A0A087XRP0_POEFO Loading...

Nucleus accumbens associated 1

AlphaFold DB , UniProt , Accession A0A087XRP0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56.5	Low	82.6	Confident	242 Å²	242	144.3 Å²	144.3	100%	1.192	80%	0.799	S	S	*	*				0	136.6	0	-54.2	173.5	-151.5	0	0	107
2	A	65.4	Low	83.5	Confident	98 Å²	98	142.4 Å²	142.4	81%	0.81	78%	0.777	S	S	*	*			trans	-79.9	129.9	173	0	0	0	0	0	109.3
3	Q	72.4	Confident	84.2	Confident	188 Å²	188	135.2 Å²	135.2	88%	0.879	76%	0.756	S	S	*	*			trans	-86.9	124.4	171.7	-72	179.8	-15.4	0	0	109.1
4	T	84.6	Confident	84.8	Confident	113 Å²	113	133.1 Å²	133.1	69%	0.693	74%	0.742	S	S	*	*			trans	-102.4	115.4	176.3	42.2	0	0	0	0	110
5	L	85.9	Confident	85.4	Confident	177 Å²	177	130.1 Å²	130.1	93%	0.927	73%	0.725	S	S	*	*			trans	-80.8	136.8	166.9	-61.2	178.5	0	0	0	109.1
6	Q	88.5	Confident	86.1	Confident	183 Å²	183	125.8 Å²	125.8	86%	0.855	70%	0.702	S	S	*	*			trans	-133.5	143.2	177.4	-66	-174	-5.2	0	0	109.7
7	M	90.5	Very high	86.7	Confident	171 Å²	171	121.5 Å²	121.5	84%	0.842	68%	0.677	S	S	*	*			trans	-134.7	132	176.1	179.4	175.8	67.9	0	0	108.3
8	A	91.4	Very high	87.2	Confident	95 Å²	95	120.9 Å²	120.9	79%	0.785	67%	0.668	S	S	*	*			trans	-118.6	122.9	176.7	0	0	0	0	0	109.4
9	I	91.5	Very high	87.7	Confident	101 Å²	101	117.7 Å²	117.7	52%	0.518	66%	0.655	S	S	.	*			trans	-85.9	120.4	176.3	-60.5	175	0	0	0	107.9	F12	I9-F12 HydrophobicContact CB-CB 4.18Å; I9-F12 HydrophobicContact CB-CD2 4.5Å; I9-F12 HydrophobicContact CD1-CD2 4.48Å; I9-F12 HydrophobicContact CG2-CB 4.21Å; I9-F12 HydrophobicContact CG2-CD2 4.43Å; I9-F12 WeakPolarHBondContact O-CB 3.36Å
10	P	91.7	Very high	88.2	Confident	105 Å²	105	114 Å²	114	68%	0.682	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	146.3	179.2	27.5	-34.6	0	0	0	110.8	F12	P10-F12 PolarHBondContact O-N 3.3Å
11	N	90.7	Very high	88.7	Confident	114 Å²	114	109.9 Å²	109.9	61%	0.61	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.8	9.2	178.7	-59.7	-28.9	0	0	0	116.7	G13 N14 N15	N11-G13 VanDerWaalsContact C-N 3.27Å; N11-G13 PolarHBondContact O-N 3.17Å; N11-G13 VanDerWaalsContact O-N 3.08Å; N11-N14 WeakPolarHBondContact O-CB 3.35Å; N11-N14 PolarHBondContact O-N 2.67Å; N11-N15 PolarHBondContact O-N 2.88Å; N11-N15 PolarHBondContact O-OD1 3.1Å
12	F	93.4	Very high	90.6	Very high	122 Å²	122	103.5 Å²	103.5	54%	0.535	58%	0.577	S	S	.	*	H	α-helix	trans	-48.4	-43.2	-175.9	179	-101.5	0	0	0	114.2	I9 P10 N14 N15 V16	I9-F12 HydrophobicContact CB-CB 4.18Å; I9-F12 HydrophobicContact CB-CD2 4.5Å; I9-F12 HydrophobicContact CD1-CD2 4.48Å; I9-F12 HydrophobicContact CG2-CB 4.21Å; I9-F12 HydrophobicContact CG2-CD2 4.43Å; I9-F12 WeakPolarHBondContact O-CB 3.36Å; P10-F12 PolarHBondContact O-N 3.3Å; F12-N14 VanDerWaalsContact C-N 3.33Å; F12-N14 PolarHBondContact O-N 2.7Å; F12-N15 PolarHBondContact O-N 3.37Å; F12-V16 HydrophobicContact CD1-CG2 4.25Å; F12-V16 HydrophobicContact CE1-CG2 3.85Å; F12-V16 HydrophobicContact CE2-CG2 4.12Å; F12-V16 HydrophobicContact CZ-CG2 3.77Å; F12-V16 WeakPolarHBondContact O-CG2 3.32Å; F12-V16 PolarHBondContact O-N 3.34Å
13	G	92.7	Very high	92.1	Very high	49 Å²	49	101.5 Å²	101.5	51%	0.505	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-32.4	178	0	0	0	0	0	114.4	N11 L17	N11-G13 VanDerWaalsContact C-N 3.27Å; N11-G13 PolarHBondContact O-N 3.17Å; N11-G13 VanDerWaalsContact O-N 3.08Å; G13-L17 WeakPolarHBondContact O-CB 3.08Å; G13-L17 PolarHBondContact O-N 2.84Å
14	N	92.4	Very high	93.3	Very high	105 Å²	105	94.3 Å²	94.3	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-70.8	-46.4	177	-61.8	-13.7	0	0	0	110.1	N11 F12 V16 L17 E18	N11-N14 WeakPolarHBondContact O-CB 3.35Å; N11-N14 PolarHBondContact O-N 2.67Å; F12-N14 VanDerWaalsContact C-N 3.33Å; F12-N14 PolarHBondContact O-N 2.7Å; N14-V16 VanDerWaalsContact C-N 3.3Å; N14-V16 PolarHBondContact O-N 3.48Å; N14-L17 PolarHBondContact O-N 2.61Å; N14-L17 VanDerWaalsContact O-N 3.13Å; N14-E18 PolarHBondContact O-N 3.33Å
15	N	93.2	Very high	93.9	Very high	89 Å²	89	94.5 Å²	94.5	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-61	-40.6	178	-56.6	11.2	0	0	0	111	N11 F12 E18 C19	N11-N15 PolarHBondContact O-N 2.88Å; N11-N15 PolarHBondContact O-OD1 3.1Å; F12-N15 PolarHBondContact O-N 3.37Å; N15-E18 PolarHBondContact O-N 3.26Å; N15-C19 PolarHBondContact O-N 3.02Å; N15-C19 PolarHBondContact O-SG 3.49Å; N15-C19 VanDerWaalsContact O-SG 3.32Å
16	V	96.4	Very high	94.4	Very high	61 Å²	61	92.3 Å²	92.3	37%	0.37	50%	0.497	S	S	.	.	H	α-helix	trans	-64.4	-41.7	174.4	169.5	0	0	0	0	111.7	F12 N14 E18 C19 L20	F12-V16 HydrophobicContact CD1-CG2 4.25Å; F12-V16 HydrophobicContact CE1-CG2 3.85Å; F12-V16 HydrophobicContact CE2-CG2 4.12Å; F12-V16 HydrophobicContact CZ-CG2 3.77Å; F12-V16 WeakPolarHBondContact O-CG2 3.32Å; F12-V16 PolarHBondContact O-N 3.34Å; N14-V16 VanDerWaalsContact C-N 3.3Å; N14-V16 PolarHBondContact O-N 3.48Å; V16-E18 VanDerWaalsContact C-N 3.34Å; V16-C19 PolarHBondContact O-N 2.79Å; V16-L20 HydrophobicContact CG1-CD1 4.08Å; V16-L20 VanDerWaalsContact O-CG 3.31Å; V16-L20 WeakPolarHBondContact O-CG 3.48Å; V16-L20 PolarHBondContact O-N 2.79Å
17	L	96.3	Very high	94.7	Very high	52 Å²	52	84.5 Å²	84.5	27%	0.272	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-36.3	178	-170.7	64.6	0	0	0	112.2	G13 N14 L20 N21 V47	G13-L17 WeakPolarHBondContact O-CB 3.08Å; G13-L17 PolarHBondContact O-N 2.84Å; N14-L17 PolarHBondContact O-N 2.61Å; N14-L17 VanDerWaalsContact O-N 3.13Å; L17-L20 PolarHBondContact O-N 3.34Å; L17-N21 PolarHBondContact O-N 3.23Å; L17-V47 HydrophobicContact CD1-CG1 4.47Å
18	E	96.1	Very high	94.9	Very high	111 Å²	111	79.9 Å²	79.9	52%	0.519	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-47.9	174.6	-170.2	151.7	-119.1	0	0	111.6	N14 N15 V16 L20 N21 E22	N14-E18 PolarHBondContact O-N 3.33Å; N15-E18 PolarHBondContact O-N 3.26Å; V16-E18 VanDerWaalsContact C-N 3.34Å; E18-L20 VanDerWaalsContact C-N 3.3Å; E18-L20 PolarHBondContact O-N 2.8Å; E18-N21 WeakPolarHBondContact O-CA 3.47Å; E18-N21 VanDerWaalsContact O-CB 3.29Å; E18-N21 WeakPolarHBondContact O-CB 3.41Å; E18-N21 PolarHBondContact O-N 2.71Å; E18-E22 PolarHBondContact O-N 3.17Å
19	C	97	Very high	95.1	Very high	60 Å²	60	84 Å²	84	41%	0.405	44%	0.441	S	S	.	.	H	α-helix	trans	-57.4	-39.7	171.7	-68.9	0	0	0	0	112.8	N15 V16 N21 E22 Q23	N15-C19 PolarHBondContact O-N 3.02Å; N15-C19 PolarHBondContact O-SG 3.49Å; N15-C19 VanDerWaalsContact O-SG 3.32Å; V16-C19 PolarHBondContact O-N 2.79Å; C19-N21 VanDerWaalsContact C-N 3.29Å; C19-N21 PolarHBondContact O-N 2.81Å; C19-E22 PolarHBondContact O-N 2.83Å; C19-Q23 WeakPolarHBondContact O-CB 3.21Å; C19-Q23 WeakPolarHBondContact O-CG 3.18Å; C19-Q23 PolarHBondContact O-N 2.9Å
20	L	97.8	Very high	95.3	Very high	44 Å²	44	80.7 Å²	80.7	23%	0.23	43%	0.426	C	S	.	.	H	α-helix	trans	-66.5	-30	175	-73.6	168.5	0	0	0	112.4	V16 L17 E18 R24 H44 V47 Y87	V16-L20 HydrophobicContact CG1-CD1 4.08Å; V16-L20 VanDerWaalsContact O-CG 3.31Å; V16-L20 WeakPolarHBondContact O-CG 3.48Å; V16-L20 PolarHBondContact O-N 2.79Å; L17-L20 PolarHBondContact O-N 3.34Å; E18-L20 VanDerWaalsContact C-N 3.3Å; E18-L20 PolarHBondContact O-N 2.8Å; L20-R24 WeakPolarHBondContact O-CB 3.34Å; L20-R24 PolarHBondContact O-N 3.12Å; L20-H44 PolarHBondContact O-CE1 2.83Å; L20-V47 HydrophobicContact CD1-CG2 4.13Å; L20-Y87 HydrophobicContact CB-CD1 4.33Å; L20-Y87 HydrophobicContact CB-CE1 4.19Å; L20-Y87 WeakPolarHBondContact O-CE1 3.29Å
21	N	97.6	Very high	95.4	Very high	28 Å²	28	79.6 Å²	79.6	15%	0.15	42%	0.415	C	S	.	.	H	α-helix	trans	-72	-41.9	175	-172.2	44.4	0	0	0	111.8	L17 E18 C19 R24 L25 Y87	L17-N21 PolarHBondContact O-N 3.23Å; E18-N21 WeakPolarHBondContact O-CA 3.47Å; E18-N21 VanDerWaalsContact O-CB 3.29Å; E18-N21 WeakPolarHBondContact O-CB 3.41Å; E18-N21 PolarHBondContact O-N 2.71Å; C19-N21 VanDerWaalsContact C-N 3.29Å; C19-N21 PolarHBondContact O-N 2.81Å; N21-R24 WeakPolarHBondContact O-CB 3.37Å; N21-R24 PolarHBondContact O-N 3.02Å; N21-R24 PolarHBondContact OD1-NE 2.91Å; N21-R24 PolarHBondContact OD1-NH2 3.39Å; N21-L25 WeakPolarHBondContact O-CG 3.18Å; N21-L25 PolarHBondContact O-N 3.33Å; N21-Y87 HydrophobicContact CB-CD1 4.16Å; N21-Y87 WeakPolarHBondContact OD1-CB 3.46Å
22	E	97.4	Very high	95.7	Very high	107 Å²	107	74.4 Å²	74.4	50%	0.5	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-47.6	173	-65.9	-174.7	155.4	0	0	111.6	E18 C19 R24 L25 Q26	E18-E22 PolarHBondContact O-N 3.17Å; C19-E22 PolarHBondContact O-N 2.83Å; E22-R24 VanDerWaalsContact C-N 3.3Å; E22-R24 PolarHBondContact O-N 2.88Å; E22-L25 PolarHBondContact O-N 3.26Å; E22-Q26 WeakPolarHBondContact O-CG 3.26Å; E22-Q26 PolarHBondContact O-N 3.23Å
23	Q	97.4	Very high	95.8	Very high	56 Å²	56	69.9 Å²	69.9	26%	0.262	37%	0.37	S	S	.	.	H	α-helix	trans	-57.7	-43.6	176.1	-71.4	166.5	22.1	0	0	111.3	C19 Q26 G27 L28 Y29	C19-Q23 WeakPolarHBondContact O-CB 3.21Å; C19-Q23 WeakPolarHBondContact O-CG 3.18Å; C19-Q23 PolarHBondContact O-N 2.9Å; Q23-Q26 CarbonylContact O-C 3.6Å; Q23-Q26 PolarHBondContact O-N 2.8Å; Q23-G27 PolarHBondContact O-N 3.13Å; Q23-L28 HydrophobicContact CB-CB 4.39Å; Q23-L28 PolarHBondContact O-N 3.11Å; Q23-Y29 HydrophobicContact CB-CD2 4.35Å; Q23-Y29 HydrophobicContact CG-CD2 3.95Å; Q23-Y29 HydrophobicContact CG-CE2 4.29Å
24	R	97.3	Very high	96	Very high	37 Å²	37	67.6 Å²	67.6	14%	0.14	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-47.1	174.8	-177.4	-169.6	63.2	77.3	1.9	112.2	L20 N21 E22 Q26 G27 K42 Y87	L20-R24 WeakPolarHBondContact O-CB 3.34Å; L20-R24 PolarHBondContact O-N 3.12Å; N21-R24 WeakPolarHBondContact O-CB 3.37Å; N21-R24 PolarHBondContact O-N 3.02Å; N21-R24 PolarHBondContact OD1-NE 2.91Å; N21-R24 PolarHBondContact OD1-NH2 3.39Å; E22-R24 VanDerWaalsContact C-N 3.3Å; E22-R24 PolarHBondContact O-N 2.88Å; R24-Q26 VanDerWaalsContact C-N 3.32Å; R24-Q26 PolarHBondContact O-N 2.71Å; R24-G27 PolarHBondContact O-N 3.36Å; R24-K42 VanDerWaalsContact CG-O 3.26Å; R24-K42 WeakPolarHBondContact CG-O 3.25Å; R24-Y87 HydrophobicContact CB-CD1 4.31Å; R24-Y87 HydrophobicContact CB-CE1 3.97Å; R24-Y87 HydrophobicContact CG-CE1 4.36Å
25	L	95.9	Very high	96.2	Very high	118 Å²	118	63.6 Å²	63.6	62%	0.618	33%	0.326	S	S	*	.	H	α-helix	trans	-65.4	-35	-179.8	-72.6	168.7	0	0	0	112.3	N21 E22 G27	N21-L25 WeakPolarHBondContact O-CG 3.18Å; N21-L25 PolarHBondContact O-N 3.33Å; E22-L25 PolarHBondContact O-N 3.26Å; L25-G27 VanDerWaalsContact C-N 3.26Å
26	Q	96.7	Very high	96.3	Very high	131 Å²	131	59.3 Å²	59.3	61%	0.612	30%	0.303	S	S	*	.	H	α-helix	trans	-79.6	-8	172.8	-63	174.1	34.8	0	0	112.8	E22 Q23 R24 L28	E22-Q26 WeakPolarHBondContact O-CG 3.26Å; E22-Q26 PolarHBondContact O-N 3.23Å; Q23-Q26 CarbonylContact O-C 3.6Å; Q23-Q26 PolarHBondContact O-N 2.8Å; R24-Q26 VanDerWaalsContact C-N 3.32Å; R24-Q26 PolarHBondContact O-N 2.71Å; Q26-L28 HydrophobicContact CB-CD1 4.11Å; Q26-L28 HydrophobicContact CB-CG 3.9Å; Q26-L28 PolarHBondContact O-N 2.66Å
27	G	94.3	Very high	96.1	Very high	19 Å²	19	61.1 Å²	61.1	20%	0.196	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	67	21.1	-175.8	0	0	0	0	0	114.6	Q23 R24 L25	Q23-G27 PolarHBondContact O-N 3.13Å; R24-G27 PolarHBondContact O-N 3.36Å; L25-G27 VanDerWaalsContact C-N 3.26Å
28	L	94.8	Very high	95.9	Very high	74 Å²	74	62 Å²	62	39%	0.387	33%	0.327	S	S	.	.			trans	-81.7	146.4	175	-61.2	178.4	0	0	0	110.3	Q23 Q26 C30 H44	Q23-L28 HydrophobicContact CB-CB 4.39Å; Q23-L28 PolarHBondContact O-N 3.11Å; Q26-L28 HydrophobicContact CB-CD1 4.11Å; Q26-L28 HydrophobicContact CB-CG 3.9Å; Q26-L28 PolarHBondContact O-N 2.66Å; L28-C30 PolarHBondContact O-N 2.9Å; L28-C30 PolarHBondContact O-SG 3.21Å; L28-C30 VanDerWaalsContact O-SG 3.35Å; L28-H44 PolarHBondContact O-NE2 3.46Å
29	Y	95.8	Very high	95.8	Very high	181 Å²	181	62 Å²	62	71%	0.71	33%	0.327	S	S	*	.	S	Bend	trans	54.5	-1.7	175.9	-46.7	-65.1	0	0	0	117.6	Q23 D31 H44	Q23-Y29 HydrophobicContact CB-CD2 4.35Å; Q23-Y29 HydrophobicContact CG-CD2 3.95Å; Q23-Y29 HydrophobicContact CG-CE2 4.29Å; Y29-D31 PolarHBondContact O-N 2.86Å; Y29-H44 PolarHBondContact O-CD2 3.33Å
30	C	96.1	Very high	95.8	Very high	31 Å²	31	62.5 Å²	62.5	21%	0.209	34%	0.336	C	S	.	.			trans	-62.6	121.2	176.2	-66.6	0	0	0	0	111.3	L28 K42 A43	L28-C30 PolarHBondContact O-N 2.9Å; L28-C30 PolarHBondContact O-SG 3.21Å; L28-C30 VanDerWaalsContact O-SG 3.35Å; C30-K42 HydrophobicContact CB-CB 4.01Å; C30-A43 WeakPolarHBondContact CA-O 3.24Å; C30-A43 WeakPolarHBondContact CB-O 3.48Å
31	D	94.9	Very high	95.8	Very high	82 Å²	82	61.6 Å²	61.6	44%	0.439	33%	0.33	S	S	.	.			trans	-103.2	3.3	-178.6	64.7	-33.5	0	0	0	113.3	Y29 A43 H44 R45	Y29-D31 PolarHBondContact O-N 2.86Å; D31-A43 PolarHBondContact N-O 3.01Å; D31-H44 VanDerWaalsContact OD1-CA 3.26Å; D31-H44 WeakPolarHBondContact OD1-CA 3.28Å; D31-R45 WeakPolarHBondContact OD1-CG 3.3Å; D31-R45 PolarHBondContact OD1-N 3.17Å; D31-R45 WeakPolarHBondContact OD2-CB 3.47Å; D31-R45 WeakPolarHBondContact OD2-CD 3.25Å; D31-R45 VanDerWaalsContact OD2-CG 3.28Å; D31-R45 WeakPolarHBondContact OD2-CG 3.12Å
32	V	95.8	Very high	95.8	Very high	5 Å²	5	65.9 Å²	65.9	3%	0.03	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.8	168.9	64.8	0	0	0	0	112.6	V34 A43 R45 L48 F59 S66 V68	V32-V34 HydrophobicContact CG2-CG2 4.42Å; V32-A43 HydrophobicContact CG1-CB 4.17Å; V32-A43 WeakPolarHBondContact CG1-O 3.46Å; V32-A43 PolarHBondContact N-O 2.98Å; V32-A43 VanDerWaalsContact N-O 3.14Å; V32-A43 PolarHBondContact O-N 3.42Å; V32-R45 HydrophobicContact CB-CG 3.59Å; V32-R45 HydrophobicContact CG1-CG 3.5Å; V32-R45 VanDerWaalsContact CG1-CG 3.5Å; V32-L48 HydrophobicContact CG1-CD1 3.97Å; V32-F59 HydrophobicContact CG1-CZ 4.31Å; V32-F59 HydrophobicContact CG2-CE1 4.43Å; V32-F59 HydrophobicContact CG2-CZ 4.49Å; V32-S66 CarbonylContact C-O 3.5Å; V32-S66 WeakPolarHBondContact CA-O 3.44Å; V32-V68 HydrophobicContact CG2-CB 4.35Å; V32-V68 HydrophobicContact CG2-CG2 3.98Å
33	S	96.3	Very high	95.8	Very high	27 Å²	27	60.8 Å²	60.8	19%	0.189	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.8	167.1	-178.4	0	0	0	0	108.8	F41 S66 V67 V68	S33-F41 WeakPolarHBondContact CA-O 3.42Å; S33-S66 PolarHBondContact N-O 3.02Å; S33-V67 WeakPolarHBondContact O-CA 3.37Å; S33-V68 PolarHBondContact O-N 2.94Å
34	V	96.5	Very high	95.8	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.7	176.3	-175.8	0	0	0	0	109	V32 V36 F41 L48 F55 V68 L70 F79	V32-V34 HydrophobicContact CG2-CG2 4.42Å; V34-V36 HydrophobicContact CG1-CG2 4.31Å; V34-F41 PolarHBondContact N-O 2.9Å; V34-F41 PolarHBondContact O-N 3.32Å; V34-L48 HydrophobicContact CG2-CD1 4.03Å; V34-F55 HydrophobicContact CG1-CE1 4.34Å; V34-F55 HydrophobicContact CG1-CZ 4.13Å; V34-F55 HydrophobicContact CG2-CE1 3.93Å; V34-F55 HydrophobicContact CG2-CZ 4.06Å; V34-V68 CarbonylContact C-O 3.47Å; V34-V68 VanDerWaalsContact CA-O 3.28Å; V34-V68 WeakPolarHBondContact CA-O 3.43Å; V34-L70 HydrophobicContact CG1-CD1 3.82Å; V34-L70 HydrophobicContact CG1-CD2 4.2Å; V34-L70 HydrophobicContact CG1-CG 3.66Å; V34-F79 HydrophobicContact CB-CE1 3.95Å; V34-F79 HydrophobicContact CB-CZ 3.85Å; V34-F79 HydrophobicContact CG1-CE1 3.89Å; V34-F79 HydrophobicContact CG1-CE2 4.18Å; V34-F79 HydrophobicContact CG1-CZ 3.61Å; V34-F79 HydrophobicContact CG2-CZ 4.14Å
35	V	96.2	Very high	95.7	Very high	21 Å²	21	59.5 Å²	59.5	13%	0.127	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.3	179.3	-178.8	0	0	0	0	109.6	H39 A40 V67 V68 E69 L70	V35-H39 CarbonylContact C-O 3.54Å; V35-H39 WeakPolarHBondContact CA-O 3.48Å; V35-A40 HydrophobicContact CG2-CB 4.39Å; V35-V67 HydrophobicContact CG2-CG1 3.74Å; V35-V68 PolarHBondContact N-O 2.63Å; V35-E69 HydrophobicContact CB-CG 4.19Å; V35-E69 WeakPolarHBondContact O-CA 3.32Å; V35-L70 PolarHBondContact O-N 2.85Å
36	V	96	Very high	95.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	109.9	176.3	-170.8	0	0	0	0	107.7	V34 G38 H39 F41 L70 V74 P76 F79	V34-V36 HydrophobicContact CG1-CG2 4.31Å; V36-G38 VanDerWaalsContact C-N 3.33Å; V36-G38 PolarHBondContact O-N 3.07Å; V36-H39 PolarHBondContact N-O 3.11Å; V36-H39 VanDerWaalsContact O-CB 3.31Å; V36-H39 WeakPolarHBondContact O-CB 3.43Å; V36-H39 PolarHBondContact O-N 3.46Å; V36-F41 HydrophobicContact CB-CE2 4.18Å; V36-F41 HydrophobicContact CG2-CD2 4.21Å; V36-F41 HydrophobicContact CG2-CE2 4.16Å; V36-L70 HydrophobicContact CG2-CB 4.25Å; V36-L70 HydrophobicContact CG2-CD1 3.86Å; V36-L70 HydrophobicContact CG2-CG 4.19Å; V36-V74 HydrophobicContact CG1-CB 4.15Å; V36-V74 HydrophobicContact CG1-CG1 3.85Å; V36-V74 WeakPolarHBondContact CG1-O 3.19Å; V36-P76 HydrophobicContact CB-CG 4.37Å; V36-P76 HydrophobicContact CG1-CG 4.04Å; V36-F79 HydrophobicContact CG2-CB 4.07Å; V36-F79 HydrophobicContact CG2-CD1 3.82Å; V36-F79 HydrophobicContact CG2-CD2 4.46Å; V36-F79 HydrophobicContact CG2-CE1 4.45Å; V36-F79 HydrophobicContact CG2-CG 3.82Å
37	K	92.4	Very high	95.7	Very high	98 Å²	98	52.3 Å²	52.3	43%	0.426	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	53.9	-177	-56.1	-171.9	-179.9	-175.9	0	112.5	H39 P72 V74 Q75 P76	K37-H39 PolarHBondContact O-N 3.34Å; K37-H39 VanDerWaalsContact O-N 3.1Å; K37-H39 PolarHBondContact O-ND1 2.96Å; K37-P72 WeakPolarHBondContact CE-O 3.46Å; K37-P72 PolarHBondContact NZ-O 3.06Å; K37-V74 WeakPolarHBondContact CE-O 3.27Å; K37-Q75 VanDerWaalsContact NZ-CD 3.34Å; K37-P76 HydrophobicContact CB-CG 4.19Å
38	G	91.3	Very high	95.8	Very high	70 Å²	70	51.5 Å²	51.5	72%	0.722	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	-11.7	-176.9	0	0	0	0	0	116.2	V36	V36-G38 VanDerWaalsContact C-N 3.33Å; V36-G38 PolarHBondContact O-N 3.07Å
39	H	95.4	Very high	95.8	Very high	112 Å²	112	49 Å²	49	52%	0.519	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	117.7	178.9	-63.4	63.6	0	0	0	110.1	V35 V36 K37 F41 P76	V35-H39 CarbonylContact C-O 3.54Å; V35-H39 WeakPolarHBondContact CA-O 3.48Å; V36-H39 PolarHBondContact N-O 3.11Å; V36-H39 VanDerWaalsContact O-CB 3.31Å; V36-H39 WeakPolarHBondContact O-CB 3.43Å; V36-H39 PolarHBondContact O-N 3.46Å; K37-H39 PolarHBondContact O-N 3.34Å; K37-H39 VanDerWaalsContact O-N 3.1Å; K37-H39 PolarHBondContact O-ND1 2.96Å; H39-F41 HydrophobicContact CB-CE2 3.74Å; H39-F41 HydrophobicContact CB-CZ 4.17Å; H39-F41 WeakPolarHBondContact O-CD2 3.39Å; H39-P76 HydrophobicContact CB-CB 4.18Å; H39-P76 HydrophobicContact CB-CG 4.37Å
40	A	95.8	Very high	95.7	Very high	70 Å²	70	44.2 Å²	44.2	58%	0.579	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.9	-176.1	0	0	0	0	0	112.4	V35	V35-A40 HydrophobicContact CG2-CB 4.39Å
41	F	97.4	Very high	95.6	Very high	26 Å²	26	44.4 Å²	44.4	11%	0.114	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	107.6	-178.2	-63	-89.1	0	0	0	110.9	S33 V34 V36 H39 P76 F79 Q80 L83	S33-F41 WeakPolarHBondContact CA-O 3.42Å; V34-F41 PolarHBondContact N-O 2.9Å; V34-F41 PolarHBondContact O-N 3.32Å; V36-F41 HydrophobicContact CB-CE2 4.18Å; V36-F41 HydrophobicContact CG2-CD2 4.21Å; V36-F41 HydrophobicContact CG2-CE2 4.16Å; H39-F41 HydrophobicContact CB-CE2 3.74Å; H39-F41 HydrophobicContact CB-CZ 4.17Å; H39-F41 WeakPolarHBondContact O-CD2 3.39Å; F41-P76 HydrophobicContact CE2-CB 4.29Å; F41-P76 HydrophobicContact CZ-CB 4.13Å; F41-F79 HydrophobicContact CB-CD1 4.31Å; F41-F79 HydrophobicContact CB-CE1 3.8Å; F41-F79 HydrophobicContact CD1-CD1 4.31Å; F41-F79 AromaticContact CD2-CD1 3.58Å; F41-F79 HydrophobicContact CD2-CD1 3.58Å; F41-F79 AromaticContact CD2-CE1 3.89Å; F41-F79 HydrophobicContact CD2-CE1 3.89Å; F41-F79 AromaticContact CE2-CD1 3.88Å; F41-F79 HydrophobicContact CE2-CD1 3.88Å; F41-F79 AromaticContact CG-CD1 3.81Å; F41-F79 HydrophobicContact CG-CD1 3.81Å; F41-F79 AromaticContact CG-CE1 3.83Å; F41-F79 HydrophobicContact CG-CE1 3.83Å; F41-F79 HydrophobicContact CZ-CD1 4.36Å; F41-Q80 HydrophobicContact CE1-CB 3.9Å; F41-Q80 HydrophobicContact CE1-CG 4.22Å; F41-Q80 HydrophobicContact CZ-CB 4.36Å; F41-L83 HydrophobicContact CB-CD2 3.94Å; F41-L83 HydrophobicContact CD1-CD2 4.2Å; F41-L83 HydrophobicContact CG-CD2 4.41Å
42	K	97.4	Very high	95.7	Very high	117 Å²	117	40.6 Å²	40.6	51%	0.509	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	137.9	172.8	-68.7	-176.3	176.6	-177.2	0	111.3	R24 C30	R24-K42 VanDerWaalsContact CG-O 3.26Å; R24-K42 WeakPolarHBondContact CG-O 3.25Å; C30-K42 HydrophobicContact CB-CB 4.01Å
43	A	97.7	Very high	95.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	166.6	176.9	0	0	0	0	0	112.4	C30 D31 V32 L48 L83	C30-A43 WeakPolarHBondContact CA-O 3.24Å; C30-A43 WeakPolarHBondContact CB-O 3.48Å; D31-A43 PolarHBondContact N-O 3.01Å; V32-A43 HydrophobicContact CG1-CB 4.17Å; V32-A43 WeakPolarHBondContact CG1-O 3.46Å; V32-A43 PolarHBondContact N-O 2.98Å; V32-A43 VanDerWaalsContact N-O 3.14Å; V32-A43 PolarHBondContact O-N 3.42Å; A43-L48 HydrophobicContact CB-CD1 3.85Å; A43-L48 HydrophobicContact CB-CG 4.21Å; A43-L83 HydrophobicContact CB-CD1 4.13Å
44	H	97.3	Very high	95.4	Very high	15 Å²	15	42.7 Å²	42.7	7%	0.069	26%	0.263	C	S	.	.			trans	-92.2	129.4	167	-47.3	93.2	0	0	0	110.6	L20 L28 Y29 D31 A46 V47 L48 Y87	L20-H44 PolarHBondContact O-CE1 2.83Å; L28-H44 PolarHBondContact O-NE2 3.46Å; Y29-H44 PolarHBondContact O-CD2 3.33Å; D31-H44 VanDerWaalsContact OD1-CA 3.26Å; D31-H44 WeakPolarHBondContact OD1-CA 3.28Å; H44-A46 VanDerWaalsContact C-N 3.3Å; H44-A46 PolarHBondContact O-N 3.48Å; H44-V47 HydrophobicContact CB-CG2 4.22Å; H44-V47 PolarHBondContact O-N 3.1Å; H44-L48 PolarHBondContact O-N 3.34Å; H44-Y87 WeakPolarHBondContact CB-OH 3.45Å; H44-Y87 PolarHBondContact N-OH 3.16Å; H44-Y87 AromaticContact ND1-CE1 3.56Å; H44-Y87 AromaticContact ND1-CZ 3.75Å; H44-Y87 PolarHBondContact ND1-OH 2.91Å; H44-Y87 PolarHBondContact O-OH 2.83Å
45	R	95.4	Very high	95.3	Very high	52 Å²	52	42.8 Å²	42.8	20%	0.196	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-36.8	-179.2	-65.7	178	74.1	168.7	3.7	112.6	D31 V32 V47 L48 A49 F59 G63	D31-R45 WeakPolarHBondContact OD1-CG 3.3Å; D31-R45 PolarHBondContact OD1-N 3.17Å; D31-R45 WeakPolarHBondContact OD2-CB 3.47Å; D31-R45 WeakPolarHBondContact OD2-CD 3.25Å; D31-R45 VanDerWaalsContact OD2-CG 3.28Å; D31-R45 WeakPolarHBondContact OD2-CG 3.12Å; V32-R45 HydrophobicContact CB-CG 3.59Å; V32-R45 HydrophobicContact CG1-CG 3.5Å; V32-R45 VanDerWaalsContact CG1-CG 3.5Å; R45-V47 PolarHBondContact O-N 2.95Å; R45-L48 PolarHBondContact O-N 3.23Å; R45-A49 WeakPolarHBondContact O-CB 3.26Å; R45-A49 PolarHBondContact O-N 3.27Å; R45-F59 HydrophobicContact CB-CD2 3.84Å; R45-F59 HydrophobicContact CB-CE2 3.54Å; R45-F59 HydrophobicContact CB-CZ 4.09Å; R45-F59 HydrophobicContact CG-CD2 4.25Å; R45-F59 HydrophobicContact CG-CE1 4.28Å; R45-F59 HydrophobicContact CG-CE2 3.8Å; R45-F59 HydrophobicContact CG-CZ 3.81Å; R45-F59 VanDerWaalsContact NH2-CB 3.3Å; R45-F59 VanDerWaalsContact NH2-CG 3.32Å; R45-F59 WeakPolarHBondContact O-CE2 3.29Å; R45-G63 PolarHBondContact NH1-O 2.91Å; R45-G63 PolarHBondContact NH2-O 3.28Å
46	A	95.7	Very high	95.2	Very high	80 Å²	80	46.6 Å²	46.6	66%	0.661	28%	0.275	S	S	*	.	H	α-helix	trans	-59.6	-43.5	178.6	0	0	0	0	0	112.7	H44 A50	H44-A46 VanDerWaalsContact C-N 3.3Å; H44-A46 PolarHBondContact O-N 3.48Å; A46-A50 WeakPolarHBondContact O-CB 3.33Å; A46-A50 PolarHBondContact O-N 2.97Å; A46-A50 VanDerWaalsContact O-N 3.1Å
47	V	97.1	Very high	95	Very high	17 Å²	17	50.8 Å²	50.8	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-69.2	-44.3	178.8	-177.9	0	0	0	0	110.5	L17 L20 H44 R45 A49 A50 S51 C86 Y87	L17-V47 HydrophobicContact CD1-CG1 4.47Å; L20-V47 HydrophobicContact CD1-CG2 4.13Å; H44-V47 HydrophobicContact CB-CG2 4.22Å; H44-V47 PolarHBondContact O-N 3.1Å; R45-V47 PolarHBondContact O-N 2.95Å; V47-A49 PolarHBondContact O-N 2.67Å; V47-A50 PolarHBondContact O-N 3.2Å; V47-S51 PolarHBondContact O-N 2.9Å; V47-S51 VanDerWaalsContact O-N 3.08Å; V47-S51 PolarHBondContact O-OG 3.41Å; V47-C86 HydrophobicContact CG1-CB 4.39Å; V47-C86 VanDerWaalsContact CG1-O 3.28Å; V47-C86 WeakPolarHBondContact CG1-O 3.24Å; V47-Y87 HydrophobicContact CB-CE1 4.19Å; V47-Y87 HydrophobicContact CB-CE2 3.94Å; V47-Y87 WeakPolarHBondContact CB-OH 3.09Å; V47-Y87 HydrophobicContact CG1-CD1 4.36Å; V47-Y87 HydrophobicContact CG1-CD2 3.89Å; V47-Y87 HydrophobicContact CG1-CE1 4.07Å; V47-Y87 HydrophobicContact CG1-CE2 3.53Å; V47-Y87 HydrophobicContact CG1-CG 4.29Å; V47-Y87 HydrophobicContact CG2-CE1 3.92Å
48	L	96.1	Very high	95	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-46.1	176.9	-68.5	-179.9	0	0	0	112	V32 V34 A43 H44 R45 A50 S51 S52 F55 F59 L83	V32-L48 HydrophobicContact CG1-CD1 3.97Å; V34-L48 HydrophobicContact CG2-CD1 4.03Å; A43-L48 HydrophobicContact CB-CD1 3.85Å; A43-L48 HydrophobicContact CB-CG 4.21Å; H44-L48 PolarHBondContact O-N 3.34Å; R45-L48 PolarHBondContact O-N 3.23Å; L48-A50 VanDerWaalsContact C-N 3.29Å; L48-A50 PolarHBondContact O-N 3.47Å; L48-S51 PolarHBondContact O-N 2.93Å; L48-S52 VanDerWaalsContact O-CB 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.48Å; L48-S52 PolarHBondContact O-N 3.49Å; L48-F55 HydrophobicContact CB-CB 3.91Å; L48-F55 HydrophobicContact CB-CD2 4Å; L48-F55 HydrophobicContact CB-CG 3.97Å; L48-F55 HydrophobicContact CD1-CD1 4.26Å; L48-F55 HydrophobicContact CD1-CD2 4.32Å; L48-F55 HydrophobicContact CD1-CE1 4.34Å; L48-F55 HydrophobicContact CD1-CE2 4.39Å; L48-F55 HydrophobicContact CD1-CG 4.27Å; L48-F55 HydrophobicContact CD1-CZ 4.4Å; L48-F55 HydrophobicContact CD2-CD2 4.11Å; L48-F55 HydrophobicContact CD2-CE2 4.11Å; L48-F55 HydrophobicContact CG-CD2 4.38Å; L48-F59 HydrophobicContact CB-CE2 4.12Å; L48-F59 HydrophobicContact CD1-CZ 4.25Å; L48-L83 HydrophobicContact CD2-CD1 3.89Å
49	A	94.8	Very high	94.9	Very high	21 Å²	21	46.8 Å²	46.8	17%	0.174	26%	0.263	C	S	.	.	H	α-helix	trans	-69.2	-23.1	179.1	0	0	0	0	0	114.2	R45 V47 R56 F59	R45-A49 WeakPolarHBondContact O-CB 3.26Å; R45-A49 PolarHBondContact O-N 3.27Å; V47-A49 PolarHBondContact O-N 2.67Å; A49-R56 HydrophobicContact CB-CB 3.86Å; A49-R56 HydrophobicContact CB-CG 4.25Å; A49-R56 PolarHBondContact O-NH1 2.7Å; A49-F59 HydrophobicContact CB-CD2 4.19Å
50	A	95	Very high	94.6	Very high	81 Å²	81	47.5 Å²	47.5	67%	0.669	27%	0.27	S	S	*	.	H	α-helix	trans	-74.2	-43.1	172	0	0	0	0	0	111.6	A46 V47 L48	A46-A50 WeakPolarHBondContact O-CB 3.33Å; A46-A50 PolarHBondContact O-N 2.97Å; A46-A50 VanDerWaalsContact O-N 3.1Å; V47-A50 PolarHBondContact O-N 3.2Å; L48-A50 VanDerWaalsContact C-N 3.29Å; L48-A50 PolarHBondContact O-N 3.47Å
51	S	94.1	Very high	93.9	Very high	36 Å²	36	48.2 Å²	48.2	25%	0.252	28%	0.276	S	S	.	.	H	α-helix	trans	-84.1	-26.5	-178.3	-55.7	0	0	0	0	115.1	V47 L48 C86	V47-S51 PolarHBondContact O-N 2.9Å; V47-S51 VanDerWaalsContact O-N 3.08Å; V47-S51 PolarHBondContact O-OG 3.41Å; L48-S51 PolarHBondContact O-N 2.93Å; S51-C86 WeakPolarHBondContact CB-SG 3.27Å
52	S	95.9	Very high	92.4	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.007	30%	0.296	C	S	.	.			trans	-129.5	127.9	-170.9	165.4	0	0	0	0	111.2	L48 Y54 F55 R56 L108	L48-S52 VanDerWaalsContact O-CB 3.31Å; L48-S52 WeakPolarHBondContact O-CB 3.48Å; L48-S52 PolarHBondContact O-N 3.49Å; S52-Y54 PolarHBondContact OG-N 2.78Å; S52-F55 WeakPolarHBondContact OG-CD2 3.46Å; S52-F55 PolarHBondContact OG-N 3.33Å; S52-R56 WeakPolarHBondContact O-CB 3.42Å; S52-R56 PolarHBondContact O-N 3.49Å; S52-L108 WeakPolarHBondContact CB-O 3.46Å; S52-L108 PolarHBondContact OG-O 2.85Å
