67 HydrophobicContact CG-CG2 3.66Å; V64-V67 PolarHBondContact O-N 2.91Å; V67-I71 HydrophobicContact CG1-CB 4.05Å; V67-I71 HydrophobicContact CG1-CG2 3.97Å; V67-L72 HydrophobicContact CB-CD1 4.38Å; V67-L72 HydrophobicContact CB-CD2 4.02Å; V67-L72 HydrophobicContact CB-CG 4.07Å; V67-L72 HydrophobicContact CG1-CD2 3.85Å; V67-L72 HydrophobicContact CG1-CG 3.85Å
68	E	92.9	Very high	93	Very high	132 Å²	132	78.5 Å²	78.5	62%	0.617	39%	0.39	S	S	*	.			trans	-63	141.7	177.3	-162.2	-165.7	137.5	0	0	111.4	S70 I71 L72	E68-S70 VanDerWaalsContact C-N 3.25Å; E68-S70 PolarHBondContact O-N 2.86Å; E68-S70 WeakPolarHBondContact OE1-CB 3.49Å; E68-S70 PolarHBondContact OE1-OG 3.39Å; E68-I71 HydrophobicContact CB-CG1 4.3Å; E68-I71 PolarHBondContact O-N 2.86Å; E68-I71 VanDerWaalsContact O-N 3.17Å; E68-L72 PolarHBondContact O-N 2.9Å; E68-L72 VanDerWaalsContact O-N 3.09Å
69	R	90.3	Very high	92.9	Very high	125 Å²	125	70.1 Å²	70.1	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-56.9	-36.8	178.5	179.5	168.8	-64.4	145.8	27.8	113.5	I71 L72 N73 N162	R69-I71 VanDerWaalsContact C-N 3.3Å; R69-I71 PolarHBondContact O-N 2.63Å; R69-L72 PolarHBondContact O-N 3.06Å; R69-N73 WeakPolarHBondContact O-CB 3.19Å; R69-N73 PolarHBondContact O-N 3.2Å; R69-N162 PolarHBondContact NH1-ND2 2.96Å; R69-N162 PolarHBondContact NH2-ND2 3.17Å; R69-N162 PolarHBondContact NH2-OD1 3.48Å
70	S	90.9	Very high	92.6	Very high	46 Å²	46	67.1 Å²	67.1	32%	0.322	34%	0.344	S	S	.	.	H	α-helix	trans	-62.5	-41.4	-179.1	69.8	0	0	0	0	111.1	E68 N73 Q74	E68-S70 VanDerWaalsContact C-N 3.25Å; E68-S70 PolarHBondContact O-N 2.86Å; E68-S70 WeakPolarHBondContact OE1-CB 3.49Å; E68-S70 PolarHBondContact OE1-OG 3.39Å; S70-N73 PolarHBondContact O-N 2.89Å; S70-Q74 WeakPolarHBondContact O-CG 3.34Å; S70-Q74 PolarHBondContact O-N 3.43Å; S70-Q74 VanDerWaalsContact O-N 3.08Å
71	I	92.4	Very high	92.4	Very high	65 Å²	65	66 Å²	66	33%	0.333	34%	0.335	S	S	.	.	H	α-helix	trans	-67.5	-47.5	176.8	-58.4	-58.3	0	0	0	110.6	V67 E68 R69 N73 Q74 L75	V67-I71 HydrophobicContact CG1-CB 4.05Å; V67-I71 HydrophobicContact CG1-CG2 3.97Å; E68-I71 HydrophobicContact CB-CG1 4.3Å; E68-I71 PolarHBondContact O-N 2.86Å; E68-I71 VanDerWaalsContact O-N 3.17Å; R69-I71 VanDerWaalsContact C-N 3.3Å; R69-I71 PolarHBondContact O-N 2.63Å; I71-N73 VanDerWaalsContact C-N 3.25Å; I71-N73 PolarHBondContact O-N 2.77Å; I71-Q74 WeakPolarHBondContact O-CB 3.38Å; I71-Q74 PolarHBondContact O-N 3Å; I71-Q74 VanDerWaalsContact O-N 3.1Å; I71-L75 HydrophobicContact CG2-CD1 4.02Å; I71-L75 HydrophobicContact CG2-CG 4.31Å; I71-L75 VanDerWaalsContact O-CG 3.32Å; I71-L75 WeakPolarHBondContact O-CG 3.48Å; I71-L75 PolarHBondContact O-N 3.44Å
72	L	93.1	Very high	92.2	Very high	9 Å²	9	64.8 Å²	64.8	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-57.7	-39.1	176.8	-68.2	175.5	0	0	0	112.4	F40 V64 V67 E68 R69 L75 H76 F158	F40-L72 HydrophobicContact CD2-CD2 4.16Å; F40-L72 HydrophobicContact CE2-CD2 3.86Å; V64-L72 HydrophobicContact CG2-CD1 3.99Å; V64-L72 HydrophobicContact CG2-CD2 3.99Å; V67-L72 HydrophobicContact CB-CD1 4.38Å; V67-L72 HydrophobicContact CB-CD2 4.02Å; V67-L72 HydrophobicContact CB-CG 4.07Å; V67-L72 HydrophobicContact CG1-CD2 3.85Å; V67-L72 HydrophobicContact CG1-CG 3.85Å; E68-L72 PolarHBondContact O-N 2.9Å; E68-L72 VanDerWaalsContact O-N 3.09Å; R69-L72 PolarHBondContact O-N 3.06Å; L72-L75 PolarHBondContact O-N 3.35Å; L72-H76 WeakPolarHBondContact O-CB 3.32Å; L72-H76 PolarHBondContact O-N 3Å; L72-F158 HydrophobicContact CD1-CE1 4.5Å
73	N	93.8	Very high	91.9	Very high	82 Å²	82	67.3 Å²	67.3	44%	0.439	33%	0.331	S	S	.	.	H	α-helix	trans	-67.1	-40.4	176.5	-172	32.3	0	0	0	112.3	R69 S70 I71 H76 I77	R69-N73 WeakPolarHBondContact O-CB 3.19Å; R69-N73 PolarHBondContact O-N 3.2Å; S70-N73 PolarHBondContact O-N 2.89Å; I71-N73 VanDerWaalsContact C-N 3.25Å; I71-N73 PolarHBondContact O-N 2.77Å; N73-H76 PolarHBondContact O-N 3.4Å; N73-I77 WeakPolarHBondContact O-CG1 3.34Å; N73-I77 PolarHBondContact O-N 3.18Å
74	Q	92.8	Very high	91.5	Very high	107 Å²	107	70.3 Å²	70.3	50%	0.5	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-45.4	174.2	-71.4	172	26.6	0	0	111.3	S70 I71 H76 I77 Q78	S70-Q74 WeakPolarHBondContact O-CG 3.34Å; S70-Q74 PolarHBondContact O-N 3.43Å; S70-Q74 VanDerWaalsContact O-N 3.08Å; I71-Q74 WeakPolarHBondContact O-CB 3.38Å; I71-Q74 PolarHBondContact O-N 3Å; I71-Q74 VanDerWaalsContact O-N 3.1Å; Q74-H76 VanDerWaalsContact C-N 3.33Å; Q74-H76 PolarHBondContact O-N 3.47Å; Q74-I77 PolarHBondContact O-N 3.29Å; Q74-Q78 WeakPolarHBondContact O-CB 3.06Å; Q74-Q78 WeakPolarHBondContact O-CG 3.31Å; Q74-Q78 PolarHBondContact O-N 3.36Å
75	L	93.2	Very high	91.2	Very high	7 Å²	7	70.4 Å²	70.4	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-39.4	177.8	-64.7	174.7	0	0	0	111.9	L29 F38 F40 Y50 I71 L72 Q78 L79	L29-L75 HydrophobicContact CD2-CB 4.5Å; L29-L75 HydrophobicContact CD2-CD2 3.79Å; F38-L75 HydrophobicContact CE2-CD1 3.92Å; F38-L75 HydrophobicContact CE2-CD2 3.65Å; F38-L75 HydrophobicContact CE2-CG 4.47Å; F38-L75 HydrophobicContact CZ-CD1 4.33Å; F38-L75 HydrophobicContact CZ-CD2 3.61Å; F40-L75 HydrophobicContact CB-CD1 4.15Å; F40-L75 HydrophobicContact CD1-CB 3.74Å; F40-L75 HydrophobicContact CD2-CD1 4.38Å; F40-L75 HydrophobicContact CE1-CB 3.95Å; F40-L75 HydrophobicContact CG-CB 4.14Å; F40-L75 HydrophobicContact CG-CD1 4.1Å; Y50-L75 HydrophobicContact CD2-CD1 4.28Å; Y50-L75 HydrophobicContact CE2-CD1 4.02Å; I71-L75 HydrophobicContact CG2-CD1 4.02Å; I71-L75 HydrophobicContact CG2-CG 4.31Å; I71-L75 VanDerWaalsContact O-CG 3.32Å; I71-L75 WeakPolarHBondContact O-CG 3.48Å; I71-L75 PolarHBondContact O-N 3.44Å; L72-L75 PolarHBondContact O-N 3.35Å; L75-Q78 PolarHBondContact O-N 3.13Å; L75-L79 VanDerWaalsContact O-CB 3.29Å; L75-L79 WeakPolarHBondContact O-CB 3.39Å; L75-L79 PolarHBondContact O-N 3.34Å
76	H	93	Very high	90.9	Very high	24 Å²	24	70.8 Å²	70.8	11%	0.111	36%	0.358	C	S	.	.	H	α-helix	trans	-59.8	-50.7	173.4	173.1	70	0	0	0	111.3	E42 L72 N73 Q74 Q78 L79 M80 Y150	E42-H76 IonicContact OE1-ND1 2.75Å; E42-H76 IonicContact OE2-CE1 3.42Å; E42-H76 PolarHBondContact OE2-CE1 2.93Å; E42-H76 IonicContact OE2-CG 3.94Å; E42-H76 IonicContact OE2-ND1 3.92Å; E42-H76 PolarHBondContact OE2-ND1 3.33Å; L72-H76 WeakPolarHBondContact O-CB 3.32Å; L72-H76 PolarHBondContact O-N 3Å; N73-H76 PolarHBondContact O-N 3.4Å; Q74-H76 VanDerWaalsContact C-N 3.33Å; Q74-H76 PolarHBondContact O-N 3.47Å; H76-Q78 VanDerWaalsContact C-N 3.33Å; H76-Q78 PolarHBondContact O-N 3.06Å; H76-L79 PolarHBondContact O-N 3.29Å; H76-M80 WeakPolarHBondContact O-CG 3.25Å; H76-M80 PolarHBondContact O-N 3.06Å; H76-Y150 AromaticContact CE1-CE1 3.86Å; H76-Y150 AromaticContact CE1-CZ 3.96Å; H76-Y150 PolarHBondContact CE1-OH 3.28Å
77	I	92.3	Very high	90.5	Very high	97 Å²	97	68.3 Å²	68.3	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-44.4	178.9	-66.9	165	0	0	0	111	N73 Q74 L79 M80 E81	N73-I77 WeakPolarHBondContact O-CG1 3.34Å; N73-I77 PolarHBondContact O-N 3.18Å; Q74-I77 PolarHBondContact O-N 3.29Å; I77-L79 PolarHBondContact O-N 3.47Å; I77-M80 PolarHBondContact O-N 2.9Å; I77-E81 PolarHBondContact O-N 3Å
78	Q	91.4	Very high	90.1	Very high	87 Å²	87	72.2 Å²	72.2	41%	0.407	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-45	176.4	-74.7	177.9	-20.2	0	0	112.2	L29 Q74 L75 H76 M80 E81 L82	L29-Q78 HydrophobicContact CD2-CB 3.99Å; Q74-Q78 WeakPolarHBondContact O-CB 3.06Å; Q74-Q78 WeakPolarHBondContact O-CG 3.31Å; Q74-Q78 PolarHBondContact O-N 3.36Å; L75-Q78 PolarHBondContact O-N 3.13Å; H76-Q78 VanDerWaalsContact C-N 3.33Å; H76-Q78 PolarHBondContact O-N 3.06Å; Q78-M80 VanDerWaalsContact C-N 3.28Å; Q78-M80 PolarHBondContact O-N 2.95Å; Q78-E81 PolarHBondContact O-N 3.21Å; Q78-L82 WeakPolarHBondContact O-CG 3.33Å; Q78-L82 PolarHBondContact O-N 3.38Å
79	L	91.9	Very high	89.4	Confident	10 Å²	10	73.6 Å²	73.6	5%	0.052	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-39.6	177.2	-177.4	63.1	0	0	0	111.3	W27 L29 F40 E42 L75 H76 I77 L82 R83	W27-L79 HydrophobicContact CB-CD1 3.94Å; W27-L79 HydrophobicContact CB-CD2 4.06Å; W27-L79 HydrophobicContact CB-CG 4.21Å; L29-L79 HydrophobicContact CB-CD1 4.16Å; F40-L79 HydrophobicContact CD1-CD2 4.44Å; F40-L79 HydrophobicContact CE1-CD2 4.12Å; E42-L79 HydrophobicContact CB-CD2 3.89Å; L75-L79 VanDerWaalsContact O-CB 3.29Å; L75-L79 WeakPolarHBondContact O-CB 3.39Å; L75-L79 PolarHBondContact O-N 3.34Å; H76-L79 PolarHBondContact O-N 3.29Å; I77-L79 PolarHBondContact O-N 3.47Å; L79-L82 PolarHBondContact O-N 3.37Å; L79-R83 WeakPolarHBondContact O-CB 3.1Å; L79-R83 PolarHBondContact O-N 3.31Å
80	M	89.7	Confident	88.9	Confident	23 Å²	23	73.7 Å²	73.7	11%	0.113	37%	0.374	C	S	.	.	H	α-helix	trans	-68.8	-37.2	178.7	-65.7	-61.2	-87.7	0	0	112.6	H76 I77 Q78 R83 S84 W147 Y150	H76-M80 WeakPolarHBondContact O-CG 3.25Å; H76-M80 PolarHBondContact O-N 3.06Å; I77-M80 PolarHBondContact O-N 2.9Å; Q78-M80 VanDerWaalsContact C-N 3.28Å; Q78-M80 PolarHBondContact O-N 2.95Å; M80-R83 PolarHBondContact O-N 3.09Å; M80-R83 PolarHBondContact SD-NH1 3.44Å; M80-S84 PolarHBondContact O-N 2.87Å; M80-W147 HydrophobicContact CE-CH2 3.03Å; M80-W147 HydrophobicContact CE-CZ2 3.57Å; M80-W147 HydrophobicContact CE-CZ3 3.7Å; M80-Y150 HydrophobicContact CE-CE1 4.45Å
81	E	89.9	Confident	88.6	Confident	114 Å²	114	73.6 Å²	73.6	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-61.7	-50.3	172.5	-173.8	174.1	-172.9	0	0	110.5	I77 Q78 R83 S84 C85	I77-E81 PolarHBondContact O-N 3Å; Q78-E81 PolarHBondContact O-N 3.21Å; E81-R83 VanDerWaalsContact C-N 3.27Å; E81-R83 PolarHBondContact O-N 3Å; E81-S84 PolarHBondContact O-N 2.95Å; E81-S84 PolarHBondContact O-OG 3.09Å; E81-C85 PolarHBondContact O-N 3.22Å
82	L	89.1	Confident	88.1	Confident	59 Å²	59	74.8 Å²	74.8	31%	0.309	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-28.8	177.6	-68.1	170.4	0	0	0	113	L29 Q78 L79 S84 C85	L29-L82 HydrophobicContact CD1-CD1 3.49Å; L29-L82 VanDerWaalsContact CD1-CD1 3.49Å; Q78-L82 WeakPolarHBondContact O-CG 3.33Å; Q78-L82 PolarHBondContact O-N 3.38Å; L79-L82 PolarHBondContact O-N 3.37Å; L82-S84 PolarHBondContact O-N 3.5Å; L82-C85 PolarHBondContact O-N 3.4Å; L82-C85 PolarHBondContact O-SG 3.01Å
83	R	88	Confident	86.9	Confident	90 Å²	90	78 Å²	78	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-66.9	-30.4	173.4	-167.6	179.4	74.2	179.3	5.5	112.3	L79 M80 E81	L79-R83 WeakPolarHBondContact O-CB 3.1Å; L79-R83 PolarHBondContact O-N 3.31Å; M80-R83 PolarHBondContact O-N 3.09Å; M80-R83 PolarHBondContact SD-NH1 3.44Å; E81-R83 VanDerWaalsContact C-N 3.27Å; E81-R83 PolarHBondContact O-N 3Å
84	S	86.3	Confident	85.7	Confident	95 Å²	95	84.3 Å²	84.3	66%	0.664	42%	0.419	S	S	*	.	H	α-helix	trans	-93.4	-12.4	-178.8	71.1	0	0	0	0	114	M80 E81 L82	M80-S84 PolarHBondContact O-N 2.87Å; E81-S84 PolarHBondContact O-N 2.95Å; E81-S84 PolarHBondContact O-OG 3.09Å; L82-S84 PolarHBondContact O-N 3.5Å
85	C	88	Confident	84.1	Confident	30 Å²	30	85 Å²	85	20%	0.203	43%	0.433	C	S	.	.			trans	-69	146.2	-175.7	79.4	0	0	0	0	111.2	E81 L82 Q90 C91	E81-C85 PolarHBondContact O-N 3.22Å; L82-C85 PolarHBondContact O-N 3.4Å; L82-C85 PolarHBondContact O-SG 3.01Å; C85-Q90 HydrophobicContact CB-CB 4.28Å; C85-C91 HydrophobicContact CB-CB 3.93Å; C85-C91 WeakPolarHBondContact CB-SG 3.09Å; C85-C91 WeakPolarHBondContact SG-CA 3.33Å; C85-C91 WeakPolarHBondContact SG-CB 3.16Å; C85-C91 CovalentContact SG-SG 2.03Å; C85-C91 PolarHBondContact SG-SG 3.05Å
86	Q	85.3	Confident	82	Confident	159 Å²	159	94.4 Å²	94.4	74%	0.743	47%	0.474	S	S	*	.			trans	-131.2	123.7	174.9	-170.5	175.8	-1.3	0	0	111.1	Q90	Q86-Q90 PolarHBondContact O-OE1 3.13Å
87	G	83.8	Confident	79.5	Confident	47 Å²	47	97 Å²	97	49%	0.485	49%	0.494	S	S	.	.	S	Bend	trans	73	163.1	179.8	0	0	0	0	0	113.6	K89 Q90 C91	G87-K89 PolarHBondContact O-N 2.98Å; G87-K89 VanDerWaalsContact O-N 3.15Å; G87-Q90 PolarHBondContact O-N 2.89Å; G87-C91 WeakPolarHBondContact O-CB 3.37Å; G87-C91 PolarHBondContact O-N 2.04Å; G87-C91 PolarHBondContact O-SG 2.75Å; G87-C91 VanDerWaalsContact O-SG 3.38Å
88	Y	83	Confident	77.3	Confident	108 Å²	108	99.8 Å²	99.8	42%	0.424	51%	0.509	S	S	.	.	H	α-helix	trans	-58.3	-33.6	-171.5	77	-83.2	0	0	0	113.8	Q90 N92 E243	Y88-Q90 VanDerWaalsContact C-N 3.27Å; Y88-Q90 PolarHBondContact O-N 2.85Å; Y88-N92 WeakPolarHBondContact O-CB 3.44Å; Y88-N92 PolarHBondContact O-N 3.43Å; Y88-N92 VanDerWaalsContact O-N 3.09Å; Y88-E243 HydrophobicContact CD1-CG 4.41Å; Y88-E243 HydrophobicContact CE1-CG 4.15Å; Y88-E243 WeakPolarHBondContact CE1-OE1 3.45Å; Y88-E243 PolarHBondContact OH-OE1 3.26Å
89	K	79.3	Confident	74.9	Confident	161 Å²	161	102.2 Å²	102.2	70%	0.7	53%	0.525	S	S	*	.	H	α-helix	trans	-65.3	-30.3	-177	-63.3	-173.8	-178.8	180	0	113	G87	G87-K89 PolarHBondContact O-N 2.98Å; G87-K89 VanDerWaalsContact O-N 3.15Å
90	Q	80.1	Confident	72.6	Confident	128 Å²	128	108.6 Å²	108.6	60%	0.598	56%	0.558	S	S	*	*	H	α-helix	trans	-101.4	-30.1	-179.4	-61.9	178.2	6.4	0	0	111.7	C85 Q86 G87 Y88	C85-Q90 HydrophobicContact CB-CB 4.28Å; Q86-Q90 PolarHBondContact O-OE1 3.13Å; G87-Q90 PolarHBondContact O-N 2.89Å; Y88-Q90 VanDerWaalsContact C-N 3.27Å; Y88-Q90 PolarHBondContact O-N 2.85Å
91	C	83.9	Confident	70.6	Confident	44 Å²	44	116.2 Å²	116.2	30%	0.297	59%	0.593	S	S	.	*	H	α-helix	trans	-86.1	-9.4	-177.8	-64.5	0	0	0	0	114.9	C85 G87 P93	C85-C91 HydrophobicContact CB-CB 3.93Å; C85-C91 WeakPolarHBondContact CB-SG 3.09Å; C85-C91 WeakPolarHBondContact SG-CA 3.33Å; C85-C91 WeakPolarHBondContact SG-CB 3.16Å; C85-C91 CovalentContact SG-SG 2.03Å; C85-C91 PolarHBondContact SG-SG 3.05Å; G87-C91 WeakPolarHBondContact O-CB 3.37Å; G87-C91 PolarHBondContact O-N 2.04Å; G87-C91 PolarHBondContact O-SG 2.75Å; G87-C91 VanDerWaalsContact O-SG 3.38Å; C91-P93 WeakPolarHBondContact O-CD 3.2Å
92	N	82.4	Confident	68.2	Low	89 Å²	89	118.4 Å²	118.4	48%	0.476	61%	0.608	S	S	.	*	S	Bend	trans	-112.6	75.5	173.8	-169.8	8.7	0	0	0	110.1	Y88 R94	Y88-N92 WeakPolarHBondContact O-CB 3.44Å; Y88-N92 PolarHBondContact O-N 3.43Å; Y88-N92 VanDerWaalsContact O-N 3.09Å; N92-R94 PolarHBondContact O-N 3.02Å
93	P	68.1	Low	65.8	Low	78 Å²	78	119.7 Å²	119.7	51%	0.506	62%	0.622	S	S	.	*			trans	-65.2	108.8	174	27.3	-31.7	0	0	0	107.8	C91	C91-P93 WeakPolarHBondContact O-CD 3.2Å
94	R	67.2	Low	63.5	Low	214 Å²	214	126.5 Å²	126.5	81%	0.808	65%	0.65	S	S	*	*			trans	-56.7	140	170.3	-66.3	-176.7	-178	-179.6	-0.4	107.8	N92 K96	N92-R94 PolarHBondContact O-N 3.02Å; R94-K96 PolarHBondContact O-N 2.85Å
95	P	60.1	Low	60.9	Low	122 Å²	122	125.5 Å²	125.5	79%	0.792	65%	0.654	S	S	*	*			trans	-48.9	125.1	169.3	-20.2	29	0	0	0	107	S97	P95-S97 PolarHBondContact O-N 2.98Å
96	K	50	Low	58.5	Low	204 Å²	204	131.8 Å²	131.8	89%	0.887	68%	0.683	S	S	*	*			trans	-63	92	170.6	-70	176.9	-177.1	172.3	0	105.4	R94 L98	R94-K96 PolarHBondContact O-N 2.85Å; K96-L98 PolarHBondContact O-N 3.19Å
97	S	40.6	Very low	56.2	Low	78 Å²	78	131.2 Å²	131.2	55%	0.545	69%	0.685	S	S	.	*			trans	-52	124.8	166.5	-176.5	0	0	0	0	105.3	P95 D99	P95-S97 PolarHBondContact O-N 2.98Å; S97-D99 VanDerWaalsContact CB-OD1 3.22Å; S97-D99 WeakPolarHBondContact CB-OD1 3.43Å; S97-D99 PolarHBondContact O-N 3.18Å; S97-D99 PolarHBondContact OG-OD1 2.89Å
98	L	44.3	Very low	53.8	Low	155 Å²	155	132.6 Å²	132.6	81%	0.812	70%	0.699	S	S	*	*			trans	-66.1	79.4	161.6	-72.3	166.2	0	0	0	105.6	K96 I100	K96-L98 PolarHBondContact O-N 3.19Å; L98-I100 PolarHBondContact O-N 3.11Å
99	D	41.3	Very low	51.5	Low	138 Å²	138	137 Å²	137	74%	0.738	72%	0.721	S	S	*	*			trans	-75.1	68.3	167.9	-63.8	-27.1	0	0	0	106.9	S97	S97-D99 VanDerWaalsContact CB-OD1 3.22Å; S97-D99 WeakPolarHBondContact CB-OD1 3.43Å; S97-D99 PolarHBondContact O-N 3.18Å; S97-D99 PolarHBondContact OG-OD1 2.89Å
100	I	43.8	Very low	49.4	Very low	144 Å²	144	135.9 Å²	135.9	74%	0.738	73%	0.727	S	S	*	*			trans	-71	119.8	152.1	-67	175.7	0	0	0	104.6	L98 D102	L98-I100 PolarHBondContact O-N 3.11Å; I100-D102 PolarHBondContact O-N 3.27Å
101	E	48.7	Very low	47.1	Very low	184 Å²	184	134.7 Å²	134.7	86%	0.86	73%	0.732	S	S	*	*			trans	-36.9	121.8	178.1	-68.5	176.1	128.8	0	0	113.9
102	D	37.9	Very low	44.6	Very low	159 Å²	159	141.4 Å²	141.4	85%	0.85	76%	0.759	S	S	*	*			trans	-145.1	134.8	151.2	-91	-30.3	0	0	0	105.1	I100	I100-D102 PolarHBondContact O-N 3.27Å
103	S	38.9	Very low	42.1	Very low	86 Å²	86	142 Å²	142	60%	0.601	77%	0.77	S	S	*	*			cis	177.1	126.3	-2.1	-175.1	0	0	0	0	104.1
104	Y	39.7	Very low	40.4	Very low	233 Å²	233	144.8 Å²	144.8	91%	0.914	78%	0.781	S	S	*	*			trans	61.2	115.4	149.7	-70.1	-113.7	0	0	0	121.1
105	G	32.7	Very low	38.7	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	78%	0.781	S	S	*	*			trans	161.7	86.8	153.5	0	0	0	0	0	118.4
106	M	36.9	Very low	37.3	Very low	162 Å²	162	141.9 Å²	141.9	80%	0.798	78%	0.778	S	S	*	*			trans	78.2	105.8	149.8	-59.6	-63.2	165.7	0	0	121.4
107	D	38	Very low	36.8	Very low	147 Å²	147	137 Å²	137	79%	0.786	77%	0.769	S	S	*	*				61.6	106.1	125.6	-44.1	-12.6	0	0	0	120.9
108	G	33.2	Very low	36.6	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	78%	0.782	S	S	*	*			trans	173.4	39.7	163.7	0	0	0	0	0	120.7
109	K	35.1	Very low	35.9	Very low	202 Å²	202	139.5 Å²	139.5	88%	0.878	78%	0.783	S	S	*	*			trans	53.3	124.2	153.8	-97.7	-173	178.4	-178.5	0	120.8
110	V	33.9	Very low	35.5	Very low	137 Å²	137	136.5 Å²	136.5	83%	0.83	77%	0.772	S	S	*	*			trans	80	130.8	144.9	-176.1	0	0	0	0	115.4
111	S	31.8	Very low	35.3	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	78%	0.781	S	S	*	*			cis	-143.3	141.3	1.1	55.6	0	0	0	0	109.3
112	Q	31.1	Very low	34.6	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.864	78%	0.779	S	S	*	*			trans	-75.4	120.9	170.5	-146	140.2	4.2	0	0	109.7
113	S	31.5	Very low	34.4	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	77%	0.773	S	S	*	*			trans	-115.6	106.2	157.4	56.5	0	0	0	0	108.1	I115	S113-I115 PolarHBondContact O-N 2.89Å