53	S	93.3	Very high	90.8	Very high	26 Å²	26	45.2 Å²	45.2	18%	0.182	29%	0.286	C	S	.	.	H	α-helix	trans	-70.9	-34.5	168.4	40.2	0	0	0	0	112.5	F55 R56 D57 Q109	S53-F55 PolarHBondContact O-N 3.49Å; S53-R56 PolarHBondContact O-N 3.22Å; S53-D57 WeakPolarHBondContact O-CB 3.28Å; S53-D57 VanDerWaalsContact O-CG 3.23Å; S53-D57 PolarHBondContact O-N 2.59Å; S53-Q109 WeakPolarHBondContact OG-CB 3.36Å; S53-Q109 PolarHBondContact OG-O 2.72Å; S53-Q109 PolarHBondContact OG-OE1 2.77Å
54	Y	93.6	Very high	89.2	Confident	51 Å²	51	54.5 Å²	54.5	20%	0.2	33%	0.327	C	S	.	.	H	α-helix	trans	-54.2	-52.2	174.9	172.7	-93.3	0	0	0	111.9	S52 D57 L58 L70 F107 L108	S52-Y54 PolarHBondContact OG-N 2.78Å; Y54-D57 PolarHBondContact O-N 3.06Å; Y54-L58 HydrophobicContact CE1-CD2 4.19Å; Y54-L58 VanDerWaalsContact O-CB 3.23Å; Y54-L58 WeakPolarHBondContact O-CB 3.43Å; Y54-L58 PolarHBondContact O-N 2.86Å; Y54-L70 HydrophobicContact CE1-CD2 3.69Å; Y54-F107 HydrophobicContact CD2-CZ 4.47Å; Y54-F107 HydrophobicContact CE1-CE1 4.41Å; Y54-F107 HydrophobicContact CE2-CE1 4.15Å; Y54-F107 AromaticContact CE2-CZ 3.85Å; Y54-F107 HydrophobicContact CE2-CZ 3.85Å; Y54-L108 HydrophobicContact CD1-CD2 3.6Å; Y54-L108 HydrophobicContact CE1-CD2 3.98Å; Y54-L108 HydrophobicContact CG-CD2 4.27Å
55	F	94	Very high	88.2	Confident	2 Å²	2	57 Å²	57	1%	0.009	35%	0.346	C	S	.	.	H	α-helix	trans	-68.2	-36.8	178.3	-76.5	-62.8	0	0	0	112.6	V34 L48 S52 S53 L58 F59 V68 L70 F79 L108	V34-F55 HydrophobicContact CG1-CE1 4.34Å; V34-F55 HydrophobicContact CG1-CZ 4.13Å; V34-F55 HydrophobicContact CG2-CE1 3.93Å; V34-F55 HydrophobicContact CG2-CZ 4.06Å; L48-F55 HydrophobicContact CB-CB 3.91Å; L48-F55 HydrophobicContact CB-CD2 4Å; L48-F55 HydrophobicContact CB-CG 3.97Å; L48-F55 HydrophobicContact CD1-CD1 4.26Å; L48-F55 HydrophobicContact CD1-CD2 4.32Å; L48-F55 HydrophobicContact CD1-CE1 4.34Å; L48-F55 HydrophobicContact CD1-CE2 4.39Å; L48-F55 HydrophobicContact CD1-CG 4.27Å; L48-F55 HydrophobicContact CD1-CZ 4.4Å; L48-F55 HydrophobicContact CD2-CD2 4.11Å; L48-F55 HydrophobicContact CD2-CE2 4.11Å; L48-F55 HydrophobicContact CG-CD2 4.38Å; S52-F55 WeakPolarHBondContact OG-CD2 3.46Å; S52-F55 PolarHBondContact OG-N 3.33Å; S53-F55 PolarHBondContact O-N 3.49Å; F55-L58 HydrophobicContact CD1-CD2 4.28Å; F55-F59 HydrophobicContact CB-CE2 3.97Å; F55-F59 HydrophobicContact CB-CZ 4.15Å; F55-F59 HydrophobicContact CD1-CE1 4.31Å; F55-F59 AromaticContact CD1-CZ 3.92Å; F55-F59 HydrophobicContact CD1-CZ 3.92Å; F55-F59 HydrophobicContact CG-CZ 4.38Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 WeakPolarHBondContact O-CD2 3.21Å; F55-F59 WeakPolarHBondContact O-CG 3.1Å; F55-F59 PolarHBondContact O-N 3Å; F55-V68 HydrophobicContact CE1-CG1 4.2Å; F55-L70 HydrophobicContact CE1-CD2 4.19Å; F55-L70 HydrophobicContact CZ-CD1 4.39Å; F55-L70 HydrophobicContact CZ-CD2 4.1Å; F55-F79 HydrophobicContact CE2-CE2 4.05Å; F55-F79 HydrophobicContact CE2-CZ 4.46Å; F55-F79 AromaticContact CZ-CE2 3.9Å; F55-F79 HydrophobicContact CZ-CE2 3.9Å; F55-F79 HydrophobicContact CZ-CZ 4.13Å; F55-L108 HydrophobicContact CD2-CD2 4.49Å; F55-L108 HydrophobicContact CE2-CD1 4.35Å; F55-L108 HydrophobicContact CE2-CD2 3.79Å; F55-L108 HydrophobicContact CZ-CD2 4.03Å
56	R	93.9	Very high	87.6	Confident	102 Å²	102	58.2 Å²	58.2	39%	0.385	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-48.1	175.7	-178.5	168.8	60.1	-118.2	9.2	111.9	A49 S52 S53 F59 N60	A49-R56 HydrophobicContact CB-CB 3.86Å; A49-R56 HydrophobicContact CB-CG 4.25Å; A49-R56 PolarHBondContact O-NH1 2.7Å; S52-R56 WeakPolarHBondContact O-CB 3.42Å; S52-R56 PolarHBondContact O-N 3.49Å; S53-R56 PolarHBondContact O-N 3.22Å; R56-F59 PolarHBondContact O-N 2.87Å; R56-N60 WeakPolarHBondContact O-CB 3.15Å; R56-N60 PolarHBondContact O-N 2.85Å; R56-N60 PolarHBondContact O-ND2 2.96Å
57	D	92.6	Very high	87.4	Confident	87 Å²	87	57.6 Å²	57.6	47%	0.465	35%	0.35	S	S	.	.	H	α-helix	trans	-72.2	-38.7	-176.3	-62.5	-14.6	0	0	0	110.5	S53 Y54 F59 N60 A61	S53-D57 WeakPolarHBondContact O-CB 3.28Å; S53-D57 VanDerWaalsContact O-CG 3.23Å; S53-D57 PolarHBondContact O-N 2.59Å; Y54-D57 PolarHBondContact O-N 3.06Å; D57-F59 VanDerWaalsContact C-N 3.34Å; D57-F59 PolarHBondContact O-N 3.38Å; D57-N60 PolarHBondContact O-N 3.31Å; D57-A61 VanDerWaalsContact O-CB 3.3Å; D57-A61 WeakPolarHBondContact O-CB 3.19Å; D57-A61 PolarHBondContact O-N 3.14Å
58	L	90.7	Very high	87.1	Confident	58 Å²	58	57.6 Å²	57.6	30%	0.304	35%	0.35	S	S	.	.	H	α-helix	trans	-58.3	-41.7	171.1	-179.8	67.1	0	0	0	112.9	Y54 F55 V68	Y54-L58 HydrophobicContact CE1-CD2 4.19Å; Y54-L58 VanDerWaalsContact O-CB 3.23Å; Y54-L58 WeakPolarHBondContact O-CB 3.43Å; Y54-L58 PolarHBondContact O-N 2.86Å; F55-L58 HydrophobicContact CD1-CD2 4.28Å; L58-V68 HydrophobicContact CD2-CB 4.45Å; L58-V68 HydrophobicContact CD2-CG1 3.53Å; L58-V68 HydrophobicContact CD2-CG2 4Å
59	F	90.7	Very high	87	Confident	27 Å²	27	64.4 Å²	64.4	12%	0.118	38%	0.382	C	S	.	.	H	α-helix	trans	-74.5	-35.4	177.9	-61.8	-21.6	0	0	0	112.5	V32 R45 L48 A49 F55 R56 D57 A61 V68	V32-F59 HydrophobicContact CG1-CZ 4.31Å; V32-F59 HydrophobicContact CG2-CE1 4.43Å; V32-F59 HydrophobicContact CG2-CZ 4.49Å; R45-F59 HydrophobicContact CB-CD2 3.84Å; R45-F59 HydrophobicContact CB-CE2 3.54Å; R45-F59 HydrophobicContact CB-CZ 4.09Å; R45-F59 HydrophobicContact CG-CD2 4.25Å; R45-F59 HydrophobicContact CG-CE1 4.28Å; R45-F59 HydrophobicContact CG-CE2 3.8Å; R45-F59 HydrophobicContact CG-CZ 3.81Å; R45-F59 VanDerWaalsContact NH2-CB 3.3Å; R45-F59 VanDerWaalsContact NH2-CG 3.32Å; R45-F59 WeakPolarHBondContact O-CE2 3.29Å; L48-F59 HydrophobicContact CB-CE2 4.12Å; L48-F59 HydrophobicContact CD1-CZ 4.25Å; A49-F59 HydrophobicContact CB-CD2 4.19Å; F55-F59 HydrophobicContact CB-CE2 3.97Å; F55-F59 HydrophobicContact CB-CZ 4.15Å; F55-F59 HydrophobicContact CD1-CE1 4.31Å; F55-F59 AromaticContact CD1-CZ 3.92Å; F55-F59 HydrophobicContact CD1-CZ 3.92Å; F55-F59 HydrophobicContact CG-CZ 4.38Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 WeakPolarHBondContact O-CD2 3.21Å; F55-F59 WeakPolarHBondContact O-CG 3.1Å; F55-F59 PolarHBondContact O-N 3Å; R56-F59 PolarHBondContact O-N 2.87Å; D57-F59 VanDerWaalsContact C-N 3.34Å; D57-F59 PolarHBondContact O-N 3.38Å; F59-A61 VanDerWaalsContact C-N 3.34Å; F59-V68 HydrophobicContact CE1-CG2 4.22Å
60	N	87.8	Confident	86.8	Confident	126 Å²	126	64 Å²	64	67%	0.674	38%	0.377	S	S	*	.	H	α-helix	trans	-67.8	-32	174.5	-73.6	-20.5	0	0	0	112.5	R56 D57 G62	R56-N60 WeakPolarHBondContact O-CB 3.15Å; R56-N60 PolarHBondContact O-N 2.85Å; R56-N60 PolarHBondContact O-ND2 2.96Å; D57-N60 PolarHBondContact O-N 3.31Å; N60-G62 PolarHBondContact O-N 3.08Å
61	A	82.1	Confident	86.5	Confident	85 Å²	85	62.8 Å²	62.8	70%	0.702	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	18.5	179.5	0	0	0	0	0	115	D57 F59	D57-A61 VanDerWaalsContact O-CB 3.3Å; D57-A61 WeakPolarHBondContact O-CB 3.19Å; D57-A61 PolarHBondContact O-N 3.14Å; F59-A61 VanDerWaalsContact C-N 3.34Å
62	G	66.1	Low	86	Confident	51 Å²	51	66.2 Å²	66.2	53%	0.526	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	11.2	177.3	0	0	0	0	0	115	N60 K64	N60-G62 PolarHBondContact O-N 3.08Å; G62-K64 PolarHBondContact O-N 2.98Å
63	G	62.9	Low	85.4	Confident	29 Å²	29	68.5 Å²	68.5	30%	0.299	40%	0.402	S	S	.	.			trans	-60.7	89.9	174.9	0	0	0	0	0	112.4	R45	R45-G63 PolarHBondContact NH1-O 2.91Å; R45-G63 PolarHBondContact NH2-O 3.28Å
64	K	63.8	Low	85.2	Confident	196 Å²	196	67.3 Å²	67.3	85%	0.852	39%	0.394	S	S	*	.			trans	-85.4	-10.3	175.7	-70	175	-175.1	173.1	0	113.4	G62	G62-K64 PolarHBondContact O-N 2.98Å
65	S	77.4	Confident	85.1	Confident	67 Å²	67	68.4 Å²	68.4	47%	0.469	40%	0.401	S	S	.	.			trans	-60.1	135.5	174.9	-174.2	0	0	0	0	110.9	V67	S65-V67 VanDerWaalsContact CB-O 3.3Å; S65-V67 WeakPolarHBondContact CB-O 3.33Å; S65-V67 PolarHBondContact OG-N 3.42Å; S65-V67 PolarHBondContact OG-O 2.98Å
66	S	82.8	Confident	85.1	Confident	77 Å²	77	69.3 Å²	69.3	54%	0.538	41%	0.407	S	S	.	.	S	Bend	trans	-77.9	-6.3	166.7	52.1	0	0	0	0	112.5	V32 S33	V32-S66 CarbonylContact C-O 3.5Å; V32-S66 WeakPolarHBondContact CA-O 3.44Å; S33-S66 PolarHBondContact N-O 3.02Å
67	V	90	Very high	85	Confident	68 Å²	68	69.5 Å²	69.5	41%	0.412	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.2	176.7	-174.3	0	0	0	0	109.8	S33 V35 S65	S33-V67 WeakPolarHBondContact O-CA 3.37Å; V35-V67 HydrophobicContact CG2-CG1 3.74Å; S65-V67 VanDerWaalsContact CB-O 3.3Å; S65-V67 WeakPolarHBondContact CB-O 3.33Å; S65-V67 PolarHBondContact OG-N 3.42Å; S65-V67 PolarHBondContact OG-O 2.98Å
68	V	92.6	Very high	85	Confident	17 Å²	17	65.4 Å²	65.4	10%	0.103	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.3	176.6	165.6	0	0	0	0	108.7	V32 S33 V34 V35 F55 L58 F59 L70	V32-V68 HydrophobicContact CG2-CB 4.35Å; V32-V68 HydrophobicContact CG2-CG2 3.98Å; S33-V68 PolarHBondContact O-N 2.94Å; V34-V68 CarbonylContact C-O 3.47Å; V34-V68 VanDerWaalsContact CA-O 3.28Å; V34-V68 WeakPolarHBondContact CA-O 3.43Å; V35-V68 PolarHBondContact N-O 2.63Å; F55-V68 HydrophobicContact CE1-CG1 4.2Å; L58-V68 HydrophobicContact CD2-CB 4.45Å; L58-V68 HydrophobicContact CD2-CG1 3.53Å; L58-V68 HydrophobicContact CD2-CG2 4Å; F59-V68 HydrophobicContact CE1-CG2 4.22Å; V68-L70 HydrophobicContact CG1-CD2 4.36Å
69	E	92.4	Very high	85.2	Confident	145 Å²	145	62.7 Å²	62.7	68%	0.678	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	136.8	175.3	-49	-153.2	130.1	0	0	110.6	V35	V35-E69 HydrophobicContact CB-CG 4.19Å; V35-E69 WeakPolarHBondContact O-CA 3.32Å
70	L	91.6	Very high	85.4	Confident	13 Å²	13	67.1 Å²	67.1	7%	0.068	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-96.4	148.7	172.3	-60	-172.8	0	0	0	111.1	V34 V35 V36 Y54 F55 V68 V74 F79 L108	V34-L70 HydrophobicContact CG1-CD1 3.82Å; V34-L70 HydrophobicContact CG1-CD2 4.2Å; V34-L70 HydrophobicContact CG1-CG 3.66Å; V35-L70 PolarHBondContact O-N 2.85Å; V36-L70 HydrophobicContact CG2-CB 4.25Å; V36-L70 HydrophobicContact CG2-CD1 3.86Å; V36-L70 HydrophobicContact CG2-CG 4.19Å; Y54-L70 HydrophobicContact CE1-CD2 3.69Å; F55-L70 HydrophobicContact CE1-CD2 4.19Å; F55-L70 HydrophobicContact CZ-CD1 4.39Å; F55-L70 HydrophobicContact CZ-CD2 4.1Å; V68-L70 HydrophobicContact CG1-CD2 4.36Å; L70-V74 HydrophobicContact CB-CB 4.26Å; L70-V74 HydrophobicContact CB-CG2 4.24Å; L70-V74 HydrophobicContact CD1-CG1 4.03Å; L70-V74 HydrophobicContact CD1-CG2 4.46Å; L70-F79 HydrophobicContact CD1-CD2 3.6Å; L70-F79 HydrophobicContact CD1-CE2 3.67Å; L70-F79 HydrophobicContact CD1-CG 4.3Å; L70-F79 HydrophobicContact CD1-CZ 4.41Å; L70-L108 HydrophobicContact CD1-CD2 4.07Å; L70-L108 HydrophobicContact CD2-CD2 4.25Å
71	P	88.7	Confident	85.7	Confident	54 Å²	54	62.7 Å²	62.7	35%	0.351	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-57.8	152	-179.2	-26.7	36.1	0	0	0	113.7	A73 V74 F107	P71-A73 PolarHBondContact O-N 3.3Å; P71-V74 PolarHBondContact O-N 2.97Å; P71-F107 HydrophobicContact CG-CE1 4.37Å; P71-F107 HydrophobicContact CG-CE2 4.15Å; P71-F107 HydrophobicContact CG-CZ 3.62Å
72	P	83.6	Confident	86.3	Confident	108 Å²	108	58.7 Å²	58.7	70%	0.701	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-12.1	-179.3	-26.8	35.6	0	0	0	116.4	K37 V74	K37-P72 WeakPolarHBondContact CE-O 3.46Å; K37-P72 PolarHBondContact NZ-O 3.06Å; P72-V74 VanDerWaalsContact C-N 3.29Å
73	A	82.4	Confident	87.7	Confident	50 Å²	50	56.4 Å²	56.4	41%	0.413	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.8	171.7	0	0	0	0	0	113.2	P71 Y103	P71-A73 PolarHBondContact O-N 3.3Å; A73-Y103 HydrophobicContact CB-CE1 3.98Å; A73-Y103 WeakPolarHBondContact CB-OH 3.4Å
74	V	90.1	Very high	89.2	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	32%	0.315	C	S	.	.	S	Bend	trans	-81.3	131.7	175.9	-178.1	0	0	0	0	110	V36 K37 L70 P71 P72 F79 T104 F107	V36-V74 HydrophobicContact CG1-CB 4.15Å; V36-V74 HydrophobicContact CG1-CG1 3.85Å; V36-V74 WeakPolarHBondContact CG1-O 3.19Å; K37-V74 WeakPolarHBondContact CE-O 3.27Å; L70-V74 HydrophobicContact CB-CB 4.26Å; L70-V74 HydrophobicContact CB-CG2 4.24Å; L70-V74 HydrophobicContact CD1-CG1 4.03Å; L70-V74 HydrophobicContact CD1-CG2 4.46Å; P71-V74 PolarHBondContact O-N 2.97Å; P72-V74 VanDerWaalsContact C-N 3.29Å; V74-F79 HydrophobicContact CG1-CB 4.11Å; V74-T104 HydrophobicContact CG1-CG2 3.86Å; V74-F107 HydrophobicContact CG2-CD1 3.72Å; V74-F107 HydrophobicContact CG2-CE1 3.98Å; V74-F107 HydrophobicContact CG2-CG 4.43Å
75	Q	90.4	Very high	90.7	Very high	74 Å²	74	48.6 Å²	48.6	35%	0.346	28%	0.279	S	S	.	.			trans	-98.5	138.7	178.2	-65.9	-75.9	31.5	0	0	111.2	K37 Q77 S78 F79 L100	K37-Q75 VanDerWaalsContact NZ-CD 3.34Å; Q75-Q77 PolarHBondContact O-N 3.07Å; Q75-S78 PolarHBondContact O-N 2.88Å; Q75-F79 PolarHBondContact O-N 3.27Å; Q75-L100 HydrophobicContact CB-CD1 4.44Å; Q75-L100 HydrophobicContact CB-CD2 4.07Å; Q75-L100 HydrophobicContact CG-CD1 3.8Å; Q75-L100 HydrophobicContact CG-CD2 3.82Å; Q75-L100 HydrophobicContact CG-CG 4.29Å
76	P	93.9	Very high	91.6	Very high	21 Å²	21	45.7 Å²	45.7	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-58.1	-41.2	-176.2	-26.6	34.6	0	0	0	114.3	V36 K37 H39 F41 F79 Q80	V36-P76 HydrophobicContact CB-CG 4.37Å; V36-P76 HydrophobicContact CG1-CG 4.04Å; K37-P76 HydrophobicContact CB-CG 4.19Å; H39-P76 HydrophobicContact CB-CB 4.18Å; H39-P76 HydrophobicContact CB-CG 4.37Å; F41-P76 HydrophobicContact CE2-CB 4.29Å; F41-P76 HydrophobicContact CZ-CB 4.13Å; P76-F79 PolarHBondContact O-N 3.03Å; P76-Q80 WeakPolarHBondContact O-CB 3.44Å; P76-Q80 PolarHBondContact O-N 2.73Å
77	Q	92.2	Very high	92.2	Very high	106 Å²	106	42.1 Å²	42.1	50%	0.495	23%	0.234	S	C	.	.	H	α-helix	trans	-60.3	-47.3	177.5	174.3	174.7	-31	0	0	112	Q75 Q80 Q81 D97	Q75-Q77 PolarHBondContact O-N 3.07Å; Q77-Q80 WeakPolarHBondContact O-CB 3.28Å; Q77-Q80 PolarHBondContact O-N 3.22Å; Q77-Q81 PolarHBondContact O-N 2.99Å; Q77-D97 PolarHBondContact NE2-OD2 3.45Å
78	S	92.3	Very high	92.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-43	176.7	-50.5	0	0	0	0	110.9	Q75 Q80 Q81 I82 L100 T104	Q75-S78 PolarHBondContact O-N 2.88Å; S78-Q80 VanDerWaalsContact C-N 3.29Å; S78-Q80 PolarHBondContact O-N 3.48Å; S78-Q81 PolarHBondContact O-N 3.3Å; S78-I82 VanDerWaalsContact O-CG1 3.23Å; S78-I82 WeakPolarHBondContact O-CG1 3.17Å; S78-I82 PolarHBondContact O-N 3.33Å; S78-L100 WeakPolarHBondContact OG-CD2 3.33Å; S78-L100 WeakPolarHBondContact OG-CG 3.4Å; S78-T104 WeakPolarHBondContact CB-OG1 3.16Å
79	F	95.1	Very high	92.4	Very high	1 Å²	1	42.3 Å²	42.3	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-38.8	174.3	-174.3	-104.3	0	0	0	112.5	V34 V36 F41 F55 L70 V74 Q75 P76 I82 L83 L108	V34-F79 HydrophobicContact CB-CE1 3.95Å; V34-F79 HydrophobicContact CB-CZ 3.85Å; V34-F79 HydrophobicContact CG1-CE1 3.89Å; V34-F79 HydrophobicContact CG1-CE2 4.18Å; V34-F79 HydrophobicContact CG1-CZ 3.61Å; V34-F79 HydrophobicContact CG2-CZ 4.14Å; V36-F79 HydrophobicContact CG2-CB 4.07Å; V36-F79 HydrophobicContact CG2-CD1 3.82Å; V36-F79 HydrophobicContact CG2-CD2 4.46Å; V36-F79 HydrophobicContact CG2-CE1 4.45Å; V36-F79 HydrophobicContact CG2-CG 3.82Å; F41-F79 HydrophobicContact CB-CD1 4.31Å; F41-F79 HydrophobicContact CB-CE1 3.8Å; F41-F79 HydrophobicContact CD1-CD1 4.31Å; F41-F79 AromaticContact CD2-CD1 3.58Å; F41-F79 HydrophobicContact CD2-CD1 3.58Å; F41-F79 AromaticContact CD2-CE1 3.89Å; F41-F79 HydrophobicContact CD2-CE1 3.89Å; F41-F79 AromaticContact CE2-CD1 3.88Å; F41-F79 HydrophobicContact CE2-CD1 3.88Å; F41-F79 AromaticContact CG-CD1 3.81Å; F41-F79 HydrophobicContact CG-CD1 3.81Å; F41-F79 AromaticContact CG-CE1 3.83Å; F41-F79 HydrophobicContact CG-CE1 3.83Å; F41-F79 HydrophobicContact CZ-CD1 4.36Å; F55-F79 HydrophobicContact CE2-CE2 4.05Å; F55-F79 HydrophobicContact CE2-CZ 4.46Å; F55-F79 AromaticContact CZ-CE2 3.9Å; F55-F79 HydrophobicContact CZ-CE2 3.9Å; F55-F79 HydrophobicContact CZ-CZ 4.13Å; L70-F79 HydrophobicContact CD1-CD2 3.6Å; L70-F79 HydrophobicContact CD1-CE2 3.67Å; L70-F79 HydrophobicContact CD1-CG 4.3Å; L70-F79 HydrophobicContact CD1-CZ 4.41Å; V74-F79 HydrophobicContact CG1-CB 4.11Å; Q75-F79 PolarHBondContact O-N 3.27Å; P76-F79 PolarHBondContact O-N 3.03Å; F79-I82 PolarHBondContact O-N 2.98Å; F79-L83 HydrophobicContact CE1-CB 4.36Å; F79-L83 HydrophobicContact CE1-CD2 4.15Å; F79-L83 VanDerWaalsContact O-CB 3.29Å; F79-L83 WeakPolarHBondContact O-CB 3.38Å; F79-L83 PolarHBondContact O-N 2.93Å; F79-L108 HydrophobicContact CD2-CD1 3.74Å; F79-L108 HydrophobicContact CE2-CD1 3.81Å
80	Q	95	Very high	92.2	Very high	120 Å²	120	43.3 Å²	43.3	56%	0.561	24%	0.243	S	C	*	.	H	α-helix	trans	-63.6	-42.6	176.1	-174.1	175	-72.2	0	0	112.4	F41 P76 Q77 S78 L83 A84	F41-Q80 HydrophobicContact CE1-CB 3.9Å; F41-Q80 HydrophobicContact CE1-CG 4.22Å; F41-Q80 HydrophobicContact CZ-CB 4.36Å; P76-Q80 WeakPolarHBondContact O-CB 3.44Å; P76-Q80 PolarHBondContact O-N 2.73Å; Q77-Q80 WeakPolarHBondContact O-CB 3.28Å; Q77-Q80 PolarHBondContact O-N 3.22Å; S78-Q80 VanDerWaalsContact C-N 3.29Å; S78-Q80 PolarHBondContact O-N 3.48Å; Q80-L83 PolarHBondContact O-N 3.46Å; Q80-A84 WeakPolarHBondContact O-CB 3.26Å; Q80-A84 PolarHBondContact O-N 3.41Å
81	Q	93.4	Very high	92.1	Very high	33 Å²	33	45.2 Å²	45.2	15%	0.154	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-43	174.5	-72.9	166.1	-37.7	0	0	111.6	Q77 S78 A84 F85 S92 L101	Q77-Q81 PolarHBondContact O-N 2.99Å; S78-Q81 PolarHBondContact O-N 3.3Å; Q81-A84 PolarHBondContact O-N 2.93Å; Q81-F85 PolarHBondContact O-N 3.15Å; Q81-S92 PolarHBondContact NE2-O 3.03Å; Q81-L101 HydrophobicContact CB-CD1 3.8Å
82	I	94.8	Very high	91.7	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-45.7	175.5	-66.6	-62.1	0	0	0	111.7	S78 F79 A84 F85 C86 L91 L101 T104 A105 L108 I110 I113	S78-I82 VanDerWaalsContact O-CG1 3.23Å; S78-I82 WeakPolarHBondContact O-CG1 3.17Å; S78-I82 PolarHBondContact O-N 3.33Å; F79-I82 PolarHBondContact O-N 2.98Å; I82-A84 VanDerWaalsContact C-N 3.32Å; I82-A84 PolarHBondContact O-N 3.24Å; I82-F85 WeakPolarHBondContact O-CB 3.38Å; I82-F85 PolarHBondContact O-N 3.21Å; I82-C86 PolarHBondContact O-N 2.89Å; I82-C86 PolarHBondContact O-SG 3.16Å; I82-C86 VanDerWaalsContact O-SG 3.36Å; I82-L91 HydrophobicContact CD1-CD1 4.49Å; I82-L101 HydrophobicContact CD1-CD1 3.63Å; I82-L101 HydrophobicContact CD1-CG 4.36Å; I82-L101 HydrophobicContact CG1-CD1 3.71Å; I82-T104 HydrophobicContact CG1-CG2 4.06Å; I82-A105 HydrophobicContact CD1-CB 3.77Å; I82-L108 HydrophobicContact CG2-CD1 3.97Å; I82-I110 HydrophobicContact CG2-CD1 3.16Å; I82-I113 HydrophobicContact CD1-CD1 3.4Å
83	L	96	Very high	91.4	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-38.6	177.8	-177.8	62.8	0	0	0	111.2	F41 A43 L48 F79 Q80 C86 Y87	F41-L83 HydrophobicContact CB-CD2 3.94Å; F41-L83 HydrophobicContact CD1-CD2 4.2Å; F41-L83 HydrophobicContact CG-CD2 4.41Å; A43-L83 HydrophobicContact CB-CD1 4.13Å; L48-L83 HydrophobicContact CD2-CD1 3.89Å; F79-L83 HydrophobicContact CE1-CB 4.36Å; F79-L83 HydrophobicContact CE1-CD2 4.15Å; F79-L83 VanDerWaalsContact O-CB 3.29Å; F79-L83 WeakPolarHBondContact O-CB 3.38Å; F79-L83 PolarHBondContact O-N 2.93Å; Q80-L83 PolarHBondContact O-N 3.46Å; L83-C86 PolarHBondContact O-N 3.23Å; L83-Y87 HydrophobicContact CD1-CD2 4.05Å; L83-Y87 HydrophobicContact CD1-CE2 3.8Å; L83-Y87 WeakPolarHBondContact O-CD2 3.5Å; L83-Y87 PolarHBondContact O-N 3.07Å
84	A	95	Very high	91.2	Very high	36 Å²	36	45.4 Å²	45.4	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-62.8	-40.1	173.2	0	0	0	0	0	112.1	Q80 Q81 I82 Y87 T88	Q80-A84 WeakPolarHBondContact O-CB 3.26Å; Q80-A84 PolarHBondContact O-N 3.41Å; Q81-A84 PolarHBondContact O-N 2.93Å; I82-A84 VanDerWaalsContact C-N 3.32Å; I82-A84 PolarHBondContact O-N 3.24Å; A84-Y87 PolarHBondContact O-N 3.28Å; A84-T88 WeakPolarHBondContact O-CB 3.47Å; A84-T88 WeakPolarHBondContact O-CG2 3.4Å; A84-T88 PolarHBondContact O-N 3.2Å; A84-T88 VanDerWaalsContact O-N 3.14Å; A84-T88 PolarHBondContact O-OG1 3.31Å
85	F	95.3	Very high	90.4	Very high	25 Å²	25	52.8 Å²	52.8	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-47.4	173.7	170.1	-90.1	0	0	0	112	Q81 I82 Y87 T88 G89 R90 L91 I110 Q112 I113	Q81-F85 PolarHBondContact O-N 3.15Å; I82-F85 WeakPolarHBondContact O-CB 3.38Å; I82-F85 PolarHBondContact O-N 3.21Å; F85-Y87 PolarHBondContact O-N 3.18Å; F85-T88 PolarHBondContact O-N 3.24Å; F85-T88 VanDerWaalsContact O-N 3.07Å; F85-G89 WeakPolarHBondContact CE2-O 3.43Å; F85-G89 PolarHBondContact O-N 2.96Å; F85-R90 WeakPolarHBondContact CA-O 3.31Å; F85-L91 HydrophobicContact CB-CD1 3.92Å; F85-L91 HydrophobicContact CD2-CB 3.93Å; F85-L91 HydrophobicContact CG-CD1 4.46Å; F85-I110 HydrophobicContact CD1-CG2 4.31Å; F85-I110 HydrophobicContact CE1-CG2 3.99Å; F85-Q112 HydrophobicContact CZ-CB 4.12Å; F85-I113 HydrophobicContact CB-CD1 4.19Å; F85-I113 HydrophobicContact CD1-CD1 3.53Å; F85-I113 HydrophobicContact CD1-CG1 3.72Å; F85-I113 HydrophobicContact CD2-CD1 4.4Å; F85-I113 HydrophobicContact CD2-CG1 4.2Å; F85-I113 HydrophobicContact CE1-CD1 3.97Å; F85-I113 HydrophobicContact CE1-CG1 3.64Å; F85-I113 HydrophobicContact CE2-CG1 4.13Å; F85-I113 HydrophobicContact CG-CD1 3.77Å; F85-I113 HydrophobicContact CG-CG1 4.01Å; F85-I113 HydrophobicContact CZ-CG1 3.86Å
86	C	95.9	Very high	89.7	Confident	7 Å²	7	51.8 Å²	51.8	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-56.7	-22.7	179	-66.1	0	0	0	0	113.9	V47 S51 I82 L83	V47-C86 HydrophobicContact CG1-CB 4.39Å; V47-C86 VanDerWaalsContact CG1-O 3.28Å; V47-C86 WeakPolarHBondContact CG1-O 3.24Å; S51-C86 WeakPolarHBondContact CB-SG 3.27Å; I82-C86 PolarHBondContact O-N 2.89Å; I82-C86 PolarHBondContact O-SG 3.16Å; I82-C86 VanDerWaalsContact O-SG 3.36Å; L83-C86 PolarHBondContact O-N 3.23Å
87	Y	96.1	Very high	88.9	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.008	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	4.5	-178.3	-79	-97.9	0	0	0	114.3	L20 N21 R24 H44 V47 L83 A84 F85	L20-Y87 HydrophobicContact CB-CD1 4.33Å; L20-Y87 HydrophobicContact CB-CE1 4.19Å; L20-Y87 WeakPolarHBondContact O-CE1 3.29Å; N21-Y87 HydrophobicContact CB-CD1 4.16Å; N21-Y87 WeakPolarHBondContact OD1-CB 3.46Å; R24-Y87 HydrophobicContact CB-CD1 4.31Å; R24-Y87 HydrophobicContact CB-CE1 3.97Å; R24-Y87 HydrophobicContact CG-CE1 4.36Å; H44-Y87 WeakPolarHBondContact CB-OH 3.45Å; H44-Y87 PolarHBondContact N-OH 3.16Å; H44-Y87 AromaticContact ND1-CE1 3.56Å; H44-Y87 AromaticContact ND1-CZ 3.75Å; H44-Y87 PolarHBondContact ND1-OH 2.91Å; H44-Y87 PolarHBondContact O-OH 2.83Å; V47-Y87 HydrophobicContact CB-CE1 4.19Å; V47-Y87 HydrophobicContact CB-CE2 3.94Å; V47-Y87 WeakPolarHBondContact CB-OH 3.09Å; V47-Y87 HydrophobicContact CG1-CD1 4.36Å; V47-Y87 HydrophobicContact CG1-CD2 3.89Å; V47-Y87 HydrophobicContact CG1-CE1 4.07Å; V47-Y87 HydrophobicContact CG1-CE2 3.53Å; V47-Y87 HydrophobicContact CG1-CG 4.29Å; V47-Y87 HydrophobicContact CG2-CE1 3.92Å; L83-Y87 HydrophobicContact CD1-CD2 4.05Å; L83-Y87 HydrophobicContact CD1-CE2 3.8Å; L83-Y87 WeakPolarHBondContact O-CD2 3.5Å; L83-Y87 PolarHBondContact O-N 3.07Å; A84-Y87 PolarHBondContact O-N 3.28Å; F85-Y87 PolarHBondContact O-N 3.18Å
88	T	94.2	Very high	88.4	Confident	35 Å²	35	48.4 Å²	48.4	22%	0.215	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144.3	-14.5	-177.9	63	0	0	0	0	115.1	A84 F85 R90	A84-T88 WeakPolarHBondContact O-CB 3.47Å; A84-T88 WeakPolarHBondContact O-CG2 3.4Å; A84-T88 PolarHBondContact O-N 3.2Å; A84-T88 VanDerWaalsContact O-N 3.14Å; A84-T88 PolarHBondContact O-OG1 3.31Å; F85-T88 PolarHBondContact O-N 3.24Å; F85-T88 VanDerWaalsContact O-N 3.07Å; T88-R90 PolarHBondContact O-N 2.91Å; T88-R90 PolarHBondContact OG1-N 3.43Å; T88-R90 VanDerWaalsContact OG1-N 3.16Å; T88-R90 PolarHBondContact OG1-O 2.98Å
89	G	91.1	Very high	87.9	Confident	53 Å²	53	54.8 Å²	54.8	55%	0.546	30%	0.304	S	S	.	.	S	Bend	trans	67.2	2.4	-168.1	0	0	0	0	0	114.4	F85	F85-G89 WeakPolarHBondContact CE2-O 3.43Å; F85-G89 PolarHBondContact O-N 2.96Å
90	R	90.1	Very high	87.4	Confident	167 Å²	167	57.6 Å²	57.6	63%	0.63	32%	0.319	S	S	*	.			trans	-109.5	126.4	-175.3	-63.7	-176.8	-70.7	-96.9	11.2	110	F85 T88	F85-R90 WeakPolarHBondContact CA-O 3.31Å; T88-R90 PolarHBondContact O-N 2.91Å; T88-R90 PolarHBondContact OG1-N 3.43Å; T88-R90 VanDerWaalsContact OG1-N 3.16Å; T88-R90 PolarHBondContact OG1-O 2.98Å
91	L	88.4	Confident	87	Confident	52 Å²	52	52 Å²	52	27%	0.272	29%	0.293	S	S	.	.			trans	-109.4	134.5	173.4	-166.9	69.2	0	0	0	109	I82 F85 M93 L101 I113	I82-L91 HydrophobicContact CD1-CD1 4.49Å; F85-L91 HydrophobicContact CB-CD1 3.92Å; F85-L91 HydrophobicContact CD2-CB 3.93Å; F85-L91 HydrophobicContact CG-CD1 4.46Å; L91-M93 HydrophobicContact CD2-CE 3.91Å; L91-L101 HydrophobicContact CD1-CD2 4.15Å; L91-L101 HydrophobicContact CD2-CD2 4.2Å; L91-L101 HydrophobicContact CG-CD2 4.22Å; L91-I113 HydrophobicContact CD1-CD1 4.08Å; L91-I113 HydrophobicContact CD2-CD1 4.37Å; L91-I113 HydrophobicContact CD2-CG1 4.29Å; L91-I113 HydrophobicContact CD2-CG2 3.75Å
92	S	81.2	Confident	86.7	Confident	96 Å²	96	51.6 Å²	51.6	67%	0.671	29%	0.291	S	S	*	.			trans	-130.3	138.8	171.6	-176.7	0	0	0	0	108.6	Q81	Q81-S92 PolarHBondContact NE2-O 3.03Å
93	M	77.3	Confident	86.3	Confident	29 Å²	29	55.9 Å²	55.9	14%	0.143	31%	0.308	C	S	.	.			trans	-142.9	146.2	-177	73.8	-176.1	77.4	0	0	110.3	L91 Q98 L101 F120	L91-M93 HydrophobicContact CD2-CE 3.91Å; M93-Q98 HydrophobicContact SD-CB 3.6Å; M93-Q98 VanDerWaalsContact SD-CB 3.6Å; M93-L101 HydrophobicContact CB-CD2 3.47Å; M93-L101 VanDerWaalsContact CB-CD2 3.47Å; M93-L101 HydrophobicContact CE-CD2 4.14Å; M93-L101 HydrophobicContact SD-CD2 4.43Å; M93-F120 HydrophobicContact CE-CD1 3.63Å; M93-F120 HydrophobicContact CE-CE1 3.91Å; M93-F120 HydrophobicContact CG-CE1 3.96Å; M93-F120 HydrophobicContact SD-CD1 3.89Å; M93-F120 HydrophobicContact SD-CE1 3.84Å
94	N	77.3	Confident	86	Confident	92 Å²	92	55.8 Å²	55.8	49%	0.492	31%	0.307	S	S	.	.			trans	-80.6	154.5	170.9	-54.3	-50.5	0	0	0	110	G96 D97	N94-G96 PolarHBondContact O-N 3.1Å; N94-D97 HydrophobicContact CB-CB 4.33Å; N94-D97 WeakPolarHBondContact CB-OD2 3.21Å; N94-D97 PolarHBondContact ND2-OD2 3.46Å; N94-D97 PolarHBondContact O-N 3.35Å
95	I	73.5	Confident	85.8	Confident	155 Å²	155	54 Å²	54	80%	0.795	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	129.6	167.3	-61.6	160.7	0	0	0	107.5	V124	I95-V124 HydrophobicContact CG1-CG1 4.42Å
96	G	75.4	Confident	85.4	Confident	53 Å²	53	53.3 Å²	53.3	55%	0.546	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.8	-56.4	-169.3	0	0	0	0	0	113.2	N94 Q98	N94-G96 PolarHBondContact O-N 3.1Å; G96-Q98 PolarHBondContact O-N 2.82Å
97	D	77.6	Confident	85.1	Confident	38 Å²	38	55.7 Å²	55.7	20%	0.203	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-19	-178.4	-73	-21.4	0	0	0	113.9	Q77 N94 F99 L100 L101	Q77-D97 PolarHBondContact NE2-OD2 3.45Å; N94-D97 HydrophobicContact CB-CB 4.33Å; N94-D97 WeakPolarHBondContact CB-OD2 3.21Å; N94-D97 PolarHBondContact ND2-OD2 3.46Å; N94-D97 PolarHBondContact O-N 3.35Å; D97-F99 VanDerWaalsContact C-N 3.3Å; D97-F99 PolarHBondContact O-N 3.39Å; D97-F99 VanDerWaalsContact O-N 3.14Å; D97-L100 PolarHBondContact O-N 3.45Å; D97-L100 VanDerWaalsContact O-N 3.08Å; D97-L101 PolarHBondContact O-N 3.42Å