114	N	32	Very low	34.4	Very low	138 Å²	138	139.4 Å²	139.4	74%	0.738	78%	0.781	S	S	*	*			trans	-56.7	122.6	167.2	-78.4	-15.8	0	0	0	109.3
115	I	32.3	Very low	34.3	Very low	157 Å²	157	136.4 Å²	136.4	81%	0.805	78%	0.775	S	S	*	*			trans	-121.2	90.3	152	-64.1	178.4	0	0	0	106.2	S113	S113-I115 PolarHBondContact O-N 2.89Å
116	T	30.5	Very low	34.3	Very low	117 Å²	117	141.8 Å²	141.8	72%	0.718	78%	0.78	S	S	*	*			trans	-68.9	131.3	155.9	1.6	0	0	0	0	108.3
117	S	38.6	Very low	34.1	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	79%	0.787	S	S	*	*	S	Bend	trans	51.5	124.1	151.7	60.3	0	0	0	0	119.5
118	D	35.6	Very low	33.8	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	79%	0.785	S	S	*	*			trans	81.6	96.7	143.9	-161.1	21.3	0	0	0	117
119	T	31	Very low	33.9	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	78%	0.784	S	S	*	*			trans	-162.2	111.9	147.5	-12.4	0	0	0	0	113.8
120	S	31.6	Very low	33.9	Very low	75 Å²	75	135.3 Å²	135.3	52%	0.524	78%	0.778	S	S	.	*			trans	51.9	111.3	132.1	-161.6	0	0	0	0	120.9	Q122	S120-Q122 PolarHBondContact O-N 3.3Å
121	W	40	Very low	33.6	Very low	244 Å²	244	134.7 Å²	134.7	92%	0.924	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	33.3	170.7	-76	110.5	0	0	0	115.5	L124	W121-L124 HydrophobicContact CZ3-CD1 4.24Å
122	Q	34	Very low	33.7	Very low	173 Å²	173	136.7 Å²	136.7	81%	0.808	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	8	-176.8	-92.6	157.9	-17.1	0	0	115.5	S120	S120-Q122 PolarHBondContact O-N 3.3Å
123	G	35.3	Very low	34	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	78%	0.782	S	S	*	*	S	Bend	trans	-106.7	4.3	-177.1	0	0	0	0	0	117
124	L	37.8	Very low	34.4	Very low	145 Å²	145	137.8 Å²	137.8	76%	0.759	79%	0.785	S	S	*	*	S	Bend	trans	-101.2	8	-172	-110.4	144.4	0	0	0	114.7	W121	W121-L124 HydrophobicContact CZ3-CD1 4.24Å
125	E	37.2	Very low	34.4	Very low	171 Å²	171	139.7 Å²	139.7	80%	0.799	79%	0.79	S	S	*	*	S	Bend	trans	-93.6	-5.2	-177.7	-157.9	160.8	-160	0	0	113.9
126	E	32.5	Very low	34.6	Very low	186 Å²	186	142.8 Å²	142.8	87%	0.869	79%	0.792	S	S	*	*	S	Bend	trans	-105.3	9.9	-172.7	-72.8	-165.8	154.9	0	0	116.5
127	L	33.8	Very low	34.7	Very low	178 Å²	178	147.6 Å²	147.6	93%	0.932	80%	0.797	S	S	*	*	S	Bend	trans	-109.1	8.2	173.8	-71.5	173.6	0	0	0	114.9
128	S	31.3	Very low	34.5	Very low	108 Å²	108	147.7 Å²	147.7	76%	0.755	80%	0.798	S	S	*	*			trans	-94.4	12.7	174.4	27.5	0	0	0	0	114.4
129	G	34.8	Very low	34.6	Very low	73 Å²	73	146.1 Å²	146.1	75%	0.753	79%	0.79	S	S	*	*			trans	-109.4	81.1	179.4	0	0	0	0	0	112.9
130	A	35.2	Very low	35.3	Very low	92 Å²	92	145 Å²	145	76%	0.76	79%	0.785	S	S	*	*			trans	163.9	90	144.1	0	0	0	0	0	112.2
131	S	28.9	Very low	36	Very low	124 Å²	124	152.8 Å²	152.8	87%	0.867	80%	0.803	S	S	*	*			trans	-167.9	87.5	139.2	8.8	0	0	0	0	109.2	I133	S131-I133 PolarHBondContact O-N 2.94Å
132	N	33.7	Very low	36.6	Very low	144 Å²	144	145 Å²	145	77%	0.77	78%	0.779	S	S	*	*			trans	-71.6	106.1	163.6	-95.1	-25.6	0	0	0	108.9
133	I	36.1	Very low	37.9	Very low	164 Å²	164	139.4 Å²	139.4	84%	0.841	76%	0.758	S	S	*	*			trans	-136.2	88.6	143.9	-64.1	-177.2	0	0	0	105.5	S131	S131-I133 PolarHBondContact O-N 2.94Å
134	D	39.5	Very low	38.9	Very low	146 Å²	146	143 Å²	143	78%	0.781	76%	0.76	S	S	*	*			trans	-77.9	113.1	169.8	-81.2	-48.3	0	0	0	109.2
135	E	33.3	Very low	39.9	Very low	178 Å²	178	141.6 Å²	141.6	83%	0.832	75%	0.75	S	S	*	*			trans	-147.1	99.5	151.6	-145.9	169.7	-167.4	0	0	110.7	R137	E135-R137 PolarHBondContact O-N 3.1Å
136	Y	36.9	Very low	41.1	Very low	221 Å²	221	137.2 Å²	137.2	87%	0.867	73%	0.732	S	S	*	*			trans	32.6	82.4	155.8	-89.7	-96.5	0	0	0	117.7
137	R	31.7	Very low	42.6	Very low	218 Å²	218	132.6 Å²	132.6	82%	0.823	71%	0.707	S	S	*	*			trans	-125.8	101.8	147.5	-158.2	174	-172.9	116.6	-2.7	108.8	E135 N139	E135-R137 PolarHBondContact O-N 3.1Å; R137-N139 PolarHBondContact O-N 2.49Å
138	S	35	Very low	43.8	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	68%	0.678	S	S	*	*			trans	-65.7	78	173.3	-49.4	0	0	0	0	109.7	P140	S138-P140 VanDerWaalsContact O-CD 3.3Å; S138-P140 WeakPolarHBondContact O-CD 3.4Å
139	N	37.3	Very low	45.5	Very low	117 Å²	117	124.8 Å²	124.8	63%	0.626	66%	0.659	S	S	*	*			trans	-77.7	112.7	159.3	-73.3	-26.6	0	0	0	106	R137 R141	R137-N139 PolarHBondContact O-N 2.49Å; N139-R141 PolarHBondContact O-N 3.45Å
140	P	46.6	Very low	47.1	Very low	112 Å²	112	123.7 Å²	123.7	73%	0.727	63%	0.633	S	S	*	*			trans	-68.5	94.7	165.8	28.6	-29	0	0	0	106.1	S138 L142	S138-P140 VanDerWaalsContact O-CD 3.3Å; S138-P140 WeakPolarHBondContact O-CD 3.4Å; P140-L142 VanDerWaalsContact C-N 3.34Å; P140-L142 PolarHBondContact O-N 3.42Å
141	R	44.9	Very low	48.3	Very low	240 Å²	240	122.5 Å²	122.5	91%	0.906	61%	0.613	S	S	*	*			trans	-56.8	109	156.3	-80	-166.7	169.3	-176.3	-1.4	104.8	N139 S143	N139-R141 PolarHBondContact O-N 3.45Å; R141-S143 PolarHBondContact O-N 2.75Å
142	L	52.6	Low	49.9	Very low	81 Å²	81	122.3 Å²	122.3	42%	0.424	59%	0.593	S	S	.	*			trans	-49.9	128	173.8	-88	86.4	0	0	0	107.5	P140 D146	P140-L142 VanDerWaalsContact C-N 3.34Å; P140-L142 PolarHBondContact O-N 3.42Å; L142-D146 HydrophobicContact CB-CB 4.06Å; L142-D146 HydrophobicContact CD2-CB 3.97Å; L142-D146 HydrophobicContact CG-CB 4.19Å
143	S	62.1	Low	51.1	Low	54 Å²	54	118 Å²	118	38%	0.378	58%	0.578	S	S	.	*			trans	-61.5	157.2	178.6	72.2	0	0	0	0	109.3	R141 E145 D146 W147	R141-S143 PolarHBondContact O-N 2.75Å; S143-E145 PolarHBondContact O-N 2.84Å; S143-E145 VanDerWaalsContact O-N 3.07Å; S143-D146 WeakPolarHBondContact CB-OD2 3.45Å; S143-D146 PolarHBondContact N-OD2 3Å; S143-D146 PolarHBondContact O-N 3.24Å; S143-D146 PolarHBondContact OG-N 3.42Å; S143-D146 VanDerWaalsContact OG-N 3.17Å; S143-D146 PolarHBondContact OG-OD2 3.5Å; S143-W147 PolarHBondContact O-N 3.42Å; S143-W147 VanDerWaalsContact O-N 3.08Å
144	L	55.7	Low	52.4	Low	147 Å²	147	111.5 Å²	111.5	77%	0.77	55%	0.546	S	S	*	.	H	α-helix	trans	-53.7	-30.8	175.9	-174.6	64.7	0	0	0	111.6	T148	L144-T148 WeakPolarHBondContact O-CG2 3.35Å; L144-T148 PolarHBondContact O-N 3.3Å; L144-T148 VanDerWaalsContact O-N 3.14Å; L144-T148 PolarHBondContact O-OG1 2.94Å
145	E	59.8	Low	53.5	Low	116 Å²	116	112.3 Å²	112.3	54%	0.542	54%	0.539	S	S	.	.	H	α-helix	trans	-73.9	-35.5	176.7	-165.9	60.5	-153.1	0	0	112.8	S143 W147 T148 N149	S143-E145 PolarHBondContact O-N 2.84Å; S143-E145 VanDerWaalsContact O-N 3.07Å; E145-W147 VanDerWaalsContact C-N 3.29Å; E145-W147 PolarHBondContact O-N 3.39Å; E145-T148 WeakPolarHBondContact CA-OG1 3.38Å; E145-T148 PolarHBondContact O-N 3.4Å; E145-T148 PolarHBondContact O-OG1 3.01Å; E145-N149 WeakPolarHBondContact O-CB 2.98Å; E145-N149 VanDerWaalsContact O-CG 3.28Å; E145-N149 PolarHBondContact O-N 3.24Å; E145-N149 VanDerWaalsContact O-N 3.08Å; E145-N149 PolarHBondContact O-ND2 3.33Å
146	D	61.9	Low	55.2	Low	79 Å²	79	111.2 Å²	111.2	42%	0.422	53%	0.528	S	S	.	.	H	α-helix	trans	-67.7	-35.8	174.2	-59.7	-44.9	0	0	0	110.9	L142 S143 N149 Y150	L142-D146 HydrophobicContact CB-CB 4.06Å; L142-D146 HydrophobicContact CD2-CB 3.97Å; L142-D146 HydrophobicContact CG-CB 4.19Å; S143-D146 WeakPolarHBondContact CB-OD2 3.45Å; S143-D146 PolarHBondContact N-OD2 3Å; S143-D146 PolarHBondContact O-N 3.24Å; S143-D146 PolarHBondContact OG-N 3.42Å; S143-D146 VanDerWaalsContact OG-N 3.17Å; S143-D146 PolarHBondContact OG-OD2 3.5Å; D146-N149 PolarHBondContact O-N 3.44Å; D146-Y150 VanDerWaalsContact O-CB 3.29Å; D146-Y150 WeakPolarHBondContact O-CB 3.28Å; D146-Y150 PolarHBondContact O-N 3.03Å
147	W	63.1	Low	56.8	Low	89 Å²	89	102.7 Å²	102.7	34%	0.337	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-44.5	175.4	-98	107.5	0	0	0	113.3	M80 S143 E145 N149 Y150 L151	M80-W147 HydrophobicContact CE-CH2 3.03Å; M80-W147 HydrophobicContact CE-CZ2 3.57Å; M80-W147 HydrophobicContact CE-CZ3 3.7Å; S143-W147 PolarHBondContact O-N 3.42Å; S143-W147 VanDerWaalsContact O-N 3.08Å; E145-W147 VanDerWaalsContact C-N 3.29Å; E145-W147 PolarHBondContact O-N 3.39Å; W147-N149 VanDerWaalsContact C-N 3.33Å; W147-Y150 HydrophobicContact CE3-CD1 4.22Å; W147-Y150 HydrophobicContact CZ3-CD1 4.31Å; W147-Y150 HydrophobicContact CZ3-CE1 4.43Å; W147-Y150 PolarHBondContact O-N 2.96Å; W147-L151 HydrophobicContact CE3-CG 4.43Å; W147-L151 WeakPolarHBondContact O-CG 3.41Å; W147-L151 PolarHBondContact O-N 2.03Å
148	T	60.5	Low	58.3	Low	54 Å²	54	94.2 Å²	94.2	33%	0.331	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-37	177.3	56.5	0	0	0	0	111.4	L144 E145 R152	L144-T148 WeakPolarHBondContact O-CG2 3.35Å; L144-T148 PolarHBondContact O-N 3.3Å; L144-T148 VanDerWaalsContact O-N 3.14Å; L144-T148 PolarHBondContact O-OG1 2.94Å; E145-T148 WeakPolarHBondContact CA-OG1 3.38Å; E145-T148 PolarHBondContact O-N 3.4Å; E145-T148 PolarHBondContact O-OG1 3.01Å; T148-R152 VanDerWaalsContact O-CB 3.28Å; T148-R152 WeakPolarHBondContact O-CB 3.36Å; T148-R152 PolarHBondContact O-N 3.05Å
149	N	65.1	Low	59.8	Low	68 Å²	68	92 Å²	92	36%	0.364	46%	0.46	S	S	.	.	H	α-helix	trans	-68.2	-38.9	176.1	-74.5	-43.1	0	0	0	112.4	E145 D146 W147 R152 A153	E145-N149 WeakPolarHBondContact O-CB 2.98Å; E145-N149 VanDerWaalsContact O-CG 3.28Å; E145-N149 PolarHBondContact O-N 3.24Å; E145-N149 VanDerWaalsContact O-N 3.08Å; E145-N149 PolarHBondContact O-ND2 3.33Å; D146-N149 PolarHBondContact O-N 3.44Å; W147-N149 VanDerWaalsContact C-N 3.33Å; N149-R152 PolarHBondContact O-N 3.03Å; N149-R152 PolarHBondContact OD1-NH1 2.98Å; N149-A153 PolarHBondContact O-N 3.18Å
150	Y	68.5	Low	61.3	Low	49 Å²	49	92.3 Å²	92.3	19%	0.192	46%	0.461	C	S	.	.	H	α-helix	trans	-64.8	-50.5	173.9	170.2	-102.4	0	0	0	112.3	E42 H76 M80 D146 W147 R152 A153 V154	E42-Y150 PolarHBondContact OE1-OH 3.46Å; E42-Y150 PolarHBondContact OE2-OH 2.79Å; H76-Y150 AromaticContact CE1-CE1 3.86Å; H76-Y150 AromaticContact CE1-CZ 3.96Å; H76-Y150 PolarHBondContact CE1-OH 3.28Å; M80-Y150 HydrophobicContact CE-CE1 4.45Å; D146-Y150 VanDerWaalsContact O-CB 3.29Å; D146-Y150 WeakPolarHBondContact O-CB 3.28Å; D146-Y150 PolarHBondContact O-N 3.03Å; W147-Y150 HydrophobicContact CE3-CD1 4.22Å; W147-Y150 HydrophobicContact CZ3-CD1 4.31Å; W147-Y150 HydrophobicContact CZ3-CE1 4.43Å; W147-Y150 PolarHBondContact O-N 2.96Å; Y150-R152 PolarHBondContact O-N 3.38Å; Y150-A153 WeakPolarHBondContact O-CA 3.02Å; Y150-A153 WeakPolarHBondContact O-CB 2.8Å; Y150-A153 PolarHBondContact O-N 3.33Å; Y150-V154 HydrophobicContact CD1-CG2 4.42Å; Y150-V154 HydrophobicContact CD2-CG2 4.36Å; Y150-V154 HydrophobicContact CE1-CG2 4.04Å; Y150-V154 HydrophobicContact CE2-CG2 3.95Å; Y150-V154 WeakPolarHBondContact O-CG2 3.38Å; Y150-V154 PolarHBondContact O-N 2.69Å
151	L	60.8	Low	61.9	Low	67 Å²	67	92.6 Å²	92.6	35%	0.351	46%	0.456	S	S	.	.	H	α-helix	trans	-56.8	-41.2	176.2	-74.1	171.8	0	0	0	111.1	W147 A153 V154 Y155	W147-L151 HydrophobicContact CE3-CG 4.43Å; W147-L151 WeakPolarHBondContact O-CG 3.41Å; W147-L151 PolarHBondContact O-N 2.03Å; L151-A153 VanDerWaalsContact C-N 3.3Å; L151-A153 PolarHBondContact O-N 3.15Å; L151-V154 PolarHBondContact O-N 2.91Å; L151-Y155 HydrophobicContact CB-CD2 4.49Å; L151-Y155 WeakPolarHBondContact O-CD2 3.42Å; L151-Y155 PolarHBondContact O-N 2.83Å
152	R	62.6	Low	62.1	Low	120 Å²	120	85.5 Å²	85.5	45%	0.453	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-32.3	176.3	-165.6	-175.3	-69.3	144.6	-7.7	112.7	T148 N149 Y150 R156	T148-R152 VanDerWaalsContact O-CB 3.28Å; T148-R152 WeakPolarHBondContact O-CB 3.36Å; T148-R152 PolarHBondContact O-N 3.05Å; N149-R152 PolarHBondContact O-N 3.03Å; N149-R152 PolarHBondContact OD1-NH1 2.98Å; Y150-R152 PolarHBondContact O-N 3.38Å; R152-R156 WeakPolarHBondContact O-CB 3.38Å; R152-R156 WeakPolarHBondContact O-CG 3.29Å; R152-R156 PolarHBondContact O-N 3.04Å; R152-R156 VanDerWaalsContact O-N 3.11Å
153	A	59.7	Low	62.1	Low	54 Å²	54	85.2 Å²	85.2	45%	0.446	44%	0.44	S	S	.	.	H	α-helix	trans	-70.1	-44.8	174.2	0	0	0	0	0	111.3	N149 Y150 L151 R156 A157	N149-A153 PolarHBondContact O-N 3.18Å; Y150-A153 WeakPolarHBondContact O-CA 3.02Å; Y150-A153 WeakPolarHBondContact O-CB 2.8Å; Y150-A153 PolarHBondContact O-N 3.33Å; L151-A153 VanDerWaalsContact C-N 3.3Å; L151-A153 PolarHBondContact O-N 3.15Å; A153-R156 PolarHBondContact O-N 2.9Å; A153-A157 PolarHBondContact O-N 2.91Å
154	V	63.1	Low	61.3	Low	28 Å²	28	89.9 Å²	89.9	17%	0.17	46%	0.456	C	S	.	.	H	α-helix	trans	-58.1	-51.9	174.9	174.7	0	0	0	0	110.5	Y150 L151 R156 A157 F158	Y150-V154 HydrophobicContact CD1-CG2 4.42Å; Y150-V154 HydrophobicContact CD2-CG2 4.36Å; Y150-V154 HydrophobicContact CE1-CG2 4.04Å; Y150-V154 HydrophobicContact CE2-CG2 3.95Å; Y150-V154 WeakPolarHBondContact O-CG2 3.38Å; Y150-V154 PolarHBondContact O-N 2.69Å; L151-V154 PolarHBondContact O-N 2.91Å; V154-R156 VanDerWaalsContact C-N 3.27Å; V154-R156 PolarHBondContact O-N 2.9Å; V154-A157 PolarHBondContact O-N 3.41Å; V154-F158 HydrophobicContact CG1-CD2 3.72Å; V154-F158 HydrophobicContact CG1-CE2 3.53Å; V154-F158 WeakPolarHBondContact O-CD2 3.48Å; V154-F158 PolarHBondContact O-N 3.5Å
155	Y	61.5	Low	60.9	Low	163 Å²	163	88.1 Å²	88.1	64%	0.639	45%	0.453	S	S	*	.	H	α-helix	trans	-60	-34.7	177	-79.5	-66.9	0	0	0	113.2	L151 A159	L151-Y155 HydrophobicContact CB-CD2 4.49Å; L151-Y155 WeakPolarHBondContact O-CD2 3.42Å; L151-Y155 PolarHBondContact O-N 2.83Å; Y155-A159 WeakPolarHBondContact O-CB 3.3Å; Y155-A159 PolarHBondContact O-N 3.08Å
156	R	70.1	Confident	60	Low	155 Å²	155	88.4 Å²	88.4	59%	0.585	46%	0.458	S	S	*	.	H	α-helix	trans	-69.6	-43.3	174.5	-87.4	-170.6	-103.2	-128.5	9.4	112.9	R152 A153 V154 F158 A159 L160	R152-R156 WeakPolarHBondContact O-CB 3.38Å; R152-R156 WeakPolarHBondContact O-CG 3.29Å; R152-R156 PolarHBondContact O-N 3.04Å; R152-R156 VanDerWaalsContact O-N 3.11Å; A153-R156 PolarHBondContact O-N 2.9Å; V154-R156 VanDerWaalsContact C-N 3.27Å; V154-R156 PolarHBondContact O-N 2.9Å; R156-F158 VanDerWaalsContact C-N 3.29Å; R156-F158 PolarHBondContact O-N 3.04Å; R156-A159 PolarHBondContact O-N 3.48Å; R156-L160 WeakPolarHBondContact O-CG 3.39Å; R156-L160 PolarHBondContact O-N 3.48Å
157	A	70.1	Confident	59.5	Low	41 Å²	41	90 Å²	90	34%	0.339	47%	0.473	S	S	.	.	H	α-helix	trans	-58.5	-44.6	175.6	0	0	0	0	0	110.6	A153 V154 L160 L161	A153-A157 PolarHBondContact O-N 2.91Å; V154-A157 PolarHBondContact O-N 3.41Å; A157-L160 PolarHBondContact O-N 3.5Å; A157-L161 WeakPolarHBondContact O-CD1 3.49Å; A157-L161 PolarHBondContact O-N 2.85Å
158	F	62.8	Low	58.6	Low	41 Å²	41	93 Å²	93	18%	0.18	50%	0.496	C	S	.	.	H	α-helix	trans	-64.6	-40.9	174.2	-78.3	-67.6	0	0	0	113.1	L48 L72 V154 R156 L160 L161 N162	L48-F158 HydrophobicContact CD1-CE1 4.4Å; L48-F158 HydrophobicContact CD1-CE2 4.27Å; L48-F158 HydrophobicContact CD1-CZ 3.62Å; L72-F158 HydrophobicContact CD1-CE1 4.5Å; V154-F158 HydrophobicContact CG1-CD2 3.72Å; V154-F158 HydrophobicContact CG1-CE2 3.53Å; V154-F158 WeakPolarHBondContact O-CD2 3.48Å; V154-F158 PolarHBondContact O-N 3.5Å; R156-F158 VanDerWaalsContact C-N 3.29Å; R156-F158 PolarHBondContact O-N 3.04Å; F158-L160 VanDerWaalsContact C-N 3.29Å; F158-L160 PolarHBondContact O-N 3.14Å; F158-L161 PolarHBondContact O-N 3.49Å; F158-N162 VanDerWaalsContact O-CG 3.28Å; F158-N162 PolarHBondContact O-N 3.08Å; F158-N162 PolarHBondContact O-ND2 3.07Å
159	A	67.1	Low	57.9	Low	58 Å²	58	99.5 Å²	99.5	48%	0.479	52%	0.52	S	S	.	.	H	α-helix	trans	-60	-39.8	176.6	0	0	0	0	0	112.1	Y155 R156 N162 S163	Y155-A159 WeakPolarHBondContact O-CB 3.3Å; Y155-A159 PolarHBondContact O-N 3.08Å; R156-A159 PolarHBondContact O-N 3.48Å; A159-N162 PolarHBondContact O-N 2.92Å; A159-S163 WeakPolarHBondContact O-CB 3.43Å; A159-S163 PolarHBondContact O-N 3.41Å; A159-S163 VanDerWaalsContact O-N 3.13Å; A159-S163 PolarHBondContact O-OG 3.45Å
160	L	68.3	Low	57	Low	122 Å²	122	99.9 Å²	99.9	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-69.1	-37.6	177.2	-67.7	171.9	0	0	0	112.8	R156 A157 F158 N162 S163	R156-L160 WeakPolarHBondContact O-CG 3.39Å; R156-L160 PolarHBondContact O-N 3.48Å; A157-L160 PolarHBondContact O-N 3.5Å; F158-L160 VanDerWaalsContact C-N 3.29Å; F158-L160 PolarHBondContact O-N 3.14Å; L160-N162 VanDerWaalsContact C-N 3.35Å; L160-S163 WeakPolarHBondContact CA-OG 3.29Å; L160-S163 PolarHBondContact O-N 3.35Å; L160-S163 PolarHBondContact O-OG 3.07Å
161	L	58.9	Low	55.9	Low	119 Å²	119	105.5 Å²	105.5	62%	0.623	57%	0.566	S	S	*	*	H	α-helix	trans	-67.6	-33.2	176.4	-80.2	155	0	0	0	112.6	A157 F158	A157-L161 WeakPolarHBondContact O-CD1 3.49Å; A157-L161 PolarHBondContact O-N 2.85Å; F158-L161 PolarHBondContact O-N 3.49Å
162	N	49.7	Very low	54.7	Low	90 Å²	90	105.7 Å²	105.7	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-85.7	-11.4	176.3	-56.8	-51.9	0	0	0	114.1	R69 F158 A159 L160 H164	R69-N162 PolarHBondContact NH1-ND2 2.96Å; R69-N162 PolarHBondContact NH2-ND2 3.17Å; R69-N162 PolarHBondContact NH2-OD1 3.48Å; F158-N162 VanDerWaalsContact O-CG 3.28Å; F158-N162 PolarHBondContact O-N 3.08Å; F158-N162 PolarHBondContact O-ND2 3.07Å; A159-N162 PolarHBondContact O-N 2.92Å; L160-N162 VanDerWaalsContact C-N 3.35Å; N162-H164 PolarHBondContact O-N 2.9Å
163	S	53.2	Low	53.2	Low	75 Å²	75	106.1 Å²	106.1	52%	0.524	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	4.4	-178.8	60.1	0	0	0	0	113.5	A159 L160 P165	A159-S163 WeakPolarHBondContact O-CB 3.43Å; A159-S163 PolarHBondContact O-N 3.41Å; A159-S163 VanDerWaalsContact O-N 3.13Å; A159-S163 PolarHBondContact O-OG 3.45Å; L160-S163 WeakPolarHBondContact CA-OG 3.29Å; L160-S163 PolarHBondContact O-N 3.35Å; L160-S163 PolarHBondContact O-OG 3.07Å; S163-P165 WeakPolarHBondContact O-CD 3.45Å
164	H	44.4	Very low	52	Low	152 Å²	152	109.1 Å²	109.1	70%	0.704	61%	0.614	S	S	*	*			trans	-66.8	115.9	169.2	-89.2	-69.8	0	0	0	109.8	N162 D166	N162-H164 PolarHBondContact O-N 2.9Å; H164-D166 PolarHBondContact O-N 3.4Å
165	P	48.3	Very low	50.4	Low	111 Å²	111	114.3 Å²	114.3	72%	0.721	65%	0.647	S	S	*	*			trans	-65.8	132.5	172.5	-10.5	26.1	0	0	0	108.4	S163 P167	S163-P165 WeakPolarHBondContact O-CD 3.45Å; P165-P167 WeakPolarHBondContact O-CD 3.35Å; P165-P167 VanDerWaalsContact O-N 3.14Å