98	Q	81.3	Confident	84.9	Confident	18 Å²	18	55.6 Å²	55.6	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-49.4	-41.5	-172.3	61.5	175.1	5.6	0	0	114.8	M93 G96 M102 F121 S125	M93-Q98 HydrophobicContact SD-CB 3.6Å; M93-Q98 VanDerWaalsContact SD-CB 3.6Å; G96-Q98 PolarHBondContact O-N 2.82Å; Q98-M102 WeakPolarHBondContact O-CB 3.37Å; Q98-M102 PolarHBondContact O-N 3.37Å; Q98-F121 HydrophobicContact CB-CD2 4.23Å; Q98-F121 VanDerWaalsContact CD-CD2 3.43Å; Q98-F121 HydrophobicContact CG-CD2 3.91Å; Q98-F121 HydrophobicContact CG-CE2 3.98Å; Q98-F121 VanDerWaalsContact NE2-CE2 3.35Å; Q98-S125 PolarHBondContact NE2-OG 2.96Å; Q98-S125 VanDerWaalsContact NE2-OG 3.08Å
99	F	81.8	Confident	84.7	Confident	135 Å²	135	57.2 Å²	57.2	59%	0.592	31%	0.307	S	S	*	.	H	α-helix	trans	-68.5	-43.9	-179.8	-70.3	-81.6	0	0	0	112.3	D97 M102 Y103 F121	D97-F99 VanDerWaalsContact C-N 3.3Å; D97-F99 PolarHBondContact O-N 3.39Å; D97-F99 VanDerWaalsContact O-N 3.14Å; F99-M102 PolarHBondContact O-N 3.28Å; F99-Y103 WeakPolarHBondContact O-CB 3.48Å; F99-Y103 PolarHBondContact O-N 3.03Å; F99-F121 AromaticContact CD1-CE2 3.81Å; F99-F121 HydrophobicContact CD1-CE2 3.81Å; F99-F121 HydrophobicContact CD1-CZ 4.13Å; F99-F121 HydrophobicContact CD2-CE2 4.34Å; F99-F121 AromaticContact CE1-CE2 3.44Å; F99-F121 HydrophobicContact CE1-CE2 3.44Å; F99-F121 VanDerWaalsContact CE1-CE2 3.44Å; F99-F121 AromaticContact CE1-CZ 3.36Å; F99-F121 HydrophobicContact CE1-CZ 3.36Å; F99-F121 HydrophobicContact CE2-CE2 4Å; F99-F121 HydrophobicContact CE2-CZ 4.41Å; F99-F121 HydrophobicContact CG-CE2 4.26Å; F99-F121 AromaticContact CZ-CE2 3.55Å; F99-F121 HydrophobicContact CZ-CE2 3.55Å; F99-F121 AromaticContact CZ-CZ 3.54Å; F99-F121 HydrophobicContact CZ-CZ 3.54Å
100	L	84.9	Confident	84.7	Confident	60 Å²	60	54.9 Å²	54.9	31%	0.314	28%	0.282	S	S	.	.	H	α-helix	trans	-68.6	-38.6	-179.4	175.8	67.2	0	0	0	111.4	Q75 S78 D97 T104	Q75-L100 HydrophobicContact CB-CD1 4.44Å; Q75-L100 HydrophobicContact CB-CD2 4.07Å; Q75-L100 HydrophobicContact CG-CD1 3.8Å; Q75-L100 HydrophobicContact CG-CD2 3.82Å; Q75-L100 HydrophobicContact CG-CG 4.29Å; S78-L100 WeakPolarHBondContact OG-CD2 3.33Å; S78-L100 WeakPolarHBondContact OG-CG 3.4Å; D97-L100 PolarHBondContact O-N 3.45Å; D97-L100 VanDerWaalsContact O-N 3.08Å; L100-T104 WeakPolarHBondContact O-CB 3.49Å; L100-T104 PolarHBondContact O-N 2.84Å; L100-T104 PolarHBondContact O-OG1 3.49Å
101	L	87.3	Confident	84.5	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-42.5	173.3	-174.8	62.6	0	0	0	111.5	Q81 I82 L91 M93 D97 T104 A105	Q81-L101 HydrophobicContact CB-CD1 3.8Å; I82-L101 HydrophobicContact CD1-CD1 3.63Å; I82-L101 HydrophobicContact CD1-CG 4.36Å; I82-L101 HydrophobicContact CG1-CD1 3.71Å; L91-L101 HydrophobicContact CD1-CD2 4.15Å; L91-L101 HydrophobicContact CD2-CD2 4.2Å; L91-L101 HydrophobicContact CG-CD2 4.22Å; M93-L101 HydrophobicContact CB-CD2 3.47Å; M93-L101 VanDerWaalsContact CB-CD2 3.47Å; M93-L101 HydrophobicContact CE-CD2 4.14Å; M93-L101 HydrophobicContact SD-CD2 4.43Å; D97-L101 PolarHBondContact O-N 3.42Å; L101-T104 PolarHBondContact O-N 3Å; L101-A105 WeakPolarHBondContact O-CB 3.42Å; L101-A105 PolarHBondContact O-N 2.98Å
102	M	86.6	Confident	84.2	Confident	26 Å²	26	54.9 Å²	54.9	13%	0.128	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-41.3	175.9	-161.2	57.9	49.4	0	0	112.3	Q98 F99 T104 A105 G106 I113 M114 G117 T118	Q98-M102 WeakPolarHBondContact O-CB 3.37Å; Q98-M102 PolarHBondContact O-N 3.37Å; F99-M102 PolarHBondContact O-N 3.28Å; M102-T104 VanDerWaalsContact C-N 3.34Å; M102-A105 PolarHBondContact O-N 2.85Å; M102-G106 PolarHBondContact O-N 2.95Å; M102-I113 HydrophobicContact CE-CG2 4.5Å; M102-M114 HydrophobicContact CG-SD 4.3Å; M102-M114 HydrophobicContact SD-CE 4.39Å; M102-M114 HydrophobicContact SD-SD 3.64Å; M102-M114 VanDerWaalsContact SD-SD 3.64Å; M102-G117 VanDerWaalsContact CE-C 3.48Å; M102-G117 WeakPolarHBondContact CE-O 3.47Å; M102-T118 HydrophobicContact SD-CG2 4.15Å
103	Y	86.4	Confident	84.4	Confident	91 Å²	91	50.5 Å²	50.5	36%	0.357	26%	0.257	S	S	.	.	H	α-helix	trans	-58.8	-46	172.1	173.3	-94.6	0	0	0	111.3	A73 F99 G106 F107 L492	A73-Y103 HydrophobicContact CB-CE1 3.98Å; A73-Y103 WeakPolarHBondContact CB-OH 3.4Å; F99-Y103 WeakPolarHBondContact O-CB 3.48Å; F99-Y103 PolarHBondContact O-N 3.03Å; Y103-G106 PolarHBondContact O-N 3.38Å; Y103-F107 WeakPolarHBondContact O-CB 3.47Å; Y103-F107 PolarHBondContact O-N 2.95Å; Y103-L492 HydrophobicContact CD2-CD2 3.85Å; Y103-L492 HydrophobicContact CE2-CD2 3.65Å
104	T	89.6	Confident	84.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-42.8	178.1	-55.6	0	0	0	0	111.9	V74 S78 I82 L100 L101 M102 G106 F107 L108	V74-T104 HydrophobicContact CG1-CG2 3.86Å; S78-T104 WeakPolarHBondContact CB-OG1 3.16Å; I82-T104 HydrophobicContact CG1-CG2 4.06Å; L100-T104 WeakPolarHBondContact O-CB 3.49Å; L100-T104 PolarHBondContact O-N 2.84Å; L100-T104 PolarHBondContact O-OG1 3.49Å; L101-T104 PolarHBondContact O-N 3Å; M102-T104 VanDerWaalsContact C-N 3.34Å; T104-G106 VanDerWaalsContact C-N 3.32Å; T104-G106 PolarHBondContact O-N 3.18Å; T104-F107 PolarHBondContact O-N 3.06Å; T104-L108 HydrophobicContact CG2-CD1 4.02Å; T104-L108 WeakPolarHBondContact O-CB 3.36Å; T104-L108 WeakPolarHBondContact O-CG 3.3Å; T104-L108 PolarHBondContact O-N 3.48Å
105	A	89.9	Confident	84.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-37.1	174.8	0	0	0	0	0	112.8	I82 L101 M102 Q109 I110 I113 M114	I82-A105 HydrophobicContact CD1-CB 3.77Å; L101-A105 WeakPolarHBondContact O-CB 3.42Å; L101-A105 PolarHBondContact O-N 2.98Å; M102-A105 PolarHBondContact O-N 2.85Å; A105-Q109 PolarHBondContact O-N 3.2Å; A105-I110 PolarHBondContact O-N 3.4Å; A105-I113 HydrophobicContact CB-CB 4Å; A105-I113 HydrophobicContact CB-CD1 4.4Å; A105-I113 HydrophobicContact CB-CG2 3.49Å; A105-I113 VanDerWaalsContact CB-CG2 3.49Å; A105-M114 HydrophobicContact CB-CG 4.45Å; A105-M114 HydrophobicContact CB-SD 3.87Å
106	G	86.9	Confident	84.6	Confident	9 Å²	9	49.7 Å²	49.7	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-68.7	-48.2	176	0	0	0	0	0	112.3	M102 Y103 T104 L108 Q109 M114 W485	M102-G106 PolarHBondContact O-N 2.95Å; Y103-G106 PolarHBondContact O-N 3.38Å; T104-G106 VanDerWaalsContact C-N 3.32Å; T104-G106 PolarHBondContact O-N 3.18Å; G106-L108 VanDerWaalsContact C-N 3.34Å; G106-L108 PolarHBondContact O-N 2.92Å; G106-Q109 WeakPolarHBondContact O-CA 3.12Å; G106-Q109 PolarHBondContact O-N 2.98Å; G106-M114 VanDerWaalsContact CA-SD 3.55Å; G106-M114 PolarHBondContact N-SD 2.69Å; G106-M114 VanDerWaalsContact N-SD 3.37Å; G106-W485 WeakPolarHBondContact O-CH2 3.34Å; G106-W485 VanDerWaalsContact O-CZ3 3.24Å; G106-W485 WeakPolarHBondContact O-CZ3 3.38Å
107	F	89.6	Confident	84.2	Confident	58 Å²	58	47.4 Å²	47.4	25%	0.254	22%	0.221	S	C	.	.	H	α-helix	trans	-57.4	-45.7	175	174.7	-97.1	0	0	0	111.9	Y54 P71 V74 Y103 T104 Q109	Y54-F107 HydrophobicContact CD2-CZ 4.47Å; Y54-F107 HydrophobicContact CE1-CE1 4.41Å; Y54-F107 HydrophobicContact CE2-CE1 4.15Å; Y54-F107 AromaticContact CE2-CZ 3.85Å; Y54-F107 HydrophobicContact CE2-CZ 3.85Å; P71-F107 HydrophobicContact CG-CE1 4.37Å; P71-F107 HydrophobicContact CG-CE2 4.15Å; P71-F107 HydrophobicContact CG-CZ 3.62Å; V74-F107 HydrophobicContact CG2-CD1 3.72Å; V74-F107 HydrophobicContact CG2-CE1 3.98Å; V74-F107 HydrophobicContact CG2-CG 4.43Å; Y103-F107 WeakPolarHBondContact O-CB 3.47Å; Y103-F107 PolarHBondContact O-N 2.95Å; T104-F107 PolarHBondContact O-N 3.06Å; F107-Q109 PolarHBondContact O-N 2.92Å
108	L	92.1	Very high	83.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	0.1	176.4	-63.3	175.2	0	0	0	113.7	S52 Y54 F55 L70 F79 I82 T104 G106 I110	S52-L108 WeakPolarHBondContact CB-O 3.46Å; S52-L108 PolarHBondContact OG-O 2.85Å; Y54-L108 HydrophobicContact CD1-CD2 3.6Å; Y54-L108 HydrophobicContact CE1-CD2 3.98Å; Y54-L108 HydrophobicContact CG-CD2 4.27Å; F55-L108 HydrophobicContact CD2-CD2 4.49Å; F55-L108 HydrophobicContact CE2-CD1 4.35Å; F55-L108 HydrophobicContact CE2-CD2 3.79Å; F55-L108 HydrophobicContact CZ-CD2 4.03Å; L70-L108 HydrophobicContact CD1-CD2 4.07Å; L70-L108 HydrophobicContact CD2-CD2 4.25Å; F79-L108 HydrophobicContact CD2-CD1 3.74Å; F79-L108 HydrophobicContact CE2-CD1 3.81Å; I82-L108 HydrophobicContact CG2-CD1 3.97Å; T104-L108 HydrophobicContact CG2-CD1 4.02Å; T104-L108 WeakPolarHBondContact O-CB 3.36Å; T104-L108 WeakPolarHBondContact O-CG 3.3Å; T104-L108 PolarHBondContact O-N 3.48Å; G106-L108 VanDerWaalsContact C-N 3.34Å; G106-L108 PolarHBondContact O-N 2.92Å; L108-I110 HydrophobicContact CB-CD1 3.97Å; L108-I110 HydrophobicContact CB-CG1 4.11Å; L108-I110 PolarHBondContact O-N 2.72Å
109	Q	90.6	Very high	82.8	Confident	69 Å²	69	52.6 Å²	52.6	32%	0.322	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	46.1	175.7	-51	179.2	3.7	0	0	113.8	S53 A105 G106 F107 Q111 W485	S53-Q109 WeakPolarHBondContact OG-CB 3.36Å; S53-Q109 PolarHBondContact OG-O 2.72Å; S53-Q109 PolarHBondContact OG-OE1 2.77Å; A105-Q109 PolarHBondContact O-N 3.2Å; G106-Q109 WeakPolarHBondContact O-CA 3.12Å; G106-Q109 PolarHBondContact O-N 2.98Å; F107-Q109 PolarHBondContact O-N 2.92Å; Q109-Q111 PolarHBondContact O-N 3.26Å; Q109-W485 HydrophobicContact CG-CZ3 4.2Å
110	I	91.6	Very high	81.9	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	24%	0.242	C	C	.	.			trans	-91.3	87.8	-179	-62.3	171.2	0	0	0	108.7	I82 F85 A105 L108 Q112 I113 M114	I82-I110 HydrophobicContact CG2-CD1 3.16Å; F85-I110 HydrophobicContact CD1-CG2 4.31Å; F85-I110 HydrophobicContact CE1-CG2 3.99Å; A105-I110 PolarHBondContact O-N 3.4Å; L108-I110 HydrophobicContact CB-CD1 3.97Å; L108-I110 HydrophobicContact CB-CG1 4.11Å; L108-I110 PolarHBondContact O-N 2.72Å; I110-Q112 VanDerWaalsContact C-N 3.29Å; I110-Q112 PolarHBondContact O-N 3.04Å; I110-Q112 VanDerWaalsContact O-N 3.16Å; I110-I113 HydrophobicContact CB-CD1 4.35Å; I110-I113 HydrophobicContact CG2-CB 4.19Å; I110-I113 HydrophobicContact CG2-CD1 3.74Å; I110-I113 HydrophobicContact CG2-CG1 3.77Å; I110-I113 PolarHBondContact O-N 3.23Å; I110-M114 PolarHBondContact O-N 3.11Å; I110-M114 VanDerWaalsContact O-N 3.16Å
111	Q	84.3	Confident	80.8	Confident	84 Å²	84	50.5 Å²	50.5	39%	0.393	24%	0.237	S	C	.	.	H	α-helix	trans	-51.3	-43.3	-168.6	-172.6	64.6	17.4	0	0	113.5	Q109 I113 M114 E115	Q109-Q111 PolarHBondContact O-N 3.26Å; Q111-I113 PolarHBondContact O-N 2.96Å; Q111-M114 PolarHBondContact O-N 2.83Å; Q111-M114 VanDerWaalsContact O-N 3.14Å; Q111-E115 HydrophobicContact CG-CG 4.34Å; Q111-E115 WeakPolarHBondContact CG-OE1 3.46Å; Q111-E115 PolarHBondContact NE2-OE1 2.89Å; Q111-E115 WeakPolarHBondContact O-CG 3.46Å; Q111-E115 PolarHBondContact O-N 3.21Å
112	Q	83.5	Confident	79.5	Confident	135 Å²	135	56 Å²	56	63%	0.631	27%	0.265	S	S	*	.	H	α-helix	trans	-66.9	-33.6	-177.5	-65.7	-163.4	1.5	0	0	113.5	F85 I110 K116	F85-Q112 HydrophobicContact CZ-CB 4.12Å; I110-Q112 VanDerWaalsContact C-N 3.29Å; I110-Q112 PolarHBondContact O-N 3.04Å; I110-Q112 VanDerWaalsContact O-N 3.16Å; Q112-K116 WeakPolarHBondContact O-CB 3.39Å; Q112-K116 PolarHBondContact O-N 2.93Å
113	I	84.8	Confident	78.1	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-70.3	-39.1	172.5	-63.2	177.3	0	0	0	110.1	I82 F85 L91 M102 A105 I110 Q111 E115 G117	I82-I113 HydrophobicContact CD1-CD1 3.4Å; F85-I113 HydrophobicContact CB-CD1 4.19Å; F85-I113 HydrophobicContact CD1-CD1 3.53Å; F85-I113 HydrophobicContact CD1-CG1 3.72Å; F85-I113 HydrophobicContact CD2-CD1 4.4Å; F85-I113 HydrophobicContact CD2-CG1 4.2Å; F85-I113 HydrophobicContact CE1-CD1 3.97Å; F85-I113 HydrophobicContact CE1-CG1 3.64Å; F85-I113 HydrophobicContact CE2-CG1 4.13Å; F85-I113 HydrophobicContact CG-CD1 3.77Å; F85-I113 HydrophobicContact CG-CG1 4.01Å; F85-I113 HydrophobicContact CZ-CG1 3.86Å; L91-I113 HydrophobicContact CD1-CD1 4.08Å; L91-I113 HydrophobicContact CD2-CD1 4.37Å; L91-I113 HydrophobicContact CD2-CG1 4.29Å; L91-I113 HydrophobicContact CD2-CG2 3.75Å; M102-I113 HydrophobicContact CE-CG2 4.5Å; A105-I113 HydrophobicContact CB-CB 4Å; A105-I113 HydrophobicContact CB-CD1 4.4Å; A105-I113 HydrophobicContact CB-CG2 3.49Å; A105-I113 VanDerWaalsContact CB-CG2 3.49Å; I110-I113 HydrophobicContact CB-CD1 4.35Å; I110-I113 HydrophobicContact CG2-CB 4.19Å; I110-I113 HydrophobicContact CG2-CD1 3.74Å; I110-I113 HydrophobicContact CG2-CG1 3.77Å; I110-I113 PolarHBondContact O-N 3.23Å; Q111-I113 PolarHBondContact O-N 2.96Å; I113-E115 VanDerWaalsContact C-N 3.33Å; I113-E115 PolarHBondContact O-N 3.3Å; I113-G117 WeakPolarHBondContact O-CA 3.49Å; I113-G117 PolarHBondContact O-N 3.29Å
114	M	80.3	Confident	76.5	Confident	36 Å²	36	61.6 Å²	61.6	18%	0.177	30%	0.296	C	S	.	.	H	α-helix	trans	-69.7	-31.4	-179.6	-63.6	-62.3	-66.9	0	0	112.4	M102 A105 G106 I110 Q111 T118 W485	M102-M114 HydrophobicContact CG-SD 4.3Å; M102-M114 HydrophobicContact SD-CE 4.39Å; M102-M114 HydrophobicContact SD-SD 3.64Å; M102-M114 VanDerWaalsContact SD-SD 3.64Å; A105-M114 HydrophobicContact CB-CG 4.45Å; A105-M114 HydrophobicContact CB-SD 3.87Å; G106-M114 VanDerWaalsContact CA-SD 3.55Å; G106-M114 PolarHBondContact N-SD 2.69Å; G106-M114 VanDerWaalsContact N-SD 3.37Å; I110-M114 PolarHBondContact O-N 3.11Å; I110-M114 VanDerWaalsContact O-N 3.16Å; Q111-M114 PolarHBondContact O-N 2.83Å; Q111-M114 VanDerWaalsContact O-N 3.14Å; M114-T118 VanDerWaalsContact O-CG2 3.28Å; M114-T118 WeakPolarHBondContact O-CG2 3.31Å; M114-T118 PolarHBondContact O-OG1 2.85Å; M114-W485 HydrophobicContact CB-CZ2 3.93Å; M114-W485 HydrophobicContact CE-CH2 4.21Å; M114-W485 HydrophobicContact CE-CZ2 3.78Å; M114-W485 HydrophobicContact CG-CH2 4.01Å; M114-W485 HydrophobicContact CG-CZ2 3.69Å
115	E	79	Confident	74.5	Confident	97 Å²	97	64 Å²	64	45%	0.453	31%	0.312	S	S	.	.	H	α-helix	trans	-76.4	-42.8	174	-73	176.3	176.6	0	0	113.1	Q111 I113 T118	Q111-E115 HydrophobicContact CG-CG 4.34Å; Q111-E115 WeakPolarHBondContact CG-OE1 3.46Å; Q111-E115 PolarHBondContact NE2-OE1 2.89Å; Q111-E115 WeakPolarHBondContact O-CG 3.46Å; Q111-E115 PolarHBondContact O-N 3.21Å; I113-E115 VanDerWaalsContact C-N 3.33Å; I113-E115 PolarHBondContact O-N 3.3Å; E115-T118 PolarHBondContact O-OG1 3.47Å
116	K	73.4	Confident	72.2	Confident	125 Å²	125	68 Å²	68	54%	0.543	34%	0.34	S	S	.	.	H	α-helix	trans	-102.3	-27.6	-173.5	-67.8	-51.7	-165	178.9	0	115.7	Q112 T118 E119 F120	Q112-K116 WeakPolarHBondContact O-CB 3.39Å; Q112-K116 PolarHBondContact O-N 2.93Å; K116-T118 VanDerWaalsContact C-N 3.28Å; K116-T118 PolarHBondContact O-N 2.82Å; K116-E119 WeakPolarHBondContact CD-OE2 3.37Å; K116-E119 IonicContact NZ-OE1 3.85Å; K116-E119 PolarHBondContact NZ-OE1 2.88Å; K116-E119 IonicContact NZ-OE2 3.31Å; K116-E119 PolarHBondContact NZ-OE2 2.9Å; K116-E119 PolarHBondContact O-N 3.28Å; K116-F120 PolarHBondContact O-N 2.92Å; K116-F120 VanDerWaalsContact O-N 3.14Å
117	G	66.4	Low	69.9	Low	5 Å²	5	73 Å²	73	5%	0.052	37%	0.371	C	S	.	.	H	α-helix	trans	-72.4	-20.3	173.7	0	0	0	0	0	113.3	M102 I113 F121	M102-G117 VanDerWaalsContact CE-C 3.48Å; M102-G117 WeakPolarHBondContact CE-O 3.47Å; I113-G117 WeakPolarHBondContact O-CA 3.49Å; I113-G117 PolarHBondContact O-N 3.29Å; G117-F121 WeakPolarHBondContact O-CB 3.39Å; G117-F121 PolarHBondContact O-N 2.87Å
118	T	65.1	Low	67.5	Low	57 Å²	57	74.5 Å²	74.5	35%	0.35	39%	0.389	S	S	.	.	H	α-helix	trans	-75.1	-38.6	171.2	46.9	0	0	0	0	112.3	M102 M114 E115 K116 F120 F121 L122	M102-T118 HydrophobicContact SD-CG2 4.15Å; M114-T118 VanDerWaalsContact O-CG2 3.28Å; M114-T118 WeakPolarHBondContact O-CG2 3.31Å; M114-T118 PolarHBondContact O-OG1 2.85Å; E115-T118 PolarHBondContact O-OG1 3.47Å; K116-T118 VanDerWaalsContact C-N 3.28Å; K116-T118 PolarHBondContact O-N 2.82Å; T118-F120 VanDerWaalsContact C-N 3.34Å; T118-F121 PolarHBondContact O-N 3.13Å; T118-L122 WeakPolarHBondContact O-CG 3.48Å; T118-L122 PolarHBondContact O-N 3Å; T118-L122 VanDerWaalsContact O-N 3.1Å
119	E	64.5	Low	64.7	Low	109 Å²	109	79.8 Å²	79.8	51%	0.509	42%	0.424	S	S	.	.	H	α-helix	trans	-59	-45.2	168.5	-63.8	173.7	-173.7	0	0	111.1	K116 K123	K116-E119 WeakPolarHBondContact CD-OE2 3.37Å; K116-E119 IonicContact NZ-OE1 3.85Å; K116-E119 PolarHBondContact NZ-OE1 2.88Å; K116-E119 IonicContact NZ-OE2 3.31Å; K116-E119 PolarHBondContact NZ-OE2 2.9Å; K116-E119 PolarHBondContact O-N 3.28Å; E119-K123 PolarHBondContact O-N 3.27Å
120	F	63.7	Low	62	Low	106 Å²	106	82.4 Å²	82.4	47%	0.465	44%	0.441	S	S	.	.	H	α-helix	trans	-64.3	-46.8	176.9	-172.4	-92.6	0	0	0	112.6	M93 K116 T118 L122 K123 V124	M93-F120 HydrophobicContact CE-CD1 3.63Å; M93-F120 HydrophobicContact CE-CE1 3.91Å; M93-F120 HydrophobicContact CG-CE1 3.96Å; M93-F120 HydrophobicContact SD-CD1 3.89Å; M93-F120 HydrophobicContact SD-CE1 3.84Å; K116-F120 PolarHBondContact O-N 2.92Å; K116-F120 VanDerWaalsContact O-N 3.14Å; T118-F120 VanDerWaalsContact C-N 3.34Å; F120-L122 VanDerWaalsContact C-N 3.33Å; F120-L122 PolarHBondContact O-N 3.48Å; F120-K123 PolarHBondContact O-N 3.28Å; F120-K123 VanDerWaalsContact O-N 3.12Å; F120-V124 HydrophobicContact CD1-CG2 4.12Å; F120-V124 HydrophobicContact CE1-CG2 3.74Å; F120-V124 HydrophobicContact CE2-CG2 4.47Å; F120-V124 HydrophobicContact CZ-CG2 3.93Å; F120-V124 PolarHBondContact O-N 3.3Å
121	F	62	Low	59.3	Low	45 Å²	45	87.3 Å²	87.3	20%	0.197	48%	0.475	C	S	.	.	H	α-helix	trans	-56.5	-44.5	177.9	169.4	-89.3	0	0	0	112.3	Q98 F99 G117 T118 K123 V124 S125	Q98-F121 HydrophobicContact CB-CD2 4.23Å; Q98-F121 VanDerWaalsContact CD-CD2 3.43Å; Q98-F121 HydrophobicContact CG-CD2 3.91Å; Q98-F121 HydrophobicContact CG-CE2 3.98Å; Q98-F121 VanDerWaalsContact NE2-CE2 3.35Å; F99-F121 AromaticContact CD1-CE2 3.81Å; F99-F121 HydrophobicContact CD1-CE2 3.81Å; F99-F121 HydrophobicContact CD1-CZ 4.13Å; F99-F121 HydrophobicContact CD2-CE2 4.34Å; F99-F121 AromaticContact CE1-CE2 3.44Å; F99-F121 HydrophobicContact CE1-CE2 3.44Å; F99-F121 VanDerWaalsContact CE1-CE2 3.44Å; F99-F121 AromaticContact CE1-CZ 3.36Å; F99-F121 HydrophobicContact CE1-CZ 3.36Å; F99-F121 HydrophobicContact CE2-CE2 4Å; F99-F121 HydrophobicContact CE2-CZ 4.41Å; F99-F121 HydrophobicContact CG-CE2 4.26Å; F99-F121 AromaticContact CZ-CE2 3.55Å; F99-F121 HydrophobicContact CZ-CE2 3.55Å; F99-F121 AromaticContact CZ-CZ 3.54Å; F99-F121 HydrophobicContact CZ-CZ 3.54Å; G117-F121 WeakPolarHBondContact O-CB 3.39Å; G117-F121 PolarHBondContact O-N 2.87Å; T118-F121 PolarHBondContact O-N 3.13Å; F121-K123 VanDerWaalsContact C-N 3.34Å; F121-V124 PolarHBondContact O-N 3.36Å; F121-S125 WeakPolarHBondContact O-CB 3.38Å; F121-S125 PolarHBondContact O-N 3.17Å; F121-S125 PolarHBondContact O-OG 3.03Å
122	L	59.7	Low	57	Low	115 Å²	115	91.6 Å²	91.6	60%	0.602	50%	0.495	S	S	*	.	H	α-helix	trans	-64.4	-39.5	177.3	-71.5	169.9	0	0	0	111.5	T118 F120 S125 S126	T118-L122 WeakPolarHBondContact O-CG 3.48Å; T118-L122 PolarHBondContact O-N 3Å; T118-L122 VanDerWaalsContact O-N 3.1Å; F120-L122 VanDerWaalsContact C-N 3.33Å; F120-L122 PolarHBondContact O-N 3.48Å; L122-S125 PolarHBondContact O-N 3.43Å; L122-S126 PolarHBondContact O-N 3.41Å; L122-S126 PolarHBondContact O-OG 2.71Å
123	K	56.1	Low	54.6	Low	176 Å²	176	88.7 Å²	88.7	77%	0.765	50%	0.502	S	S	*	.	H	α-helix	trans	-68.7	-31	179.5	-169.1	169.1	-176.3	172.7	0	113.8	E119 F120 F121	E119-K123 PolarHBondContact O-N 3.27Å; F120-K123 PolarHBondContact O-N 3.28Å; F120-K123 VanDerWaalsContact O-N 3.12Å; F121-K123 VanDerWaalsContact C-N 3.34Å
124	V	52.6	Low	52.2	Low	60 Å²	60	96.7 Å²	96.7	36%	0.364	54%	0.544	S	S	.	.	H	α-helix	trans	-88.5	-27.1	176.8	179	0	0	0	0	112.3	I95 F120 F121 S126	I95-V124 HydrophobicContact CG1-CG1 4.42Å; F120-V124 HydrophobicContact CD1-CG2 4.12Å; F120-V124 HydrophobicContact CE1-CG2 3.74Å; F120-V124 HydrophobicContact CE2-CG2 4.47Å; F120-V124 HydrophobicContact CZ-CG2 3.93Å; F120-V124 PolarHBondContact O-N 3.3Å; F121-V124 PolarHBondContact O-N 3.36Å; V124-S126 VanDerWaalsContact C-N 3.3Å; V124-S126 PolarHBondContact O-N 3.27Å
125	S	49.3	Very low	49.9	Very low	50 Å²	50	103.2 Å²	103.2	35%	0.35	57%	0.574	S	S	.	*	S	Bend	trans	-83.8	-1.4	179.5	-53.9	0	0	0	0	114	Q98 F121 L122 P127	Q98-S125 PolarHBondContact NE2-OG 2.96Å; Q98-S125 VanDerWaalsContact NE2-OG 3.08Å; F121-S125 WeakPolarHBondContact O-CB 3.38Å; F121-S125 PolarHBondContact O-N 3.17Å; F121-S125 PolarHBondContact O-OG 3.03Å; L122-S125 PolarHBondContact O-N 3.43Å; S125-P127 WeakPolarHBondContact O-CD 3.45Å
126	S	40.2	Very low	47.7	Very low	83 Å²	83	103.1 Å²	103.1	58%	0.58	59%	0.589	S	S	*	*	S	Bend	trans	-84.5	109.5	163.8	-64.2	0	0	0	0	109.3	L122 V124 S128	L122-S126 PolarHBondContact O-N 3.41Å; L122-S126 PolarHBondContact O-OG 2.71Å; V124-S126 VanDerWaalsContact C-N 3.3Å; V124-S126 PolarHBondContact O-N 3.27Å; S126-S128 PolarHBondContact O-N 3.39Å; S126-S128 VanDerWaalsContact O-N 3.11Å
127	P	39.3	Very low	45.6	Very low	115 Å²	115	104 Å²	104	75%	0.747	60%	0.595	S	S	*	*			trans	-66	114.7	172.4	27.7	-32.7	0	0	0	108.8	S125 C129	S125-P127 WeakPolarHBondContact O-CD 3.45Å; P127-C129 PolarHBondContact O-N 2.87Å
128	S	38.2	Very low	43.8	Very low	89 Å²	89	112.4 Å²	112.4	62%	0.622	63%	0.633	S	S	*	*			trans	-58.4	123.2	158.5	-179.5	0	0	0	0	107.2	S126 D130	S126-S128 PolarHBondContact O-N 3.39Å; S126-S128 VanDerWaalsContact O-N 3.11Å; S128-D130 WeakPolarHBondContact CB-OD1 3.32Å; S128-D130 PolarHBondContact O-N 2.62Å; S128-D130 PolarHBondContact OG-OD1 2.97Å
129	C	35	Very low	42.1	Very low	111 Å²	111	114.7 Å²	114.7	75%	0.75	65%	0.647	S	S	*	*			trans	-73.8	75.3	168.3	-72.8	0	0	0	0	108.2	P127 S131	P127-C129 PolarHBondContact O-N 2.87Å; C129-S131 PolarHBondContact O-N 3.28Å; C129-S131 PolarHBondContact O-OG 3.05Å
130	D	33.8	Very low	40.5	Very low	124 Å²	124	114.7 Å²	114.7	66%	0.663	66%	0.657	S	S	*	*			trans	-60.9	82.5	178	-79	4.1	0	0	0	109.8	S128 Q132	S128-D130 WeakPolarHBondContact CB-OD1 3.32Å; S128-D130 PolarHBondContact O-N 2.62Å; S128-D130 PolarHBondContact OG-OD1 2.97Å; D130-Q132 PolarHBondContact O-N 2.96Å
131	S	35.2	Very low	38.7	Very low	107 Å²	107	115.9 Å²	115.9	75%	0.748	68%	0.679	S	S	*	*			trans	-80.1	75	-177.9	-60.8	0	0	0	0	107	C129 G133	C129-S131 PolarHBondContact O-N 3.28Å; C129-S131 PolarHBondContact O-OG 3.05Å; S131-G133 PolarHBondContact O-N 3.04Å
132	Q	35.4	Very low	37.2	Very low	174 Å²	174	118.5 Å²	118.5	81%	0.813	70%	0.702	S	S	*	*			trans	-53.3	113.3	175.7	-69.3	-170.4	-13.6	0	0	108.3	D130 L134	D130-Q132 PolarHBondContact O-N 2.96Å; Q132-L134 PolarHBondContact O-N 3.31Å
133	G	33.2	Very low	35.8	Very low	75 Å²	75	121.5 Å²	121.5	77%	0.773	71%	0.713	S	S	*	*			trans	-61.9	104.9	-179.3	0	0	0	0	0	109.6	S131 H135	S131-G133 PolarHBondContact O-N 3.04Å; G133-H135 PolarHBondContact O-N 3.23Å
134	L	33.3	Very low	34.9	Very low	171 Å²	171	118.8 Å²	118.8	90%	0.895	71%	0.714	S	S	*	*			trans	-63.9	108.6	173.6	-78.1	173.4	0	0	0	108.4	Q132 A136	Q132-L134 PolarHBondContact O-N 3.31Å; L134-A136 VanDerWaalsContact C-N 3.27Å; L134-A136 PolarHBondContact O-N 2.9Å
135	H	33.1	Very low	33.8	Very low	173 Å²	173	125.1 Å²	125.1	80%	0.801	74%	0.739	S	S	*	*			trans	-72.2	80.4	179.4	-172.7	-66.8	0	0	0	109.9	G133 E137	G133-H135 PolarHBondContact O-N 3.23Å; H135-E137 PolarHBondContact O-N 2.87Å
136	A	32.2	Very low	33	Very low	95 Å²	95	128 Å²	128	79%	0.785	76%	0.759	S	S	*	*			trans	-68.3	116.7	165.8	0	0	0	0	0	108.5	L134	L134-A136 VanDerWaalsContact C-N 3.27Å; L134-A136 PolarHBondContact O-N 2.9Å
137	E	30.5	Very low	33.4	Very low	144 Å²	144	129.6 Å²	129.6	67%	0.673	77%	0.768	S	S	*	*			trans	-83.6	133.3	176.3	-162.7	-134.1	144.9	0	0	109.9	H135 T139	H135-E137 PolarHBondContact O-N 2.87Å; E137-T139 WeakPolarHBondContact OE1-CG2 3.49Å
138	E	28.5	Very low	32.9	Very low	181 Å²	181	130.7 Å²	130.7	85%	0.846	77%	0.772	S	S	*	*			trans	-131.6	129.3	169.3	-96.9	-91.3	70.7	0	0	107.5
139	T	29.1	Very low	32.7	Very low	105 Å²	105	132 Å²	132	64%	0.644	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-78.7	152.5	-169.7	47.3	0	0	0	0	113.1	E137	E137-T139 WeakPolarHBondContact OE1-CG2 3.49Å
140	P	30.3	Very low	32.5	Very low	110 Å²	110	134.5 Å²	134.5	71%	0.714	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-79	140.4	-171.3	31.3	-36	0	0	0	114.1
141	S	26.7	Very low	32.6	Very low	131 Å²	131	134.7 Å²	134.7	92%	0.916	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.1	144.8	160.7	-169.1	0	0	0	0	110.4
142	S	30.3	Very low	32.4	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	79%	0.788	S	S	*	*			trans	-122.7	122.8	-167.3	-65.8	0	0	0	0	112.8
143	E	29.5	Very low	32.3	Very low	179 Å²	179	131.8 Å²	131.8	84%	0.836	79%	0.788	S	S	*	*			trans	-161.4	123.1	154.8	-121.2	-175.5	135.5	0	0	112.3
144	P	37.6	Very low	32.2	Very low	119 Å²	119	131.9 Å²	131.9	77%	0.773	79%	0.789	S	S	*	*			trans	-132.5	123.1	164.6	34.9	-19.9	0	0	0	113.2
145	Q	28.9	Very low	32.1	Very low	192 Å²	192	132.3 Å²	132.3	90%	0.897	79%	0.788	S	S	*	*			trans	-95.8	114.1	167.5	-71.7	-172.5	-68.2	0	0	111.7
146	S	33	Very low	31.9	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	78%	0.784	S	S	*	*			trans	-77.6	174.8	160.7	-67.7	0	0	0	0	110.1
147	P	48.2	Very low	31.8	Very low	117 Å²	117	129.3 Å²	129.3	76%	0.76	79%	0.786	S	S	*	*			cis	-144.1	177.3	16.3	43.3	-24.8	0	0	0	117.7
148	V	28.9	Very low	31.7	Very low	138 Å²	138	125.9 Å²	125.9	84%	0.836	79%	0.789	S	S	*	*				-171.1	155.2	120.9	142.2	0	0	0	0	110.9
149	T	34.7	Very low	31.7	Very low	116 Å²	116	123.8 Å²	123.8	71%	0.712	79%	0.788	S	S	*	*			trans	-93.1	172.1	-172.1	45.3	0	0	0	0	112.6
150	Q	30.8	Very low	31.7	Very low	165 Å²	165	123.1 Å²	123.1	77%	0.771	79%	0.794	S	S	*	*				-168.4	143.9	56.1	-76	-172.7	-9.3	0	0	115.6
151	T	34.6	Very low	31.8	Very low	127 Å²	127	122.9 Å²	122.9	78%	0.779	80%	0.801	S	S	*	*			trans	50.6	141.4	146.1	44.2	0	0	0	0	122.3
152	V	32.3	Very low	31.9	Very low	142 Å²	142	121.1 Å²	121.1	86%	0.861	79%	0.794	S	S	*	*			cis	-144.7	157.4	11.1	-171.4	0	0	0	0	109.1
153	G	32	Very low	32.7	Very low	78 Å²	78	121.8 Å²	121.8	80%	0.804	80%	0.797	S	S	*	*			cis	145.8	30	-11.7	0	0	0	0	0	119.8
154	G	32.8	Very low	32.8	Very low	77 Å²	77	120.4 Å²	120.4	79%	0.794	80%	0.8	S	S	*	*			trans	179.8	156.7	172.4	0	0	0	0	0	114.4
155	M	29.2	Very low	32.4	Very low	180 Å²	180	118.3 Å²	118.3	89%	0.887	80%	0.8	S	S	*	*			cis	-154	124	2.4	-173.8	80.7	84.7	0	0	106.9
156	G	30.3	Very low	32.6	Very low	70 Å²	70	120.9 Å²	120.9	72%	0.722	80%	0.801	S	S	*	*				91.8	150.1	85.6	0	0	0	0	0	112.6
157	V	29.5	Very low	33.2	Very low	135 Å²	135	121.2 Å²	121.2	82%	0.818	80%	0.8	S	S	*	*			cis	-158.5	134	1.8	179.6	0	0	0	0	111.3
158	G	28.3	Very low	32.4	Very low	72 Å²	72	119.5 Å²	119.5	74%	0.742	80%	0.797	S	S	*	*			trans	62.1	174.5	143.9	0	0	0	0	0	121.8
159	V	28.7	Very low	32.4	Very low	137 Å²	137	118.4 Å²	118.4	83%	0.83	80%	0.795	S	S	*	*			cis	-150.6	132.1	-2.5	178.7	0	0	0	0	111.7
160	A	29.1	Very low	32	Very low	92 Å²	92	117.9 Å²	117.9	76%	0.76	80%	0.795	S	S	*	*			trans	52.2	150.2	151.2	0	0	0	0	0	126.1
161	A	31.6	Very low	31.9	Very low	104 Å²	104	117.5 Å²	117.5	86%	0.86	80%	0.797	S	S	*	*			trans	82.2	126.5	145	0	0	0	0	0	121.8
162	A	30.1	Very low	31.8	Very low	94 Å²	94	118.2 Å²	118.2	78%	0.777	80%	0.802	S	S	*	*			trans	-102	-175.7	160.3	0	0	0	0	0	108.4
163	P	45.9	Very low	31.9	Very low	114 Å²	114	117 Å²	117	74%	0.74	80%	0.797	S	S	*	*			cis	-149.5	-175.5	33.8	42.4	-19.6	0	0	0	118.2
164	V	32.3	Very low	31.9	Very low	150 Å²	150	121.7 Å²	121.7	91%	0.909	80%	0.802	S	S	*	*			trans	67.8	131.4	163.9	-170.1	0	0	0	0	118.2
165	G	29.6	Very low	32	Very low	74 Å²	74	123.7 Å²	123.7	76%	0.763	80%	0.801	S	S	*	*			trans	145	99.7	159.1	0	0	0	0	0	117
166	R	32.9	Very low	32	Very low	247 Å²	247	123 Å²	123	93%	0.932	80%	0.8	S	S	*	*			trans	-135.4	160.5	158.8	-109.2	-170.1	167.4	-174.9	-3	106.8
167	P	45.7	Very low	31.9	Very low	116 Å²	116	126.1 Å²	126.1	75%	0.753	81%	0.805	S	S	*	*			cis	-138.9	-169.4	28.8	43.2	-25	0	0	0	116.4
168	A	31.3	Very low	31.9	Very low	82 Å²	82	124.7 Å²	124.7	68%	0.678	80%	0.801	S	S	*	*			trans	77.7	117.8	154	0	0	0	0	0	120.5
169	S	28.8	Very low	31.9	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	80%	0.804	S	S	*	*				37.9	139.5	115.1	-53	0	0	0	0	120.7
170	C	26.6	Very low	31.9	Very low	104 Å²	104	129.9 Å²	129.9	70%	0.703	80%	0.803	S	S	*	*			cis	-170.8	-179.9	-0.8	46	0	0	0	0	111.3
171	L	29.2	Very low	31.8	Very low	157 Å²	157	134.8 Å²	134.8	82%	0.822	81%	0.807	S	S	*	*			trans	70.3	114.9	165.7	-53.2	177.5	0	0	0	118.8
172	T	31.7	Very low	31.7	Very low	143 Å²	143	135 Å²	135	88%	0.877	80%	0.798	S	S	*	*			trans	-165.8	154.1	137.2	8.9	0	0	0	0	109.5
173	P	35.2	Very low	31.4	Very low	117 Å²	117	139.9 Å²	139.9	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.8	161.9	-170.6	36.2	-35.1	0	0	0	114.3
174	L	31.1	Very low	30.5	Very low	175 Å²	175	142.8 Å²	142.8	92%	0.916	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.3	133.2	176.2	-67.3	170.4	0	0	0	112.8
175	P	35	Very low	30.2	Very low	119 Å²	119	142.5 Å²	142.5	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-95.1	167.1	160.5	36	-31.6	0	0	0	112.9
176	L	28.3	Very low	30	Very low	165 Å²	165	148.1 Å²	148.1	86%	0.864	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.9	163.7	-177.2	-57.9	121.7	0	0	0	114.1
177	V	29.5	Very low	29.7	Very low	136 Å²	136	140.2 Å²	140.2	82%	0.824	81%	0.808	S	S	*	*				172.7	107.9	113.3	155.3	0	0	0	0	114.2
178	S	28.5	Very low	28.9	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	81%	0.812	S	S	*	*				64.9	159.7	127.6	-147.8	0	0	0	0	125.5
179	K	29.3	Very low	29.4	Very low	187 Å²	187	141.5 Å²	141.5	81%	0.813	81%	0.813	S	S	*	*			trans	70.7	122	172.2	-64.2	176.3	-179.2	173.6	0	117
180	V	28.8	Very low	29.4	Very low	131 Å²	131	146.3 Å²	146.3	79%	0.794	82%	0.815	S	S	*	*			cis	81.5	109	34.1	-177.1	0	0	0	0	114.7
181	K	26.8	Very low	29.4	Very low	195 Å²	195	146.4 Å²	146.4	85%	0.848	82%	0.817	S	S	*	*			trans	-156.5	90.8	149	-168.4	172.2	-178.8	-178.6	0	108.8
182	T	28.1	Very low	29.5	Very low	109 Å²	109	144.8 Å²	144.8	67%	0.669	81%	0.813	S	S	*	*				42.3	113.3	107.6	23	0	0	0	0	117
183	E	24.3	Very low	29.3	Very low	196 Å²	196	143.5 Å²	143.5	92%	0.916	81%	0.805	S	S	*	*				-144.2	167.6	122.3	-156.4	159	105.7	0	0	109
184	Q	26.7	Very low	28.9	Very low	175 Å²	175	143.7 Å²	143.7	82%	0.818	81%	0.807	S	S	*	*			trans	-125.3	149	-171.7	-61.7	172.4	-69.6	0	0	111.6
185	T	26.1	Very low	28.8	Very low	144 Å²	144	140.8 Å²	140.8	88%	0.883	80%	0.797	S	S	*	*			trans	-149	144.9	149.2	-69.2	0	0	0	0	108.3
186	E	26.9	Very low	28.8	Very low	193 Å²	193	141.2 Å²	141.2	90%	0.902	80%	0.8	S	S	*	*			trans	-91.1	159	-170.9	-57	-178.4	111.9	0	0	114
187	G	26.9	Very low	28.7	Very low	80 Å²	80	140.2 Å²	140.2	83%	0.825	80%	0.801	S	S	*	*			trans	169.7	75.4	175.5	0	0	0	0	0	116.3
188	S	28.2	Very low	28.7	Very low	120 Å²	120	137.8 Å²	137.8	84%	0.839	80%	0.795	S	S	*	*			trans	-73.1	157.3	165.6	-142	0	0	0	0	110
189	P	40.5	Very low	28.8	Very low	106 Å²	106	142.3 Å²	142.3	69%	0.688	80%	0.801	S	S	*	*			cis	-149.6	-174.6	36.4	42.8	-20.9	0	0	0	119.1
190	Y	29.5	Very low	28.8	Very low	215 Å²	215	144.6 Å²	144.6	84%	0.843	81%	0.805	S	S	*	*			trans	70.9	88.4	165.8	-87.3	-81.1	0	0	0	119.3
191	S	27.8	Very low	28.9	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	80%	0.803	S	S	*	*			trans	-89.8	138.4	150.9	59.1	0	0	0	0	111
192	V	30.1	Very low	29.1	Very low	123 Å²	123	142.3 Å²	142.3	75%	0.745	79%	0.794	S	S	*	*			trans	-107.9	117.1	167.7	178.5	0	0	0	0	108.8
193	V	27	Very low	29	Very low	117 Å²	117	146.9 Å²	146.9	71%	0.709	80%	0.799	S	S	*	*			trans	-96.8	122.1	178.4	177.8	0	0	0	0	109.3	T195	V193-T195 HydrophobicContact CG1-CG2 4.38Å
194	C	26.8	Very low	29.1	Very low	120 Å²	120	147.4 Å²	147.4	81%	0.811	80%	0.798	S	S	*	*			trans	-100.9	95.7	178.6	-70.2	0	0	0	0	111.3
195	T	29.8	Very low	29.1	Very low	114 Å²	114	144 Å²	144	70%	0.699	80%	0.8	S	S	*	*			trans	-90	138.2	168.1	45.9	0	0	0	0	111.2	V193	V193-T195 HydrophobicContact CG1-CG2 4.38Å
196	P	34.3	Very low	29.3	Very low	129 Å²	129	141.4 Å²	141.4	84%	0.838	79%	0.793	S	S	*	*			trans	-82	135.3	179.3	31.6	-33.6	0	0	0	112.3
197	V	27.6	Very low	29.4	Very low	144 Å²	144	143.4 Å²	143.4	87%	0.873	79%	0.792	S	S	*	*			trans	-119.7	138.8	169.2	174.3	0	0	0	0	109.3
198	A	29.4	Very low	29.4	Very low	85 Å²	85	150.4 Å²	150.4	70%	0.702	80%	0.795	S	S	*	*			trans	-128.1	148.6	-170.9	0	0	0	0	0	114.1
199	K	30.9	Very low	29.4	Very low	200 Å²	200	149.8 Å²	149.8	87%	0.87	79%	0.791	S	S	*	*			trans	63.9	109.8	163.4	-62.3	177.4	177.2	173.8	0	118.8
200	R	29	Very low	28.8	Very low	234 Å²	234	150.7 Å²	150.7	88%	0.883	80%	0.8	S	S	*	*				-173.5	138.5	96.7	-94.7	167.5	179.6	155.8	0.9	109.3
201	L	30.6	Very low	28.7	Very low	145 Å²	145	145.3 Å²	145.3	76%	0.759	79%	0.794	S	S	*	*				73	128.4	68.3	-142.8	90.1	0	0	0	111.1
202	M	29.9	Very low	28.7	Very low	133 Å²	133	144.8 Å²	144.8	66%	0.655	79%	0.79	S	S	*	*			cis	-142.6	174	23.9	-127.5	-138.1	-147	0	0	116.2
203	R	26.7	Very low	28.7	Very low	205 Å²	205	144.4 Å²	144.4	77%	0.774	79%	0.793	S	S	*	*			trans	-50.5	154.8	173.2	-44.4	155.8	-174	151.7	-5.5	114.9
204	K	25.6	Very low	28.7	Very low	208 Å²	208	145 Å²	145	90%	0.904	80%	0.802	S	S	*	*				150.4	111.6	96.1	-172.2	177.6	-179.3	-176.5	0	114.5
205	A	26.8	Very low	28.7	Very low	103 Å²	103	144.1 Å²	144.1	85%	0.851	80%	0.798	S	S	*	*			trans	-152	149.5	150.8	0	0	0	0	0	108.4
206	A	30.1	Very low	28.7	Very low	90 Å²	90	145.1 Å²	145.1	74%	0.744	81%	0.809	S	S	*	*			trans	-156.1	154.6	-174.9	0	0	0	0	0	113.3
207	R	30.1	Very low	28.6	Very low	234 Å²	234	144.2 Å²	144.2	88%	0.883	81%	0.806	S	S	*	*			trans	69.2	111.3	174.3	-52.7	-175	-65.4	-172.2	0.3	116.2
208	Y	26.4	Very low	28.5	Very low	227 Å²	227	142.9 Å²	142.9	89%	0.89	80%	0.802	S	S	*	*				-144.9	157.6	107.7	-136.5	-94.9	0	0	0	110.6
209	S	27.9	Very low	28.6	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	81%	0.813	S	S	*	*			trans	-120	126.4	-179.7	-54.3	0	0	0	0	109.8
210	S	28.4	Very low	28.5	Very low	125 Å²	125	142.7 Å²	142.7	87%	0.874	81%	0.813	S	S	*	*			trans	-163	159.8	161.4	49.9	0	0	0	0	111.1
211	S	28	Very low	28.6	Very low	103 Å²	103	136.4 Å²	136.4	72%	0.72	81%	0.811	S	S	*	*			trans	-106.7	-173.6	-168.9	56.3	0	0	0	0	113.1
212	S	27.6	Very low	28.7	Very low	94 Å²	94	135.1 Å²	135.1	66%	0.657	81%	0.809	S	S	*	*			trans	66.9	98.8	146.6	46.2	0	0	0	0	118.8
213	S	29.1	Very low	28.8	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	81%	0.813	S	S	*	*				49.4	125.8	123.6	63.3	0	0	0	0	120.9
214	S	27.4	Very low	28.8	Very low	128 Å²	128	133.5 Å²	133.5	90%	0.895	81%	0.814	S	S	*	*			trans	-136.8	149.2	140.4	53	0	0	0	0	110.4
215	S	28.1	Very low	29.2	Very low	103 Å²	103	127.8 Å²	127.8	72%	0.72	81%	0.805	S	S	*	*			trans	-99.6	162.7	-173.9	52.4	0	0	0	0	112
216	S	28.3	Very low	29.4	Very low	134 Å²	134	128.3 Å²	128.3	94%	0.937	80%	0.803	S	S	*	*			trans	-135.3	97.3	162.3	-69.4	0	0	0	0	109
217	S	31.9	Very low	29.4	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	80%	0.804	S	S	*	*			trans	-114.8	131.9	175.2	52.8	0	0	0	0	109.5
218	C	26.3	Very low	29.5	Very low	117 Å²	117	128.3 Å²	128.3	79%	0.791	81%	0.807	S	S	*	*			trans	-142.1	115.5	163.8	55.7	0	0	0	0	110.2
219	N	31.4	Very low	29.6	Very low	174 Å²	174	120.6 Å²	120.6	93%	0.93	80%	0.797	S	S	*	*			trans	-169.1	131.8	143.8	-98.6	-22.6	0	0	0	106.7
220	A	29.5	Very low	30.4	Very low	106 Å²	106	121.6 Å²	121.6	88%	0.876	80%	0.801	S	S	*	*			trans	-115.3	131.1	-172.8	0	0	0	0	0	110.7
221	A	31.5	Very low	30.5	Very low	102 Å²	102	122 Å²	122	84%	0.843	80%	0.797	S	S	*	*			trans	-149.2	117.4	161	0	0	0	0	0	108
222	T	31.2	Very low	30.7	Very low	118 Å²	118	123 Å²	123	72%	0.724	80%	0.804	S	S	*	*			trans	-76.6	162.7	168.1	52	0	0	0	0	108.9
223	Q	32.7	Very low	30.8	Very low	158 Å²	158	122.2 Å²	122.2	74%	0.738	81%	0.811	S	S	*	*			cis	-149	150.3	33	-119.8	133	89.1	0	0	111.4
224	D	27.1	Very low	30.7	Very low	147 Å²	147	124 Å²	124	79%	0.786	82%	0.817	S	S	*	*				24.8	150.8	123.9	-65.1	-58.3	0	0	0	121.8
225	A	33.7	Very low	30.8	Very low	87 Å²	87	122.5 Å²	122.5	72%	0.719	81%	0.813	S	S	*	*			cis	-168.2	-173.8	-16	0	0	0	0	0	107.3
226	S	30.7	Very low	30.9	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	82%	0.823	S	S	*	*			cis	-161.3	144.7	8.5	57.5	0	0	0	0	111.2
227	G	29.3	Very low	31	Very low	75 Å²	75	125 Å²	125	77%	0.773	82%	0.816	S	S	*	*			trans	65	161.3	155.9	0	0	0	0	0	119.2
228	R	33.2	Very low	30.8	Very low	249 Å²	249	124 Å²	124	94%	0.94	82%	0.815	S	S	*	*			cis	-145	146.1	-12.2	-67.1	-177	172.3	-171.9	-3.4	108.6
229	G	27.9	Very low	31.1	Very low	66 Å²	66	124.9 Å²	124.9	68%	0.68	82%	0.822	S	S	*	*			trans	-91.5	-156.4	159	0	0	0	0	0	111.1
230	P	45.6	Very low	30.9	Very low	128 Å²	128	120.1 Å²	120.1	83%	0.831	81%	0.814	S	S	*	*			cis	-98	-145.1	-3.2	16.1	7.6	0	0	0	110.3
231	V	30.9	Very low	30.8	Very low	132 Å²	132	119.2 Å²	119.2	80%	0.8	82%	0.816	S	S	*	*			cis	-149	172.9	17.9	-69.2	0	0	0	0	112.9
232	S	30.7	Very low	30.6	Very low	125 Å²	125	118.3 Å²	118.3	87%	0.874	82%	0.816	S	S	*	*			trans	-63.7	163.8	174.3	-40.9	0	0	0	0	115.6
233	G	29.6	Very low	30.5	Very low	78 Å²	78	117.5 Å²	117.5	80%	0.804	82%	0.822	S	S	*	*			trans	178	86.2	164.5	0	0	0	0	0	115.8
234	V	27.8	Very low	30.2	Very low	153 Å²	153	114 Å²	114	93%	0.927	82%	0.82	S	S	*	*			trans	-78.7	133.3	174.3	175.2	0	0	0	0	111.2
235	A	29.1	Very low	30.2	Very low	97 Å²	97	114.7 Å²	114.7	80%	0.802	82%	0.823	S	S	*	*			trans	-166.8	153.6	150.4	0	0	0	0	0	113.3
236	M	29.9	Very low	30	Very low	193 Å²	193	117.7 Å²	117.7	95%	0.951	83%	0.831	S	S	*	*			trans	-115.7	124.7	168.1	-77.7	-89.2	-151.3	0	0	109.7
237	A	30.4	Very low	29.8	Very low	95 Å²	95	116 Å²	116	79%	0.785	83%	0.832	S	S	*	*			trans	-169.1	126	158.4	0	0	0	0	0	106.8
238	A	29.5	Very low	29.7	Very low	91 Å²	91	115.9 Å²	115.9	75%	0.752	83%	0.831	S	S	*	*				84.7	125.6	51.6	0	0	0	0	0	112.8
239	S	30.6	Very low	29.5	Very low	134 Å²	134	109.5 Å²	109.5	94%	0.937	83%	0.831	S	S	*	*			trans	60.9	154.4	-172.4	80.7	0	0	0	0	116.6
240	G	27.8	Very low	29.4	Very low	74 Å²	74	109.4 Å²	109.4	76%	0.763	83%	0.831	S	S	*	*			cis	159.6	117.5	-16.2	0	0	0	0	0	114.9
241	G	27.8	Very low	28.6	Very low	88 Å²	88	111.8 Å²	111.8	91%	0.907	84%	0.835	S	S	*	*			trans	73.3	167.4	166.5	0	0	0	0	0	116.5
242	G	27.7	Very low	28.5	Very low	82 Å²	82	112 Å²	112	85%	0.845	83%	0.832	S	S	*	*			trans	120.9	105.5	168.2	0	0	0	0	0	115.6
243	A	29	Very low	28.6	Very low	102 Å²	102	111.7 Å²	111.7	84%	0.843	83%	0.825	S	S	*	*			trans	-58.5	164.4	158.8	0	0	0	0	0	111.4
244	A	26.7	Very low	28.6	Very low	85 Å²	85	113.2 Å²	113.2	70%	0.702	82%	0.815	S	S	*	*			cis	173.5	-159.7	-15.7	0	0	0	0	0	105.7
245	L	27.3	Very low	29	Very low	161 Å²	161	113.7 Å²	113.7	84%	0.843	81%	0.807	S	S	*	*			trans	83.8	118.5	159.4	-56.8	172.8	0	0	0	119.7
246	V	28.7	Very low	29.3	Very low	149 Å²	149	114.7 Å²	114.7	90%	0.903	80%	0.799	S	S	*	*			trans	71.5	124.4	142.8	-178.9	0	0	0	0	119.2
247	G	27	Very low	29.5	Very low	78 Å²	78	109.8 Å²	109.8	80%	0.804	78%	0.783	S	S	*	*			trans	165.2	72	171.7	0	0	0	0	0	111.6
248	G	26.7	Very low	29.5	Very low	74 Å²	74	112 Å²	112	76%	0.763	78%	0.782	S	S	*	*			trans	-87.6	-167.3	-165.8	0	0	0	0	0	117.1
249	A	28	Very low	29.7	Very low	114 Å²	114	114 Å²	114	94%	0.942	78%	0.78	S	S	*	*			trans	71.1	143.1	-173.6	0	0	0	0	0	115.5
250	G	26.4	Very low	29.7	Very low	65 Å²	65	114 Å²	114	67%	0.67	77%	0.769	S	S	*	*			cis	167.7	-179.2	-5.4	0	0	0	0	0	112.7
251	L	29.9	Very low	29.8	Very low	177 Å²	177	116.6 Å²	116.6	93%	0.927	77%	0.77	S	S	*	*			trans	72.8	141.5	-179.2	-50.1	176.5	0	0	0	115.8
252	N	28.1	Very low	30	Very low	136 Å²	136	115.7 Å²	115.7	73%	0.727	76%	0.761	S	S	*	*				172.3	167	-51.1	175.8	37	0	0	0	107.4
253	T	32.7	Very low	30.2	Very low	119 Å²	119	118 Å²	118	73%	0.73	76%	0.759	S	S	*	*			trans	86.7	103.7	172.5	-30.1	0	0	0	0	113.4
254	N	30.3	Very low	31.1	Very low	111 Å²	111	118.2 Å²	118.2	59%	0.594	75%	0.752	S	S	*	*			cis	97.8	110.4	26.9	-174.4	6.9	0	0	0	113.5
255	H	35.8	Very low	31.2	Very low	162 Å²	162	123.4 Å²	123.4	75%	0.75	76%	0.762	S	S	*	*			trans	171.3	150.9	131.1	-92	-1.7	0	0	0	112.1
256	N	34.1	Very low	31.3	Very low	118 Å²	118	118.8 Å²	118.8	63%	0.631	75%	0.753	S	S	*	*			cis	-166.2	173.5	-26.1	-164.2	16.2	0	0	0	110
257	S	34.6	Very low	31.5	Very low	90 Å²	90	118.4 Å²	118.4	63%	0.629	75%	0.751	S	S	*	*			trans	82.5	107.8	165.1	-51.4	0	0	0	0	115.1
258	N	31.8	Very low	31.8	Very low	143 Å²	143	120.1 Å²	120.1	77%	0.765	75%	0.751	S	S	*	*				71.7	130.9	74.6	-73.4	4.7	0	0	0	112.3
259	N	33.1	Very low	32.8	Very low	133 Å²	133	122.6 Å²	122.6	71%	0.711	75%	0.754	S	S	*	*			cis	-151.4	-177.8	5.6	-142.4	17.6	0	0	0	109
260	N	29.3	Very low	33	Very low	132 Å²	132	120.7 Å²	120.7	71%	0.706	75%	0.745	S	S	*	*			cis	-152	-178.7	13.1	-166.4	21	0	0	0	112
261	V	31.4	Very low	33.2	Very low	129 Å²	129	124.5 Å²	124.5	78%	0.782	76%	0.755	S	S	*	*			trans	-82.4	149.5	178.8	172.6	0	0	0	0	114.1
262	G	30.7	Very low	33.3	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	75%	0.754	S	S	*	*			trans	178.7	106	161.8	0	0	0	0	0	114.5
263	T	32.8	Very low	33.5	Very low	131 Å²	131	123.7 Å²	123.7	80%	0.804	76%	0.761	S	S	*	*			trans	-143	172.7	176.6	59.4	0	0	0	0	108.6
264	P	47.7	Very low	33.3	Very low	106 Å²	106	126 Å²	126	69%	0.688	77%	0.765	S	S	*	*			cis	-136.1	-152.7	11.6	37	-12.6	0	0	0	114.3
265	E	28.8	Very low	33.5	Very low	193 Å²	193	130.9 Å²	130.9	90%	0.902	78%	0.777	S	S	*	*			trans	73	140.1	173	-50.8	-172.9	118.4	0	0	116.6
266	G	30.4	Very low	33.3	Very low	64 Å²	64	130 Å²	130	66%	0.66	78%	0.783	S	S	*	*			cis	173.5	151.4	-10.3	0	0	0	0	0	113.6
267	T	31.6	Very low	33.3	Very low	141 Å²	141	129.9 Å²	129.9	87%	0.865	79%	0.792	S	S	*	*			trans	71.7	116.2	166.7	-28.5	0	0	0	0	118.3
268	S	33.6	Very low	33.1	Very low	115 Å²	115	132.9 Å²	132.9	80%	0.804	80%	0.801	S	S	*	*			trans	-95.9	150.3	152.3	-52.2	0	0	0	0	109.6
269	P	47.4	Very low	33.2	Very low	126 Å²	126	131.1 Å²	131.1	82%	0.818	80%	0.799	S	S	*	*				-135.8	157.8	111.2	37.8	-29.1	0	0	0	112.7
270	G	31.4	Very low	33.4	Very low	74 Å²	74	131 Å²	131	76%	0.763	81%	0.806	S	S	*	*			trans	-106.3	156	177.9	0	0	0	0	0	113.5
271	T	32.2	Very low	33.7	Very low	144 Å²	144	131.9 Å²	131.9	88%	0.883	81%	0.809	S	S	*	*			trans	-137.8	153.1	166.4	48.4	0	0	0	0	109.7
272	L	31	Very low	33.8	Very low	173 Å²	173	131.3 Å²	131.3	91%	0.906	81%	0.811	S	S	*	*			trans	-89.5	146.8	-179.2	-56.3	90.8	0	0	0	111.5
273	S	32.3	Very low	34	Very low	123 Å²	123	137.1 Å²	137.1	86%	0.86	81%	0.812	S	S	*	*			trans	-167.2	-176.3	134.6	51.4	0	0	0	0	110.1
274	M	29.9	Very low	34.3	Very low	169 Å²	169	137.1 Å²	137.1	83%	0.833	80%	0.803	S	S	*	*			trans	-118.4	151	-157.6	-60.8	176.4	62	0	0	113.8
275	Y	33.2	Very low	33.5	Very low	213 Å²	213	138.8 Å²	138.8	84%	0.835	81%	0.806	S	S	*	*			trans	46.5	84.7	140.4	-122.5	-84.5	0	0	0	118.9
276	T	31.6	Very low	33.7	Very low	143 Å²	143	135 Å²	135	88%	0.877	79%	0.792	S	S	*	*				-146.1	136.1	127.7	43.7	0	0	0	0	109
277	S	34.2	Very low	33.9	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	81%	0.805	S	S	*	*			trans	-122.5	95	172.2	58.2	0	0	0	0	108.8
278	D	29.9	Very low	34.2	Very low	153 Å²	153	144.3 Å²	144.3	82%	0.818	81%	0.808	S	S	*	*			trans	-136.2	142.4	167.2	-162	-9.5	0	0	0	107.1
279	S	33.9	Very low	34.5	Very low	105 Å²	105	148 Å²	148	73%	0.734	81%	0.813	S	S	*	*			trans	-153.6	117.3	-170.9	-71.4	0	0	0	0	110.5
280	P	37.6	Very low	34.3	Very low	130 Å²	130	149.2 Å²	149.2	84%	0.844	81%	0.812	S	S	*	*			trans	-82.5	167.1	-170.6	33.4	-36.7	0	0	0	114.1
281	I	36	Very low	34.6	Very low	151 Å²	151	154.2 Å²	154.2	77%	0.774	82%	0.816	S	S	*	*			trans	-64.9	150.5	178.6	-104.4	64.5	0	0	0	113.3
282	S	34.2	Very low	35.1	Very low	118 Å²	118	154.6 Å²	154.6	83%	0.825	81%	0.811	S	S	*	*			trans	-143.9	132.2	153.9	-174.1	0	0	0	0	111
283	Y	33.6	Very low	35.7	Very low	192 Å²	192	149.6 Å²	149.6	75%	0.753	80%	0.795	S	S	*	*			trans	-69.3	179.6	167.6	-71.3	-88	0	0	0	112
284	H	39.3	Very low	36.4	Very low	131 Å²	131	148.7 Å²	148.7	61%	0.606	78%	0.78	S	S	*	*			cis	-151.6	153.9	-1.3	-136.6	-77.4	0	0	0	105.1	D286	H284-D286 IonicContact CE1-OD1 3.04Å; H284-D286 IonicContact CE1-OD2 3.08Å; H284-D286 PolarHBondContact CE1-OD2 3.19Å; H284-D286 IonicContact CG-OD2 3.95Å; H284-D286 IonicContact ND1-OD2 2.69Å; H284-D286 PolarHBondContact ND1-OD2 3.44Å
285	D	31.3	Very low	37.1	Very low	141 Å²	141	148.2 Å²	148.2	75%	0.754	78%	0.776	S	S	*	*				-173.4	132.7	77.1	-99.5	-145.2	0	0	0	105.5
286	D	34.2	Very low	37.5	Very low	113 Å²	113	141.8 Å²	141.8	60%	0.604	76%	0.762	S	S	*	*				80	80.2	78.8	-65.8	-61.2	0	0	0	116.5	H284	H284-D286 IonicContact CE1-OD1 3.04Å; H284-D286 IonicContact CE1-OD2 3.08Å; H284-D286 PolarHBondContact CE1-OD2 3.19Å; H284-D286 IonicContact CG-OD2 3.95Å; H284-D286 IonicContact ND1-OD2 2.69Å; H284-D286 PolarHBondContact ND1-OD2 3.44Å
287	E	34.2	Very low	38.2	Very low	201 Å²	201	136.6 Å²	136.6	94%	0.939	73%	0.734	S	S	*	*			trans	-151.7	68.7	145.4	-79.6	-158.5	142.8	0	0	109.3
288	E	37.9	Very low	39	Very low	199 Å²	199	136.6 Å²	136.6	93%	0.93	72%	0.721	S	S	*	*			trans	-88.3	96.8	159.8	-77.7	-168.8	143.4	0	0	108.8
289	E	38.4	Very low	39.9	Very low	193 Å²	193	134 Å²	134	90%	0.902	70%	0.704	S	S	*	*			trans	-86.1	136.9	159.6	-82.5	-162.8	122	0	0	109.9	E291	E289-E291 PolarHBondContact O-N 3.48Å; E289-E291 VanDerWaalsContact O-N 3.15Å
290	D	43.6	Very low	40.4	Very low	151 Å²	151	135 Å²	135	81%	0.807	70%	0.697	S	S	*	*			trans	-63.4	108.7	-178.1	-66.6	-87.1	0	0	0	113.1
291	E	38.1	Very low	41.1	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	67%	0.67	S	S	*	*			trans	-110.8	58.1	156.3	-159.9	169.3	-140.3	0	0	111	E289 A293	E289-E291 PolarHBondContact O-N 3.48Å; E289-E291 VanDerWaalsContact O-N 3.15Å; E291-A293 HydrophobicContact CG-CB 4.24Å; E291-A293 PolarHBondContact O-N 2.96Å
292	I	43.2	Very low	41.8	Very low	151 Å²	151	131 Å²	131	77%	0.774	66%	0.656	S	S	*	*			trans	-71.2	71.5	157.4	-53.5	-179.9	0	0	0	107.6	D294	I292-D294 PolarHBondContact O-N 3.38Å
293	A	43.5	Very low	42.5	Very low	68 Å²	68	132 Å²	132	56%	0.562	65%	0.648	S	S	*	*			trans	-64.8	127.1	169.8	0	0	0	0	0	108.9	E291 E295	E291-A293 HydrophobicContact CG-CB 4.24Å; E291-A293 PolarHBondContact O-N 2.96Å; A293-E295 PolarHBondContact O-N 3.42Å
294	D	46.2	Very low	43.6	Very low	105 Å²	105	125.1 Å²	125.1	56%	0.561	62%	0.623	S	S	*	*			trans	-51.2	109.7	-167.8	-176.2	8	0	0	0	113.1	I292 S296 A297 E298	I292-D294 PolarHBondContact O-N 3.38Å; D294-S296 PolarHBondContact O-N 3.08Å; D294-S296 VanDerWaalsContact O-N 3.13Å; D294-S296 WeakPolarHBondContact OD1-CB 3.36Å; D294-S296 PolarHBondContact OD1-N 3.38Å; D294-A297 HydrophobicContact CB-CB 4.18Å; D294-A297 WeakPolarHBondContact O-CA 3.46Å; D294-A297 WeakPolarHBondContact O-CB 3.04Å; D294-A297 PolarHBondContact O-N 3.11Å; D294-E298 PolarHBondContact O-N 2.85Å
295	E	44.8	Very low	44	Very low	158 Å²	158	120 Å²	120	74%	0.738	60%	0.602	S	S	*	*	H	α-helix	trans	-57.8	-27.8	178.7	-167.5	173.6	-167.7	0	0	111.3	A293 E298 E299	A293-E295 PolarHBondContact O-N 3.42Å; E295-E298 PolarHBondContact O-N 3.05Å; E295-E299 WeakPolarHBondContact O-CB 3.49Å; E295-E299 PolarHBondContact O-N 3.17Å
296	S	42.4	Very low	44.9	Very low	78 Å²	78	118.3 Å²	118.3	55%	0.545	59%	0.593	S	S	.	*	H	α-helix	trans	-63.6	-37.9	172.5	-167.6	0	0	0	0	112.6	D294 Q300	D294-S296 PolarHBondContact O-N 3.08Å; D294-S296 VanDerWaalsContact O-N 3.13Å; D294-S296 WeakPolarHBondContact OD1-CB 3.36Å; D294-S296 PolarHBondContact OD1-N 3.38Å; S296-Q300 VanDerWaalsContact O-CB 3.27Å; S296-Q300 WeakPolarHBondContact O-CB 3.09Å; S296-Q300 PolarHBondContact O-N 3.32Å
297	A	46.7	Very low	45.9	Very low	35 Å²	35	116 Å²	116	29%	0.289	58%	0.58	S	S	.	*	H	α-helix	trans	-71.6	-42.7	178.2	0	0	0	0	0	111.4	D294 Y301	D294-A297 HydrophobicContact CB-CB 4.18Å; D294-A297 WeakPolarHBondContact O-CA 3.46Å; D294-A297 WeakPolarHBondContact O-CB 3.04Å; D294-A297 PolarHBondContact O-N 3.11Å; A297-Y301 WeakPolarHBondContact O-CB 3.29Å; A297-Y301 PolarHBondContact O-N 2.92Å
298	E	49.8	Very low	46.8	Very low	115 Å²	115	107 Å²	107	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-58.9	-46.4	170.8	-91.4	-111.8	139.5	0	0	111.7	D294 E295 Y301 R302	D294-E298 PolarHBondContact O-N 2.85Å; E295-E298 PolarHBondContact O-N 3.05Å; E298-Y301 WeakPolarHBondContact O-CB 3.16Å; E298-Y301 PolarHBondContact O-N 3.14Å; E298-R302 VanDerWaalsContact O-CG 3.32Å; E298-R302 WeakPolarHBondContact O-CG 3.22Å; E298-R302 PolarHBondContact O-N 3.2Å; E298-R302 IonicContact OE2-CZ 3.37Å; E298-R302 IonicContact OE2-NE 3.17Å; E298-R302 IonicContact OE2-NH2 3.21Å; E298-R302 PolarHBondContact OE2-NH2 3.36Å
299	E	48.3	Very low	47.6	Very low	98 Å²	98	100.4 Å²	100.4	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-69.2	-39.6	-178.6	-158	67.5	-93.9	0	0	111.7	E295 Y301 R302 Q303	E295-E299 WeakPolarHBondContact O-CB 3.49Å; E295-E299 PolarHBondContact O-N 3.17Å; E299-Y301 VanDerWaalsContact C-N 3.34Å; E299-Y301 PolarHBondContact O-N 2.9Å; E299-R302 WeakPolarHBondContact O-CB 3.4Å; E299-R302 PolarHBondContact O-N 3.47Å; E299-R302 WeakPolarHBondContact OE1-CD 3.45Å; E299-Q303 WeakPolarHBondContact O-CB 3.47Å; E299-Q303 PolarHBondContact O-N 3.49Å
300	Q	45.6	Very low	48	Very low	127 Å²	127	96.3 Å²	96.3	59%	0.593	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-38.7	172.3	-170.4	170.2	-92.6	0	0	111.5	S296 Q303 I304	S296-Q300 VanDerWaalsContact O-CB 3.27Å; S296-Q300 WeakPolarHBondContact O-CB 3.09Å; S296-Q300 PolarHBondContact O-N 3.32Å; Q300-Q303 PolarHBondContact O-N 3Å; Q300-I304 HydrophobicContact CG-CD1 4.14Å; Q300-I304 VanDerWaalsContact O-CG1 3.24Å; Q300-I304 WeakPolarHBondContact O-CG1 3.34Å; Q300-I304 PolarHBondContact O-N 3.44Å
301	Y	50.9	Low	48.3	Very low	69 Å²	69	92.6 Å²	92.6	27%	0.271	47%	0.468	S	S	.	.	H	α-helix	trans	-63.9	-41.8	174.3	-166.3	-80.1	0	0	0	111.7	A297 E298 E299 I304 C305 V399	A297-Y301 WeakPolarHBondContact O-CB 3.29Å; A297-Y301 PolarHBondContact O-N 2.92Å; E298-Y301 WeakPolarHBondContact O-CB 3.16Å; E298-Y301 PolarHBondContact O-N 3.14Å; E299-Y301 VanDerWaalsContact C-N 3.34Å; E299-Y301 PolarHBondContact O-N 2.9Å; Y301-I304 PolarHBondContact O-N 3.03Å; Y301-C305 WeakPolarHBondContact O-CB 3.33Å; Y301-C305 PolarHBondContact O-N 2.88Å; Y301-C305 PolarHBondContact O-SG 3.39Å; Y301-V399 HydrophobicContact CE1-CG1 4.34Å; Y301-V399 WeakPolarHBondContact CE1-O 3.49Å; Y301-V399 PolarHBondContact OH-O 3.08Å
302	R	51.7	Low	48.5	Very low	128 Å²	128	85.9 Å²	85.9	48%	0.483	44%	0.44	S	S	.	.	H	α-helix	trans	-62.7	-43.3	172	-73.2	173.2	-172	-169.7	10.1	111.7	E298 E299 I304 C305 N306	E298-R302 VanDerWaalsContact O-CG 3.32Å; E298-R302 WeakPolarHBondContact O-CG 3.22Å; E298-R302 PolarHBondContact O-N 3.2Å; E298-R302 IonicContact OE2-CZ 3.37Å; E298-R302 IonicContact OE2-NE 3.17Å; E298-R302 IonicContact OE2-NH2 3.21Å; E298-R302 PolarHBondContact OE2-NH2 3.36Å; E299-R302 WeakPolarHBondContact O-CB 3.4Å; E299-R302 PolarHBondContact O-N 3.47Å; E299-R302 WeakPolarHBondContact OE1-CD 3.45Å; R302-I304 PolarHBondContact O-N 3.31Å; R302-C305 WeakPolarHBondContact O-CB 3.43Å; R302-C305 PolarHBondContact O-N 3.47Å; R302-N306 WeakPolarHBondContact O-CB 3.4Å; R302-N306 PolarHBondContact O-N 3.21Å; R302-N306 PolarHBondContact O-ND2 3.1Å
303	Q	49.7	Very low	48.5	Very low	140 Å²	140	84.6 Å²	84.6	65%	0.654	43%	0.433	S	S	*	.	H	α-helix	trans	-63.1	-42.2	178.5	-168	168.5	1.2	0	0	111.3	E299 Q300 N306 M307	E299-Q303 WeakPolarHBondContact O-CB 3.47Å; E299-Q303 PolarHBondContact O-N 3.49Å; Q300-Q303 PolarHBondContact O-N 3Å; Q303-N306 PolarHBondContact O-N 2.92Å; Q303-M307 VanDerWaalsContact O-CB 3.26Å; Q303-M307 WeakPolarHBondContact O-CB 3.44Å; Q303-M307 PolarHBondContact O-N 3.19Å
304	I	55.3	Low	48.5	Very low	46 Å²	46	86.7 Å²	86.7	24%	0.236	43%	0.434	C	S	.	.	H	α-helix	trans	-65.6	-41.2	173.1	-64.5	164.1	0	0	0	111.2	Q300 Y301 R302 M307 Y308 P354 V399	Q300-I304 HydrophobicContact CG-CD1 4.14Å; Q300-I304 VanDerWaalsContact O-CG1 3.24Å; Q300-I304 WeakPolarHBondContact O-CG1 3.34Å; Q300-I304 PolarHBondContact O-N 3.44Å; Y301-I304 PolarHBondContact O-N 3.03Å; R302-I304 PolarHBondContact O-N 3.31Å; I304-M307 PolarHBondContact O-N 3.14Å; I304-Y308 HydrophobicContact CG2-CD2 3.69Å; I304-Y308 HydrophobicContact CG2-CE2 3.69Å; I304-Y308 WeakPolarHBondContact O-CD2 3.46Å; I304-Y308 PolarHBondContact O-N 3.02Å; I304-P354 HydrophobicContact CD1-CG 4.44Å; I304-V399 HydrophobicContact CG2-CG1 4.08Å
305	C	48.1	Very low	48.5	Very low	25 Å²	25	85.2 Å²	85.2	17%	0.169	43%	0.426	C	S	.	.	H	α-helix	trans	-58.7	-47.8	173.7	-73.8	0	0	0	0	112	Y301 R302 T309	Y301-C305 WeakPolarHBondContact O-CB 3.33Å; Y301-C305 PolarHBondContact O-N 2.88Å; Y301-C305 PolarHBondContact O-SG 3.39Å; R302-C305 WeakPolarHBondContact O-CB 3.43Å; R302-C305 PolarHBondContact O-N 3.47Å; C305-T309 VanDerWaalsContact O-CB 3.31Å; C305-T309 WeakPolarHBondContact O-CB 3.37Å; C305-T309 PolarHBondContact O-N 3.06Å; C305-T309 PolarHBondContact O-OG1 3.12Å
306	N	50.8	Low	48.4	Very low	104 Å²	104	80.8 Å²	80.8	56%	0.556	42%	0.417	S	S	*	.	H	α-helix	trans	-65.2	-43.7	-179.6	-70.4	-21.4	0	0	0	110.9	R302 Q303 T309 M310	R302-N306 WeakPolarHBondContact O-CB 3.4Å; R302-N306 PolarHBondContact O-N 3.21Å; R302-N306 PolarHBondContact O-ND2 3.1Å; Q303-N306 PolarHBondContact O-N 2.92Å; N306-T309 PolarHBondContact O-N 3.32Å; N306-M310 WeakPolarHBondContact O-CG 3.39Å; N306-M310 PolarHBondContact O-N 3.44Å
307	M	54.9	Low	48	Very low	66 Å²	66	80.1 Å²	80.1	33%	0.325	42%	0.422	S	S	.	.	H	α-helix	trans	-54.9	-58.6	173.6	-173.7	-156.4	84.3	0	0	111.3	Q303 I304 T309 M310 Y311	Q303-M307 VanDerWaalsContact O-CB 3.26Å; Q303-M307 WeakPolarHBondContact O-CB 3.44Å; Q303-M307 PolarHBondContact O-N 3.19Å; I304-M307 PolarHBondContact O-N 3.14Å; M307-T309 PolarHBondContact O-N 3.44Å; M307-M310 WeakPolarHBondContact O-CB 3.43Å; M307-M310 PolarHBondContact O-N 3.47Å; M307-M310 VanDerWaalsContact O-N 3.07Å; M307-Y311 HydrophobicContact CE-CD2 4.33Å; M307-Y311 HydrophobicContact CE-CE2 4.39Å; M307-Y311 HydrophobicContact CG-CD2 3.94Å; M307-Y311 HydrophobicContact CG-CE2 3.6Å; M307-Y311 WeakPolarHBondContact O-CD2 3.5Å; M307-Y311 PolarHBondContact O-N 3.4Å; M307-Y311 HydrophobicContact SD-CE2 4.31Å