166	D	41.3	Very low	48.7	Very low	121 Å²	121	113 Å²	113	65%	0.647	66%	0.656	S	S	*	*			trans	-47	118.9	169.5	-76.5	-48.5	0	0	0	110.3	H164 N168 K169	H164-D166 PolarHBondContact O-N 3.4Å; D166-N168 PolarHBondContact O-N 2.85Å; D166-K169 PolarHBondContact O-N 2.9Å
167	P	49.8	Very low	46.8	Very low	113 Å²	113	114.6 Å²	114.6	73%	0.734	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-64.8	-10	171.4	25.1	-30.8	0	0	0	112	P165	P165-P167 WeakPolarHBondContact O-CD 3.35Å; P165-P167 VanDerWaalsContact O-N 3.14Å
168	N	45.8	Very low	44.6	Very low	152 Å²	152	116.2 Å²	116.2	81%	0.813	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-91.2	6.3	-179.2	-65.5	-22.7	0	0	0	114.4	D166	D166-N168 PolarHBondContact O-N 2.85Å
169	K	45.4	Very low	42.9	Very low	191 Å²	191	117.9 Å²	117.9	83%	0.83	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-112.9	22.1	174.2	-130.5	176.9	-172.3	175.2	0	114.2	D166	D166-K169 PolarHBondContact O-N 2.9Å
170	A	45.4	Very low	41	Very low	76 Å²	76	123.5 Å²	123.5	63%	0.628	74%	0.741	S	S	*	*			trans	-122.3	71.7	169.9	0	0	0	0	0	109.8
171	N	46.8	Very low	38.9	Very low	167 Å²	167	126.3 Å²	126.3	89%	0.893	75%	0.749	S	S	*	*			trans	-161.5	72.3	157.5	-92	-21.6	0	0	0	109
172	G	33.9	Very low	37.4	Very low	70 Å²	70	127.9 Å²	127.9	72%	0.722	76%	0.757	S	S	*	*			trans	-130.6	81.9	162.8	0	0	0	0	0	107.2	P174	G172-P174 WeakPolarHBondContact O-CD 3.29Å
173	T	32.3	Very low	36.1	Very low	130 Å²	130	128.7 Å²	128.7	80%	0.798	77%	0.765	S	S	*	*			trans	-55.9	120.2	170.8	-9.4	0	0	0	0	108.4	T175	T173-T175 PolarHBondContact O-N 2.87Å
174	P	34.7	Very low	34.7	Very low	116 Å²	116	131 Å²	131	75%	0.753	78%	0.775	S	S	*	*			trans	-77.5	112.4	171.5	29	-27.4	0	0	0	107.8	G172 T176	G172-P174 WeakPolarHBondContact O-CD 3.29Å; P174-T176 PolarHBondContact O-N 3.02Å
175	T	28.2	Very low	33.8	Very low	138 Å²	138	129.5 Å²	129.5	85%	0.847	78%	0.782	S	S	*	*			trans	-63.9	116.1	167.4	-31	0	0	0	0	107.7	T173 Q177	T173-T175 PolarHBondContact O-N 2.87Å; T175-Q177 PolarHBondContact O-N 2.67Å; T175-Q177 VanDerWaalsContact O-N 3.15Å
176	T	26	Very low	32.9	Very low	135 Å²	135	128.4 Å²	128.4	83%	0.828	78%	0.783	S	S	*	*			trans	-64.4	107.5	173.2	-45.3	0	0	0	0	109.2	P174	P174-T176 PolarHBondContact O-N 3.02Å
177	Q	29.9	Very low	32.1	Very low	189 Å²	189	132.3 Å²	132.3	88%	0.883	80%	0.797	S	S	*	*			trans	-107.8	109.8	151.3	-98.4	-175.1	5	0	0	107.4	T175 G179	T175-Q177 PolarHBondContact O-N 2.67Å; T175-Q177 VanDerWaalsContact O-N 3.15Å; Q177-G179 PolarHBondContact O-N 3.2Å
178	G	25.1	Very low	31	Very low	75 Å²	75	137.6 Å²	137.6	77%	0.773	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.8	123.7	167.2	0	0	0	0	0	109.2
179	G	26.2	Very low	30	Very low	76 Å²	76	137.9 Å²	137.9	78%	0.784	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.5	139.9	163.5	0	0	0	0	0	110.5	Q177	Q177-G179 PolarHBondContact O-N 3.2Å
180	D	27	Very low	29.2	Very low	175 Å²	175	134.7 Å²	134.7	94%	0.936	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-52.4	155.4	163.6	-113.3	-28.1	0	0	0	111.9
181	F	25	Very low	28.8	Very low	182 Å²	182	136.8 Å²	136.8	80%	0.798	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-65.5	158	-171.1	-138.4	-100.1	0	0	0	114.7
182	L	26.4	Very low	27.7	Very low	152 Å²	152	134 Å²	134	80%	0.796	81%	0.806	S	S	*	*			trans	109.4	92.9	167.1	-64	165	0	0	0	114.5
183	V	23.6	Very low	27.4	Very low	107 Å²	107	138.4 Å²	138.4	65%	0.648	81%	0.808	S	S	*	*				72.7	97.2	80.8	175.1	0	0	0	0	112.6
184	T	23.1	Very low	27.2	Very low	122 Å²	122	140 Å²	140	75%	0.748	81%	0.809	S	S	*	*				68.7	112.9	129.2	-38.7	0	0	0	0	118.8
185	S	26.9	Very low	26.8	Very low	121 Å²	121	138.9 Å²	138.9	85%	0.846	81%	0.809	S	S	*	*				-164.3	137.9	104.1	-78.3	0	0	0	0	111.9
186	A	29.1	Very low	26.7	Very low	88 Å²	88	138 Å²	138	73%	0.727	81%	0.808	S	S	*	*			trans	-81.4	154.7	-177.8	0	0	0	0	0	111.4
187	E	24.7	Very low	26.8	Very low	204 Å²	204	135.8 Å²	135.8	95%	0.953	80%	0.804	S	S	*	*			trans	-153	152.3	131.6	-116.9	162.2	149.7	0	0	111.9
188	R	25.8	Very low	26.7	Very low	223 Å²	223	135.8 Å²	135.8	84%	0.842	80%	0.804	S	S	*	*			trans	-118.6	161.6	-154.7	-168.3	-176.9	-172.1	180	3	108
189	L	24.7	Very low	26.8	Very low	159 Å²	159	138.3 Å²	138.3	83%	0.832	81%	0.81	S	S	*	*			trans	143.8	99.7	149.6	-75.6	159.2	0	0	0	109.5
190	V	27.7	Very low	26.8	Very low	123 Å²	123	137.6 Å²	137.6	75%	0.745	80%	0.803	S	S	*	*				72.7	136.5	85.4	178.7	0	0	0	0	113.9
191	P	38	Very low	27	Very low	120 Å²	120	139.2 Å²	139.2	78%	0.779	80%	0.804	S	S	*	*			trans	-100.4	164.9	-163.5	38.3	-27.8	0	0	0	113.9
192	A	24.6	Very low	27	Very low	108 Å²	108	137.5 Å²	137.5	89%	0.893	80%	0.804	S	S	*	*			trans	-141.6	144.4	172.6	0	0	0	0	0	113.6
193	E	27.5	Very low	27.8	Very low	164 Å²	164	135.5 Å²	135.5	77%	0.766	80%	0.8	S	S	*	*			trans	-77.1	160.9	-172.9	-80.1	172.2	103.9	0	0	116.6
194	M	27.3	Very low	28	Very low	163 Å²	163	135.3 Å²	135.3	80%	0.803	80%	0.803	S	S	*	*			trans	35.7	130	139.5	-54.9	-175.2	-154.6	0	0	122.1
195	A	26	Very low	28.2	Very low	93 Å²	93	137.7 Å²	137.7	77%	0.769	81%	0.806	S	S	*	*				147.1	144.6	117.2	0	0	0	0	0	116
196	S	27.2	Very low	28.3	Very low	118 Å²	118	139 Å²	139	83%	0.825	81%	0.808	S	S	*	*			trans	78.5	110.3	145.8	-61.5	0	0	0	0	124.2
197	A	26.8	Very low	28.2	Very low	89 Å²	89	140.6 Å²	140.6	74%	0.736	81%	0.809	S	S	*	*				24.3	135.2	117.7	0	0	0	0	0	124.8
198	E	28.1	Very low	28.3	Very low	189 Å²	189	134.4 Å²	134.4	88%	0.883	80%	0.8	S	S	*	*			trans	86.5	131.7	134.3	-77.6	-177.9	157.7	0	0	124.8
199	S	26.7	Very low	28.4	Very low	129 Å²	129	132.9 Å²	132.9	90%	0.902	80%	0.802	S	S	*	*			trans	71.7	136.7	151	-153.9	0	0	0	0	118
200	G	26.5	Very low	28.4	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	80%	0.802	S	S	*	*			cis	157.9	154.9	8.9	0	0	0	0	0	107.3
201	E	30.8	Very low	28.5	Very low	208 Å²	208	131.5 Å²	131.5	97%	0.972	80%	0.803	S	S	*	*			trans	101.7	116.3	163.8	-49.9	-174.9	147	0	0	119.8
202	D	26.3	Very low	28.2	Very low	147 Å²	147	131.3 Å²	131.3	79%	0.786	80%	0.802	S	S	*	*			trans	-92.4	158.4	172.8	-173	37.8	0	0	0	109.1
203	P	42	Very low	28.1	Very low	110 Å²	110	133.9 Å²	133.9	71%	0.714	80%	0.799	S	S	*	*				-152	162.4	71.9	34.4	-9.8	0	0	0	119.1
204	S	28.5	Very low	28	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	80%	0.798	S	S	*	*			trans	114.3	89	138.5	73.8	0	0	0	0	120.7
205	H	27.3	Very low	28	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.796	80%	0.8	S	S	*	*				41.7	109.2	121	-113.3	-87.6	0	0	0	121
206	V	29.2	Very low	28.2	Very low	149 Å²	149	133.5 Å²	133.5	90%	0.903	80%	0.804	S	S	*	*				-148.3	139.8	130	178.6	0	0	0	0	109.7
207	V	26.9	Very low	28.1	Very low	121 Å²	121	134 Å²	134	73%	0.733	80%	0.801	S	S	*	*			trans	-72.6	143.6	-165.6	169.2	0	0	0	0	115
208	G	27.4	Very low	28.2	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	81%	0.808	S	S	*	*			trans	-163.7	123	161	0	0	0	0	0	111.3
209	E	26.5	Very low	28.2	Very low	190 Å²	190	135 Å²	135	89%	0.888	80%	0.799	S	S	*	*			trans	-62.2	146.3	-164.2	-63.8	164.7	129.9	0	0	116.7
210	T	26.1	Very low	28.3	Very low	136 Å²	136	137 Å²	137	83%	0.834	80%	0.795	S	S	*	*			trans	-92.5	147.8	160	13.3	0	0	0	0	110.8
211	P	29.6	Very low	28.5	Very low	117 Å²	117	140.6 Å²	140.6	76%	0.76	81%	0.805	S	S	*	*				-136.8	160.8	116.4	14.5	7.4	0	0	0	114.8
212	P	30.3	Very low	28.3	Very low	117 Å²	117	139.2 Å²	139.2	76%	0.76	80%	0.803	S	S	*	*			trans	-93	153.8	-166	37.6	-33.2	0	0	0	113.1
213	L	24.3	Very low	28.4	Very low	161 Å²	161	140.2 Å²	140.2	84%	0.843	80%	0.803	S	S	*	*			trans	-138.2	97.5	169.9	-80.1	164.7	0	0	0	108.6
214	T	25.1	Very low	27.6	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	81%	0.806	S	S	*	*				84.6	108	86.2	48	0	0	0	0	114.1
215	L	27.5	Very low	27.5	Very low	165 Å²	165	144.4 Å²	144.4	86%	0.864	81%	0.81	S	S	*	*			trans	-61.1	136.7	159.5	-69.9	161.4	0	0	0	109.9	V217	L215-V217 PolarHBondContact O-N 2.98Å
216	P	28.8	Very low	27.4	Very low	129 Å²	129	145.9 Å²	145.9	84%	0.838	81%	0.809	S	S	*	*			trans	-83.3	105.9	173.2	30.4	-28.2	0	0	0	110.6
217	V	26.6	Very low	27.3	Very low	128 Å²	128	144 Å²	144	78%	0.776	80%	0.799	S	S	*	*			trans	-80.2	121.7	149.7	169.9	0	0	0	0	106.9	L215	L215-V217 PolarHBondContact O-N 2.98Å
218	N	27.1	Very low	27.3	Very low	162 Å²	162	144.4 Å²	144.4	87%	0.866	80%	0.803	S	S	*	*			trans	-144.2	99.4	150.2	-148.1	-19	0	0	0	109.7
219	L	29.6	Very low	27.4	Very low	136 Å²	136	148.6 Å²	148.6	71%	0.712	81%	0.807	S	S	*	*			trans	-92.4	149.8	168.4	-100.7	161.6	0	0	0	108
220	Q	29	Very low	27.5	Very low	172 Å²	172	144.7 Å²	144.7	80%	0.804	80%	0.8	S	S	*	*			trans	95.5	96.3	165.6	-55.5	163.7	24.6	0	0	115.1
221	T	28.8	Very low	28.1	Very low	136 Å²	136	143 Å²	143	83%	0.834	79%	0.791	S	S	*	*				-176.2	111.9	101.6	42.6	0	0	0	0	108.8
222	L	27.6	Very low	28.3	Very low	179 Å²	179	145.9 Å²	145.9	94%	0.937	80%	0.795	S	S	*	*	S	Bend	trans	-166.7	127.1	137.2	-102.1	160.1	0	0	0	110.4
223	H	27.9	Very low	28.3	Very low	169 Å²	169	152.2 Å²	152.2	78%	0.782	80%	0.804	S	S	*	*			trans	-32.6	128.6	-173.2	-102	-111.3	0	0	0	118.7	N225	H223-N225 PolarHBondContact O-N 2.83Å
224	L	26.6	Very low	28.4	Very low	150 Å²	150	153.9 Å²	153.9	79%	0.785	80%	0.804	S	S	*	*			trans	-67.8	108.3	163.5	-148	89.2	0	0	0	109.7
225	N	26.6	Very low	28.9	Very low	151 Å²	151	155.3 Å²	155.3	81%	0.807	81%	0.807	S	S	*	*			trans	-101.4	99.5	158.3	-81	-22.1	0	0	0	107.6	H223 P227	H223-N225 PolarHBondContact O-N 2.83Å; N225-P227 WeakPolarHBondContact O-CD 3.38Å
226	R	24.7	Very low	28.9	Very low	202 Å²	202	155.2 Å²	155.2	76%	0.762	80%	0.802	S	S	*	*			trans	-81.4	117.2	173.2	167.3	-177.2	-83.5	-148.5	-5.9	108.9
227	P	26.1	Very low	29.3	Very low	109 Å²	109	156 Å²	156	71%	0.708	79%	0.788	S	S	*	*			trans	-83.5	123.3	156.2	-1.3	21.4	0	0	0	108.1	N225 L229	N225-P227 WeakPolarHBondContact O-CD 3.38Å; P227-L229 PolarHBondContact O-N 3.3Å
228	T	27.1	Very low	29.9	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	78%	0.78	S	S	*	*			trans	-73.3	105.1	175	-44.1	0	0	0	0	109
229	L	30.7	Very low	30.8	Very low	162 Å²	162	152.8 Å²	152.8	85%	0.848	77%	0.767	S	S	*	*			trans	-108.1	125.2	165.1	-77.9	164.2	0	0	0	108.9	P227	P227-L229 PolarHBondContact O-N 3.3Å
230	S	27.1	Very low	31.2	Very low	108 Å²	108	152.2 Å²	152.2	76%	0.755	76%	0.764	S	S	*	*			trans	-70.1	169.5	178.6	53.9	0	0	0	0	112.6
231	P	39	Very low	31.8	Very low	99 Å²	99	150.2 Å²	150.2	64%	0.643	76%	0.758	S	S	*	*	S	Bend	trans	-84.1	151.2	-136	31.9	-35	0	0	0	116.5
232	E	34.8	Very low	32.2	Very low	179 Å²	179	148.5 Å²	148.5	84%	0.836	75%	0.749	S	S	*	*			trans	30.8	95.4	157.4	-60.7	97.5	-134.3	0	0	119.1
233	R	29.1	Very low	33	Very low	250 Å²	250	146.9 Å²	146.9	94%	0.943	74%	0.736	S	S	*	*			trans	-92	99.8	137.8	-87.7	-172.2	-179.4	171.9	0.7	107.8	L235	R233-L235 PolarHBondContact O-N 3.49Å; R233-L235 VanDerWaalsContact O-N 3.1Å
234	K	26.7	Very low	33.7	Very low	196 Å²	196	142.7 Å²	142.7	85%	0.852	72%	0.722	S	S	*	*			trans	-54.3	111.9	166.4	-161.6	178.8	-175.8	-171.3	0	107.4	E236	K234-E236 PolarHBondContact O-N 3.36Å
235	L	35.3	Very low	34.4	Very low	149 Å²	149	142.8 Å²	142.8	78%	0.78	72%	0.724	S	S	*	*			trans	-67.3	100	168.9	-90.7	155.4	0	0	0	106.7	R233 W237	R233-L235 PolarHBondContact O-N 3.49Å; R233-L235 VanDerWaalsContact O-N 3.1Å; L235-W237 PolarHBondContact O-N 3.28Å
236	E	27.4	Very low	35.1	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.762	72%	0.718	S	S	*	*			trans	-73.7	108.4	174.7	-170.8	163.6	-146.3	0	0	108.3	K234 D238	K234-E236 PolarHBondContact O-N 3.36Å; E236-D238 VanDerWaalsContact C-N 3.32Å; E236-D238 PolarHBondContact O-N 3.28Å
237	W	38	Very low	36	Very low	146 Å²	146	140.7 Å²	140.7	55%	0.553	72%	0.722	S	S	*	*			trans	-83.9	72.4	176	-91.3	85.8	0	0	0	110.1	V32 L235 N239	V32-W237 HydrophobicContact CB-CH2 3.64Å; V32-W237 HydrophobicContact CB-CZ2 3.54Å; V32-W237 HydrophobicContact CG1-CH2 4.43Å; V32-W237 HydrophobicContact CG1-CZ2 3.83Å; V32-W237 WeakPolarHBondContact O-CH2 3.49Å; V32-W237 WeakPolarHBondContact O-CZ2 3.45Å; L235-W237 PolarHBondContact O-N 3.28Å; W237-N239 VanDerWaalsContact CE3-ND2 3.25Å; W237-N239 VanDerWaalsContact CZ3-ND2 3.26Å; W237-N239 WeakPolarHBondContact CZ3-ND2 3.35Å; W237-N239 PolarHBondContact O-N 3.4Å
238	D	38.4	Very low	36.9	Very low	112 Å²	112	142.7 Å²	142.7	60%	0.599	73%	0.727	S	S	*	*			trans	-90.4	86.8	169.7	-97.8	-8	0	0	0	109.7	E236	E236-D238 VanDerWaalsContact C-N 3.32Å; E236-D238 PolarHBondContact O-N 3.28Å
239	N	45.5	Very low	37.7	Very low	110 Å²	110	139.5 Å²	139.5	59%	0.588	71%	0.709	S	S	*	*			trans	-92.1	15.6	160.2	-74.4	-39.8	0	0	0	111.7	W237 I241	W237-N239 VanDerWaalsContact CE3-ND2 3.25Å; W237-N239 VanDerWaalsContact CZ3-ND2 3.26Å; W237-N239 WeakPolarHBondContact CZ3-ND2 3.35Å; W237-N239 PolarHBondContact O-N 3.4Å; N239-I241 PolarHBondContact O-N 3.33Å
240	D	38.5	Very low	38.4	Very low	124 Å²	124	139.3 Å²	139.3	66%	0.663	70%	0.704	S	S	*	*			trans	-70.2	99.5	175.9	-78.4	-16.2	0	0	0	109	P242	D240-P242 WeakPolarHBondContact O-CD 3.37Å
241	I	42.1	Very low	39.1	Very low	130 Å²	130	140.3 Å²	140.3	67%	0.667	70%	0.697	S	S	*	*			trans	-67.5	112.5	165.4	-59.5	172.8	0	0	0	105.8	N239 E243	N239-I241 PolarHBondContact O-N 3.33Å; I241-E243 PolarHBondContact O-N 3.44Å
242	P	37.5	Very low	38.9	Very low	99 Å²	99	144.1 Å²	144.1	64%	0.643	70%	0.698	S	S	*	*			trans	-62.2	132	-179.8	24.5	-31.6	0	0	0	109	D240 V244	D240-P242 WeakPolarHBondContact O-CD 3.37Å; P242-V244 PolarHBondContact O-N 3.48Å
243	E	43.6	Very low	39.2	Very low	145 Å²	145	143.2 Å²	143.2	68%	0.678	69%	0.687	S	S	*	*	S	Bend	trans	-63.8	0.2	179	-68.6	-177.6	164.1	0	0	113.2	Y88 I241	Y88-E243 HydrophobicContact CD1-CG 4.41Å; Y88-E243 HydrophobicContact CE1-CG 4.15Å; Y88-E243 WeakPolarHBondContact CE1-OE1 3.45Å; Y88-E243 PolarHBondContact OH-OE1 3.26Å; I241-E243 PolarHBondContact O-N 3.44Å
244	V	42.8	Very low	39.6	Very low	81 Å²	81	139.1 Å²	139.1	49%	0.491	68%	0.676	S	S	.	*	S	Bend	trans	-135.3	116.2	-172.3	-159.6	0	0	0	0	111.4	P242 H246	P242-V244 PolarHBondContact O-N 3.48Å; V244-H246 VanDerWaalsContact C-N 3.32Å; V244-H246 VanDerWaalsContact CG1-NE2 3.35Å; V244-H246 WeakPolarHBondContact CG1-NE2 3.46Å; V244-H246 PolarHBondContact O-N 3.27Å
245	N	41.9	Very low	40.3	Very low	153 Å²	153	133 Å²	133	82%	0.818	66%	0.655	S	S	*	*			trans	-64.5	85.5	170.1	-98.2	-8.8	0	0	0	110.6	L247	N245-L247 PolarHBondContact O-N 3.18Å
246	H	40.9	Very low	40.6	Very low	150 Å²	150	132.9 Å²	132.9	69%	0.694	65%	0.651	S	S	*	*			trans	-92.8	84.2	162.6	-68	-62.3	0	0	0	109.1	V244 N248	V244-H246 VanDerWaalsContact C-N 3.32Å; V244-H246 VanDerWaalsContact CG1-NE2 3.35Å; V244-H246 WeakPolarHBondContact CG1-NE2 3.46Å; V244-H246 PolarHBondContact O-N 3.27Å; H246-N248 PolarHBondContact O-N 3.38Å
247	L	43.2	Very low	41.3	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	65%	0.645	S	S	*	*			trans	-63.1	27.9	172.6	-97.3	152.9	0	0	0	114.2	N245	N245-L247 PolarHBondContact O-N 3.18Å
248	N	44.9	Very low	41.4	Very low	151 Å²	151	131.1 Å²	131.1	81%	0.807	65%	0.646	S	S	*	*			trans	-147.7	42.4	-174.6	-118	-10.2	0	0	0	113.5	H246	H246-N248 PolarHBondContact O-N 3.38Å
249	S	43.7	Very low	41.5	Very low	63 Å²	63	130.6 Å²	130.6	44%	0.441	64%	0.643	S	S	.	*			trans	-86.2	122.7	167.2	171.1	0	0	0	0	109.9	H251 W252	S249-H251 PolarHBondContact O-N 3.47Å; S249-H251 VanDerWaalsContact OG-CB 3.29Å; S249-H251 WeakPolarHBondContact OG-CB 3.3Å; S249-H251 PolarHBondContact OG-N 3.47Å; S249-W252 PolarHBondContact O-N 3.31Å; S249-W252 VanDerWaalsContact O-N 3.07Å
250	E	45.3	Very low	40.9	Very low	158 Å²	158	127.5 Å²	127.5	74%	0.738	64%	0.636	S	S	*	*	H	α-helix	trans	-48.1	-18.4	172.3	-75.8	-91.5	138.5	0	0	113.7	W252	E250-W252 VanDerWaalsContact C-N 3.34Å; E250-W252 PolarHBondContact O-N 2.97Å
251	H	42.7	Very low	40.6	Very low	129 Å²	129	131 Å²	131	60%	0.597	64%	0.64	S	S	*	*	H	α-helix	trans	-57.4	-42	174.3	-170.9	88.1	0	0	0	112.7	S249 T255	S249-H251 PolarHBondContact O-N 3.47Å; S249-H251 VanDerWaalsContact OG-CB 3.29Å; S249-H251 WeakPolarHBondContact OG-CB 3.3Å; S249-H251 PolarHBondContact OG-N 3.47Å; H251-T255 PolarHBondContact O-OG1 3.31Å
252	W	34.6	Very low	40.2	Very low	180 Å²	180	131.1 Å²	131.1	68%	0.682	64%	0.638	S	S	*	*	H	α-helix	trans	-78.5	-28.8	-175.6	-66.9	108.8	0	0	0	113.7	S249 E250 K254 E256	S249-W252 PolarHBondContact O-N 3.31Å; S249-W252 VanDerWaalsContact O-N 3.07Å; E250-W252 VanDerWaalsContact C-N 3.34Å; E250-W252 PolarHBondContact O-N 2.97Å; W252-K254 VanDerWaalsContact C-N 3.26Å; W252-K254 PolarHBondContact O-N 3.3Å; W252-E256 PolarHBondContact O-N 2.65Å
253	R	40.2	Very low	40	Very low	160 Å²	160	134.2 Å²	134.2	60%	0.604	64%	0.644	S	S	*	*	H	α-helix	trans	-67.4	-25.8	176.7	-89.3	-176.3	155.7	-125.6	-8.2	113.6
254	K	39	Very low	39.5	Very low	164 Å²	164	133.5 Å²	133.5	71%	0.713	64%	0.644	S	S	*	*	H	α-helix	trans	-78.2	-37.3	-177.5	-136.9	176	-176.3	-179.2	0	111.4	W252 K257 Q258	W252-K254 VanDerWaalsContact C-N 3.26Å; W252-K254 PolarHBondContact O-N 3.3Å; K254-K257 PolarHBondContact O-N 2.8Å; K254-Q258 PolarHBondContact O-N 2.78Å
255	T	40.7	Very low	39	Very low	66 Å²	66	137 Å²	137	41%	0.405	66%	0.655	S	S	.	*	H	α-helix	trans	-67.1	-40.8	178.1	-45.5	0	0	0	0	111.9	H251 K257 Q258 I259	H251-T255 PolarHBondContact O-OG1 3.31Å; T255-K257 PolarHBondContact O-N 3.42Å; T255-Q258 PolarHBondContact O-N 3.44Å; T255-I259 HydrophobicContact CG2-CD1 4.35Å; T255-I259 WeakPolarHBondContact O-CG1 3.29Å; T255-I259 PolarHBondContact O-N 3.5Å
256	E	41.3	Very low	38.4	Very low	148 Å²	148	137.9 Å²	137.9	69%	0.692	65%	0.654	S	S	*	*	H	α-helix	trans	-63.9	-39.3	175.4	-76.3	-177.7	153.9	0	0	112.9	W252 Q258 G260	W252-E256 PolarHBondContact O-N 2.65Å; E256-Q258 VanDerWaalsContact C-N 3.32Å; E256-Q258 PolarHBondContact O-N 3.42Å; E256-G260 PolarHBondContact O-N 3.35Å