308	Y	52.5	Low	47.5	Very low	11 Å²	11	81.6 Å²	81.6	4%	0.043	43%	0.434	C	S	.	.	H	α-helix	trans	-63.7	-26.5	179.2	-80.9	-64.3	0	0	0	113.6	I304 S312 A351 A392 M395 N396	I304-Y308 HydrophobicContact CG2-CD2 3.69Å; I304-Y308 HydrophobicContact CG2-CE2 3.69Å; I304-Y308 WeakPolarHBondContact O-CD2 3.46Å; I304-Y308 PolarHBondContact O-N 3.02Å; Y308-S312 WeakPolarHBondContact O-CB 3.33Å; Y308-S312 PolarHBondContact O-N 2.68Å; Y308-S312 PolarHBondContact O-OG 3.04Å; Y308-A351 WeakPolarHBondContact OH-CB 3.43Å; Y308-A392 HydrophobicContact CD1-CB 4.48Å; Y308-M395 HydrophobicContact CE1-CB 4.1Å; Y308-M395 HydrophobicContact CE2-CE 4.11Å; Y308-M395 WeakPolarHBondContact OH-CE 3.47Å; Y308-N396 WeakPolarHBondContact CB-ND2 3.45Å
309	T	54.5	Low	46.8	Very low	61 Å²	61	80.4 Å²	80.4	37%	0.374	44%	0.444	S	S	.	.	H	α-helix	trans	-69.4	-41	173.6	-58.9	0	0	0	0	110.9	C305 N306 M307 S312 M313	C305-T309 VanDerWaalsContact O-CB 3.31Å; C305-T309 WeakPolarHBondContact O-CB 3.37Å; C305-T309 PolarHBondContact O-N 3.06Å; C305-T309 PolarHBondContact O-OG1 3.12Å; N306-T309 PolarHBondContact O-N 3.32Å; M307-T309 PolarHBondContact O-N 3.44Å; T309-S312 WeakPolarHBondContact O-CB 3.34Å; T309-S312 PolarHBondContact O-N 2.87Å; T309-M313 WeakPolarHBondContact O-CG 3.35Å; T309-M313 PolarHBondContact O-N 3Å
310	M	46.5	Very low	46.2	Very low	106 Å²	106	81.8 Å²	81.8	52%	0.522	46%	0.459	S	S	.	.	H	α-helix	trans	-62	-47.5	172.1	-71.1	-66.2	-70.5	0	0	111.9	N306 M307 S312 M313 L314	N306-M310 WeakPolarHBondContact O-CG 3.39Å; N306-M310 PolarHBondContact O-N 3.44Å; M307-M310 WeakPolarHBondContact O-CB 3.43Å; M307-M310 PolarHBondContact O-N 3.47Å; M307-M310 VanDerWaalsContact O-N 3.07Å; M310-S312 VanDerWaalsContact C-N 3.25Å; M310-S312 PolarHBondContact O-N 2.92Å; M310-M313 PolarHBondContact O-N 3.13Å; M310-M313 HydrophobicContact SD-CE 3.75Å; M310-L314 VanDerWaalsContact O-CD1 3.27Å; M310-L314 WeakPolarHBondContact O-CD1 3.25Å; M310-L314 PolarHBondContact O-N 3.37Å
311	Y	50.7	Low	45.7	Very low	74 Å²	74	82.1 Å²	82.1	29%	0.29	47%	0.469	S	S	.	.	H	α-helix	trans	-59.2	-36.1	174.4	-76	-72.1	0	0	0	113	M307 L314 N315 D349	M307-Y311 HydrophobicContact CE-CD2 4.33Å; M307-Y311 HydrophobicContact CE-CE2 4.39Å; M307-Y311 HydrophobicContact CG-CD2 3.94Å; M307-Y311 HydrophobicContact CG-CE2 3.6Å; M307-Y311 WeakPolarHBondContact O-CD2 3.5Å; M307-Y311 PolarHBondContact O-N 3.4Å; M307-Y311 HydrophobicContact SD-CE2 4.31Å; Y311-L314 PolarHBondContact O-N 3.4Å; Y311-N315 PolarHBondContact O-N 3.26Å; Y311-D349 VanDerWaalsContact CE1-OD2 3.25Å; Y311-D349 WeakPolarHBondContact CE1-OD2 3.36Å; Y311-D349 PolarHBondContact OH-OD1 2.7Å; Y311-D349 PolarHBondContact OH-OD2 2.85Å
312	S	42.8	Very low	44.6	Very low	38 Å²	38	82.6 Å²	82.6	27%	0.266	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-36.4	175.2	-59.2	0	0	0	0	112.2	Y308 T309 M310 A316	Y308-S312 WeakPolarHBondContact O-CB 3.33Å; Y308-S312 PolarHBondContact O-N 2.68Å; Y308-S312 PolarHBondContact O-OG 3.04Å; T309-S312 WeakPolarHBondContact O-CB 3.34Å; T309-S312 PolarHBondContact O-N 2.87Å; M310-S312 VanDerWaalsContact C-N 3.25Å; M310-S312 PolarHBondContact O-N 2.92Å; S312-A316 VanDerWaalsContact O-CB 3.28Å; S312-A316 WeakPolarHBondContact O-CB 3.17Å; S312-A316 PolarHBondContact O-N 3.08Å; S312-A316 VanDerWaalsContact O-N 3.08Å
313	M	42.2	Very low	43.7	Very low	124 Å²	124	83.8 Å²	83.8	61%	0.611	51%	0.506	S	S	*	.	H	α-helix	trans	-72.3	-36.8	174.8	-66.2	-157.1	-58.4	0	0	112.9	T309 M310	T309-M313 WeakPolarHBondContact O-CG 3.35Å; T309-M313 PolarHBondContact O-N 3Å; M310-M313 PolarHBondContact O-N 3.13Å; M310-M313 HydrophobicContact SD-CE 3.75Å
314	L	44.7	Very low	42.9	Very low	113 Å²	113	87.6 Å²	87.6	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-64.6	-50.9	173.8	-89.5	76.2	0	0	0	111.4	M310 Y311 A316 G317	M310-L314 VanDerWaalsContact O-CD1 3.27Å; M310-L314 WeakPolarHBondContact O-CD1 3.25Å; M310-L314 PolarHBondContact O-N 3.37Å; Y311-L314 PolarHBondContact O-N 3.4Å; L314-A316 VanDerWaalsContact C-N 3.33Å; L314-A316 PolarHBondContact O-N 3.18Å; L314-G317 PolarHBondContact O-N 3.15Å; L314-G317 VanDerWaalsContact O-N 3.14Å
315	N	45.5	Very low	41.7	Very low	74 Å²	74	91.8 Å²	91.8	40%	0.396	54%	0.542	S	S	.	.	H	α-helix	trans	-71.8	-23	-177.4	-83.9	17.8	0	0	0	113.9	Y311 G317 A318 A319	Y311-N315 PolarHBondContact O-N 3.26Å; N315-G317 PolarHBondContact O-N 3.12Å; N315-A318 PolarHBondContact O-N 3.33Å; N315-A319 PolarHBondContact O-N 2.87Å
316	A	41.9	Very low	40.7	Very low	65 Å²	65	100 Å²	100	54%	0.537	58%	0.577	S	S	.	*	H	α-helix	trans	-60.4	-29.8	170.5	0	0	0	0	0	112.5	S312 L314 A318	S312-A316 VanDerWaalsContact O-CB 3.28Å; S312-A316 WeakPolarHBondContact O-CB 3.17Å; S312-A316 PolarHBondContact O-N 3.08Å; S312-A316 VanDerWaalsContact O-N 3.08Å; L314-A316 VanDerWaalsContact C-N 3.33Å; L314-A316 PolarHBondContact O-N 3.18Å; A316-A318 VanDerWaalsContact C-N 3.34Å
317	G	34.6	Very low	39.7	Very low	64 Å²	64	99.6 Å²	99.6	66%	0.66	59%	0.589	S	S	*	*	H	α-helix	trans	-71	-24.9	173.3	0	0	0	0	0	114.3	L314 N315	L314-G317 PolarHBondContact O-N 3.15Å; L314-G317 VanDerWaalsContact O-N 3.14Å; N315-G317 PolarHBondContact O-N 3.12Å
318	A	37	Very low	38.2	Very low	66 Å²	66	103.8 Å²	103.8	55%	0.545	61%	0.612	S	S	.	*	H	α-helix	trans	-87.6	-28.7	-177.5	0	0	0	0	0	113.6	N315 A316 V320 V321	N315-A318 PolarHBondContact O-N 3.33Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A318-V320 PolarHBondContact O-N 2.84Å; A318-V320 VanDerWaalsContact O-N 3.07Å; A318-V321 PolarHBondContact O-N 3.37Å
319	A	35.5	Very low	37.5	Very low	89 Å²	89	109.1 Å²	109.1	74%	0.736	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-5.1	-170.8	0	0	0	0	0	115.9	N315	N315-A319 PolarHBondContact O-N 2.87Å
320	V	35.3	Very low	36.3	Very low	128 Å²	128	112.5 Å²	112.5	78%	0.776	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-6.4	-176	-174.7	0	0	0	0	112.7	A318	A318-V320 PolarHBondContact O-N 2.84Å; A318-V320 VanDerWaalsContact O-N 3.07Å
321	V	34	Very low	35.4	Very low	134 Å²	134	115.4 Å²	115.4	81%	0.812	68%	0.68	S	S	*	*			trans	-127.4	107	176.9	-175.3	0	0	0	0	109.9	A318	A318-V321 PolarHBondContact O-N 3.37Å
322	G	29.3	Very low	34.3	Very low	79 Å²	79	115.9 Å²	115.9	81%	0.814	70%	0.7	S	S	*	*			trans	173.4	83.8	-179	0	0	0	0	0	111.9
323	E	32.5	Very low	34.7	Very low	152 Å²	152	119.9 Å²	119.9	71%	0.71	73%	0.725	S	S	*	*			trans	-89.5	147.2	-177.8	-156.2	-162.3	118.5	0	0	112.6
324	R	32	Very low	33.9	Very low	221 Å²	221	121.6 Å²	121.6	83%	0.834	74%	0.736	S	S	*	*			trans	66.6	165.6	157.5	-97.8	-177.4	170	99.5	-4.8	119
325	V	31.3	Very low	33.4	Very low	134 Å²	134	121.3 Å²	121.3	81%	0.812	74%	0.744	S	S	*	*			trans	-120.6	133.2	-175.7	169.6	0	0	0	0	107.6
326	E	26.7	Very low	32.6	Very low	196 Å²	196	121.9 Å²	121.9	92%	0.916	77%	0.768	S	S	*	*			trans	-153.6	178.6	146.5	-126.5	166.3	172	0	0	112.1
327	A	28.4	Very low	32	Very low	96 Å²	96	122.9 Å²	122.9	79%	0.793	78%	0.784	S	S	*	*			trans	-81.3	162.8	-144.1	0	0	0	0	0	118.1
328	L	25.3	Very low	31.9	Very low	154 Å²	154	123.6 Å²	123.6	81%	0.806	79%	0.792	S	S	*	*			trans	-65.2	160	161.1	-146.1	80.6	0	0	0	110.4
329	P	36.2	Very low	31.7	Very low	124 Å²	124	132.6 Å²	132.6	81%	0.805	81%	0.811	S	S	*	*				-138.8	161.6	90.5	38.7	-26.3	0	0	0	116.5
330	D	29.2	Very low	31.4	Very low	131 Å²	131	132.5 Å²	132.5	70%	0.701	82%	0.819	S	S	*	*			trans	-46	148.8	176.2	-166.2	9.8	0	0	0	117.3
331	L	27.8	Very low	31.2	Very low	167 Å²	167	130.2 Å²	130.2	87%	0.874	82%	0.821	S	S	*	*			trans	177.5	141	136.5	-99.5	170.6	0	0	0	112.9
332	A	27.7	Very low	31.3	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	83%	0.829	S	S	*	*			trans	-162.3	174.8	172.6	0	0	0	0	0	109.8
333	P	51.3	Low	31.3	Very low	122 Å²	122	134.3 Å²	134.3	79%	0.792	83%	0.827	S	S	*	*			cis	-121.4	179.6	-24.1	40	-27.1	0	0	0	112.2
334	D	26.5	Very low	31.6	Very low	159 Å²	159	131 Å²	131	85%	0.85	83%	0.834	S	S	*	*			trans	-151.4	166.4	150.1	-156.8	4.6	0	0	0	112
335	S	33.7	Very low	31.8	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	84%	0.838	S	S	*	*			trans	-133.3	139.3	-163.1	-66.5	0	0	0	0	116.1
336	G	29.3	Very low	32.1	Very low	86 Å²	86	130.1 Å²	130.1	89%	0.887	83%	0.83	S	S	*	*			trans	95.2	150.8	166.1	0	0	0	0	0	115.1
337	G	29.1	Very low	32.7	Very low	86 Å²	86	129.3 Å²	129.3	89%	0.887	82%	0.818	S	S	*	*			cis	156.5	116	-8.4	0	0	0	0	0	112.2
338	G	30.9	Very low	33.5	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	81%	0.814	S	S	*	*			trans	-177	76.7	-173.4	0	0	0	0	0	117.9
339	R	33.2	Very low	34.7	Very low	255 Å²	255	127.6 Å²	127.6	96%	0.962	79%	0.792	S	S	*	*			trans	4.4	128.1	157.7	-66.9	173.8	166	178.9	-4.9	120.5
340	G	29.3	Very low	35.7	Very low	86 Å²	86	125.1 Å²	125.1	89%	0.887	77%	0.771	S	S	*	*				127.6	122.7	117	0	0	0	0	0	118.9
341	G	32	Very low	37.6	Very low	81 Å²	81	120.7 Å²	120.7	84%	0.835	75%	0.753	S	S	*	*			trans	154.8	95.3	168.4	0	0	0	0	0	114.1
342	K	34.7	Very low	40.1	Very low	223 Å²	223	115.1 Å²	115.1	97%	0.97	73%	0.728	S	S	*	*			trans	-58.8	134.7	-175.6	-69.3	176.1	174.3	178.9	0	113.6
343	G	30.3	Very low	42.6	Very low	75 Å²	75	111.2 Å²	111.2	77%	0.773	70%	0.695	S	S	*	*			trans	-176.8	65.2	170.7	0	0	0	0	0	112.4	R345	G343-R345 PolarHBondContact O-N 3.05Å
344	G	38.9	Very low	44.1	Very low	83 Å²	83	106.9 Å²	106.9	86%	0.856	67%	0.667	S	S	*	*			trans	-68.5	117.7	-165.8	0	0	0	0	0	115.1
345	R	36.4	Very low	46.7	Very low	246 Å²	246	103.1 Å²	103.1	93%	0.928	66%	0.658	S	S	*	*			trans	-109.3	136.8	146.1	-73	-171.9	172.6	-166.7	-2.5	108.1	G343	G343-R345 PolarHBondContact O-N 3.05Å
346	S	36.5	Very low	48.9	Very low	90 Å²	90	103.7 Å²	103.7	63%	0.629	65%	0.649	S	S	*	*			trans	-71	129.2	-164.3	37.8	0	0	0	0	113.3	Q348	S346-Q348 PolarHBondContact O-N 2.98Å; S346-Q348 PolarHBondContact OG-OE1 3.41Å
347	R	41.1	Very low	51.5	Low	180 Å²	180	99.9 Å²	99.9	68%	0.679	61%	0.608	S	S	*	*			trans	-54	100.2	159.4	-178.7	-178.2	-170.2	-94.6	4.9	109.2	E372	R347-E372 IonicContact CZ-OE1 3.74Å; R347-E372 IonicContact CZ-OE2 2.72Å; R347-E372 IonicContact NH1-OE1 2.68Å; R347-E372 PolarHBondContact NH1-OE1 3.16Å; R347-E372 IonicContact NH1-OE2 3.02Å; R347-E372 PolarHBondContact NH1-OE2 3.14Å; R347-E372 IonicContact NH2-OE1 2.7Å; R347-E372 PolarHBondContact NH2-OE1 3.07Å; R347-E372 IonicContact NH2-OE2 3.78Å; R347-E372 PolarHBondContact NH2-OE2 3Å
348	Q	44.6	Very low	54.1	Low	148 Å²	148	97.5 Å²	97.5	69%	0.692	58%	0.575	S	S	*	*			trans	-122.8	165.1	173.1	-72.6	174.2	-65	0	0	108.6	S346 L350	S346-Q348 PolarHBondContact O-N 2.98Å; S346-Q348 PolarHBondContact OG-OE1 3.41Å; Q348-L350 PolarHBondContact O-N 3.22Å
349	D	51	Low	56.7	Low	66 Å²	66	98.6 Å²	98.6	35%	0.353	57%	0.57	S	S	.	*	S	Bend	trans	66	31.1	175.6	-55.2	-26.4	0	0	0	117.6	Y311 P375	Y311-D349 VanDerWaalsContact CE1-OD2 3.25Å; Y311-D349 WeakPolarHBondContact CE1-OD2 3.36Å; Y311-D349 PolarHBondContact OH-OD1 2.7Å; Y311-D349 PolarHBondContact OH-OD2 2.85Å; D349-P375 HydrophobicContact CB-CG 4.44Å; D349-P375 WeakPolarHBondContact O-CD 3.45Å; D349-P375 WeakPolarHBondContact O-CG 3.19Å
350	L	56.9	Low	59.1	Low	71 Å²	71	91.2 Å²	91.2	37%	0.372	55%	0.546	S	S	.	.			trans	-121.4	121.3	152.2	-55.2	172.4	0	0	0	107.8	Q348 E372	Q348-L350 PolarHBondContact O-N 3.22Å; L350-E372 HydrophobicContact CB-CG 3.42Å; L350-E372 VanDerWaalsContact CB-CG 3.42Å; L350-E372 HydrophobicContact CD1-CG 4.42Å
351	A	67.6	Low	61.6	Low	38 Å²	38	87.2 Å²	87.2	31%	0.314	51%	0.505	S	S	.	.			trans	-153.2	136.3	-176.5	0	0	0	0	0	111.7	Y308 R391	Y308-A351 WeakPolarHBondContact OH-CB 3.43Å; A351-R391 VanDerWaalsContact O-CZ 3.26Å; A351-R391 PolarHBondContact O-NH1 3.1Å; A351-R391 PolarHBondContact O-NH2 3.19Å
352	S	81	Confident	64.1	Low	50 Å²	50	84.4 Å²	84.4	35%	0.35	48%	0.476	S	S	.	.			trans	-89.2	174.4	170.8	50	0	0	0	0	111.6	Y370 M395	S352-Y370 WeakPolarHBondContact CB-O 3.43Å; S352-M395 VanDerWaalsContact O-CE 3.25Å; S352-M395 WeakPolarHBondContact O-CE 3.21Å
353	L	81.1	Confident	66.4	Low	3 Å²	3	80.2 Å²	80.2	2%	0.016	46%	0.464	C	S	.	.			trans	-58.4	144.9	172	-73.6	173.4	0	0	0	110.9	A355 L357 I358 I361 L369 Y370 M395 H398 V399	L353-A355 PolarHBondContact O-N 3.42Å; L353-L357 HydrophobicContact CD2-CD2 4.25Å; L353-I358 HydrophobicContact CB-CD1 3.94Å; L353-I358 HydrophobicContact CB-CG1 3.63Å; L353-I358 WeakPolarHBondContact O-CD1 3.37Å; L353-I361 HydrophobicContact CD1-CD1 4.06Å; L353-L369 HydrophobicContact CD1-CB 3.75Å; L353-L369 HydrophobicContact CD1-CD1 4.43Å; L353-L369 HydrophobicContact CG-CB 4.02Å; L353-L369 PolarHBondContact N-O 3.01Å; L353-Y370 HydrophobicContact CD1-CE1 4.3Å; L353-M395 HydrophobicContact CD2-CE 3.97Å; L353-M395 HydrophobicContact CD2-SD 3.52Å; L353-M395 VanDerWaalsContact CD2-SD 3.52Å; L353-M395 HydrophobicContact CG-CE 4.27Å; L353-M395 HydrophobicContact CG-SD 3.66Å; L353-H398 HydrophobicContact CD2-CB 3.76Å; L353-V399 HydrophobicContact CD2-CG2 4.12Å
354	P	82.1	Confident	68.8	Low	31 Å²	31	82.5 Å²	82.5	20%	0.201	45%	0.449	C	S	.	.			trans	-53.4	132.2	173.8	-26	34.6	0	0	0	111.2	I304 E356 L357 I358 V399	I304-P354 HydrophobicContact CD1-CG 4.44Å; P354-E356 PolarHBondContact O-N 3.12Å; P354-L357 HydrophobicContact CB-CB 4.24Å; P354-L357 WeakPolarHBondContact O-CA 3.33Å; P354-L357 WeakPolarHBondContact O-CB 3.45Å; P354-L357 PolarHBondContact O-N 3.32Å; P354-I358 WeakPolarHBondContact O-CG1 3.48Å; P354-I358 PolarHBondContact O-N 3.06Å; P354-V399 HydrophobicContact CG-CG2 4.43Å
355	A	80.4	Confident	71.1	Confident	80 Å²	80	79.2 Å²	79.2	66%	0.661	41%	0.414	S	S	*	.	H	α-helix	trans	-57.7	-34.9	-173.5	0	0	0	0	0	113.3	L353 I358 S359	L353-A355 PolarHBondContact O-N 3.42Å; A355-I358 WeakPolarHBondContact O-CB 3.39Å; A355-I358 PolarHBondContact O-N 3.18Å; A355-S359 PolarHBondContact O-N 3.45Å
356	E	81.4	Confident	73.6	Confident	121 Å²	121	68.9 Å²	68.9	57%	0.565	38%	0.376	S	S	*	.	H	α-helix	trans	-62.4	-46.4	172.6	179.2	172.8	-142.4	0	0	112.5	P354 I358 S359 Q360	P354-E356 PolarHBondContact O-N 3.12Å; E356-I358 VanDerWaalsContact C-N 3.33Å; E356-I358 PolarHBondContact O-N 3.23Å; E356-S359 VanDerWaalsContact O-CB 3.31Å; E356-S359 WeakPolarHBondContact O-CB 3.32Å; E356-S359 PolarHBondContact O-N 2.86Å; E356-S359 VanDerWaalsContact O-N 3.16Å; E356-Q360 WeakPolarHBondContact O-CG 3.49Å; E356-Q360 PolarHBondContact O-N 3.1Å; E356-Q360 VanDerWaalsContact O-N 3.07Å
357	L	82.4	Confident	76	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.026	37%	0.372	C	S	.	.	H	α-helix	trans	-63.2	-40.7	174.1	-177.5	58.9	0	0	0	110.8	L353 P354 S359 Q360 I361 H398 V399	L353-L357 HydrophobicContact CD2-CD2 4.25Å; P354-L357 HydrophobicContact CB-CB 4.24Å; P354-L357 WeakPolarHBondContact O-CA 3.33Å; P354-L357 WeakPolarHBondContact O-CB 3.45Å; P354-L357 PolarHBondContact O-N 3.32Å; L357-S359 VanDerWaalsContact C-N 3.3Å; L357-S359 PolarHBondContact O-N 3.3Å; L357-Q360 PolarHBondContact O-N 3.21Å; L357-I361 HydrophobicContact CD1-CG2 3.71Å; L357-I361 HydrophobicContact CG-CG1 4.44Å; L357-I361 HydrophobicContact CG-CG2 4.35Å; L357-I361 WeakPolarHBondContact O-CG1 3.44Å; L357-I361 PolarHBondContact O-N 2.96Å; L357-H398 HydrophobicContact CD2-CB 4.38Å; L357-V399 HydrophobicContact CD2-CG2 4.39Å
358	I	85.1	Confident	78.2	Confident	36 Å²	36	64.3 Å²	64.3	19%	0.185	36%	0.358	C	S	.	.	H	α-helix	trans	-58	-42.2	173.7	-63.2	172.6	0	0	0	110.7	L353 P354 A355 E356 Q360 G362 Y370	L353-I358 HydrophobicContact CB-CD1 3.94Å; L353-I358 HydrophobicContact CB-CG1 3.63Å; L353-I358 WeakPolarHBondContact O-CD1 3.37Å; P354-I358 WeakPolarHBondContact O-CG1 3.48Å; P354-I358 PolarHBondContact O-N 3.06Å; A355-I358 WeakPolarHBondContact O-CB 3.39Å; A355-I358 PolarHBondContact O-N 3.18Å; E356-I358 VanDerWaalsContact C-N 3.33Å; E356-I358 PolarHBondContact O-N 3.23Å; I358-Q360 PolarHBondContact O-N 3.44Å; I358-G362 WeakPolarHBondContact O-CA 3.17Å; I358-G362 PolarHBondContact O-N 2.92Å; I358-Y370 HydrophobicContact CB-CD1 4.44Å; I358-Y370 HydrophobicContact CD1-CD1 3.85Å; I358-Y370 HydrophobicContact CG1-CD1 3.79Å; I358-Y370 HydrophobicContact CG1-CE1 4.09Å; I358-Y370 HydrophobicContact CG2-CD1 3.86Å; I358-Y370 HydrophobicContact CG2-CE1 3.99Å
359	S	83.9	Confident	80.2	Confident	103 Å²	103	57.3 Å²	57.3	72%	0.72	33%	0.325	S	S	*	.	H	α-helix	trans	-59.8	-45.2	175.8	-167.1	0	0	0	0	111.9	A355 E356 L357	A355-S359 PolarHBondContact O-N 3.45Å; E356-S359 VanDerWaalsContact O-CB 3.31Å; E356-S359 WeakPolarHBondContact O-CB 3.32Å; E356-S359 PolarHBondContact O-N 2.86Å; E356-S359 VanDerWaalsContact O-N 3.16Å; L357-S359 VanDerWaalsContact C-N 3.3Å; L357-S359 PolarHBondContact O-N 3.3Å
360	Q	83.4	Confident	81.8	Confident	99 Å²	99	56.2 Å²	56.2	46%	0.463	32%	0.316	S	S	.	.	H	α-helix	trans	-72	-42.2	-179.7	-63.3	174	13.4	0	0	113.7	E356 L357 I358 R364 T403	E356-Q360 WeakPolarHBondContact O-CG 3.49Å; E356-Q360 PolarHBondContact O-N 3.1Å; E356-Q360 VanDerWaalsContact O-N 3.07Å; L357-Q360 PolarHBondContact O-N 3.21Å; I358-Q360 PolarHBondContact O-N 3.44Å; Q360-R364 PolarHBondContact O-NH2 3.37Å; Q360-T403 HydrophobicContact CB-CG2 3.72Å
361	I	83	Confident	83.2	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-89.7	-17.8	-177	67.3	136.5	0	0	0	113.4	L353 L357 R364 C365 Y370 T403 F457	L353-I361 HydrophobicContact CD1-CD1 4.06Å; L357-I361 HydrophobicContact CD1-CG2 3.71Å; L357-I361 HydrophobicContact CG-CG1 4.44Å; L357-I361 HydrophobicContact CG-CG2 4.35Å; L357-I361 WeakPolarHBondContact O-CG1 3.44Å; L357-I361 PolarHBondContact O-N 2.96Å; I361-R364 VanDerWaalsContact C-NH2 3.33Å; I361-R364 VanDerWaalsContact O-CZ 3.23Å; I361-R364 PolarHBondContact O-NE 2.64Å; I361-R364 PolarHBondContact O-NH2 3.41Å; I361-C365 HydrophobicContact CD1-CB 4.25Å; I361-C365 VanDerWaalsContact CD1-SG 3.52Å; I361-Y370 HydrophobicContact CD1-CE1 4.43Å; I361-T403 HydrophobicContact CG2-CG2 4.46Å; I361-F457 HydrophobicContact CB-CE2 4.03Å; I361-F457 HydrophobicContact CG2-CE2 3.65Å; I361-F457 HydrophobicContact CG2-CZ 3.94Å
362	G	83.3	Confident	84	Confident	23 Å²	23	61.9 Å²	61.9	24%	0.237	33%	0.334	C	S	.	.			trans	60.9	-174.8	-174.9	0	0	0	0	0	113.6	I358 R364 Y370	I358-G362 WeakPolarHBondContact O-CA 3.17Å; I358-G362 PolarHBondContact O-N 2.92Å; G362-R364 PolarHBondContact O-N 3.11Å; G362-Y370 PolarHBondContact O-OH 3.32Å
363	N	83.6	Confident	84	Confident	134 Å²	134	60.3 Å²	60.3	72%	0.717	33%	0.326	S	S	*	.	S	Bend	trans	-78.6	40.7	179.4	-66.6	-4.8	0	0	0	113.2	Y370	N363-Y370 VanDerWaalsContact CA-OH 3.28Å; N363-Y370 WeakPolarHBondContact CA-OH 3.34Å
364	R	81.9	Confident	84.1	Confident	123 Å²	123	64.1 Å²	64.1	46%	0.464	35%	0.347	S	S	.	.			trans	-93.9	-3.6	-176.6	-72.1	-178.2	-69.9	-152.2	-2.9	114.6	Q360 I361 G362 Y370	Q360-R364 PolarHBondContact O-NH2 3.37Å; I361-R364 VanDerWaalsContact C-NH2 3.33Å; I361-R364 VanDerWaalsContact O-CZ 3.23Å; I361-R364 PolarHBondContact O-NE 2.64Å; I361-R364 PolarHBondContact O-NH2 3.41Å; G362-R364 PolarHBondContact O-N 3.11Å; R364-Y370 PolarHBondContact N-OH 2.71Å
365	C	86.4	Confident	84	Confident	15 Å²	15	64 Å²	64	10%	0.101	35%	0.346	C	S	.	.	S	Bend	trans	-105.2	178.7	-177.6	-70.5	0	0	0	0	112.6	I361 L369 Y370 H398 Y453	I361-C365 HydrophobicContact CD1-CB 4.25Å; I361-C365 VanDerWaalsContact CD1-SG 3.52Å; C365-L369 HydrophobicContact CB-CD1 3.86Å; C365-Y370 HydrophobicContact CB-CE2 4.46Å; C365-Y370 VanDerWaalsContact CB-OH 3.28Å; C365-Y370 WeakPolarHBondContact CB-OH 3.41Å; C365-Y370 PolarHBondContact N-OH 3.39Å; C365-H398 PolarHBondContact SG-CE1 3.2Å; C365-Y453 WeakPolarHBondContact CB-OH 3.31Å; C365-Y453 PolarHBondContact SG-OH 3.06Å
366	H	89.1	Confident	84.1	Confident	29 Å²	29	62.8 Å²	62.8	13%	0.134	34%	0.336	C	S	.	.			trans	-55.4	128.2	174.8	-176.3	-76.9	0	0	0	111.2	K368 L369 E380 L394 Y453	H366-K368 PolarHBondContact ND1-N 2.82Å; H366-K368 PolarHBondContact O-N 3.41Å; H366-L369 HydrophobicContact CB-CD1 4Å; H366-L369 HydrophobicContact CB-CG 4.31Å; H366-L369 WeakPolarHBondContact O-CB 3.07Å; H366-L369 WeakPolarHBondContact O-CD1 3.32Å; H366-L369 VanDerWaalsContact O-CG 3.3Å; H366-L369 WeakPolarHBondContact O-CG 3.41Å; H366-L369 PolarHBondContact O-N 3.08Å; H366-L369 VanDerWaalsContact O-N 3.12Å; H366-E380 PolarHBondContact CD2-O 3.42Å; H366-E380 VanDerWaalsContact CD2-O 3.26Å; H366-L394 HydrophobicContact CB-CD2 3.95Å; H366-Y453 HydrophobicContact CB-CE2 4.17Å; H366-Y453 PolarHBondContact N-OH 3.26Å
367	P	86.8	Confident	84.5	Confident	85 Å²	85	59.6 Å²	59.6	55%	0.552	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-61.2	-37.5	-165.6	20.4	-32.8	0	0	0	114.3	L369 Y370	P367-L369 PolarHBondContact O-N 2.75Å; P367-Y370 VanDerWaalsContact O-CD2 3.24Å; P367-Y370 WeakPolarHBondContact O-CD2 3.48Å; P367-Y370 PolarHBondContact O-N 2.99Å
368	K	86.3	Confident	85	Confident	89 Å²	89	67.4 Å²	67.4	39%	0.387	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-65.1	1.7	178.8	-60.4	-170.7	176.5	-179.4	0	115.4	H366 E377 L379 R391	H366-K368 PolarHBondContact ND1-N 2.82Å; H366-K368 PolarHBondContact O-N 3.41Å; K368-E377 WeakPolarHBondContact CD-OE1 3.45Å; K368-E377 WeakPolarHBondContact CD-OE2 3.39Å; K368-E377 IonicContact NZ-OE1 3.99Å; K368-E377 PolarHBondContact NZ-OE1 2.99Å; K368-E377 IonicContact NZ-OE2 2.64Å; K368-L379 HydrophobicContact CB-CD2 4.07Å; K368-L379 HydrophobicContact CD-CD2 3.8Å; K368-L379 HydrophobicContact CG-CD2 4.47Å; K368-R391 PolarHBondContact O-NE 2.81Å; K368-R391 PolarHBondContact O-NH2 3Å
369	L	86.3	Confident	85.3	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-83.8	-23.1	170.8	-61	169.7	0	0	0	112.6	L353 C365 H366 P367 L379 L394 M395	L353-L369 HydrophobicContact CD1-CB 3.75Å; L353-L369 HydrophobicContact CD1-CD1 4.43Å; L353-L369 HydrophobicContact CG-CB 4.02Å; L353-L369 PolarHBondContact N-O 3.01Å; C365-L369 HydrophobicContact CB-CD1 3.86Å; H366-L369 HydrophobicContact CB-CD1 4Å; H366-L369 HydrophobicContact CB-CG 4.31Å; H366-L369 WeakPolarHBondContact O-CB 3.07Å; H366-L369 WeakPolarHBondContact O-CD1 3.32Å; H366-L369 VanDerWaalsContact O-CG 3.3Å; H366-L369 WeakPolarHBondContact O-CG 3.41Å; H366-L369 PolarHBondContact O-N 3.08Å; H366-L369 VanDerWaalsContact O-N 3.12Å; P367-L369 PolarHBondContact O-N 2.75Å; L369-L379 HydrophobicContact CD2-CD1 4.4Å; L369-L394 HydrophobicContact CD1-CD2 3.9Å; L369-L394 HydrophobicContact CD1-CG 3.98Å; L369-L394 HydrophobicContact CD2-CB 4.21Å; L369-L394 HydrophobicContact CD2-CD2 4.08Å; L369-L394 HydrophobicContact CD2-CG 3.95Å; L369-L394 HydrophobicContact CG-CD2 4.29Å; L369-L394 HydrophobicContact CG-CG 4.49Å; L369-M395 HydrophobicContact CB-SD 4.33Å; L369-M395 HydrophobicContact CD2-CG 3.76Å; L369-M395 HydrophobicContact CD2-SD 3.68Å
370	Y	86.5	Confident	85.8	Confident	43 Å²	43	63.3 Å²	63.3	17%	0.169	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-26.1	-179.9	-53.7	-68.1	0	0	0	112.6	S352 L353 I358 I361 G362 N363 R364 C365 P367	S352-Y370 WeakPolarHBondContact CB-O 3.43Å; L353-Y370 HydrophobicContact CD1-CE1 4.3Å; I358-Y370 HydrophobicContact CB-CD1 4.44Å; I358-Y370 HydrophobicContact CD1-CD1 3.85Å; I358-Y370 HydrophobicContact CG1-CD1 3.79Å; I358-Y370 HydrophobicContact CG1-CE1 4.09Å; I358-Y370 HydrophobicContact CG2-CD1 3.86Å; I358-Y370 HydrophobicContact CG2-CE1 3.99Å; I361-Y370 HydrophobicContact CD1-CE1 4.43Å; G362-Y370 PolarHBondContact O-OH 3.32Å; N363-Y370 VanDerWaalsContact CA-OH 3.28Å; N363-Y370 WeakPolarHBondContact CA-OH 3.34Å; R364-Y370 PolarHBondContact N-OH 2.71Å; C365-Y370 HydrophobicContact CB-CE2 4.46Å; C365-Y370 VanDerWaalsContact CB-OH 3.28Å; C365-Y370 WeakPolarHBondContact CB-OH 3.41Å; C365-Y370 PolarHBondContact N-OH 3.39Å; P367-Y370 VanDerWaalsContact O-CD2 3.24Å; P367-Y370 WeakPolarHBondContact O-CD2 3.48Å; P367-Y370 PolarHBondContact O-N 2.99Å
371	E	86.4	Confident	86.3	Confident	133 Å²	133	58.7 Å²	58.7	62%	0.621	30%	0.302	S	S	*	.	S	Bend	trans	-93.6	156.3	179.2	-64.2	174	163	0	0	111.7	R391	E371-R391 PolarHBondContact O-NH2 3.05Å
372	E	82.8	Confident	86.6	Confident	95 Å²	95	59.4 Å²	59.4	44%	0.444	31%	0.306	S	S	.	.			trans	-77	122.2	174.5	-179.2	175.3	-148.1	0	0	110.2	R347 L350	R347-E372 IonicContact CZ-OE1 3.74Å; R347-E372 IonicContact CZ-OE2 2.72Å; R347-E372 IonicContact NH1-OE1 2.68Å; R347-E372 PolarHBondContact NH1-OE1 3.16Å; R347-E372 IonicContact NH1-OE2 3.02Å; R347-E372 PolarHBondContact NH1-OE2 3.14Å; R347-E372 IonicContact NH2-OE1 2.7Å; R347-E372 PolarHBondContact NH2-OE1 3.07Å; R347-E372 IonicContact NH2-OE2 3.78Å; R347-E372 PolarHBondContact NH2-OE2 3Å; L350-E372 HydrophobicContact CB-CG 3.42Å; L350-E372 VanDerWaalsContact CB-CG 3.42Å; L350-E372 HydrophobicContact CD1-CG 4.42Å
373	G	82.7	Confident	86.8	Confident	17 Å²	17	63.2 Å²	63.2	18%	0.175	33%	0.329	C	S	.	.			trans	-166.9	168.6	-172.7	0	0	0	0	0	115.1	R391	G373-R391 PolarHBondContact O-NH1 3.02Å
374	D	81.8	Confident	86.9	Confident	83 Å²	83	60.4 Å²	60.4	44%	0.444	33%	0.332	S	S	.	.			trans	-60	121.6	-169.4	170.6	20.2	0	0	0	113.1	A376 E377 R391	D374-A376 PolarHBondContact O-N 3.25Å; D374-A376 WeakPolarHBondContact OD1-CB 3.29Å; D374-A376 PolarHBondContact OD1-N 2.73Å; D374-E377 HydrophobicContact CB-CB 4.25Å; D374-E377 WeakPolarHBondContact O-CB 3.29Å; D374-E377 PolarHBondContact O-N 3.29Å; D374-E377 VanDerWaalsContact O-N 3.1Å; D374-E377 PolarHBondContact OD2-N 2.83Å; D374-R391 WeakPolarHBondContact O-CB 3.45Å; D374-R391 VanDerWaalsContact O-CD 3.29Å; D374-R391 WeakPolarHBondContact O-CD 3.2Å
375	P	80.4	Confident	87.1	Confident	30 Å²	30	56.1 Å²	56.1	20%	0.195	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.8	177.4	23.9	-34.3	0	0	0	114.2	D349 A392	D349-P375 HydrophobicContact CB-CG 4.44Å; D349-P375 WeakPolarHBondContact O-CD 3.45Å; D349-P375 WeakPolarHBondContact O-CG 3.19Å; P375-A392 HydrophobicContact CB-CB 3.82Å; P375-A392 VanDerWaalsContact O-CB 3.29Å; P375-A392 WeakPolarHBondContact O-CB 3.18Å; P375-A392 PolarHBondContact O-N 3.43Å
376	A	82.8	Confident	87.3	Confident	53 Å²	53	58.2 Å²	58.2	44%	0.438	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-11.6	177.5	0	0	0	0	0	113.6	D374 K378	D374-A376 PolarHBondContact O-N 3.25Å; D374-A376 WeakPolarHBondContact OD1-CB 3.29Å; D374-A376 PolarHBondContact OD1-N 2.73Å; A376-K378 PolarHBondContact O-N 3.47Å
377	E	90.1	Very high	87.5	Confident	54 Å²	54	57.2 Å²	57.2	25%	0.252	33%	0.33	S	S	.	.			trans	-55.3	128.9	-178	-173	-175.8	-152.3	0	0	111.5	K368 D374 L379 S390 R391	K368-E377 WeakPolarHBondContact CD-OE1 3.45Å; K368-E377 WeakPolarHBondContact CD-OE2 3.39Å; K368-E377 IonicContact NZ-OE1 3.99Å; K368-E377 PolarHBondContact NZ-OE1 2.99Å; K368-E377 IonicContact NZ-OE2 2.64Å; D374-E377 HydrophobicContact CB-CB 4.25Å; D374-E377 WeakPolarHBondContact O-CB 3.29Å; D374-E377 PolarHBondContact O-N 3.29Å; D374-E377 VanDerWaalsContact O-N 3.1Å; D374-E377 PolarHBondContact OD2-N 2.83Å; E377-L379 HydrophobicContact CG-CD2 4.01Å; E377-L379 PolarHBondContact O-N 3.33Å; E377-L379 WeakPolarHBondContact OE2-CD2 3.42Å; E377-S390 CarbonylContact O-C 3.48Å; E377-S390 WeakPolarHBondContact O-CA 3.44Å; E377-R391 HydrophobicContact CB-CB 4.21Å; E377-R391 PolarHBondContact O-N 2.83Å
378	K	91.7	Very high	87.8	Confident	170 Å²	170	58.8 Å²	58.8	74%	0.739	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	105.7	175.7	-71.2	-179.5	-180	174.6	0	110	A376	A376-K378 PolarHBondContact O-N 3.47Å