257	K	42.6	Very low	38	Very low	148 Å²	148	136.9 Å²	136.9	64%	0.643	66%	0.66	S	S	*	*	H	α-helix	trans	-67.3	-34.1	176.7	-80.9	-174.8	176.8	-178.4	0	112.2	K254 T255 G260	K254-K257 PolarHBondContact O-N 2.8Å; T255-K257 PolarHBondContact O-N 3.42Å; K257-G260 PolarHBondContact O-N 3.37Å
258	Q	39.4	Very low	37.5	Very low	124 Å²	124	139 Å²	139	58%	0.579	67%	0.666	S	S	*	*	H	α-helix	trans	-70.5	-40.1	-177.5	-165.8	153.6	-21.7	0	0	111.9	K254 T255 E256 G260 W261	K254-Q258 PolarHBondContact O-N 2.78Å; T255-Q258 PolarHBondContact O-N 3.44Å; E256-Q258 VanDerWaalsContact C-N 3.32Å; E256-Q258 PolarHBondContact O-N 3.42Å; Q258-G260 VanDerWaalsContact C-N 3.31Å; Q258-G260 PolarHBondContact O-N 3.42Å; Q258-W261 PolarHBondContact O-N 2.99Å
259	I	42	Very low	36.7	Very low	101 Å²	101	135 Å²	135	52%	0.518	66%	0.66	S	S	.	*	H	α-helix	trans	-62.4	-38.7	174.9	-64.4	161.9	0	0	0	111.1	T255 W261 E262 E263	T255-I259 HydrophobicContact CG2-CD1 4.35Å; T255-I259 WeakPolarHBondContact O-CG1 3.29Å; T255-I259 PolarHBondContact O-N 3.5Å; I259-W261 VanDerWaalsContact C-N 3.29Å; I259-W261 PolarHBondContact O-N 2.62Å; I259-E262 PolarHBondContact O-N 3.47Å; I259-E263 PolarHBondContact O-N 3.2Å
260	G	32.5	Very low	35.9	Very low	44 Å²	44	139.4 Å²	139.4	45%	0.454	68%	0.679	S	S	.	*	H	α-helix	trans	-68.4	-17.3	179.7	0	0	0	0	0	116	E256 K257 Q258	E256-G260 PolarHBondContact O-N 3.35Å; K257-G260 PolarHBondContact O-N 3.37Å; Q258-G260 VanDerWaalsContact C-N 3.31Å; Q258-G260 PolarHBondContact O-N 3.42Å
261	W	31.6	Very low	35.6	Very low	199 Å²	199	138.4 Å²	138.4	75%	0.754	68%	0.684	S	S	*	*	H	α-helix	trans	-93.9	-23.2	176.2	-73.4	105.7	0	0	0	113.2	Q258 I259	Q258-W261 PolarHBondContact O-N 2.99Å; I259-W261 VanDerWaalsContact C-N 3.29Å; I259-W261 PolarHBondContact O-N 2.62Å
262	E	32.9	Very low	34.9	Very low	132 Å²	132	139 Å²	139	62%	0.617	70%	0.696	S	S	*	*	H	α-helix	trans	-84.4	-16.1	179.7	-86.5	160.6	156.3	0	0	113.4	I259	I259-E262 PolarHBondContact O-N 3.47Å
263	E	33.8	Very low	34.7	Very low	163 Å²	163	135.4 Å²	135.4	76%	0.762	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-6.8	179.4	-144.5	166	-159.5	0	0	114	I259	I259-E263 PolarHBondContact O-N 3.2Å
264	L	34.3	Very low	34	Very low	131 Å²	131	130.9 Å²	130.9	69%	0.686	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	0	-175.3	-122.9	86.4	0	0	0	115.7
265	H	32	Very low	33.6	Very low	154 Å²	154	130.2 Å²	130.2	71%	0.713	71%	0.706	S	S	*	*			trans	-137.5	63.7	-173.7	-70.6	-54.6	0	0	0	114.7
266	H	29.1	Very low	32.9	Very low	172 Å²	172	130.7 Å²	130.7	80%	0.796	72%	0.723	S	S	*	*			trans	-139.6	112.6	155.9	-68.9	90.5	0	0	0	109.4
267	P	32.2	Very low	32.4	Very low	128 Å²	128	132.2 Å²	132.2	83%	0.831	73%	0.733	S	S	*	*			trans	-77.9	143.2	177.8	31.4	-30.3	0	0	0	110.8
268	E	33	Very low	31.8	Very low	204 Å²	204	131.1 Å²	131.1	95%	0.953	74%	0.738	S	S	*	*			trans	-52.3	137.7	176.6	-77.7	147.8	131.3	0	0	113.9
269	G	27.4	Very low	31.4	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	75%	0.751	S	S	*	*			trans	176.9	117.1	168.5	0	0	0	0	0	112.9
270	D	27.4	Very low	30.7	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	77%	0.766	S	S	*	*			trans	84.5	92.6	157.3	-58.8	-16.7	0	0	0	120.9
271	V	38.4	Very low	30.4	Very low	138 Å²	138	141.2 Å²	141.2	84%	0.836	78%	0.78	S	S	*	*			trans	12.8	112.6	130.6	-173.4	0	0	0	0	116.8
272	V	27.9	Very low	30.1	Very low	140 Å²	140	137.3 Å²	137.3	85%	0.848	78%	0.78	S	S	*	*			trans	-131.2	111.4	151.2	177.6	0	0	0	0	109.9
273	S	31.8	Very low	30	Very low	106 Å²	106	138.4 Å²	138.4	74%	0.741	79%	0.785	S	S	*	*			trans	-72	140.8	164.8	-174.7	0	0	0	0	109.9
274	G	25.3	Very low	29.6	Very low	65 Å²	65	136.1 Å²	136.1	67%	0.67	79%	0.787	S	S	*	*			trans	-177.3	57.3	-179.3	0	0	0	0	0	116.9
275	N	30.6	Very low	29.3	Very low	150 Å²	150	137.3 Å²	137.3	80%	0.802	79%	0.789	S	S	*	*			trans	62.4	104.2	141.6	-52.2	-12.8	0	0	0	119.9
276	G	26.4	Very low	29	Very low	75 Å²	75	137.6 Å²	137.6	77%	0.773	80%	0.795	S	S	*	*			trans	-70.4	133.7	158.7	0	0	0	0	0	111.9	T278	G276-T278 PolarHBondContact O-N 3.01Å
277	M	30.8	Very low	28.9	Very low	181 Å²	181	132.8 Å²	132.8	89%	0.892	79%	0.791	S	S	*	*			trans	-73.9	119.7	174.8	-71.4	-72	-75.4	0	0	109.8	E279	M277-E279 PolarHBondContact O-N 2.9Å
278	T	28.8	Very low	28.6	Very low	124 Å²	124	135 Å²	135	76%	0.761	79%	0.791	S	S	*	*			trans	-77.3	112	168.6	-57	0	0	0	0	107.9	G276 L280	G276-T278 PolarHBondContact O-N 3.01Å; T278-L280 PolarHBondContact O-N 3.47Å
279	E	31.3	Very low	28.2	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	79%	0.786	S	S	*	*			trans	-74.7	115	170.5	-85.5	-173.3	146.1	0	0	110.2	M277 L281	M277-E279 PolarHBondContact O-N 2.9Å; E279-L281 PolarHBondContact O-N 3.25Å
280	L	26.6	Very low	28	Very low	162 Å²	162	139 Å²	139	85%	0.848	80%	0.796	S	S	*	*			trans	-76.8	106.4	163.6	-73.5	166.9	0	0	0	108.3	T278 P282	T278-L280 PolarHBondContact O-N 3.47Å; L280-P282 WeakPolarHBondContact O-CD 3.3Å
281	L	25.9	Very low	27.8	Very low	141 Å²	141	137.6 Å²	137.6	74%	0.738	79%	0.793	S	S	*	*			trans	-63.4	137.1	168.7	-127.1	100.1	0	0	0	110.7	E279 Q283	E279-L281 PolarHBondContact O-N 3.25Å; L281-Q283 HydrophobicContact CD2-CG 4.15Å
282	P	26.9	Very low	27.2	Very low	117 Å²	117	136.6 Å²	136.6	76%	0.76	79%	0.792	S	S	*	*			trans	-98	115	144.3	-6.1	25.3	0	0	0	108.5	L280 S284	L280-P282 WeakPolarHBondContact O-CD 3.3Å; P282-S284 PolarHBondContact O-N 3.38Å
283	Q	30	Very low	27.3	Very low	155 Å²	155	138.7 Å²	138.7	72%	0.724	79%	0.792	S	S	*	*			trans	-60.1	121.4	166.9	-76.4	177.6	-28.1	0	0	109.9	L281	L281-Q283 HydrophobicContact CD2-CG 4.15Å
284	S	25.7	Very low	27.1	Very low	114 Å²	114	141.9 Å²	141.9	80%	0.797	80%	0.795	S	S	*	*			trans	-130.8	106.9	153.3	61.4	0	0	0	0	108.7	P282 L286	P282-S284 PolarHBondContact O-N 3.38Å; S284-L286 PolarHBondContact O-N 3.34Å
285	H	26.9	Very low	27.3	Very low	156 Å²	156	148.3 Å²	148.3	72%	0.722	81%	0.808	S	S	*	*			trans	-66.6	119.8	172.9	-64.9	-94.8	0	0	0	110
286	L	26.8	Very low	27.2	Very low	161 Å²	161	150 Å²	150	84%	0.843	81%	0.811	S	S	*	*			trans	-154.6	104.9	147.3	-140.2	80	0	0	0	108.8	S284	S284-L286 PolarHBondContact O-N 3.34Å
287	G	26.2	Very low	27	Very low	70 Å²	70	155.1 Å²	155.1	72%	0.722	81%	0.812	S	S	*	*			trans	-80.7	129.1	178	0	0	0	0	0	111.1
288	H	25.9	Very low	26.6	Very low	176 Å²	176	152.3 Å²	152.3	82%	0.815	81%	0.809	S	S	*	*			trans	-138.8	116.7	153.5	-85.9	-82.8	0	0	0	108.7
289	Q	24.6	Very low	26.4	Very low	184 Å²	184	151 Å²	151	86%	0.86	80%	0.804	S	S	*	*			trans	-82.3	122	-177.8	-168.8	166.4	35.4	0	0	108.6
290	L	23.9	Very low	26.3	Very low	171 Å²	171	151.4 Å²	151.4	90%	0.895	81%	0.806	S	S	*	*			trans	-115.2	109.3	162.4	-112.4	103.7	0	0	0	109.2
291	T	24	Very low	26.2	Very low	124 Å²	124	151.2 Å²	151.2	76%	0.761	81%	0.806	S	S	*	*			trans	-69	127	167.4	39.9	0	0	0	0	110
292	S	25.1	Very low	26.2	Very low	118 Å²	118	151.4 Å²	151.4	83%	0.825	81%	0.813	S	S	*	*			trans	-130.3	107.7	160.8	-177.1	0	0	0	0	109.5
293	Q	30.7	Very low	26.3	Very low	183 Å²	183	154.4 Å²	154.4	86%	0.855	82%	0.817	S	S	*	*			trans	-78	114.2	164.3	-79	177.6	-15.1	0	0	108.4
294	H	27.8	Very low	26.2	Very low	173 Å²	173	152.9 Å²	152.9	80%	0.801	82%	0.818	S	S	*	*			trans	-168	101.2	141.7	-114.3	58.3	0	0	0	109.7
295	Q	28.5	Very low	26.3	Very low	201 Å²	201	154.4 Å²	154.4	94%	0.939	81%	0.813	S	S	*	*			trans	-94	107.2	162.2	-87.8	179.2	-25	0	0	107.6
296	Q	28	Very low	26.3	Very low	186 Å²	186	154.3 Å²	154.3	87%	0.869	81%	0.81	S	S	*	*			trans	-86.7	111.8	168.8	-161.9	155.3	4.3	0	0	108.6
297	K	22.9	Very low	26.3	Very low	182 Å²	182	154 Å²	154	79%	0.791	81%	0.81	S	S	*	*			trans	-76	123.9	-176.4	-174.6	173	-178.9	178.4	0	109.9
298	C	21.3	Very low	26.4	Very low	122 Å²	122	155 Å²	155	82%	0.824	81%	0.811	S	S	*	*			trans	-81.9	129.4	166.3	-158.7	0	0	0	0	108.2
299	S	24.8	Very low	26.5	Very low	95 Å²	95	156.7 Å²	156.7	66%	0.664	82%	0.816	S	S	*	*			trans	-144	123.1	169.5	-65	0	0	0	0	108.8
300	Q	29.9	Very low	26.7	Very low	188 Å²	188	155.8 Å²	155.8	88%	0.879	81%	0.812	S	S	*	*			trans	-96.4	140.6	172.6	-76	179	-35.8	0	0	109.3
301	D	23.6	Very low	26.9	Very low	159 Å²	159	154.5 Å²	154.5	85%	0.85	81%	0.806	S	S	*	*			trans	-66.5	136.4	167	-77.4	-44.3	0	0	0	112
302	V	27.9	Very low	27.2	Very low	144 Å²	144	155.1 Å²	155.1	87%	0.873	80%	0.801	S	S	*	*			trans	-149.8	116	142.5	178	0	0	0	0	108.1
303	E	27.7	Very low	27.3	Very low	180 Å²	180	157.3 Å²	157.3	84%	0.841	80%	0.802	S	S	*	*			trans	-70	150.1	169	-73.9	179	132.2	0	0	112.3
304	T	27.2	Very low	27	Very low	123 Å²	123	159.7 Å²	159.7	76%	0.755	80%	0.803	S	S	*	*				-164.9	121.2	128	-58.2	0	0	0	0	109.9
305	E	27.9	Very low	27.1	Very low	147 Å²	147	157.7 Å²	157.7	69%	0.687	81%	0.805	S	S	*	*			trans	26.2	142.4	147.3	-64.5	-169.8	134.8	0	0	121.3
306	K	28.2	Very low	27.1	Very low	153 Å²	153	155.6 Å²	155.6	67%	0.665	80%	0.8	S	S	*	*			cis	-171	146.5	32.4	-125.1	153.7	-173.1	145.7	0	110.9
307	D	26.2	Very low	27	Very low	155 Å²	155	153.1 Å²	153.1	83%	0.829	80%	0.797	S	S	*	*			trans	37.8	119.1	151.7	-72.2	-26.5	0	0	0	123.2
308	A	28.4	Very low	27.4	Very low	91 Å²	91	152.9 Å²	152.9	75%	0.752	80%	0.799	S	S	*	*				-170.2	108.9	120	0	0	0	0	0	113