379	L	92.8	Very high	88.2	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	134.5	174.6	-54.2	-174.8	0	0	0	109.8	K368 L369 E377 L381 F388 I389 R391 L394	K368-L379 HydrophobicContact CB-CD2 4.07Å; K368-L379 HydrophobicContact CD-CD2 3.8Å; K368-L379 HydrophobicContact CG-CD2 4.47Å; L369-L379 HydrophobicContact CD2-CD1 4.4Å; E377-L379 HydrophobicContact CG-CD2 4.01Å; E377-L379 PolarHBondContact O-N 3.33Å; E377-L379 WeakPolarHBondContact OE2-CD2 3.42Å; L379-L381 PolarHBondContact O-N 2.97Å; L379-F388 CarbonylContact O-C 3.57Å; L379-F388 VanDerWaalsContact O-CA 3.26Å; L379-F388 WeakPolarHBondContact O-CA 3.44Å; L379-I389 HydrophobicContact CB-CG2 4.46Å; L379-I389 PolarHBondContact N-O 3.45Å; L379-I389 PolarHBondContact O-N 3.04Å; L379-R391 HydrophobicContact CD1-CB 3.95Å; L379-R391 HydrophobicContact CD1-CG 4.07Å; L379-R391 HydrophobicContact CG-CB 4.09Å; L379-L394 HydrophobicContact CD1-CD2 3.99Å
380	E	93.8	Very high	88.4	Confident	49 Å²	49	55.5 Å²	55.5	23%	0.229	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	118.2	163.7	-164.7	-174.7	-169.7	0	0	107.8	H366 V382 S383 G384 T385 S386 F388	H366-E380 PolarHBondContact CD2-O 3.42Å; H366-E380 VanDerWaalsContact CD2-O 3.26Å; E380-V382 WeakPolarHBondContact CG-O 3.28Å; E380-V382 PolarHBondContact O-N 3.07Å; E380-S383 VanDerWaalsContact OE2-CA 3.32Å; E380-S383 WeakPolarHBondContact OE2-CA 3.46Å; E380-G384 VanDerWaalsContact CD-N 3.27Å; E380-G384 WeakPolarHBondContact OE1-CA 3.19Å; E380-G384 PolarHBondContact OE1-N 3.41Å; E380-G384 PolarHBondContact OE2-N 2.87Å; E380-G384 VanDerWaalsContact OE2-N 3.11Å; E380-T385 PolarHBondContact OE1-N 3.03Å; E380-S386 WeakPolarHBondContact OE1-CA 3.32Å; E380-S386 PolarHBondContact OE1-N 2.85Å; E380-F388 HydrophobicContact CB-CD1 4.05Å; E380-F388 HydrophobicContact CB-CE1 3.8Å; E380-F388 HydrophobicContact CG-CD1 4.47Å; E380-F388 HydrophobicContact CG-CE1 4.13Å; E380-F388 HydrophobicContact CG-CZ 4.4Å
381	L	92.9	Very high	88.6	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	31%	0.309	C	S	.	.	S	Bend	trans	-56	-42.8	-171.8	-178.6	71.9	0	0	0	111.4	L379 V387 I389 L394 L412 F416 A449 V450 Y453	L379-L381 PolarHBondContact O-N 2.97Å; L381-V387 PolarHBondContact N-O 3.24Å; L381-I389 HydrophobicContact CB-CG2 4.33Å; L381-I389 HydrophobicContact CD1-CG2 4.04Å; L381-L394 HydrophobicContact CD1-CD1 3.77Å; L381-L394 HydrophobicContact CD1-CD2 4.34Å; L381-L412 HydrophobicContact CD1-CD2 4.02Å; L381-F416 HydrophobicContact CD2-CE2 3.83Å; L381-F416 HydrophobicContact CD2-CZ 3.99Å; L381-A449 HydrophobicContact CD2-CB 4.1Å; L381-V450 HydrophobicContact CD2-CG2 3.79Å; L381-Y453 HydrophobicContact CD1-CD1 4.47Å; L381-Y453 HydrophobicContact CD1-CD2 3.59Å; L381-Y453 HydrophobicContact CD1-CE2 3.94Å; L381-Y453 HydrophobicContact CD1-CG 3.88Å; L381-Y453 HydrophobicContact CG-CD2 3.74Å; L381-Y453 HydrophobicContact CG-CE2 4.49Å; L381-Y453 HydrophobicContact CG-CG 4.06Å; L381-Y453 WeakPolarHBondContact O-CD2 3.49Å
382	V	90.2	Very high	88.5	Confident	16 Å²	16	47.6 Å²	47.6	10%	0.097	28%	0.282	C	S	.	.	S	Bend	trans	-139	127.8	173.5	173.1	0	0	0	0	107.5	E380 G384 T385 A449 F452 Y453	E380-V382 WeakPolarHBondContact CG-O 3.28Å; E380-V382 PolarHBondContact O-N 3.07Å; V382-G384 PolarHBondContact O-N 2.74Å; V382-T385 HydrophobicContact CB-CG2 3.73Å; V382-T385 HydrophobicContact CG1-CG2 3.78Å; V382-T385 WeakPolarHBondContact O-CB 3.31Å; V382-T385 WeakPolarHBondContact O-CG2 3.42Å; V382-T385 PolarHBondContact O-N 3.46Å; V382-T385 VanDerWaalsContact O-N 3.13Å; V382-T385 PolarHBondContact O-OG1 3.04Å; V382-A449 WeakPolarHBondContact CG2-O 3.41Å; V382-F452 HydrophobicContact CB-CD1 4.33Å; V382-F452 HydrophobicContact CG1-CB 4.5Å; V382-F452 HydrophobicContact CG1-CD1 3.37Å; V382-F452 HydrophobicContact CG1-CE1 3.83Å; V382-F452 HydrophobicContact CG1-CG 4.19Å; V382-F452 HydrophobicContact CG2-CB 4.33Å; V382-F452 HydrophobicContact CG2-CD1 3.96Å; V382-Y453 HydrophobicContact CG2-CD2 4.08Å
383	S	86.8	Confident	88.9	Confident	104 Å²	104	46.9 Å²	46.9	73%	0.727	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	127.9	-177.5	-55	0	0	0	0	113	E380	E380-S383 VanDerWaalsContact OE2-CA 3.32Å; E380-S383 WeakPolarHBondContact OE2-CA 3.46Å
384	G	85.5	Confident	89.4	Confident	74 Å²	74	46 Å²	46	76%	0.763	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	10.1	-179.4	0	0	0	0	0	115.6	E380 V382	E380-G384 VanDerWaalsContact CD-N 3.27Å; E380-G384 WeakPolarHBondContact OE1-CA 3.19Å; E380-G384 PolarHBondContact OE1-N 3.41Å; E380-G384 PolarHBondContact OE2-N 2.87Å; E380-G384 VanDerWaalsContact OE2-N 3.11Å; V382-G384 PolarHBondContact O-N 2.74Å
385	T	87.8	Confident	89.7	Confident	34 Å²	34	42.1 Å²	42.1	21%	0.209	25%	0.249	C	C	.	.	S	Bend	trans	-94.1	-16.5	174	62.3	0	0	0	0	113.7	E380 V382 V387 A449	E380-T385 PolarHBondContact OE1-N 3.03Å; V382-T385 HydrophobicContact CB-CG2 3.73Å; V382-T385 HydrophobicContact CG1-CG2 3.78Å; V382-T385 WeakPolarHBondContact O-CB 3.31Å; V382-T385 WeakPolarHBondContact O-CG2 3.42Å; V382-T385 PolarHBondContact O-N 3.46Å; V382-T385 VanDerWaalsContact O-N 3.13Å; V382-T385 PolarHBondContact O-OG1 3.04Å; T385-V387 PolarHBondContact O-N 3.43Å; T385-A449 HydrophobicContact CG2-CB 4.01Å
386	S	89.3	Confident	90.2	Very high	58 Å²	58	41.4 Å²	41.4	41%	0.406	24%	0.243	S	C	.	.			trans	55.9	27.5	-172.6	62.4	0	0	0	0	114.5	E380 R445	E380-S386 WeakPolarHBondContact OE1-CA 3.32Å; E380-S386 PolarHBondContact OE1-N 2.85Å; S386-R445 PolarHBondContact OG-NH2 3.44Å
387	V	93.4	Very high	90.6	Very high	9 Å²	9	39 Å²	39	6%	0.055	22%	0.224	C	C	.	.			trans	-106.2	115.8	176.9	175.2	0	0	0	0	108.8	L381 T385 F416 R445 V446 A449	L381-V387 PolarHBondContact N-O 3.24Å; T385-V387 PolarHBondContact O-N 3.43Å; V387-F416 HydrophobicContact CG1-CD1 4.19Å; V387-F416 HydrophobicContact CG1-CE1 3.44Å; V387-F416 VanDerWaalsContact CG1-CE1 3.44Å; V387-F416 HydrophobicContact CG1-CE2 4.36Å; V387-F416 HydrophobicContact CG1-CZ 3.55Å; V387-R445 HydrophobicContact CG2-CB 4.43Å; V387-V446 HydrophobicContact CG1-CG2 4.36Å; V387-V446 HydrophobicContact CG2-CG2 4.38Å; V387-A449 HydrophobicContact CB-CB 3.78Å; V387-A449 HydrophobicContact CG1-CB 4.05Å; V387-A449 HydrophobicContact CG2-CB 3.78Å
388	F	94.1	Very high	90.6	Very high	117 Å²	117	36.5 Å²	36.5	51%	0.513	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	139.5	-171.9	-62.4	-87.5	0	0	0	112.9	L379 E380 F416	L379-F388 CarbonylContact O-C 3.57Å; L379-F388 VanDerWaalsContact O-CA 3.26Å; L379-F388 WeakPolarHBondContact O-CA 3.44Å; E380-F388 HydrophobicContact CB-CD1 4.05Å; E380-F388 HydrophobicContact CB-CE1 3.8Å; E380-F388 HydrophobicContact CG-CD1 4.47Å; E380-F388 HydrophobicContact CG-CE1 4.13Å; E380-F388 HydrophobicContact CG-CZ 4.4Å; F388-F416 WeakPolarHBondContact O-CE1 3.29Å
389	I	93.8	Very high	90.4	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.7	177.2	-173.2	164.8	0	0	0	108.7	L379 L381 Q393 L394 L412 A415 F416	L379-I389 HydrophobicContact CB-CG2 4.46Å; L379-I389 PolarHBondContact N-O 3.45Å; L379-I389 PolarHBondContact O-N 3.04Å; L381-I389 HydrophobicContact CB-CG2 4.33Å; L381-I389 HydrophobicContact CD1-CG2 4.04Å; I389-Q393 HydrophobicContact CD1-CB 4Å; I389-Q393 HydrophobicContact CG1-CB 3.61Å; I389-L394 HydrophobicContact CD1-CB 4.18Å; I389-L394 HydrophobicContact CD1-CD1 4.43Å; I389-L394 HydrophobicContact CG1-CB 4.35Å; I389-L394 HydrophobicContact CG2-CB 4.02Å; I389-L394 HydrophobicContact CG2-CD2 4.13Å; I389-L394 HydrophobicContact CG2-CG 4.47Å; I389-L412 HydrophobicContact CD1-CD2 4.24Å; I389-A415 HydrophobicContact CD1-CB 4.02Å; I389-F416 HydrophobicContact CB-CE1 4.31Å; I389-F416 HydrophobicContact CB-CZ 3.91Å; I389-F416 HydrophobicContact CD1-CE2 4.34Å; I389-F416 HydrophobicContact CD1-CZ 4.23Å; I389-F416 HydrophobicContact CG1-CZ 4.5Å
390	S	92	Very high	90	Very high	17 Å²	17	29 Å²	29	12%	0.119	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	151.2	175	82.4	0	0	0	0	111.3	E377 A392 Q393 L394	E377-S390 CarbonylContact O-C 3.48Å; E377-S390 WeakPolarHBondContact O-CA 3.44Å; S390-A392 VanDerWaalsContact C-N 3.27Å; S390-A392 PolarHBondContact O-N 3.33Å; S390-Q393 PolarHBondContact O-N 3.49Å; S390-Q393 VanDerWaalsContact O-N 3.1Å; S390-Q393 WeakPolarHBondContact OG-CB 3.35Å; S390-Q393 VanDerWaalsContact OG-CG 3.28Å; S390-Q393 WeakPolarHBondContact OG-CG 3.31Å; S390-Q393 PolarHBondContact OG-N 2.63Å; S390-Q393 VanDerWaalsContact OG-N 3.11Å; S390-Q393 PolarHBondContact OG-OE1 3.5Å; S390-L394 PolarHBondContact O-N 2.76Å
391	R	88.8	Confident	89.7	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-53.7	-45.2	175.3	-174.2	172	-179.7	-66	-19.5	111	A351 K368 E371 G373 D374 E377 L379 Q393 L394 M395	A351-R391 VanDerWaalsContact O-CZ 3.26Å; A351-R391 PolarHBondContact O-NH1 3.1Å; A351-R391 PolarHBondContact O-NH2 3.19Å; K368-R391 PolarHBondContact O-NE 2.81Å; K368-R391 PolarHBondContact O-NH2 3Å; E371-R391 PolarHBondContact O-NH2 3.05Å; G373-R391 PolarHBondContact O-NH1 3.02Å; D374-R391 WeakPolarHBondContact O-CB 3.45Å; D374-R391 VanDerWaalsContact O-CD 3.29Å; D374-R391 WeakPolarHBondContact O-CD 3.2Å; E377-R391 HydrophobicContact CB-CB 4.21Å; E377-R391 PolarHBondContact O-N 2.83Å; L379-R391 HydrophobicContact CD1-CB 3.95Å; L379-R391 HydrophobicContact CD1-CG 4.07Å; L379-R391 HydrophobicContact CG-CB 4.09Å; R391-Q393 PolarHBondContact O-N 2.86Å; R391-L394 PolarHBondContact O-N 3.31Å; R391-M395 HydrophobicContact CG-CG 4.46Å; R391-M395 VanDerWaalsContact O-CB 3.26Å; R391-M395 WeakPolarHBondContact O-CB 3.29Å; R391-M395 WeakPolarHBondContact O-CG 3.48Å; R391-M395 PolarHBondContact O-N 3.15Å
392	A	86.1	Confident	89.5	Confident	5 Å²	5	27 Å²	27	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-39.7	175.5	0	0	0	0	0	114.3	Y308 P375 S390 N396	Y308-A392 HydrophobicContact CD1-CB 4.48Å; P375-A392 HydrophobicContact CB-CB 3.82Å; P375-A392 VanDerWaalsContact O-CB 3.29Å; P375-A392 WeakPolarHBondContact O-CB 3.18Å; P375-A392 PolarHBondContact O-N 3.43Å; S390-A392 VanDerWaalsContact C-N 3.27Å; S390-A392 PolarHBondContact O-N 3.33Å; A392-N396 WeakPolarHBondContact O-CB 3.43Å; A392-N396 PolarHBondContact O-N 3.01Å
393	Q	90.6	Very high	89.4	Confident	80 Å²	80	29.8 Å²	29.8	37%	0.374	19%	0.191	S	C	.	.	H	α-helix	trans	-66.4	-45.2	177.3	-76.4	169.6	-34.9	0	0	111.3	I389 S390 R391 N396 C397	I389-Q393 HydrophobicContact CD1-CB 4Å; I389-Q393 HydrophobicContact CG1-CB 3.61Å; S390-Q393 PolarHBondContact O-N 3.49Å; S390-Q393 VanDerWaalsContact O-N 3.1Å; S390-Q393 WeakPolarHBondContact OG-CB 3.35Å; S390-Q393 VanDerWaalsContact OG-CG 3.28Å; S390-Q393 WeakPolarHBondContact OG-CG 3.31Å; S390-Q393 PolarHBondContact OG-N 2.63Å; S390-Q393 VanDerWaalsContact OG-N 3.11Å; S390-Q393 PolarHBondContact OG-OE1 3.5Å; R391-Q393 PolarHBondContact O-N 2.86Å; Q393-N396 PolarHBondContact O-N 3.4Å; Q393-C397 PolarHBondContact O-N 2.91Å; Q393-C397 PolarHBondContact O-SG 2.83Å
394	L	92.4	Very high	89.6	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.6	-40.3	178.4	-172.9	56.8	0	0	0	111.3	H366 L369 L379 L381 I389 S390 R391 C397 H398 L412 Y453	H366-L394 HydrophobicContact CB-CD2 3.95Å; L369-L394 HydrophobicContact CD1-CD2 3.9Å; L369-L394 HydrophobicContact CD1-CG 3.98Å; L369-L394 HydrophobicContact CD2-CB 4.21Å; L369-L394 HydrophobicContact CD2-CD2 4.08Å; L369-L394 HydrophobicContact CD2-CG 3.95Å; L369-L394 HydrophobicContact CG-CD2 4.29Å; L369-L394 HydrophobicContact CG-CG 4.49Å; L379-L394 HydrophobicContact CD1-CD2 3.99Å; L381-L394 HydrophobicContact CD1-CD1 3.77Å; L381-L394 HydrophobicContact CD1-CD2 4.34Å; I389-L394 HydrophobicContact CD1-CB 4.18Å; I389-L394 HydrophobicContact CD1-CD1 4.43Å; I389-L394 HydrophobicContact CG1-CB 4.35Å; I389-L394 HydrophobicContact CG2-CB 4.02Å; I389-L394 HydrophobicContact CG2-CD2 4.13Å; I389-L394 HydrophobicContact CG2-CG 4.47Å; S390-L394 PolarHBondContact O-N 2.76Å; R391-L394 PolarHBondContact O-N 3.31Å; L394-C397 WeakPolarHBondContact O-CB 3.48Å; L394-C397 PolarHBondContact O-N 3.1Å; L394-H398 PolarHBondContact O-CD2 3.35Å; L394-H398 PolarHBondContact O-N 3.07Å; L394-L412 HydrophobicContact CD1-CD2 3.73Å; L394-Y453 HydrophobicContact CD1-CE1 4.38Å; L394-Y453 HydrophobicContact CD2-CE2 4.49Å
395	M	89.1	Confident	89.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55.1	-51.6	169.8	-76.7	-70.2	-70.4	0	0	112.1	Y308 S352 L353 L369 R391 C397 H398 V399	Y308-M395 HydrophobicContact CE1-CB 4.1Å; Y308-M395 HydrophobicContact CE2-CE 4.11Å; Y308-M395 WeakPolarHBondContact OH-CE 3.47Å; S352-M395 VanDerWaalsContact O-CE 3.25Å; S352-M395 WeakPolarHBondContact O-CE 3.21Å; L353-M395 HydrophobicContact CD2-CE 3.97Å; L353-M395 HydrophobicContact CD2-SD 3.52Å; L353-M395 VanDerWaalsContact CD2-SD 3.52Å; L353-M395 HydrophobicContact CG-CE 4.27Å; L353-M395 HydrophobicContact CG-SD 3.66Å; L369-M395 HydrophobicContact CB-SD 4.33Å; L369-M395 HydrophobicContact CD2-CG 3.76Å; L369-M395 HydrophobicContact CD2-SD 3.68Å; R391-M395 HydrophobicContact CG-CG 4.46Å; R391-M395 VanDerWaalsContact O-CB 3.26Å; R391-M395 WeakPolarHBondContact O-CB 3.29Å; R391-M395 WeakPolarHBondContact O-CG 3.48Å; R391-M395 PolarHBondContact O-N 3.15Å; M395-C397 PolarHBondContact O-N 2.99Å; M395-H398 PolarHBondContact O-N 2.87Å; M395-H398 VanDerWaalsContact O-N 3.16Å; M395-V399 WeakPolarHBondContact O-CG2 3.44Å; M395-V399 PolarHBondContact O-N 3.06Å
396	N	89.3	Confident	90	Very high	15 Å²	15	33 Å²	33	8%	0.08	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-35.4	177.4	-174	-90	0	0	0	112.2	Y308 A392 Q393 S400 R411	Y308-N396 WeakPolarHBondContact CB-ND2 3.45Å; A392-N396 WeakPolarHBondContact O-CB 3.43Å; A392-N396 PolarHBondContact O-N 3.01Å; Q393-N396 PolarHBondContact O-N 3.4Å; N396-S400 WeakPolarHBondContact O-CB 3.31Å; N396-S400 PolarHBondContact O-N 2.96Å; N396-S400 PolarHBondContact O-OG 3.47Å; N396-S400 PolarHBondContact OD1-OG 3.01Å; N396-R411 PolarHBondContact OD1-NH1 3.4Å
397	C	91.8	Very high	90.1	Very high	4 Å²	4	32.4 Å²	32.4	3%	0.027	16%	0.158	C	C	.	.	H	α-helix	trans	-62.7	-41.3	177.1	-67.5	0	0	0	0	112.5	Q393 L394 M395 A401 L408 R411 L412	Q393-C397 PolarHBondContact O-N 2.91Å; Q393-C397 PolarHBondContact O-SG 2.83Å; L394-C397 WeakPolarHBondContact O-CB 3.48Å; L394-C397 PolarHBondContact O-N 3.1Å; M395-C397 PolarHBondContact O-N 2.99Å; C397-A401 VanDerWaalsContact O-CB 3.29Å; C397-A401 WeakPolarHBondContact O-CB 3.26Å; C397-A401 PolarHBondContact O-N 2.95Å; C397-L408 HydrophobicContact CB-CD1 3.97Å; C397-R411 HydrophobicContact CB-CB 3.93Å; C397-L412 HydrophobicContact CB-CD2 4.19Å; C397-L412 HydrophobicContact CB-CG 4.44Å
398	H	90.1	Very high	90.1	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-73.1	-49.8	177.2	-74	-64.4	0	0	0	112.7	L353 L357 C365 L394 M395 S400 A401 G402 Y453 F457	L353-H398 HydrophobicContact CD2-CB 3.76Å; L357-H398 HydrophobicContact CD2-CB 4.38Å; C365-H398 PolarHBondContact SG-CE1 3.2Å; L394-H398 PolarHBondContact O-CD2 3.35Å; L394-H398 PolarHBondContact O-N 3.07Å; M395-H398 PolarHBondContact O-N 2.87Å; M395-H398 VanDerWaalsContact O-N 3.16Å; H398-S400 PolarHBondContact O-N 3.29Å; H398-A401 PolarHBondContact O-N 3.41Å; H398-G402 PolarHBondContact O-N 3.14Å; H398-Y453 AromaticContact CE1-CE1 3.64Å; H398-Y453 PolarHBondContact CE1-OH 2.58Å; H398-Y453 AromaticContact NE2-CE1 3.6Å; H398-Y453 AromaticContact NE2-CZ 3.63Å; H398-Y453 PolarHBondContact NE2-OH 2.86Å; H398-F457 AromaticContact ND1-CE2 3.96Å
399	V	87.1	Confident	90.2	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-63.6	-25.9	177.8	-178.7	0	0	0	0	111.2	Y301 I304 L353 P354 L357 M395	Y301-V399 HydrophobicContact CE1-CG1 4.34Å; Y301-V399 WeakPolarHBondContact CE1-O 3.49Å; Y301-V399 PolarHBondContact OH-O 3.08Å; I304-V399 HydrophobicContact CG2-CG1 4.08Å; L353-V399 HydrophobicContact CD2-CG2 4.12Å; P354-V399 HydrophobicContact CG-CG2 4.43Å; L357-V399 HydrophobicContact CD2-CG2 4.39Å; M395-V399 WeakPolarHBondContact O-CG2 3.44Å; M395-V399 PolarHBondContact O-N 3.06Å
400	S	85.4	Confident	90.2	Very high	15 Å²	15	31 Å²	31	11%	0.105	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-20.9	170.3	-64.1	0	0	0	0	114.8	N396 H398 V407 R411	N396-S400 WeakPolarHBondContact O-CB 3.31Å; N396-S400 PolarHBondContact O-N 2.96Å; N396-S400 PolarHBondContact O-OG 3.47Å; N396-S400 PolarHBondContact OD1-OG 3.01Å; H398-S400 PolarHBondContact O-N 3.29Å; S400-V407 WeakPolarHBondContact O-CG1 3.4Å; S400-R411 VanDerWaalsContact CB-NE 3.26Å; S400-R411 PolarHBondContact OG-NE 3.01Å; S400-R411 PolarHBondContact OG-NH1 3.42Å; S400-R411 PolarHBondContact OG-NH2 3.36Å
401	A	88.1	Confident	90.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-39.6	-173.4	0	0	0	0	0	113.1	C397 H398 R404 V407 L408	C397-A401 VanDerWaalsContact O-CB 3.29Å; C397-A401 WeakPolarHBondContact O-CB 3.26Å; C397-A401 PolarHBondContact O-N 2.95Å; H398-A401 PolarHBondContact O-N 3.41Å; A401-R404 WeakPolarHBondContact O-CB 3.39Å; A401-R404 PolarHBondContact O-N 2.92Å; A401-R404 PolarHBondContact O-NE 2.77Å; A401-V407 HydrophobicContact CB-CB 4.15Å; A401-V407 HydrophobicContact CB-CG1 4.26Å; A401-L408 HydrophobicContact CB-CB 3.71Å; A401-L408 HydrophobicContact CB-CD1 4.45Å
402	G	87.8	Confident	90.6	Very high	8 Å²	8	35.1 Å²	35.1	8%	0.082	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	-142	-159	0	0	0	0	0	110	H398 R404 F457	H398-G402 PolarHBondContact O-N 3.14Å; G402-R404 PolarHBondContact O-N 3.44Å; G402-F457 WeakPolarHBondContact O-CZ 3.33Å
403	T	88.3	Confident	91	Very high	75 Å²	75	34.9 Å²	34.9	46%	0.46	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-5.5	173	53.9	0	0	0	0	114.9	Q360 I361 H405 F457	Q360-T403 HydrophobicContact CB-CG2 3.72Å; I361-T403 HydrophobicContact CG2-CG2 4.46Å; T403-H405 PolarHBondContact O-N 3.04Å; T403-H405 VanDerWaalsContact O-N 3.14Å; T403-F457 WeakPolarHBondContact O-CE1 3.06Å
404	R	90.1	Very high	91.1	Very high	151 Å²	151	33.9 Å²	33.9	57%	0.57	16%	0.164	S	C	*	.			trans	-87.1	90.9	-165.1	-57.3	174.4	-67.6	-163.4	-2.9	112.3	A401 G402 K406 V407 L408	A401-R404 WeakPolarHBondContact O-CB 3.39Å; A401-R404 PolarHBondContact O-N 2.92Å; A401-R404 PolarHBondContact O-NE 2.77Å; G402-R404 PolarHBondContact O-N 3.44Å; R404-K406 PolarHBondContact O-N 3.34Å; R404-V407 HydrophobicContact CB-CB 4.2Å; R404-V407 HydrophobicContact CB-CG2 3.82Å; R404-V407 WeakPolarHBondContact O-CA 3.38Å; R404-V407 WeakPolarHBondContact O-CB 3.45Å; R404-V407 PolarHBondContact O-N 2.97Å; R404-L408 PolarHBondContact O-N 3Å; R404-L408 VanDerWaalsContact O-N 3.08Å
405	H	90.6	Very high	91.1	Very high	42 Å²	42	35.6 Å²	35.6	19%	0.194	18%	0.178	C	C	.	.	H	α-helix	trans	-52.4	-32.3	-178.8	67.1	-93.7	0	0	0	114.8	T403 V407 L408 L409 F457 A458 F461	T403-H405 PolarHBondContact O-N 3.04Å; T403-H405 VanDerWaalsContact O-N 3.14Å; H405-V407 VanDerWaalsContact C-N 3.29Å; H405-V407 PolarHBondContact O-N 3.24Å; H405-L408 PolarHBondContact O-N 3.36Å; H405-L409 WeakPolarHBondContact O-CB 3.32Å; H405-L409 PolarHBondContact O-N 2.98Å; H405-F457 HydrophobicContact CB-CD1 3.79Å; H405-F457 HydrophobicContact CB-CE1 3.86Å; H405-A458 HydrophobicContact CB-CB 3.78Å; H405-F461 AromaticContact CD2-CD2 3.86Å
406	K	92.2	Very high	91.3	Very high	88 Å²	88	37.9 Å²	37.9	38%	0.383	19%	0.189	S	C	.	.	H	α-helix	trans	-75.3	-12.5	176.6	-55.4	-170	178.3	-179.7	0	114.5	R404 R410 E465 I469	R404-K406 PolarHBondContact O-N 3.34Å; K406-R410 WeakPolarHBondContact O-CG 3.48Å; K406-R410 PolarHBondContact O-NH1 3.41Å; K406-R410 VanDerWaalsContact O-NH1 3.1Å; K406-E465 WeakPolarHBondContact CE-OE1 2.88Å; K406-E465 IonicContact NZ-OE1 3.28Å; K406-E465 PolarHBondContact NZ-OE1 3.26Å; K406-I469 HydrophobicContact CB-CD1 4.08Å; K406-I469 HydrophobicContact CD-CD1 4.42Å; K406-I469 HydrophobicContact CG-CD1 4.17Å
407	V	92	Very high	91.5	Very high	45 Å²	45	37.9 Å²	37.9	27%	0.273	19%	0.188	S	C	.	.	H	α-helix	trans	-91.5	-44.9	168.8	-175.7	0	0	0	0	109.2	S400 A401 R404 H405 L409 R410 R411	S400-V407 WeakPolarHBondContact O-CG1 3.4Å; A401-V407 HydrophobicContact CB-CB 4.15Å; A401-V407 HydrophobicContact CB-CG1 4.26Å; R404-V407 HydrophobicContact CB-CB 4.2Å; R404-V407 HydrophobicContact CB-CG2 3.82Å; R404-V407 WeakPolarHBondContact O-CA 3.38Å; R404-V407 WeakPolarHBondContact O-CB 3.45Å; R404-V407 PolarHBondContact O-N 2.97Å; H405-V407 VanDerWaalsContact C-N 3.29Å; H405-V407 PolarHBondContact O-N 3.24Å; V407-L409 VanDerWaalsContact C-N 3.34Å; V407-L409 PolarHBondContact O-N 3.29Å; V407-R410 PolarHBondContact O-N 2.88Å; V407-R410 VanDerWaalsContact O-N 3.11Å; V407-R411 HydrophobicContact CG1-CG 4.46Å; V407-R411 WeakPolarHBondContact O-CG 3.33Å; V407-R411 PolarHBondContact O-N 3.38Å
408	L	93.3	Very high	91.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-53.5	-48.9	174.7	179.5	62.8	0	0	0	111.6	C397 A401 R404 H405 R410 R411 L412 Y453 F457	C397-L408 HydrophobicContact CB-CD1 3.97Å; A401-L408 HydrophobicContact CB-CB 3.71Å; A401-L408 HydrophobicContact CB-CD1 4.45Å; R404-L408 PolarHBondContact O-N 3Å; R404-L408 VanDerWaalsContact O-N 3.08Å; H405-L408 PolarHBondContact O-N 3.36Å; L408-R410 VanDerWaalsContact C-N 3.34Å; L408-R410 PolarHBondContact O-N 3.17Å; L408-R411 PolarHBondContact O-N 3.36Å; L408-L412 HydrophobicContact CD1-CD1 4.08Å; L408-L412 HydrophobicContact CD1-CG 4.16Å; L408-L412 HydrophobicContact CG-CD1 3.91Å; L408-L412 HydrophobicContact CG-CG 4.4Å; L408-L412 WeakPolarHBondContact O-CG 3.41Å; L408-L412 PolarHBondContact O-N 3.37Å; L408-Y453 HydrophobicContact CD2-CE1 4.32Å; L408-F457 HydrophobicContact CD2-CB 4.01Å; L408-F457 HydrophobicContact CD2-CD1 3.66Å; L408-F457 HydrophobicContact CD2-CD2 3.62Å; L408-F457 HydrophobicContact CD2-CE1 3.98Å; L408-F457 HydrophobicContact CD2-CE2 3.92Å; L408-F457 HydrophobicContact CD2-CG 3.47Å; L408-F457 VanDerWaalsContact CD2-CG 3.47Å; L408-F457 HydrophobicContact CD2-CZ 4.09Å
409	L	94.4	Very high	91.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57	-45.2	176.9	176.1	67.1	0	0	0	112.3	H405 V407 R411 L412 L413 V450 F461 M466 I469	H405-L409 WeakPolarHBondContact O-CB 3.32Å; H405-L409 PolarHBondContact O-N 2.98Å; V407-L409 VanDerWaalsContact C-N 3.34Å; V407-L409 PolarHBondContact O-N 3.29Å; L409-R411 VanDerWaalsContact C-N 3.33Å; L409-R411 PolarHBondContact O-N 3.03Å; L409-L412 PolarHBondContact O-N 3.44Å; L409-L413 HydrophobicContact CD1-CD1 3.89Å; L409-L413 HydrophobicContact CD1-CG 4Å; L409-L413 HydrophobicContact CD2-CD1 4.48Å; L409-L413 HydrophobicContact CG-CD1 3.92Å; L409-L413 HydrophobicContact CG-CG 4.38Å; L409-L413 WeakPolarHBondContact O-CB 3.33Å; L409-L413 WeakPolarHBondContact O-CG 3.22Å; L409-L413 PolarHBondContact O-N 3.37Å; L409-V450 HydrophobicContact CD1-CG1 3.5Å; L409-V450 VanDerWaalsContact CD1-CG1 3.5Å; L409-F461 HydrophobicContact CD1-CZ 4.28Å; L409-F461 HydrophobicContact CD2-CE2 4.02Å; L409-F461 HydrophobicContact CD2-CZ 3.88Å; L409-M466 HydrophobicContact CD1-CG 4.09Å; L409-M466 HydrophobicContact CD2-CB 4.43Å; L409-M466 HydrophobicContact CD2-CG 4.26Å; L409-I469 HydrophobicContact CD2-CB 3.76Å; L409-I469 HydrophobicContact CD2-CD1 3.77Å; L409-I469 HydrophobicContact CD2-CG1 4.34Å; L409-I469 HydrophobicContact CD2-CG2 3.72Å; L409-I469 HydrophobicContact CG-CG2 4.23Å
410	R	94.3	Very high	91.1	Very high	101 Å²	101	53.2 Å²	53.2	38%	0.381	26%	0.264	S	S	.	.	H	α-helix	trans	-65.4	-37.3	179.5	-73.8	-174.3	174.1	103.8	-12.9	111.9	K406 V407 L408 A414 I469 D472 M473	K406-R410 WeakPolarHBondContact O-CG 3.48Å; K406-R410 PolarHBondContact O-NH1 3.41Å; K406-R410 VanDerWaalsContact O-NH1 3.1Å; V407-R410 PolarHBondContact O-N 2.88Å; V407-R410 VanDerWaalsContact O-N 3.11Å; L408-R410 VanDerWaalsContact C-N 3.34Å; L408-R410 PolarHBondContact O-N 3.17Å; R410-A414 VanDerWaalsContact O-CB 3.25Å; R410-A414 WeakPolarHBondContact O-CB 3.49Å; R410-A414 PolarHBondContact O-N 3.06Å; R410-I469 HydrophobicContact CG-CG2 3.57Å; R410-D472 IonicContact NE-OD2 2.67Å; R410-D472 IonicContact NH2-OD2 2.71Å; R410-D472 PolarHBondContact NH2-OD2 2.85Å; R410-M473 HydrophobicContact CB-SD 4.08Å; R410-M473 HydrophobicContact CG-CG 4.42Å; R410-M473 HydrophobicContact CG-SD 3.86Å; R410-M473 WeakPolarHBondContact O-CE 3.38Å
411	R	94.3	Very high	91.2	Very high	106 Å²	106	55 Å²	55	40%	0.4	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-47.4	175.7	-72	-76.4	180	152.8	3.1	111.4	N396 C397 S400 V407 L408 L409 A414 A415	N396-R411 PolarHBondContact OD1-NH1 3.4Å; C397-R411 HydrophobicContact CB-CB 3.93Å; S400-R411 VanDerWaalsContact CB-NE 3.26Å; S400-R411 PolarHBondContact OG-NE 3.01Å; S400-R411 PolarHBondContact OG-NH1 3.42Å; S400-R411 PolarHBondContact OG-NH2 3.36Å; V407-R411 HydrophobicContact CG1-CG 4.46Å; V407-R411 WeakPolarHBondContact O-CG 3.33Å; V407-R411 PolarHBondContact O-N 3.38Å; L408-R411 PolarHBondContact O-N 3.36Å; L409-R411 VanDerWaalsContact C-N 3.33Å; L409-R411 PolarHBondContact O-N 3.03Å; R411-A414 PolarHBondContact O-N 3.18Å; R411-A415 PolarHBondContact O-N 3.36Å
412	L	95	Very high	91.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-49.3	175.5	-70.8	171.4	0	0	0	111.9	L381 I389 L394 C397 L408 L409 A414 A415 F416 V450 Y453	L381-L412 HydrophobicContact CD1-CD2 4.02Å; I389-L412 HydrophobicContact CD1-CD2 4.24Å; L394-L412 HydrophobicContact CD1-CD2 3.73Å; C397-L412 HydrophobicContact CB-CD2 4.19Å; C397-L412 HydrophobicContact CB-CG 4.44Å; L408-L412 HydrophobicContact CD1-CD1 4.08Å; L408-L412 HydrophobicContact CD1-CG 4.16Å; L408-L412 HydrophobicContact CG-CD1 3.91Å; L408-L412 HydrophobicContact CG-CG 4.4Å; L408-L412 WeakPolarHBondContact O-CG 3.41Å; L408-L412 PolarHBondContact O-N 3.37Å; L409-L412 PolarHBondContact O-N 3.44Å; L412-A414 VanDerWaalsContact C-N 3.26Å; L412-A414 PolarHBondContact O-N 3.46Å; L412-A415 WeakPolarHBondContact O-CB 3.45Å; L412-A415 PolarHBondContact O-N 3.37Å; L412-F416 WeakPolarHBondContact O-CD2 3.49Å; L412-F416 PolarHBondContact O-N 3.45Å; L412-V450 HydrophobicContact CB-CG1 3.98Å; L412-V450 HydrophobicContact CB-CG2 4.29Å; L412-V450 HydrophobicContact CD1-CG1 4.26Å; L412-Y453 HydrophobicContact CD1-CD1 3.73Å; L412-Y453 HydrophobicContact CD1-CE1 4.4Å; L412-Y453 HydrophobicContact CD1-CG 4.43Å
413	L	94.2	Very high	91.1	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-34.5	177	-71.4	175.2	0	0	0	112.4	L409 F417 L447 V450 A470 M473	L409-L413 HydrophobicContact CD1-CD1 3.89Å; L409-L413 HydrophobicContact CD1-CG 4Å; L409-L413 HydrophobicContact CD2-CD1 4.48Å; L409-L413 HydrophobicContact CG-CD1 3.92Å; L409-L413 HydrophobicContact CG-CG 4.38Å; L409-L413 WeakPolarHBondContact O-CB 3.33Å; L409-L413 WeakPolarHBondContact O-CG 3.22Å; L409-L413 PolarHBondContact O-N 3.37Å; L413-F417 HydrophobicContact CD2-CD2 4.11Å; L413-F417 HydrophobicContact CD2-CE2 3.94Å; L413-F417 WeakPolarHBondContact O-CB 3.28Å; L413-F417 PolarHBondContact O-N 3.43Å; L413-L447 HydrophobicContact CD2-CD2 3.84Å; L413-V450 HydrophobicContact CD2-CG1 4.26Å; L413-V450 HydrophobicContact CG-CG1 4.4Å; L413-A470 HydrophobicContact CD1-CB 4.3Å; L413-M473 HydrophobicContact CB-CE 3.74Å; L413-M473 HydrophobicContact CB-SD 3.84Å; L413-M473 HydrophobicContact CD1-SD 3.83Å; L413-M473 HydrophobicContact CG-SD 4.5Å
414	A	93.2	Very high	90.9	Very high	58 Å²	58	56.4 Å²	56.4	48%	0.479	28%	0.278	S	S	.	.	H	α-helix	trans	-75.4	-20.5	175.1	0	0	0	0	0	113.8	R410 R411 L412 M473	R410-A414 VanDerWaalsContact O-CB 3.25Å; R410-A414 WeakPolarHBondContact O-CB 3.49Å; R410-A414 PolarHBondContact O-N 3.06Å; R411-A414 PolarHBondContact O-N 3.18Å; L412-A414 VanDerWaalsContact C-N 3.26Å; L412-A414 PolarHBondContact O-N 3.46Å; A414-M473 HydrophobicContact CB-CE 4.17Å
415	A	93	Very high	90.5	Very high	36 Å²	36	49.7 Å²	49.7	30%	0.298	25%	0.254	S	S	.	.	H	α-helix	trans	-78.6	-24.7	174.2	0	0	0	0	0	113	I389 R411 L412	I389-A415 HydrophobicContact CD1-CB 4.02Å; R411-A415 PolarHBondContact O-N 3.36Å; L412-A415 WeakPolarHBondContact O-CB 3.45Å; L412-A415 PolarHBondContact O-N 3.37Å
416	F	93	Very high	89.8	Confident	48 Å²	48	48.9 Å²	48.9	21%	0.211	25%	0.254	C	S	.	.	H	α-helix	trans	-103	-22.8	177	-65.6	-72.1	0	0	0	114.8	L381 V387 F388 I389 L412 V446 V450	L381-F416 HydrophobicContact CD2-CE2 3.83Å; L381-F416 HydrophobicContact CD2-CZ 3.99Å; V387-F416 HydrophobicContact CG1-CD1 4.19Å; V387-F416 HydrophobicContact CG1-CE1 3.44Å; V387-F416 VanDerWaalsContact CG1-CE1 3.44Å; V387-F416 HydrophobicContact CG1-CE2 4.36Å; V387-F416 HydrophobicContact CG1-CZ 3.55Å; F388-F416 WeakPolarHBondContact O-CE1 3.29Å; I389-F416 HydrophobicContact CB-CE1 4.31Å; I389-F416 HydrophobicContact CB-CZ 3.91Å; I389-F416 HydrophobicContact CD1-CE2 4.34Å; I389-F416 HydrophobicContact CD1-CZ 4.23Å; I389-F416 HydrophobicContact CG1-CZ 4.5Å; L412-F416 WeakPolarHBondContact O-CD2 3.49Å; L412-F416 PolarHBondContact O-N 3.45Å; F416-V446 HydrophobicContact CB-CG1 3.53Å; F416-V446 HydrophobicContact CD1-CG1 4.15Å; F416-V446 HydrophobicContact CD2-CG1 3.79Å; F416-V446 HydrophobicContact CG-CG1 3.56Å; F416-V450 HydrophobicContact CD2-CG2 3.82Å; F416-V450 HydrophobicContact CE2-CG2 3.76Å
417	F	92.9	Very high	88.4	Confident	15 Å²	15	45 Å²	45	7%	0.066	24%	0.238	C	C	.	.	S	Bend	trans	-128.1	108.3	-175.4	-56.8	-60.9	0	0	0	112.2	L413 T421 L422 L442 D443 V446 L447	L413-F417 HydrophobicContact CD2-CD2 4.11Å; L413-F417 HydrophobicContact CD2-CE2 3.94Å; L413-F417 WeakPolarHBondContact O-CB 3.28Å; L413-F417 PolarHBondContact O-N 3.43Å; F417-T421 HydrophobicContact CB-CG2 4.47Å; F417-T421 HydrophobicContact CD1-CG2 4.09Å; F417-L422 HydrophobicContact CB-CD1 4.39Å; F417-L422 HydrophobicContact CB-CD2 3.79Å; F417-L422 HydrophobicContact CB-CG 3.8Å; F417-L422 HydrophobicContact CG-CD2 4.44Å; F417-L422 WeakPolarHBondContact O-CD1 3.36Å; F417-L442 HydrophobicContact CD1-CD2 3.94Å; F417-L442 HydrophobicContact CD2-CD1 4.41Å; F417-L442 HydrophobicContact CD2-CD2 4.16Å; F417-L442 HydrophobicContact CE1-CB 4.31Å; F417-L442 HydrophobicContact CE1-CD2 4.05Å; F417-L442 HydrophobicContact CE2-CB 4.31Å; F417-L442 HydrophobicContact CE2-CD1 4.21Å; F417-L442 HydrophobicContact CE2-CD2 4.26Å; F417-L442 HydrophobicContact CG-CD2 3.99Å; F417-L442 HydrophobicContact CZ-CB 3.91Å; F417-L442 HydrophobicContact CZ-CD2 4.2Å; F417-L442 HydrophobicContact CZ-CG 4.47Å; F417-D443 HydrophobicContact CE1-CB 4.29Å; F417-D443 HydrophobicContact CZ-CB 4.43Å; F417-V446 HydrophobicContact CE1-CB 4.46Å; F417-V446 HydrophobicContact CE1-CG1 4.35Å; F417-V446 HydrophobicContact CE2-CB 4.39Å; F417-V446 HydrophobicContact CE2-CG1 3.75Å; F417-V446 HydrophobicContact CZ-CB 3.77Å; F417-V446 HydrophobicContact CZ-CG1 3.58Å; F417-V446 HydrophobicContact CZ-CG2 4.46Å; F417-L447 HydrophobicContact CE2-CD2 4.18Å
418	D	89.7	Confident	86.9	Confident	113 Å²	113	44.5 Å²	44.5	60%	0.604	24%	0.235	S	C	*	.			trans	-55.5	156.5	172.6	-69.4	-51.2	0	0	0	113.2	S420 T421 L422	D418-S420 PolarHBondContact O-N 3.37Å; D418-T421 WeakPolarHBondContact O-CB 3.27Å; D418-T421 PolarHBondContact O-N 3.14Å; D418-L422 PolarHBondContact O-N 3.23Å
419	R	87.2	Confident	85	Confident	145 Å²	145	48 Å²	48	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-29.8	179	-157.4	175.5	-154.7	145.9	11.4	113.2	A423 A477	R419-A423 VanDerWaalsContact O-CB 3.32Å; R419-A423 WeakPolarHBondContact O-CB 3.47Å; R419-A423 PolarHBondContact O-N 3.27Å; R419-A477 HydrophobicContact CG-CB 4.03Å
420	S	85.3	Confident	82.7	Confident	70 Å²	70	54.4 Å²	54.4	49%	0.49	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-49.7	172.2	48.7	0	0	0	0	111.4	D418 A423 N424	D418-S420 PolarHBondContact O-N 3.37Å; S420-A423 PolarHBondContact O-N 3.16Å; S420-N424 WeakPolarHBondContact O-CB 3.44Å; S420-N424 PolarHBondContact O-N 3.25Å; S420-N424 PolarHBondContact O-ND2 3.16Å
421	T	87.5	Confident	80.6	Confident	53 Å²	53	60.4 Å²	60.4	33%	0.325	33%	0.327	S	S	.	.	H	α-helix	trans	-58.4	-50.4	175.2	-57.5	0	0	0	0	111.2	F417 D418 A423 N424 S425	F417-T421 HydrophobicContact CB-CG2 4.47Å; F417-T421 HydrophobicContact CD1-CG2 4.09Å; D418-T421 WeakPolarHBondContact O-CB 3.27Å; D418-T421 PolarHBondContact O-N 3.14Å; T421-A423 VanDerWaalsContact C-N 3.31Å; T421-A423 PolarHBondContact O-N 3.08Å; T421-N424 CarbonylContact O-C 3.58Å; T421-N424 PolarHBondContact O-N 3.13Å; T421-N424 VanDerWaalsContact O-N 3.12Å; T421-S425 WeakPolarHBondContact O-CB 3.4Å; T421-S425 PolarHBondContact O-N 3.33Å; T421-S425 PolarHBondContact O-OG 2.93Å
422	L	88.8	Confident	78.4	Confident	12 Å²	12	58.4 Å²	58.4	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-60	-36.2	175.5	-69.8	170.9	0	0	0	113	F417 D418 L442 M473 C474 A477	F417-L422 HydrophobicContact CB-CD1 4.39Å; F417-L422 HydrophobicContact CB-CD2 3.79Å; F417-L422 HydrophobicContact CB-CG 3.8Å; F417-L422 HydrophobicContact CG-CD2 4.44Å; F417-L422 WeakPolarHBondContact O-CD1 3.36Å; D418-L422 PolarHBondContact O-N 3.23Å; L422-L442 HydrophobicContact CD2-CD1 4.48Å; L422-L442 HydrophobicContact CD2-CD2 4.25Å; L422-M473 HydrophobicContact CD1-CE 3.96Å; L422-C474 WeakPolarHBondContact O-CA 3.26Å; L422-C474 WeakPolarHBondContact O-CB 3.35Å; L422-C474 PolarHBondContact O-SG 2.9Å; L422-A477 HydrophobicContact CB-CB 3.75Å
423	A	84.8	Confident	76.1	Confident	7 Å²	7	64.6 Å²	64.6	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-68	-39.7	175.7	0	0	0	0	0	111.9	R419 S420 T421 R439 A477 R478 V481	R419-A423 VanDerWaalsContact O-CB 3.32Å; R419-A423 WeakPolarHBondContact O-CB 3.47Å; R419-A423 PolarHBondContact O-N 3.27Å; S420-A423 PolarHBondContact O-N 3.16Å; T421-A423 VanDerWaalsContact C-N 3.31Å; T421-A423 PolarHBondContact O-N 3.08Å; A423-R439 PolarHBondContact O-NH1 2.85Å; A423-A477 HydrophobicContact CB-CB 4.11Å; A423-R478 HydrophobicContact CB-CG 4.16Å; A423-R478 WeakPolarHBondContact O-CD 3.48Å; A423-R478 WeakPolarHBondContact O-CG 3.17Å; A423-R478 PolarHBondContact O-NH1 2.93Å; A423-R478 VanDerWaalsContact O-NH1 3.1Å; A423-V481 HydrophobicContact CB-CG2 4.25Å
424	N	82.4	Confident	74.1	Confident	93 Å²	93	70.5 Å²	70.5	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-84.2	-17.8	-176	-71.9	-28	0	0	0	114.7	S420 T421 R439	S420-N424 WeakPolarHBondContact O-CB 3.44Å; S420-N424 PolarHBondContact O-N 3.25Å; S420-N424 PolarHBondContact O-ND2 3.16Å; T421-N424 CarbonylContact O-C 3.58Å; T421-N424 PolarHBondContact O-N 3.13Å; T421-N424 VanDerWaalsContact O-N 3.12Å; N424-R439 VanDerWaalsContact O-CB 3.29Å; N424-R439 WeakPolarHBondContact O-CB 3.15Å; N424-R439 VanDerWaalsContact O-CG 3.31Å; N424-R439 WeakPolarHBondContact O-CG 3.4Å; N424-R439 PolarHBondContact OD1-NH1 2.79Å
425	S	83.1	Confident	72.3	Confident	10 Å²	10	70.4 Å²	70.4	7%	0.07	40%	0.4	C	S	.	.	S	Bend	trans	-94	154.8	178.7	-74	0	0	0	0	115.1	T421 K440 L442 R478	T421-S425 WeakPolarHBondContact O-CB 3.4Å; T421-S425 PolarHBondContact O-N 3.33Å; T421-S425 PolarHBondContact O-OG 2.93Å; S425-K440 WeakPolarHBondContact CA-O 3.44Å; S425-K440 WeakPolarHBondContact CB-O 3.21Å; S425-K440 PolarHBondContact OG-O 3.33Å; S425-L442 VanDerWaalsContact CB-CD2 3.49Å; S425-R478 PolarHBondContact O-NH1 3.3Å
426	C	76.1	Confident	70.5	Confident	26 Å²	26	71.6 Å²	71.6	18%	0.176	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-84.2	114.4	162.8	-67.3	0	0	0	0	108.9	T428 K440	C426-T428 PolarHBondContact O-N 3.06Å; C426-K440 PolarHBondContact N-O 2.93Å
427	G	61.3	Low	68.8	Low	5 Å²	5	75 Å²	75	5%	0.052	43%	0.428	C	S	.	.	S	Bend	trans	-64.8	-18.8	-175.1	0	0	0	0	0	114.6	A470 C474	G427-A470 WeakPolarHBondContact O-CB 3.41Å; G427-C474 WeakPolarHBondContact CA-SG 3.28Å
428	T	61	Low	67.4	Low	35 Å²	35	78.6 Å²	78.6	22%	0.215	46%	0.455	C	S	.	.	S	Bend	trans	-138.4	154	163	64.7	0	0	0	0	108.3	C426 I430 N467	C426-T428 PolarHBondContact O-N 3.06Å; T428-I430 PolarHBondContact O-N 3.48Å; T428-N467 HydrophobicContact CG2-CB 3.58Å; T428-N467 VanDerWaalsContact CG2-O 3.32Å; T428-N467 WeakPolarHBondContact CG2-O 3.31Å
429	G	53.6	Low	66.4	Low	73 Å²	73	76.8 Å²	76.8	75%	0.753	44%	0.44	S	S	*	.	S	Bend	trans	-70.3	3.1	-178.6	0	0	0	0	0	115.6	R431	G429-R431 PolarHBondContact O-N 2.85Å
430	I	47.2	Very low	65.9	Low	136 Å²	136	77.7 Å²	77.7	70%	0.697	45%	0.448	S	S	*	.			trans	-79.8	115.1	-177.5	-57.7	-179.3	0	0	0	109.3	T428 S432	T428-I430 PolarHBondContact O-N 3.48Å; I430-S432 VanDerWaalsContact C-N 3.32Å; I430-S432 PolarHBondContact O-N 3.04Å
431	R	49.4	Very low	65.6	Low	227 Å²	227	78.2 Å²	78.2	86%	0.857	45%	0.45	S	S	*	.			trans	-64.5	84.6	176.4	-68.8	175.2	173.1	-100.4	1.4	111.4	G429 S433	G429-R431 PolarHBondContact O-N 2.85Å; R431-S433 PolarHBondContact O-N 2.71Å
432	S	47.6	Very low	65.6	Low	64 Å²	64	76 Å²	76	45%	0.448	44%	0.436	S	S	.	.			trans	-59.9	129.7	158.5	-9.9	0	0	0	0	107.5	I430 T434 N435	I430-S432 VanDerWaalsContact C-N 3.32Å; I430-S432 PolarHBondContact O-N 3.04Å; S432-T434 PolarHBondContact O-N 2.73Å; S432-N435 WeakPolarHBondContact CB-ND2 3.39Å; S432-N435 PolarHBondContact O-N 3.04Å; S432-N435 PolarHBondContact OG-ND2 3.02Å
433	S	47.6	Very low	65.5	Low	129 Å²	129	78.9 Å²	78.9	90%	0.902	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-4.5	-169.7	50.3	0	0	0	0	115.6	R431	R431-S433 PolarHBondContact O-N 2.71Å
434	T	50.9	Low	65.7	Low	125 Å²	125	83.3 Å²	83.3	77%	0.767	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	0.8	179.3	53	0	0	0	0	113.9	S432	S432-T434 PolarHBondContact O-N 2.73Å
435	N	55.8	Low	66.1	Low	56 Å²	56	85.6 Å²	85.6	30%	0.299	48%	0.475	S	S	.	.	S	Bend	trans	-86.2	128.4	178.6	-78.6	-70.5	0	0	0	112.8	S432	S432-N435 WeakPolarHBondContact CB-ND2 3.39Å; S432-N435 PolarHBondContact O-N 3.04Å; S432-N435 PolarHBondContact OG-ND2 3.02Å
436	D	55.2	Low	66.6	Low	61 Å²	61	85.9 Å²	85.9	33%	0.326	48%	0.477	S	S	.	.			trans	-50.4	122.5	167.2	154.7	17.9	0	0	0	111.5	S438 R439	D436-S438 VanDerWaalsContact CG-OG 3.25Å; D436-S438 PolarHBondContact O-N 3.02Å; D436-S438 VanDerWaalsContact O-N 3.15Å; D436-S438 WeakPolarHBondContact OD1-CB 3.47Å; D436-S438 PolarHBondContact OD1-N 3.38Å; D436-S438 PolarHBondContact OD1-OG 3.24Å; D436-S438 PolarHBondContact OD2-OG 3.28Å; D436-R439 HydrophobicContact CB-CG 4.43Å; D436-R439 PolarHBondContact O-N 3.06Å; D436-R439 IonicContact OD2-CZ 4Å; D436-R439 VanDerWaalsContact OD2-CZ 3.28Å; D436-R439 IonicContact OD2-NE 2.72Å; D436-R439 PolarHBondContact OD2-NE 3.33Å; D436-R439 IonicContact OD2-NH2 2.61Å; D436-R439 PolarHBondContact OD2-NH2 3.32Å
437	P	57.8	Low	67.3	Low	121 Å²	121	85.4 Å²	85.4	79%	0.786	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-4.3	-169.9	30.8	-36.9	0	0	0	114.5	R439	P437-R439 VanDerWaalsContact C-N 3.32Å
438	S	62.5	Low	68.7	Low	90 Å²	90	90.5 Å²	90.5	63%	0.629	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.5	175.5	69.3	0	0	0	0	114	D436 K440	D436-S438 VanDerWaalsContact CG-OG 3.25Å; D436-S438 PolarHBondContact O-N 3.02Å; D436-S438 VanDerWaalsContact O-N 3.15Å; D436-S438 WeakPolarHBondContact OD1-CB 3.47Å; D436-S438 PolarHBondContact OD1-N 3.38Å; D436-S438 PolarHBondContact OD1-OG 3.24Å; D436-S438 PolarHBondContact OD2-OG 3.28Å; S438-K440 PolarHBondContact O-N 2.88Å
439	R	70.3	Confident	70.3	Confident	75 Å²	75	88.8 Å²	88.8	28%	0.283	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-76.8	124.6	-170.7	-64.7	-173.3	-172.7	-82.2	-33.4	112.4	A423 N424 D436 P437	A423-R439 PolarHBondContact O-NH1 2.85Å; N424-R439 VanDerWaalsContact O-CB 3.29Å; N424-R439 WeakPolarHBondContact O-CB 3.15Å; N424-R439 VanDerWaalsContact O-CG 3.31Å; N424-R439 WeakPolarHBondContact O-CG 3.4Å; N424-R439 PolarHBondContact OD1-NH1 2.79Å; D436-R439 HydrophobicContact CB-CG 4.43Å; D436-R439 PolarHBondContact O-N 3.06Å; D436-R439 IonicContact OD2-CZ 4Å; D436-R439 VanDerWaalsContact OD2-CZ 3.28Å; D436-R439 IonicContact OD2-NE 2.72Å; D436-R439 PolarHBondContact OD2-NE 3.33Å; D436-R439 IonicContact OD2-NH2 2.61Å; D436-R439 PolarHBondContact OD2-NH2 3.32Å; P437-R439 VanDerWaalsContact C-N 3.32Å
440	K	76.1	Confident	72.2	Confident	164 Å²	164	85.3 Å²	85.3	71%	0.713	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-74.7	149.6	176.8	-63.9	-178.9	-179.3	179.2	0	110.6	S425 C426 S438	S425-K440 WeakPolarHBondContact CA-O 3.44Å; S425-K440 WeakPolarHBondContact CB-O 3.21Å; S425-K440 PolarHBondContact OG-O 3.33Å; C426-K440 PolarHBondContact N-O 2.93Å; S438-K440 PolarHBondContact O-N 2.88Å
441	P	79.8	Confident	74.4	Confident	81 Å²	81	80.6 Å²	80.6	53%	0.526	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-63	165.2	164.9	30.1	-35.3	0	0	0	110.7
442	L	85.6	Confident	76.4	Confident	7 Å²	7	74.7 Å²	74.7	4%	0.037	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-67.8	163	162.9	-66.4	173.8	0	0	0	110.3	F417 L422 S425 N444 L447 A470	F417-L442 HydrophobicContact CD1-CD2 3.94Å; F417-L442 HydrophobicContact CD2-CD1 4.41Å; F417-L442 HydrophobicContact CD2-CD2 4.16Å; F417-L442 HydrophobicContact CE1-CB 4.31Å; F417-L442 HydrophobicContact CE1-CD2 4.05Å; F417-L442 HydrophobicContact CE2-CB 4.31Å; F417-L442 HydrophobicContact CE2-CD1 4.21Å; F417-L442 HydrophobicContact CE2-CD2 4.26Å; F417-L442 HydrophobicContact CG-CD2 3.99Å; F417-L442 HydrophobicContact CZ-CB 3.91Å; F417-L442 HydrophobicContact CZ-CD2 4.2Å; F417-L442 HydrophobicContact CZ-CG 4.47Å; L422-L442 HydrophobicContact CD2-CD1 4.48Å; L422-L442 HydrophobicContact CD2-CD2 4.25Å; S425-L442 VanDerWaalsContact CB-CD2 3.49Å; L442-N444 PolarHBondContact O-N 3.36Å; L442-L447 HydrophobicContact CB-CD1 4.03Å; L442-L447 HydrophobicContact CB-CG 4.33Å; L442-L447 HydrophobicContact CD1-CD2 4.26Å; L442-A470 HydrophobicContact CD1-CB 4.44Å
443	D	88.2	Confident	78.6	Confident	72 Å²	72	72 Å²	72	39%	0.385	38%	0.383	S	S	.	.			trans	-69.3	114.1	177.1	-171.4	-18.4	0	0	0	110.7	F417 R445 V446 L447	F417-D443 HydrophobicContact CE1-CB 4.29Å; F417-D443 HydrophobicContact CZ-CB 4.43Å; D443-R445 PolarHBondContact O-N 2.96Å; D443-R445 WeakPolarHBondContact OD1-CB 3.43Å; D443-R445 PolarHBondContact OD1-N 3.38Å; D443-V446 HydrophobicContact CB-CB 4.32Å; D443-V446 HydrophobicContact CB-CG2 4.09Å; D443-V446 PolarHBondContact O-N 3.35Å; D443-L447 PolarHBondContact O-N 3Å
444	N	89.2	Confident	80.8	Confident	100 Å²	100	65.8 Å²	65.8	54%	0.535	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-31.7	178.1	-71.9	-14.1	0	0	0	112.8	L442 L447 H448	L442-N444 PolarHBondContact O-N 3.36Å; N444-L447 PolarHBondContact O-N 3.43Å; N444-H448 WeakPolarHBondContact O-CB 3.46Å; N444-H448 PolarHBondContact O-CD2 2.81Å; N444-H448 PolarHBondContact O-N 2.8Å
445	R	90.4	Very high	82.7	Confident	140 Å²	140	63.1 Å²	63.1	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-46.9	177.8	-68.6	166.3	64.5	-152.4	5.1	110.8	S386 V387 D443 H448 A449	S386-R445 PolarHBondContact OG-NH2 3.44Å; V387-R445 HydrophobicContact CG2-CB 4.43Å; D443-R445 PolarHBondContact O-N 2.96Å; D443-R445 WeakPolarHBondContact OD1-CB 3.43Å; D443-R445 PolarHBondContact OD1-N 3.38Å; R445-H448 PolarHBondContact O-N 2.88Å; R445-A449 PolarHBondContact O-N 2.86Å
446	V	92.1	Very high	84.3	Confident	16 Å²	16	64 Å²	64	10%	0.097	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-45.6	175.4	176.5	0	0	0	0	110.5	V387 F416 F417 D443 H448 A449 V450	V387-V446 HydrophobicContact CG1-CG2 4.36Å; V387-V446 HydrophobicContact CG2-CG2 4.38Å; F416-V446 HydrophobicContact CB-CG1 3.53Å; F416-V446 HydrophobicContact CD1-CG1 4.15Å; F416-V446 HydrophobicContact CD2-CG1 3.79Å; F416-V446 HydrophobicContact CG-CG1 3.56Å; F417-V446 HydrophobicContact CE1-CB 4.46Å; F417-V446 HydrophobicContact CE1-CG1 4.35Å; F417-V446 HydrophobicContact CE2-CB 4.39Å; F417-V446 HydrophobicContact CE2-CG1 3.75Å; F417-V446 HydrophobicContact CZ-CB 3.77Å; F417-V446 HydrophobicContact CZ-CG1 3.58Å; F417-V446 HydrophobicContact CZ-CG2 4.46Å; D443-V446 HydrophobicContact CB-CB 4.32Å; D443-V446 HydrophobicContact CB-CG2 4.09Å; D443-V446 PolarHBondContact O-N 3.35Å; V446-H448 PolarHBondContact O-N 3.03Å; V446-A449 PolarHBondContact O-N 2.95Å; V446-V450 HydrophobicContact CG1-CG2 4.27Å; V446-V450 WeakPolarHBondContact O-CB 3.49Å; V446-V450 WeakPolarHBondContact O-CG2 3.42Å; V446-V450 PolarHBondContact O-N 3.48Å
447	L	91.6	Very high	86	Confident	17 Å²	17	61.6 Å²	61.6	9%	0.089	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-42.2	176.3	-69.1	-179.8	0	0	0	112.3	L413 F417 L442 D443 N444 K451 M466	L413-L447 HydrophobicContact CD2-CD2 3.84Å; F417-L447 HydrophobicContact CE2-CD2 4.18Å; L442-L447 HydrophobicContact CB-CD1 4.03Å; L442-L447 HydrophobicContact CB-CG 4.33Å; L442-L447 HydrophobicContact CD1-CD2 4.26Å; D443-L447 PolarHBondContact O-N 3Å; N444-L447 PolarHBondContact O-N 3.43Å; L447-K451 WeakPolarHBondContact O-CB 3.29Å; L447-K451 PolarHBondContact O-N 2.97Å; L447-M466 HydrophobicContact CB-CE 4.36Å
448	H	91.5	Very high	87.5	Confident	111 Å²	111	56.3 Å²	56.3	51%	0.514	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-40.8	176.7	-78.5	-61	0	0	0	112.8	N444 R445 V446 K451 F452	N444-H448 WeakPolarHBondContact O-CB 3.46Å; N444-H448 PolarHBondContact O-CD2 2.81Å; N444-H448 PolarHBondContact O-N 2.8Å; R445-H448 PolarHBondContact O-N 2.88Å; V446-H448 PolarHBondContact O-N 3.03Å; H448-K451 WeakPolarHBondContact O-CB 3.23Å; H448-K451 PolarHBondContact O-N 3.01Å; H448-F452 PolarHBondContact O-N 3.38Å
449	A	93.9	Very high	88.7	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-47.9	176	0	0	0	0	0	111.7	L381 V382 T385 V387 R445 V446 K451 F452 Y453	L381-A449 HydrophobicContact CD2-CB 4.1Å; V382-A449 WeakPolarHBondContact CG2-O 3.41Å; T385-A449 HydrophobicContact CG2-CB 4.01Å; V387-A449 HydrophobicContact CB-CB 3.78Å; V387-A449 HydrophobicContact CG1-CB 4.05Å; V387-A449 HydrophobicContact CG2-CB 3.78Å; R445-A449 PolarHBondContact O-N 2.86Å; V446-A449 PolarHBondContact O-N 2.95Å; A449-K451 PolarHBondContact O-N 3.24Å; A449-F452 PolarHBondContact O-N 3.39Å; A449-Y453 WeakPolarHBondContact O-CB 3.26Å; A449-Y453 PolarHBondContact O-N 2.88Å
450	V	94	Very high	89.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-39	177.3	173.1	0	0	0	0	111.5	L381 L409 L412 L413 F416 V446 Y453 C454	L381-V450 HydrophobicContact CD2-CG2 3.79Å; L409-V450 HydrophobicContact CD1-CG1 3.5Å; L409-V450 VanDerWaalsContact CD1-CG1 3.5Å; L412-V450 HydrophobicContact CB-CG1 3.98Å; L412-V450 HydrophobicContact CB-CG2 4.29Å; L412-V450 HydrophobicContact CD1-CG1 4.26Å; L413-V450 HydrophobicContact CD2-CG1 4.26Å; L413-V450 HydrophobicContact CG-CG1 4.4Å; F416-V450 HydrophobicContact CD2-CG2 3.82Å; F416-V450 HydrophobicContact CE2-CG2 3.76Å; V446-V450 HydrophobicContact CG1-CG2 4.27Å; V446-V450 WeakPolarHBondContact O-CB 3.49Å; V446-V450 WeakPolarHBondContact O-CG2 3.42Å; V446-V450 PolarHBondContact O-N 3.48Å; V450-Y453 PolarHBondContact O-N 3.47Å; V450-C454 WeakPolarHBondContact O-CB 3.45Å; V450-C454 PolarHBondContact O-N 2.87Å
451	K	92.6	Very high	90.1	Very high	36 Å²	36	50.1 Å²	50.1	16%	0.157	26%	0.263	C	S	.	.	H	α-helix	trans	-54.4	-58.2	172.5	179.9	-172.9	174.3	178	0	110.9	L447 H448 A449 Y453 C454 Q455 E463 M466	L447-K451 WeakPolarHBondContact O-CB 3.29Å; L447-K451 PolarHBondContact O-N 2.97Å; H448-K451 WeakPolarHBondContact O-CB 3.23Å; H448-K451 PolarHBondContact O-N 3.01Å; A449-K451 PolarHBondContact O-N 3.24Å; K451-Y453 VanDerWaalsContact C-N 3.3Å; K451-Y453 PolarHBondContact O-N 3.31Å; K451-C454 PolarHBondContact O-N 3.3Å; K451-Q455 WeakPolarHBondContact O-CG 3.26Å; K451-Q455 PolarHBondContact O-N 2.91Å; K451-E463 WeakPolarHBondContact CD-OE1 3.4Å; K451-E463 WeakPolarHBondContact CE-OE1 3.42Å; K451-E463 IonicContact NZ-OE1 2.7Å; K451-E463 PolarHBondContact NZ-OE1 3.28Å; K451-E463 IonicContact NZ-OE2 3.48Å; K451-E463 PolarHBondContact NZ-OE2 3.06Å; K451-M466 HydrophobicContact CB-CE 4.13Å; K451-M466 HydrophobicContact CB-SD 3.62Å; K451-M466 HydrophobicContact CD-CE 4.47Å; K451-M466 HydrophobicContact CG-CE 4.45Å; K451-M466 HydrophobicContact CG-SD 4.24Å
452	F	91.9	Very high	90.5	Very high	103 Å²	103	52.7 Å²	52.7	45%	0.452	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-38.6	-175.9	-167.1	-91.8	0	0	0	111.4	V382 H448 A449 C454 Q455 N456	V382-F452 HydrophobicContact CB-CD1 4.33Å; V382-F452 HydrophobicContact CG1-CB 4.5Å; V382-F452 HydrophobicContact CG1-CD1 3.37Å; V382-F452 HydrophobicContact CG1-CE1 3.83Å; V382-F452 HydrophobicContact CG1-CG 4.19Å; V382-F452 HydrophobicContact CG2-CB 4.33Å; V382-F452 HydrophobicContact CG2-CD1 3.96Å; H448-F452 PolarHBondContact O-N 3.38Å; A449-F452 PolarHBondContact O-N 3.39Å; F452-C454 PolarHBondContact O-N 2.77Å; F452-Q455 PolarHBondContact O-N 3.33Å; F452-N456 WeakPolarHBondContact CD1-ND2 3.5Å; F452-N456 VanDerWaalsContact CE1-ND2 3.33Å; F452-N456 WeakPolarHBondContact CE1-ND2 3.35Å; F452-N456 PolarHBondContact O-N 3.46Å
453	Y	93.9	Very high	90.6	Very high	7 Å²	7	56.1 Å²	56.1	3%	0.027	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-48.9	173.4	-163.7	-84.8	0	0	0	112.6	C365 H366 L381 V382 L394 H398 L408 L412 A449 V450 K451 Q455 N456 F457	C365-Y453 WeakPolarHBondContact CB-OH 3.31Å; C365-Y453 PolarHBondContact SG-OH 3.06Å; H366-Y453 HydrophobicContact CB-CE2 4.17Å; H366-Y453 PolarHBondContact N-OH 3.26Å; L381-Y453 HydrophobicContact CD1-CD1 4.47Å; L381-Y453 HydrophobicContact CD1-CD2 3.59Å; L381-Y453 HydrophobicContact CD1-CE2 3.94Å; L381-Y453 HydrophobicContact CD1-CG 3.88Å; L381-Y453 HydrophobicContact CG-CD2 3.74Å; L381-Y453 HydrophobicContact CG-CE2 4.49Å; L381-Y453 HydrophobicContact CG-CG 4.06Å; L381-Y453 WeakPolarHBondContact O-CD2 3.49Å; V382-Y453 HydrophobicContact CG2-CD2 4.08Å; L394-Y453 HydrophobicContact CD1-CE1 4.38Å; L394-Y453 HydrophobicContact CD2-CE2 4.49Å; H398-Y453 AromaticContact CE1-CE1 3.64Å; H398-Y453 PolarHBondContact CE1-OH 2.58Å; H398-Y453 AromaticContact NE2-CE1 3.6Å; H398-Y453 AromaticContact NE2-CZ 3.63Å; H398-Y453 PolarHBondContact NE2-OH 2.86Å; L408-Y453 HydrophobicContact CD2-CE1 4.32Å; L412-Y453 HydrophobicContact CD1-CD1 3.73Å; L412-Y453 HydrophobicContact CD1-CE1 4.4Å; L412-Y453 HydrophobicContact CD1-CG 4.43Å; A449-Y453 WeakPolarHBondContact O-CB 3.26Å; A449-Y453 PolarHBondContact O-N 2.88Å; V450-Y453 PolarHBondContact O-N 3.47Å; K451-Y453 VanDerWaalsContact C-N 3.3Å; K451-Y453 PolarHBondContact O-N 3.31Å; Y453-Q455 VanDerWaalsContact C-N 3.32Å; Y453-Q455 PolarHBondContact O-N 3.36Å; Y453-N456 PolarHBondContact O-N 3.3Å; Y453-F457 PolarHBondContact O-N 3.37Å; Y453-F457 VanDerWaalsContact O-N 3.1Å
454	C	92.7	Very high	90.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68	-28.4	177.5	-73.3	0	0	0	0	113.2	V450 K451 F452 A458 F461	V450-C454 WeakPolarHBondContact O-CB 3.45Å; V450-C454 PolarHBondContact O-N 2.87Å; K451-C454 PolarHBondContact O-N 3.3Å; F452-C454 PolarHBondContact O-N 2.77Å; C454-A458 PolarHBondContact O-N 3.38Å; C454-F461 HydrophobicContact CB-CD1 3.51Å; C454-F461 HydrophobicContact CB-CE1 3.38Å; C454-F461 HydrophobicContact CB-CG 4.22Å; C454-F461 HydrophobicContact CB-CZ 3.97Å
455	Q	91.7	Very high	90.5	Very high	69 Å²	69	53.9 Å²	53.9	32%	0.322	28%	0.275	S	S	.	.	H	α-helix	trans	-70.7	-38.1	173.6	-69.9	-175.5	-69.7	0	0	112.3	K451 F452 Y453 A458 P459 F461	K451-Q455 WeakPolarHBondContact O-CG 3.26Å; K451-Q455 PolarHBondContact O-N 2.91Å; F452-Q455 PolarHBondContact O-N 3.33Å; Y453-Q455 VanDerWaalsContact C-N 3.32Å; Y453-Q455 PolarHBondContact O-N 3.36Å; Q455-A458 CarbonylContact O-C 3.2Å; Q455-P459 VanDerWaalsContact O-CA 3.3Å; Q455-P459 WeakPolarHBondContact O-CA 3.34Å; Q455-F461 HydrophobicContact CG-CD1 3.84Å
456	N	89.9	Confident	90.5	Very high	73 Å²	73	47.5 Å²	47.5	39%	0.39	25%	0.251	S	S	.	.	H	α-helix	trans	-65.3	-43	173.3	-67.3	-16.9	0	0	0	111.4	F452 Y453	F452-N456 WeakPolarHBondContact CD1-ND2 3.5Å; F452-N456 VanDerWaalsContact CE1-ND2 3.33Å; F452-N456 WeakPolarHBondContact CE1-ND2 3.35Å; F452-N456 PolarHBondContact O-N 3.46Å; Y453-N456 PolarHBondContact O-N 3.3Å
457	F	90.1	Very high	90.4	Very high	11 Å²	11	49.5 Å²	49.5	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-44.7	176.1	-178.4	-94.6	0	0	0	112.8	I361 H398 G402 T403 H405 L408 Y453	I361-F457 HydrophobicContact CB-CE2 4.03Å; I361-F457 HydrophobicContact CG2-CE2 3.65Å; I361-F457 HydrophobicContact CG2-CZ 3.94Å; H398-F457 AromaticContact ND1-CE2 3.96Å; G402-F457 WeakPolarHBondContact O-CZ 3.33Å; T403-F457 WeakPolarHBondContact O-CE1 3.06Å; H405-F457 HydrophobicContact CB-CD1 3.79Å; H405-F457 HydrophobicContact CB-CE1 3.86Å; L408-F457 HydrophobicContact CD2-CB 4.01Å; L408-F457 HydrophobicContact CD2-CD1 3.66Å; L408-F457 HydrophobicContact CD2-CD2 3.62Å; L408-F457 HydrophobicContact CD2-CE1 3.98Å; L408-F457 HydrophobicContact CD2-CE2 3.92Å; L408-F457 HydrophobicContact CD2-CG 3.47Å; L408-F457 VanDerWaalsContact CD2-CG 3.47Å; L408-F457 HydrophobicContact CD2-CZ 4.09Å; Y453-F457 PolarHBondContact O-N 3.37Å; Y453-F457 VanDerWaalsContact O-N 3.1Å
458	A	90	Very high	90.3	Very high	11 Å²	11	51.5 Å²	51.5	9%	0.091	28%	0.28	C	S	.	.			trans	-138	96.3	-179.3	0	0	0	0	0	110.7	H405 C454 Q455 S460 F461	H405-A458 HydrophobicContact CB-CB 3.78Å; C454-A458 PolarHBondContact O-N 3.38Å; Q455-A458 CarbonylContact O-C 3.2Å; A458-S460 PolarHBondContact O-N 3.34Å; A458-F461 HydrophobicContact CB-CB 4.4Å; A458-F461 WeakPolarHBondContact O-CB 3.48Å; A458-F461 PolarHBondContact O-N 3.48Å
459	P	86.7	Confident	90.3	Very high	104 Å²	104	46.9 Å²	46.9	68%	0.675	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.8	-176.1	-29.5	37.1	0	0	0	115.9	Q455 F461	Q455-P459 VanDerWaalsContact O-CA 3.3Å; Q455-P459 WeakPolarHBondContact O-CA 3.34Å; P459-F461 VanDerWaalsContact C-N 3.34Å
460	S	85.2	Confident	90.1	Very high	90 Å²	90	46.9 Å²	46.9	63%	0.629	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-9.4	174.4	52.5	0	0	0	0	114.5	A458	A458-S460 PolarHBondContact O-N 3.34Å
461	F	90.9	Very high	89.9	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.018	27%	0.272	C	S	.	.			trans	-66.9	127.1	-175.3	174.2	-115.7	0	0	0	112.8	H405 L409 C454 Q455 A458 P459 E465 M466	H405-F461 AromaticContact CD2-CD2 3.86Å; L409-F461 HydrophobicContact CD1-CZ 4.28Å; L409-F461 HydrophobicContact CD2-CE2 4.02Å; L409-F461 HydrophobicContact CD2-CZ 3.88Å; C454-F461 HydrophobicContact CB-CD1 3.51Å; C454-F461 HydrophobicContact CB-CE1 3.38Å; C454-F461 HydrophobicContact CB-CG 4.22Å; C454-F461 HydrophobicContact CB-CZ 3.97Å; Q455-F461 HydrophobicContact CG-CD1 3.84Å; A458-F461 HydrophobicContact CB-CB 4.4Å; A458-F461 WeakPolarHBondContact O-CB 3.48Å; A458-F461 PolarHBondContact O-N 3.48Å; P459-F461 VanDerWaalsContact C-N 3.34Å; F461-E465 HydrophobicContact CD2-CB 4.46Å; F461-E465 HydrophobicContact CE2-CB 4.17Å; F461-M466 HydrophobicContact CE1-CB 4.32Å; F461-M466 HydrophobicContact CE2-CB 4.47Å; F461-M466 HydrophobicContact CZ-CB 3.67Å; F461-M466 HydrophobicContact CZ-CG 4.24Å