309	F	27.1	Very low	27.5	Very low	212 Å²	212	152.5 Å²	152.5	93%	0.93	80%	0.797	S	S	*	*			trans	57.2	118	147.6	-79.7	-91.7	0	0	0	122.9
310	E	30.3	Very low	27.6	Very low	164 Å²	164	154.4 Å²	154.4	77%	0.766	80%	0.8	S	S	*	*			trans	-60.4	150.5	155.2	-69.8	173.4	116.6	0	0	112.5
311	D	28.2	Very low	27.4	Very low	145 Å²	145	157.1 Å²	157.1	78%	0.775	80%	0.802	S	S	*	*				-156.6	153.8	110.3	-132.4	-14	0	0	0	113.7
312	Q	29.9	Very low	27.6	Very low	137 Å²	137	155.7 Å²	155.7	64%	0.64	80%	0.799	S	S	*	*			trans	-74.9	164	-158.3	-63.8	155.5	65.7	0	0	113.8
313	L	27.6	Very low	28.2	Very low	163 Å²	163	154.3 Å²	154.3	85%	0.853	79%	0.794	S	S	*	*				-177.6	135.4	77.5	-78.7	159.9	0	0	0	110.7
314	R	24.4	Very low	28.2	Very low	234 Å²	234	151.3 Å²	151.3	88%	0.883	79%	0.787	S	S	*	*			trans	-87.7	166	155.4	-60.9	-175.1	179.8	-118.6	3.1	109
315	P	28.7	Very low	28.1	Very low	130 Å²	130	153.8 Å²	153.8	84%	0.844	79%	0.79	S	S	*	*				-146.8	163.2	86.5	31.2	-10.2	0	0	0	116.2
316	L	29.9	Very low	28	Very low	158 Å²	158	157.6 Å²	157.6	83%	0.827	80%	0.798	S	S	*	*			trans	-71.9	153.5	165.1	-178.7	71.3	0	0	0	110.7
317	V	25.8	Very low	27.9	Very low	134 Å²	134	156.1 Å²	156.1	81%	0.812	80%	0.801	S	S	*	*				170.4	133.8	129.8	158	0	0	0	0	112
318	H	29.6	Very low	28.3	Very low	177 Å²	177	158 Å²	158	82%	0.819	80%	0.803	S	S	*	*			trans	-71.2	151.6	170.7	-131.6	52.6	0	0	0	111.6
319	S	24.9	Very low	28.1	Very low	114 Å²	114	161.3 Å²	161.3	80%	0.797	81%	0.808	S	S	*	*			trans	-160	144.8	146.6	-156.5	0	0	0	0	113.8
320	D	25.3	Very low	28.2	Very low	135 Å²	135	156.6 Å²	156.6	72%	0.722	80%	0.796	S	S	*	*			trans	-57.6	154	-170.2	-63.6	-53.2	0	0	0	118.3
321	R	26.6	Very low	27.9	Very low	244 Å²	244	154.8 Å²	154.8	92%	0.921	80%	0.801	S	S	*	*				163.1	119.8	107.6	-91.1	-177.8	171.8	172.9	-3.1	113.6
322	T	28.7	Very low	27.8	Very low	129 Å²	129	159 Å²	159	79%	0.791	81%	0.807	S	S	*	*			trans	-69.9	166.4	157.9	41.4	0	0	0	0	111.8
323	P	39	Very low	27.7	Very low	116 Å²	116	158.9 Å²	158.9	75%	0.753	81%	0.814	S	S	*	*			cis	-155	155.8	43.5	38.5	-14.1	0	0	0	121.7
324	V	27.6	Very low	27.6	Very low	117 Å²	117	159.2 Å²	159.2	71%	0.709	81%	0.812	S	S	*	*			trans	39.8	123.4	133.5	-169.1	0	0	0	0	122.7
325	H	25.8	Very low	27.6	Very low	174 Å²	174	156.6 Å²	156.6	81%	0.806	81%	0.809	S	S	*	*				168.8	106.4	122.7	-94.2	-72.8	0	0	0	108.9
326	R	25.6	Very low	28.6	Very low	227 Å²	227	155.3 Å²	155.3	86%	0.857	80%	0.801	S	S	*	*				75.4	124.6	79.3	-135.6	-165.7	-167.4	174	5	116
327	V	25.5	Very low	28.3	Very low	122 Å²	122	156.2 Å²	156.2	74%	0.739	81%	0.806	S	S	*	*			trans	102.8	127.8	150	-164.9	0	0	0	0	118
328	F	35.4	Very low	28.4	Very low	196 Å²	196	157.7 Å²	157.7	86%	0.86	80%	0.804	S	S	*	*			trans	-69.4	150.9	178.4	-72.1	-102.8	0	0	0	113.2
329	D	23.7	Very low	28.4	Very low	160 Å²	160	153.8 Å²	153.8	86%	0.856	80%	0.796	S	S	*	*			trans	-151.3	150.4	137.2	-144.6	-9.8	0	0	0	112.9
330	V	29.1	Very low	28.7	Very low	112 Å²	112	153.1 Å²	153.1	68%	0.679	79%	0.791	S	S	*	*			trans	-89.6	147.9	-172.4	173.1	0	0	0	0	109.8
331	S	25.5	Very low	28.9	Very low	126 Å²	126	155 Å²	155	88%	0.881	80%	0.795	S	S	*	*			trans	-165.7	136.4	142.2	-85.9	0	0	0	0	114
332	R	26.1	Very low	29	Very low	235 Å²	235	148 Å²	148	89%	0.887	78%	0.78	S	S	*	*			trans	-70.6	169.7	179.3	-72.1	164	124	153.4	-4.4	113.4
333	V	26.4	Very low	29.2	Very low	133 Å²	133	150.1 Å²	150.1	81%	0.806	78%	0.781	S	S	*	*			trans	144.7	99.4	138.2	167	0	0	0	0	107.4
334	E	25.1	Very low	28.9	Very low	171 Å²	171	154.5 Å²	154.5	80%	0.799	78%	0.783	S	S	*	*				88.2	95.5	68.9	-157.6	168.3	-132.7	0	0	114.5
335	Q	26.1	Very low	29	Very low	178 Å²	178	155.8 Å²	155.8	83%	0.832	78%	0.783	S	S	*	*			trans	46.8	-170.7	144	-50.7	-165	-26.6	0	0	122.2
336	P	49.4	Very low	29.3	Very low	103 Å²	103	154.3 Å²	154.3	67%	0.669	78%	0.78	S	S	*	*				-123.8	-175.5	-102.9	38.5	-17.9	0	0	0	112.8
337	L	24.2	Very low	29.6	Very low	177 Å²	177	147.4 Å²	147.4	93%	0.927	77%	0.771	S	S	*	*			trans	164.3	166.2	157.4	-92.3	150.3	0	0	0	109
338	H	26.9	Very low	29.8	Very low	166 Å²	166	150.9 Å²	150.9	77%	0.769	78%	0.776	S	S	*	*				-164.9	158.9	-67.1	-175.5	-95.3	0	0	0	106.3
339	S	28.7	Very low	29.4	Very low	94 Å²	94	149.4 Å²	149.4	66%	0.657	77%	0.774	S	S	*	*			trans	79.6	150.4	159	112.7	0	0	0	0	117.7
340	S	31.1	Very low	29.6	Very low	100 Å²	100	145.4 Å²	145.4	70%	0.699	77%	0.77	S	S	*	*			cis	-177.5	153.7	-3	42	0	0	0	0	107.8
341	H	29.7	Very low	29.8	Very low	174 Å²	174	148.4 Å²	148.4	81%	0.806	78%	0.777	S	S	*	*				176.8	144.2	122.9	-143.5	-93.9	0	0	0	112.7
342	T	30.5	Very low	29.9	Very low	99 Å²	99	147 Å²	147	61%	0.607	77%	0.768	S	S	*	*			trans	-67.4	166.6	-179.6	45.8	0	0	0	0	113.5
343	E	32.3	Very low	30	Very low	172 Å²	172	143 Å²	143	80%	0.804	76%	0.764	S	S	*	*			cis	-179.3	127.6	44.7	-145.8	160.7	-178.1	0	0	108.7
344	R	32.1	Very low	30.2	Very low	209 Å²	209	142.8 Å²	142.8	79%	0.789	76%	0.763	S	S	*	*				52.9	118.5	98.1	-121.3	173.7	-165	-174.1	11	116.7
345	M	29.6	Very low	30.3	Very low	144 Å²	144	144.7 Å²	144.7	71%	0.709	77%	0.768	S	S	*	*				176.8	126.5	82.2	-82	-95.6	177.8	0	0	108.1
346	L	32.5	Very low	30.6	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	77%	0.766	S	S	*	*				92.2	118.1	73.4	-100.3	162.5	0	0	0	117.6
347	A	30.8	Very low	29.4	Very low	82 Å²	82	151.7 Å²	151.7	68%	0.678	78%	0.781	S	S	*	*			trans	71.4	151.4	136.6	0	0	0	0	0	119.8
348	K	31.6	Very low	29.7	Very low	194 Å²	194	149.5 Å²	149.5	84%	0.843	77%	0.77	S	S	*	*			cis	-173.4	156.3	13.5	-132	174.8	-177.9	-178.2	0	110.5
349	M	26.9	Very low	30.9	Very low	166 Å²	166	146.2 Å²	146.2	82%	0.818	76%	0.763	S	S	*	*			trans	65	134.3	135	-151.1	71	-175.1	0	0	123.4
350	G	27.1	Very low	30.9	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	77%	0.769	S	S	*	*			trans	166.4	108	149.8	0	0	0	0	0	115.2
351	Q	32.7	Very low	30.9	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.822	77%	0.768	S	S	*	*			trans	-91.3	159.5	171.6	-89.3	-178.7	5.5	0	0	112.6
352	S	27.6	Very low	30.9	Very low	97 Å²	97	150.2 Å²	150.2	68%	0.678	77%	0.769	S	S	*	*			trans	64.8	127.6	152.2	85.9	0	0	0	0	121.3
353	D	29.1	Very low	30.8	Very low	151 Å²	151	149.1 Å²	149.1	81%	0.807	78%	0.777	S	S	*	*				-171.3	153.2	101.6	-92.7	-8.1	0	0	0	114.1
354	T	30.2	Very low	30.8	Very low	127 Å²	127	146.9 Å²	146.9	78%	0.779	78%	0.781	S	S	*	*			trans	-71.9	156.9	-170.3	46.5	0	0	0	0	117.7
355	K	27.9	Very low	30.8	Very low	211 Å²	211	141.1 Å²	141.1	92%	0.917	78%	0.778	S	S	*	*				-171.2	129.6	119	-129	171.4	-179.7	173	0	114.9
356	E	31.3	Very low	31	Very low	167 Å²	167	139.9 Å²	139.9	78%	0.78	78%	0.783	S	S	*	*			trans	-85.1	157.5	166.3	-67.1	176.5	136.5	0	0	112.6
357	W	24.3	Very low	31.5	Very low	261 Å²	261	137.4 Å²	137.4	99%	0.989	78%	0.784	S	S	*	*				-157.7	136.2	128.5	-141.9	48.1	0	0	0	112
358	L	31.5	Very low	32.4	Very low	131 Å²	131	139.2 Å²	139.2	69%	0.686	79%	0.788	S	S	*	*			trans	-93	-158.1	-173.7	-83.3	158.7	0	0	0	111.7
359	P	52.4	Low	32.5	Very low	98 Å²	98	136 Å²	136	64%	0.636	79%	0.785	S	S	*	*				-134.6	-171	-62.6	38.6	-21.4	0	0	0	112.5
360	N	27.7	Very low	33.2	Very low	147 Å²	147	135.8 Å²	135.8	79%	0.786	79%	0.785	S	S	*	*			trans	158.4	141.9	146.9	-78.5	-21.5	0	0	0	107.8
361	L	30.6	Very low	33.7	Very low	129 Å²	129	137.4 Å²	137.4	68%	0.675	79%	0.785	S	S	*	*			cis	-168.8	142.4	19.5	-156.2	70.1	0	0	0	109.7
362	E	29.7	Very low	34.3	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	82%	0.815	S	S	*	*			trans	37.3	143.2	143.8	-64.3	162.1	154.1	0	0	122.2
363	G	29	Very low	34.6	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	82%	0.822	S	S	*	*			cis	-173.7	174.7	21.2	0	0	0	0	0	116.2
364	S	31.3	Very low	34.9	Very low	125 Å²	125	138.8 Å²	138.8	87%	0.874	82%	0.823	S	S	*	*			trans	-81.1	159.2	-172.2	-48.2	0	0	0	0	115.2
365	A	32.4	Very low	35.2	Very low	88 Å²	88	139.5 Å²	139.5	73%	0.727	83%	0.825	S	S	*	*				164.4	111.8	122.1	0	0	0	0	0	110.3
366	S	35	Very low	35.6	Very low	118 Å²	118	135.3 Å²	135.3	83%	0.825	82%	0.82	S	S	*	*				91.3	115.9	85.8	-56.3	0	0	0	0	113.7
367	A	41.7	Very low	35.9	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	82%	0.822	S	S	*	*			trans	-66.1	171	160.7	0	0	0	0	0	111.7
368	P	49.9	Very low	36.6	Very low	119 Å²	119	124.8 Å²	124.8	77%	0.773	81%	0.811	S	S	*	*				-136	143.1	119	35.5	-24	0	0	0	114.5
369	V	35	Very low	37	Very low	127 Å²	127	124.4 Å²	124.4	77%	0.77	82%	0.82	S	S	*	*			trans	-81.9	133.5	152.7	170.1	0	0	0	0	107.3
370	I	39.9	Very low	35.8	Very low	161 Å²	161	126.4 Å²	126.4	83%	0.826	83%	0.834	S	S	*	*			trans	-138.5	120.3	151.9	-62.4	-178.4	0	0	0	107.9
371	S	37.8	Very low	36.5	Very low	109 Å²	109	124.7 Å²	124.7	76%	0.762	84%	0.838	S	S	*	*			trans	-95.4	140.9	160.1	-60	0	0	0	0	109
372	A	45.7	Very low	37	Very low	177 Å²	177	124.3 Å²	124.3	100%	1.463	85%	0.853	S	S	*	*			trans	177.2	0	138.7	0	0	0	0	0	109

Retrieved 372 of 372 residues in 338 ms (Link to these results)

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