462	K	89	Confident	89.7	Confident	135 Å²	135	50.1 Å²	50.1	59%	0.587	28%	0.282	S	S	*	.			trans	-105.3	143.8	-175.9	-61.4	177.4	-174.9	175.3	0	112.3	S464 E465 M466	K462-S464 PolarHBondContact O-N 3.33Å; K462-E465 HydrophobicContact CB-CG 4.25Å; K462-E465 PolarHBondContact N-OE2 3.1Å; K462-E465 VanDerWaalsContact N-OE2 3.11Å; K462-E465 WeakPolarHBondContact O-CA 3.24Å; K462-E465 WeakPolarHBondContact O-CB 3.48Å; K462-E465 PolarHBondContact O-N 3Å; K462-M466 PolarHBondContact O-N 3.47Å
463	E	86.8	Confident	89.7	Confident	79 Å²	79	46.4 Å²	46.4	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-58.7	-29.9	175.1	179.1	155.8	-127.3	0	0	113.3	K451 E465 M466 N467	K451-E463 WeakPolarHBondContact CD-OE1 3.4Å; K451-E463 WeakPolarHBondContact CE-OE1 3.42Å; K451-E463 IonicContact NZ-OE1 2.7Å; K451-E463 PolarHBondContact NZ-OE1 3.28Å; K451-E463 IonicContact NZ-OE2 3.48Å; K451-E463 PolarHBondContact NZ-OE2 3.06Å; E463-E465 VanDerWaalsContact C-N 3.28Å; E463-E465 PolarHBondContact O-N 3.35Å; E463-M466 WeakPolarHBondContact O-CB 3.36Å; E463-M466 PolarHBondContact O-N 2.9Å; E463-N467 VanDerWaalsContact O-CB 3.29Å; E463-N467 WeakPolarHBondContact O-CB 3.46Å; E463-N467 VanDerWaalsContact O-CG 3.23Å; E463-N467 PolarHBondContact O-N 2.64Å; E463-N467 PolarHBondContact O-ND2 2.78Å
464	S	86.9	Confident	89.5	Confident	79 Å²	79	46 Å²	46	55%	0.552	27%	0.265	S	S	*	.	H	α-helix	trans	-62	-33.8	171.3	49	0	0	0	0	113	K462 A468	K462-S464 PolarHBondContact O-N 3.33Å; S464-A468 WeakPolarHBondContact O-CB 3.43Å; S464-A468 PolarHBondContact O-N 3.08Å
465	E	88.2	Confident	89.2	Confident	47 Å²	47	49.2 Å²	49.2	22%	0.22	29%	0.285	C	S	.	.	H	α-helix	trans	-74.9	-38	175.6	-57.7	-179.8	107.9	0	0	111.4	K406 F461 K462 E463 N467 A468 I469	K406-E465 WeakPolarHBondContact CE-OE1 2.88Å; K406-E465 IonicContact NZ-OE1 3.28Å; K406-E465 PolarHBondContact NZ-OE1 3.26Å; F461-E465 HydrophobicContact CD2-CB 4.46Å; F461-E465 HydrophobicContact CE2-CB 4.17Å; K462-E465 HydrophobicContact CB-CG 4.25Å; K462-E465 PolarHBondContact N-OE2 3.1Å; K462-E465 VanDerWaalsContact N-OE2 3.11Å; K462-E465 WeakPolarHBondContact O-CA 3.24Å; K462-E465 WeakPolarHBondContact O-CB 3.48Å; K462-E465 PolarHBondContact O-N 3Å; E463-E465 VanDerWaalsContact C-N 3.28Å; E463-E465 PolarHBondContact O-N 3.35Å; E465-N467 VanDerWaalsContact C-N 3.35Å; E465-A468 PolarHBondContact O-N 2.79Å; E465-I469 WeakPolarHBondContact O-CB 3.31Å; E465-I469 WeakPolarHBondContact O-CG1 3.12Å; E465-I469 PolarHBondContact O-N 3.46Å
466	M	90.5	Very high	89	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-57	-51.1	170.7	-169.2	-179.9	69.9	0	0	111	L409 L447 K451 F461 K462 E463 A468 I469 A470	L409-M466 HydrophobicContact CD1-CG 4.09Å; L409-M466 HydrophobicContact CD2-CB 4.43Å; L409-M466 HydrophobicContact CD2-CG 4.26Å; L447-M466 HydrophobicContact CB-CE 4.36Å; K451-M466 HydrophobicContact CB-CE 4.13Å; K451-M466 HydrophobicContact CB-SD 3.62Å; K451-M466 HydrophobicContact CD-CE 4.47Å; K451-M466 HydrophobicContact CG-CE 4.45Å; K451-M466 HydrophobicContact CG-SD 4.24Å; F461-M466 HydrophobicContact CE1-CB 4.32Å; F461-M466 HydrophobicContact CE2-CB 4.47Å; F461-M466 HydrophobicContact CZ-CB 3.67Å; F461-M466 HydrophobicContact CZ-CG 4.24Å; K462-M466 PolarHBondContact O-N 3.47Å; E463-M466 WeakPolarHBondContact O-CB 3.36Å; E463-M466 PolarHBondContact O-N 2.9Å; M466-A468 VanDerWaalsContact C-N 3.35Å; M466-A468 PolarHBondContact O-N 2.92Å; M466-I469 PolarHBondContact O-N 3.23Å; M466-A470 WeakPolarHBondContact O-CB 3.5Å; M466-A470 PolarHBondContact O-N 2.69Å
467	N	90.1	Very high	88.9	Confident	59 Å²	59	46.1 Å²	46.1	32%	0.316	27%	0.271	S	S	.	.	H	α-helix	trans	-60.6	-41.6	-179.5	-79	-25.2	0	0	0	112.1	T428 E463 E465 A471	T428-N467 HydrophobicContact CG2-CB 3.58Å; T428-N467 VanDerWaalsContact CG2-O 3.32Å; T428-N467 WeakPolarHBondContact CG2-O 3.31Å; E463-N467 VanDerWaalsContact O-CB 3.29Å; E463-N467 WeakPolarHBondContact O-CB 3.46Å; E463-N467 VanDerWaalsContact O-CG 3.23Å; E463-N467 PolarHBondContact O-N 2.64Å; E463-N467 PolarHBondContact O-ND2 2.78Å; E465-N467 VanDerWaalsContact C-N 3.35Å; N467-A471 VanDerWaalsContact O-CB 3.31Å; N467-A471 WeakPolarHBondContact O-CB 3.5Å; N467-A471 PolarHBondContact O-N 2.89Å; N467-A471 VanDerWaalsContact O-N 3.1Å
468	A	89.8	Confident	88.6	Confident	59 Å²	59	47 Å²	47	49%	0.488	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-45	174.4	0	0	0	0	0	112.4	S464 E465 M466 A471 D472	S464-A468 WeakPolarHBondContact O-CB 3.43Å; S464-A468 PolarHBondContact O-N 3.08Å; E465-A468 PolarHBondContact O-N 2.79Å; M466-A468 VanDerWaalsContact C-N 3.35Å; M466-A468 PolarHBondContact O-N 2.92Å; A468-A471 PolarHBondContact O-N 2.79Å; A468-D472 WeakPolarHBondContact O-CB 3.34Å; A468-D472 PolarHBondContact O-N 2.92Å
469	I	91.1	Very high	88.2	Confident	13 Å²	13	53.9 Å²	53.9	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-70.9	-38.2	-178.1	-70.8	168.2	0	0	0	111.6	K406 L409 R410 E465 M466 D472 M473	K406-I469 HydrophobicContact CB-CD1 4.08Å; K406-I469 HydrophobicContact CD-CD1 4.42Å; K406-I469 HydrophobicContact CG-CD1 4.17Å; L409-I469 HydrophobicContact CD2-CB 3.76Å; L409-I469 HydrophobicContact CD2-CD1 3.77Å; L409-I469 HydrophobicContact CD2-CG1 4.34Å; L409-I469 HydrophobicContact CD2-CG2 3.72Å; L409-I469 HydrophobicContact CG-CG2 4.23Å; R410-I469 HydrophobicContact CG-CG2 3.57Å; E465-I469 WeakPolarHBondContact O-CB 3.31Å; E465-I469 WeakPolarHBondContact O-CG1 3.12Å; E465-I469 PolarHBondContact O-N 3.46Å; M466-I469 PolarHBondContact O-N 3.23Å; I469-D472 PolarHBondContact O-N 2.88Å; I469-M473 HydrophobicContact CG2-CG 4.43Å; I469-M473 HydrophobicContact CG2-SD 4.15Å; I469-M473 WeakPolarHBondContact O-CB 3.36Å; I469-M473 WeakPolarHBondContact O-CG 3.35Å; I469-M473 PolarHBondContact O-N 2.77Å
470	A	90.3	Very high	87.8	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-41.3	173.2	0	0	0	0	0	111.8	L413 G427 L442 M466 M473 C474	L413-A470 HydrophobicContact CD1-CB 4.3Å; G427-A470 WeakPolarHBondContact O-CB 3.41Å; L442-A470 HydrophobicContact CD1-CB 4.44Å; M466-A470 WeakPolarHBondContact O-CB 3.5Å; M466-A470 PolarHBondContact O-N 2.69Å; A470-M473 PolarHBondContact O-N 3.17Å; A470-C474 WeakPolarHBondContact O-CB 3.46Å; A470-C474 PolarHBondContact O-N 3.21Å; A470-C474 PolarHBondContact O-SG 3.28Å
471	A	88.8	Confident	87	Confident	33 Å²	33	50 Å²	50	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-66.5	-39.5	175.3	0	0	0	0	0	113	N467 A468 T475	N467-A471 VanDerWaalsContact O-CB 3.31Å; N467-A471 WeakPolarHBondContact O-CB 3.5Å; N467-A471 PolarHBondContact O-N 2.89Å; N467-A471 VanDerWaalsContact O-N 3.1Å; A468-A471 PolarHBondContact O-N 2.79Å; A471-T475 VanDerWaalsContact O-CB 3.26Å; A471-T475 WeakPolarHBondContact O-CB 3.31Å; A471-T475 PolarHBondContact O-N 2.76Å; A471-T475 PolarHBondContact O-OG1 2.9Å
472	D	89.8	Confident	85.8	Confident	70 Å²	70	57.1 Å²	57.1	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-53.6	171	173.4	42.2	0	0	0	110.9	R410 A468 I469 C474 T475 N476	R410-D472 IonicContact NE-OD2 2.67Å; R410-D472 IonicContact NH2-OD2 2.71Å; R410-D472 PolarHBondContact NH2-OD2 2.85Å; A468-D472 WeakPolarHBondContact O-CB 3.34Å; A468-D472 PolarHBondContact O-N 2.92Å; I469-D472 PolarHBondContact O-N 2.88Å; D472-C474 PolarHBondContact O-N 3.25Å; D472-T475 CarbonylContact O-C 3.56Å; D472-T475 WeakPolarHBondContact O-CA 3.32Å; D472-T475 PolarHBondContact O-N 3.14Å; D472-N476 VanDerWaalsContact O-CB 3.31Å; D472-N476 WeakPolarHBondContact O-CB 3.37Å; D472-N476 PolarHBondContact O-N 3.42Å
473	M	91.1	Very high	83.9	Confident	25 Å²	25	57 Å²	57	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-56.6	-45.2	179.4	-75.2	179.7	68.5	0	0	112.7	R410 L413 A414 L422 I469 A470 T475 N476 A477	R410-M473 HydrophobicContact CB-SD 4.08Å; R410-M473 HydrophobicContact CG-CG 4.42Å; R410-M473 HydrophobicContact CG-SD 3.86Å; R410-M473 WeakPolarHBondContact O-CE 3.38Å; L413-M473 HydrophobicContact CB-CE 3.74Å; L413-M473 HydrophobicContact CB-SD 3.84Å; L413-M473 HydrophobicContact CD1-SD 3.83Å; L413-M473 HydrophobicContact CG-SD 4.5Å; A414-M473 HydrophobicContact CB-CE 4.17Å; L422-M473 HydrophobicContact CD1-CE 3.96Å; I469-M473 HydrophobicContact CG2-CG 4.43Å; I469-M473 HydrophobicContact CG2-SD 4.15Å; I469-M473 WeakPolarHBondContact O-CB 3.36Å; I469-M473 WeakPolarHBondContact O-CG 3.35Å; I469-M473 PolarHBondContact O-N 2.77Å; A470-M473 PolarHBondContact O-N 3.17Å; M473-T475 VanDerWaalsContact C-N 3.31Å; M473-T475 PolarHBondContact O-N 3.22Å; M473-N476 PolarHBondContact O-N 3.43Å; M473-A477 VanDerWaalsContact O-CB 3.29Å; M473-A477 WeakPolarHBondContact O-CB 3.38Å; M473-A477 PolarHBondContact O-N 3.48Å
474	C	89.1	Confident	82.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-37.6	175.9	-64.6	0	0	0	0	112.1	L422 G427 A470 D472 R478	L422-C474 WeakPolarHBondContact O-CA 3.26Å; L422-C474 WeakPolarHBondContact O-CB 3.35Å; L422-C474 PolarHBondContact O-SG 2.9Å; G427-C474 WeakPolarHBondContact CA-SG 3.28Å; A470-C474 WeakPolarHBondContact O-CB 3.46Å; A470-C474 PolarHBondContact O-N 3.21Å; A470-C474 PolarHBondContact O-SG 3.28Å; D472-C474 PolarHBondContact O-N 3.25Å; C474-R478 WeakPolarHBondContact O-CG 3.28Å; C474-R478 VanDerWaalsContact O-CZ 3.28Å; C474-R478 PolarHBondContact O-N 2.85Å; C474-R478 PolarHBondContact O-NE 3.46Å
475	T	87.4	Confident	80	Confident	67 Å²	67	56.4 Å²	56.4	41%	0.411	29%	0.288	S	S	.	.	H	α-helix	trans	-74.5	-37.3	179.8	-60	0	0	0	0	112	A471 D472 M473 R478 R479	A471-T475 VanDerWaalsContact O-CB 3.26Å; A471-T475 WeakPolarHBondContact O-CB 3.31Å; A471-T475 PolarHBondContact O-N 2.76Å; A471-T475 PolarHBondContact O-OG1 2.9Å; D472-T475 CarbonylContact O-C 3.56Å; D472-T475 WeakPolarHBondContact O-CA 3.32Å; D472-T475 PolarHBondContact O-N 3.14Å; M473-T475 VanDerWaalsContact C-N 3.31Å; M473-T475 PolarHBondContact O-N 3.22Å; T475-R478 PolarHBondContact OG1-NH2 3.21Å; T475-R479 WeakPolarHBondContact O-CB 3.38Å; T475-R479 PolarHBondContact O-N 2.96Å
476	N	87.9	Confident	78	Confident	73 Å²	73	59.1 Å²	59.1	39%	0.39	30%	0.303	S	S	.	.	H	α-helix	trans	-64.7	-46.1	171.8	-171.5	-36.7	0	0	0	110.6	D472 M473 R478 R479 V480	D472-N476 VanDerWaalsContact O-CB 3.31Å; D472-N476 WeakPolarHBondContact O-CB 3.37Å; D472-N476 PolarHBondContact O-N 3.42Å; M473-N476 PolarHBondContact O-N 3.43Å; N476-R478 PolarHBondContact O-N 3.36Å; N476-R479 CarbonylContact O-C 3.53Å; N476-R479 PolarHBondContact O-N 2.99Å; N476-V480 WeakPolarHBondContact O-CG2 3.13Å; N476-V480 PolarHBondContact O-N 2.91Å; N476-V480 WeakPolarHBondContact OD1-CG2 3.04Å
477	A	87	Confident	75.6	Confident	3 Å²	3	62.7 Å²	62.7	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-54.6	-53.7	173.1	0	0	0	0	0	111.6	R419 L422 A423 M473 R479 V480 V481	R419-A477 HydrophobicContact CG-CB 4.03Å; L422-A477 HydrophobicContact CB-CB 3.75Å; A423-A477 HydrophobicContact CB-CB 4.11Å; M473-A477 VanDerWaalsContact O-CB 3.29Å; M473-A477 WeakPolarHBondContact O-CB 3.38Å; M473-A477 PolarHBondContact O-N 3.48Å; A477-R479 VanDerWaalsContact C-N 3.3Å; A477-R479 PolarHBondContact O-N 3.1Å; A477-V480 PolarHBondContact O-N 3.3Å; A477-V481 WeakPolarHBondContact O-CG2 3.38Å; A477-V481 PolarHBondContact O-N 3.27Å
478	R	84.4	Confident	73.2	Confident	31 Å²	31	67.1 Å²	67.1	12%	0.117	34%	0.343	C	S	.	.	H	α-helix	trans	-54.8	-43.1	172	-75.7	-177.9	-76.2	-86.9	5.4	112.8	A423 S425 C474 T475 N476 R482	A423-R478 HydrophobicContact CB-CG 4.16Å; A423-R478 WeakPolarHBondContact O-CD 3.48Å; A423-R478 WeakPolarHBondContact O-CG 3.17Å; A423-R478 PolarHBondContact O-NH1 2.93Å; A423-R478 VanDerWaalsContact O-NH1 3.1Å; S425-R478 PolarHBondContact O-NH1 3.3Å; C474-R478 WeakPolarHBondContact O-CG 3.28Å; C474-R478 VanDerWaalsContact O-CZ 3.28Å; C474-R478 PolarHBondContact O-N 2.85Å; C474-R478 PolarHBondContact O-NE 3.46Å; T475-R478 PolarHBondContact OG1-NH2 3.21Å; N476-R478 PolarHBondContact O-N 3.36Å; R478-R482 WeakPolarHBondContact O-CG 3.44Å; R478-R482 PolarHBondContact O-N 2.93Å; R478-R482 VanDerWaalsContact O-N 3.13Å
479	R	80.6	Confident	71.1	Confident	155 Å²	155	68.7 Å²	68.7	59%	0.585	34%	0.343	S	S	*	.	H	α-helix	trans	-69.5	-34.6	-177.1	-160.9	177.7	-140.1	159.1	3.8	111.9	T475 N476 A477 K483	T475-R479 WeakPolarHBondContact O-CB 3.38Å; T475-R479 PolarHBondContact O-N 2.96Å; N476-R479 CarbonylContact O-C 3.53Å; N476-R479 PolarHBondContact O-N 2.99Å; A477-R479 VanDerWaalsContact C-N 3.3Å; A477-R479 PolarHBondContact O-N 3.1Å; R479-K483 HydrophobicContact CG-CD 4.34Å; R479-K483 HydrophobicContact CG-CG 4.45Å; R479-K483 WeakPolarHBondContact O-CA 3.23Å; R479-K483 WeakPolarHBondContact O-CB 3.41Å; R479-K483 VanDerWaalsContact O-CG 3.31Å; R479-K483 WeakPolarHBondContact O-CG 3.49Å; R479-K483 PolarHBondContact O-N 2.92Å
480	V	78.3	Confident	68.7	Low	48 Å²	48	75.5 Å²	75.5	29%	0.291	37%	0.372	S	S	.	.	H	α-helix	trans	-79.5	-37.7	176.9	174.6	0	0	0	0	111.8	N476 A477 R482 K483 S484	N476-V480 WeakPolarHBondContact O-CG2 3.13Å; N476-V480 PolarHBondContact O-N 2.91Å; N476-V480 WeakPolarHBondContact OD1-CG2 3.04Å; A477-V480 PolarHBondContact O-N 3.3Å; V480-R482 VanDerWaalsContact C-N 3.25Å; V480-R482 PolarHBondContact O-N 2.76Å; V480-K483 PolarHBondContact O-N 2.93Å; V480-S484 VanDerWaalsContact O-CB 3.27Å; V480-S484 WeakPolarHBondContact O-CB 3.46Å; V480-S484 PolarHBondContact O-N 3.44Å
481	V	68.8	Low	66.6	Low	64 Å²	64	80.6 Å²	80.6	39%	0.388	40%	0.398	S	S	.	.	H	α-helix	trans	-55.8	-43.7	170.1	170.9	0	0	0	0	110.4	A423 A477	A423-V481 HydrophobicContact CB-CG2 4.25Å; A477-V481 WeakPolarHBondContact O-CG2 3.38Å; A477-V481 PolarHBondContact O-N 3.27Å
482	R	66.1	Low	64.6	Low	153 Å²	153	83 Å²	83	58%	0.577	41%	0.406	S	S	*	.	H	α-helix	trans	-74.3	-38.8	173.9	-62.9	-170.9	-135.1	111	-10.1	114.3	R478 V480 I486	R478-R482 WeakPolarHBondContact O-CG 3.44Å; R478-R482 PolarHBondContact O-N 2.93Å; R478-R482 VanDerWaalsContact O-N 3.13Å; V480-R482 VanDerWaalsContact C-N 3.25Å; V480-R482 PolarHBondContact O-N 2.76Å; R482-I486 WeakPolarHBondContact O-CG1 3.38Å
483	K	50.1	Low	62.7	Low	132 Å²	132	85.6 Å²	85.6	57%	0.574	42%	0.418	S	S	*	.	H	α-helix	trans	-78.2	-19.9	-178.4	-82.8	-168	170.6	-164.8	0	114.2	R479 V480 W485 P487	R479-K483 HydrophobicContact CG-CD 4.34Å; R479-K483 HydrophobicContact CG-CG 4.45Å; R479-K483 WeakPolarHBondContact O-CA 3.23Å; R479-K483 WeakPolarHBondContact O-CB 3.41Å; R479-K483 VanDerWaalsContact O-CG 3.31Å; R479-K483 WeakPolarHBondContact O-CG 3.49Å; R479-K483 PolarHBondContact O-N 2.92Å; V480-K483 PolarHBondContact O-N 2.93Å; K483-W485 PolarHBondContact O-N 3.12Å; K483-P487 WeakPolarHBondContact O-CD 2.82Å
484	S	49.9	Very low	60.5	Low	77 Å²	77	87 Å²	87	54%	0.538	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-23.4	174.5	-167	0	0	0	0	112	V480	V480-S484 VanDerWaalsContact O-CB 3.27Å; V480-S484 WeakPolarHBondContact O-CB 3.46Å; V480-S484 PolarHBondContact O-N 3.44Å
485	W	40.1	Very low	58.2	Low	70 Å²	70	91.7 Å²	91.7	27%	0.265	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-46	178.1	-85.5	67.7	0	0	0	114.1	G106 Q109 M114 K483 K488 L489	G106-W485 WeakPolarHBondContact O-CH2 3.34Å; G106-W485 VanDerWaalsContact O-CZ3 3.24Å; G106-W485 WeakPolarHBondContact O-CZ3 3.38Å; Q109-W485 HydrophobicContact CG-CZ3 4.2Å; M114-W485 HydrophobicContact CB-CZ2 3.93Å; M114-W485 HydrophobicContact CE-CH2 4.21Å; M114-W485 HydrophobicContact CE-CZ2 3.78Å; M114-W485 HydrophobicContact CG-CH2 4.01Å; M114-W485 HydrophobicContact CG-CZ2 3.69Å; K483-W485 PolarHBondContact O-N 3.12Å; W485-K488 PolarHBondContact O-N 3Å; W485-L489 HydrophobicContact CE3-CD1 4.29Å; W485-L489 PolarHBondContact O-N 3.06Å
486	I	46	Very low	56.1	Low	104 Å²	104	91.6 Å²	91.6	53%	0.533	46%	0.46	S	S	.	.	H	α-helix	trans	-67.4	-47.2	-163.1	-64.5	162.7	0	0	0	114	R482 K490	R482-I486 WeakPolarHBondContact O-CG1 3.38Å; I486-K490 PolarHBondContact O-N 2.96Å
487	P	40.2	Very low	54	Low	79 Å²	79	93.7 Å²	93.7	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-33.1	178.6	-18.9	33.6	0	0	0	113	K483 K490 L491	K483-P487 WeakPolarHBondContact O-CD 2.82Å; P487-K490 PolarHBondContact O-N 3.02Å; P487-L491 PolarHBondContact O-N 3.38Å
488	K	40.7	Very low	52	Low	153 Å²	153	96.9 Å²	96.9	67%	0.665	50%	0.498	S	S	*	.	H	α-helix	trans	-65.8	-38.4	176.7	-85.1	-167.6	169.7	-171.7	0	112	W485 L492	W485-K488 PolarHBondContact O-N 3Å; K488-L492 VanDerWaalsContact O-CD1 3.26Å; K488-L492 WeakPolarHBondContact O-CD1 3.37Å; K488-L492 PolarHBondContact O-N 3.46Å
489	L	44.8	Very low	49.9	Very low	91 Å²	91	103.5 Å²	103.5	48%	0.476	52%	0.524	S	S	.	.	H	α-helix	trans	-60	-49.4	168.9	-98.9	77.8	0	0	0	111.3	W485 L491 L492 M493	W485-L489 HydrophobicContact CE3-CD1 4.29Å; W485-L489 PolarHBondContact O-N 3.06Å; L489-L491 PolarHBondContact O-N 3.2Å; L489-L492 PolarHBondContact O-N 3.14Å; L489-M493 VanDerWaalsContact O-CG 3.26Å; L489-M493 WeakPolarHBondContact O-CG 3.26Å; L489-M493 PolarHBondContact O-N 3.02Å
490	K	41.1	Very low	48.2	Very low	157 Å²	157	99.3 Å²	99.3	68%	0.683	52%	0.518	S	S	*	.	H	α-helix	trans	-62.8	-38.2	-177.4	-77	-160.6	168.9	-160.7	0	114.1	I486 P487 M493 A494	I486-K490 PolarHBondContact O-N 2.96Å; P487-K490 PolarHBondContact O-N 3.02Å; K490-M493 PolarHBondContact O-N 3.29Å; K490-A494 PolarHBondContact O-N 2.74Å; K490-A494 VanDerWaalsContact O-N 3.14Å
491	L	45.9	Very low	46.7	Very low	107 Å²	107	100.3 Å²	100.3	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-67.2	-49.2	178.3	-169.9	63.7	0	0	0	111	P487 L489 M493 A494 D495	P487-L491 PolarHBondContact O-N 3.38Å; L489-L491 PolarHBondContact O-N 3.2Å; L491-M493 PolarHBondContact O-N 3.45Å; L491-A494 PolarHBondContact O-N 3.4Å; L491-D495 PolarHBondContact O-N 3.43Å
492	L	46.7	Very low	45.2	Very low	84 Å²	84	105.2 Å²	105.2	44%	0.44	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	-18.6	177.7	-85.3	79.9	0	0	0	113.7	Y103 K488 L489 S496	Y103-L492 HydrophobicContact CD2-CD2 3.85Å; Y103-L492 HydrophobicContact CE2-CD2 3.65Å; K488-L492 VanDerWaalsContact O-CD1 3.26Å; K488-L492 WeakPolarHBondContact O-CD1 3.37Å; K488-L492 PolarHBondContact O-N 3.46Å; L489-L492 PolarHBondContact O-N 3.14Å; L492-S496 WeakPolarHBondContact O-CB 3.3Å; L492-S496 PolarHBondContact O-N 2.89Å
493	M	49.8	Very low	44.2	Very low	125 Å²	125	102.6 Å²	102.6	62%	0.616	55%	0.545	S	S	*	.	H	α-helix	trans	-75.6	-44.8	168.7	-70.3	175.4	84.2	0	0	111.3	L489 K490 L491 D495 S496 D497	L489-M493 VanDerWaalsContact O-CG 3.26Å; L489-M493 WeakPolarHBondContact O-CG 3.26Å; L489-M493 PolarHBondContact O-N 3.02Å; K490-M493 PolarHBondContact O-N 3.29Å; L491-M493 PolarHBondContact O-N 3.45Å; M493-D495 PolarHBondContact O-N 2.9Å; M493-S496 WeakPolarHBondContact O-CB 3.49Å; M493-S496 PolarHBondContact O-N 2.71Å; M493-S496 VanDerWaalsContact O-N 3.12Å; M493-D497 PolarHBondContact O-N 3.02Å; M493-D497 VanDerWaalsContact O-N 3.16Å
494	A	46	Very low	43.8	Very low	54 Å²	54	99.6 Å²	99.6	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-62.8	-40.6	177.6	0	0	0	0	0	112.7	K490 L491 S496 D497 A498	K490-A494 PolarHBondContact O-N 2.74Å; K490-A494 VanDerWaalsContact O-N 3.14Å; L491-A494 PolarHBondContact O-N 3.4Å; A494-S496 PolarHBondContact O-N 3.24Å; A494-D497 PolarHBondContact O-N 3.46Å; A494-A498 PolarHBondContact O-N 3.18Å
495	D	39.5	Very low	43	Very low	98 Å²	98	102 Å²	102	52%	0.524	55%	0.552	S	S	.	*	H	α-helix	trans	-65	-29.7	175.1	-62.1	-32.2	0	0	0	111.9	L491 M493 Y499	L491-D495 PolarHBondContact O-N 3.43Å; M493-D495 PolarHBondContact O-N 2.9Å; D495-Y499 PolarHBondContact O-N 3.3Å
496	S	44.4	Very low	43.1	Very low	65 Å²	65	102.8 Å²	102.8	46%	0.455	57%	0.568	S	S	.	*	H	α-helix	trans	-72.4	-36	177	-170.2	0	0	0	0	112.8	L492 M493 A494 Y499 S500	L492-S496 WeakPolarHBondContact O-CB 3.3Å; L492-S496 PolarHBondContact O-N 2.89Å; M493-S496 WeakPolarHBondContact O-CB 3.49Å; M493-S496 PolarHBondContact O-N 2.71Å; M493-S496 VanDerWaalsContact O-N 3.12Å; A494-S496 PolarHBondContact O-N 3.24Å; S496-Y499 PolarHBondContact O-N 3.16Å; S496-S500 WeakPolarHBondContact O-CB 3.44Å; S496-S500 PolarHBondContact O-N 3.34Å; S496-S500 PolarHBondContact O-OG 2.82Å
497	D	44.6	Very low	42.9	Very low	117 Å²	117	103.1 Å²	103.1	63%	0.626	58%	0.575	S	S	*	*	H	α-helix	trans	-67.3	-40.5	177	-68.6	-28.5	0	0	0	110.8	M493 A494 Y499 S500 A501	M493-D497 PolarHBondContact O-N 3.02Å; M493-D497 VanDerWaalsContact O-N 3.16Å; A494-D497 PolarHBondContact O-N 3.46Å; D497-Y499 PolarHBondContact O-N 3.34Å; D497-S500 WeakPolarHBondContact O-CB 3.3Å; D497-S500 PolarHBondContact O-N 2.69Å; D497-A501 PolarHBondContact O-N 3.45Å
498	A	44.3	Very low	42.7	Very low	70 Å²	70	107.7 Å²	107.7	58%	0.579	59%	0.587	S	S	*	*	H	α-helix	trans	-61.2	-41.4	175.2	0	0	0	0	0	112.6	A494	A494-A498 PolarHBondContact O-N 3.18Å
499	Y	40.7	Very low	42.8	Very low	171 Å²	171	109.1 Å²	109.1	67%	0.671	60%	0.598	S	S	*	*	H	α-helix	trans	-71.2	-31.6	176.9	-143.4	-89.8	0	0	0	112.6	D495 S496 D497 F502 L503	D495-Y499 PolarHBondContact O-N 3.3Å; S496-Y499 PolarHBondContact O-N 3.16Å; D497-Y499 PolarHBondContact O-N 3.34Å; Y499-F502 PolarHBondContact O-N 3.28Å; Y499-L503 HydrophobicContact CD1-CD1 3.94Å; Y499-L503 HydrophobicContact CD1-CG 4.31Å; Y499-L503 HydrophobicContact CE1-CD1 4.2Å; Y499-L503 HydrophobicContact CE1-CG 4.44Å; Y499-L503 PolarHBondContact O-N 3.22Å
500	S	43.4	Very low	42.6	Very low	66 Å²	66	114.1 Å²	114.1	46%	0.462	62%	0.619	S	S	.	*	H	α-helix	trans	-66.2	-36.8	177.8	-59.3	0	0	0	0	112.3	S496 D497 F502 L503 A504	S496-S500 WeakPolarHBondContact O-CB 3.44Å; S496-S500 PolarHBondContact O-N 3.34Å; S496-S500 PolarHBondContact O-OG 2.82Å; D497-S500 WeakPolarHBondContact O-CB 3.3Å; D497-S500 PolarHBondContact O-N 2.69Å; S500-F502 VanDerWaalsContact C-N 3.33Å; S500-F502 PolarHBondContact O-N 3.29Å; S500-L503 PolarHBondContact O-N 3.37Å; S500-A504 PolarHBondContact O-N 3.38Å
501	A	46.8	Very low	42.4	Very low	70 Å²	70	111 Å²	111	58%	0.579	62%	0.622	S	S	*	*	H	α-helix	trans	-63	-36.8	176.2	0	0	0	0	0	113	D497	D497-A501 PolarHBondContact O-N 3.45Å
502	F	39.3	Very low	41.9	Very low	167 Å²	167	113.4 Å²	113.4	73%	0.732	64%	0.635	S	S	*	*	H	α-helix	trans	-74.5	-31.8	-178.3	-147.2	-89.1	0	0	0	112.9	Y499 S500 S506	Y499-F502 PolarHBondContact O-N 3.28Å; S500-F502 VanDerWaalsContact C-N 3.33Å; S500-F502 PolarHBondContact O-N 3.29Å; F502-S506 PolarHBondContact O-OG 3.37Å
503	L	44.7	Very low	41.5	Very low	97 Å²	97	115.5 Å²	115.5	51%	0.508	65%	0.651	S	S	.	*	H	α-helix	trans	-77.4	-28.4	176.8	-68.2	174	0	0	0	113	Y499 S500 D505 S506	Y499-L503 HydrophobicContact CD1-CD1 3.94Å; Y499-L503 HydrophobicContact CD1-CG 4.31Å; Y499-L503 HydrophobicContact CE1-CD1 4.2Å; Y499-L503 HydrophobicContact CE1-CG 4.44Å; Y499-L503 PolarHBondContact O-N 3.22Å; S500-L503 PolarHBondContact O-N 3.37Å; L503-D505 VanDerWaalsContact C-N 3.32Å; L503-D505 PolarHBondContact O-N 3.46Å; L503-S506 PolarHBondContact O-N 3.45Å
504	A	41.8	Very low	40.9	Very low	70 Å²	70	117.9 Å²	117.9	58%	0.579	67%	0.665	S	S	*	*	H	α-helix	trans	-62.2	-35.7	-178.8	0	0	0	0	0	113.5	S500	S500-A504 PolarHBondContact O-N 3.38Å
505	D	33.1	Very low	40.2	Very low	128 Å²	128	118.9 Å²	118.9	68%	0.684	68%	0.681	S	S	*	*	H	α-helix	trans	-77.2	-30.6	179.8	-146.9	35.4	0	0	0	111.9	L503 V507 K508	L503-D505 VanDerWaalsContact C-N 3.32Å; L503-D505 PolarHBondContact O-N 3.46Å; D505-V507 VanDerWaalsContact C-N 3.28Å; D505-V507 PolarHBondContact O-N 3.3Å; D505-K508 PolarHBondContact O-N 3.3Å
506	S	41.4	Very low	39.8	Very low	85 Å²	85	121.4 Å²	121.4	59%	0.594	70%	0.7	S	S	*	*	H	α-helix	trans	-66.2	-25.1	-179.5	-60	0	0	0	0	113.9	F502 L503 K508	F502-S506 PolarHBondContact O-OG 3.37Å; L503-S506 PolarHBondContact O-N 3.45Å; S506-K508 VanDerWaalsContact C-N 3.34Å
507	V	41.3	Very low	39.3	Very low	112 Å²	112	126.7 Å²	126.7	68%	0.679	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-9.3	-176.4	177.6	0	0	0	0	112.2	D505 M509	D505-V507 VanDerWaalsContact C-N 3.28Å; D505-V507 PolarHBondContact O-N 3.3Å; V507-M509 VanDerWaalsContact C-N 3.32Å; V507-M509 PolarHBondContact O-N 3.34Å
508	K	36.6	Very low	38.7	Very low	175 Å²	175	130 Å²	130	76%	0.761	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	8.9	-168.8	-146.1	177	-178.3	-179.4	0	115.4	D505 S506	D505-K508 PolarHBondContact O-N 3.3Å; S506-K508 VanDerWaalsContact C-N 3.34Å
509	M	42.3	Very low	37.8	Very low	182 Å²	182	130 Å²	130	90%	0.897	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	-8.7	-175.6	-111	-179.4	176.5	0	0	116.2	V507	V507-M509 VanDerWaalsContact C-N 3.32Å; V507-M509 PolarHBondContact O-N 3.34Å
510	E	40.3	Very low	37.1	Very low	197 Å²	197	131.4 Å²	131.4	92%	0.921	75%	0.746	S	S	*	*	S	Bend	trans	-124.8	59.9	174	-69.2	-155.2	122.6	0	0	111.5
511	A	36.7	Very low	36.4	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	76%	0.764	S	S	*	*			trans	-141.9	33.3	179.4	0	0	0	0	0	113.3
512	D	35.8	Very low	36.1	Very low	159 Å²	159	136.9 Å²	136.9	85%	0.85	77%	0.765	S	S	*	*			trans	-144.5	85.3	172.6	-166.4	8.3	0	0	0	111.4
513	V	38.3	Very low	35.7	Very low	128 Å²	128	135.3 Å²	135.3	78%	0.776	77%	0.769	S	S	*	*	S	Bend	trans	-175.7	128	156.8	135.9	0	0	0	0	108.4
514	L	36.8	Very low	34.9	Very low	174 Å²	174	136.3 Å²	136.3	91%	0.911	79%	0.785	S	S	*	*			trans	58.1	78.6	174.9	-59.4	178.2	0	0	0	117.7
515	G	31.5	Very low	34.3	Very low	75 Å²	75	141.2 Å²	141.2	77%	0.773	80%	0.8	S	S	*	*			trans	-92.6	154.3	147.9	0	0	0	0	0	111.8
516	V	31.8	Very low	34.2	Very low	151 Å²	151	143.8 Å²	143.8	92%	0.915	81%	0.808	S	S	*	*			trans	-168.2	133.3	141.8	140.6	0	0	0	0	107.1
517	E	34.5	Very low	33.6	Very low	176 Å²	176	144.2 Å²	144.2	82%	0.822	82%	0.817	S	S	*	*			trans	-80	155.7	179.9	-67.9	-162.8	108.2	0	0	113.4
518	Q	30.7	Very low	33.1	Very low	186 Å²	186	145.7 Å²	145.7	87%	0.869	83%	0.826	S	S	*	*			trans	-143.4	99.5	141.4	-108.7	175.1	17.9	0	0	109.9
519	G	27	Very low	32.8	Very low	70 Å²	70	142.2 Å²	142.2	72%	0.722	83%	0.83	S	S	*	*			trans	-70	149.9	164.1	0	0	0	0	0	110.8
520	F	25.9	Very low	32.1	Very low	202 Å²	202	138.7 Å²	138.7	89%	0.886	83%	0.83	S	S	*	*			trans	-129.8	120.4	-176.7	-136.5	-83.4	0	0	0	110
521	D	28.1	Very low	31.7	Very low	156 Å²	156	134.5 Å²	134.5	83%	0.834	83%	0.829	S	S	*	*			trans	-129.8	137.9	174.1	-144.2	2.5	0	0	0	107.4
522	P	39.3	Very low	31.3	Very low	94 Å²	94	133.7 Å²	133.7	61%	0.61	83%	0.829	S	S	*	*			trans	-90.4	170.5	-164.1	35.5	-34.1	0	0	0	113.7
523	T	31.6	Very low	31.1	Very low	134 Å²	134	133 Å²	133	82%	0.822	83%	0.826	S	S	*	*			trans	80.6	92.2	172.2	71.8	0	0	0	0	117.3
524	S	28.6	Very low	30.7	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	83%	0.826	S	S	*	*			trans	-157.9	131.7	142.5	-16.7	0	0	0	0	112.7
525	L	29.2	Very low	30.5	Very low	173 Å²	173	129.9 Å²	129.9	91%	0.906	81%	0.812	S	S	*	*			trans	49.1	139.6	156.1	-95.1	68.8	0	0	0	123.7
526	E	29.6	Very low	30.5	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	82%	0.817	S	S	*	*			trans	-80.7	157.7	157.6	-59.9	162.8	90.5	0	0	111.7
527	A	30.5	Very low	30.6	Very low	95 Å²	95	132.1 Å²	132.1	79%	0.785	81%	0.807	S	S	*	*			trans	65.5	158.3	164.9	0	0	0	0	0	116.5
528	V	30.1	Very low	30.4	Very low	142 Å²	142	129.2 Å²	129.2	86%	0.861	81%	0.806	S	S	*	*			cis	-141.4	137.4	9.3	-178	0	0	0	0	109.4
529	A	29.8	Very low	30.6	Very low	103 Å²	103	126 Å²	126	85%	0.851	81%	0.805	S	S	*	*			trans	-174.4	144.9	147.5	0	0	0	0	0	111
530	A	28.4	Very low	30.9	Very low	107 Å²	107	125.8 Å²	125.8	88%	0.884	80%	0.802	S	S	*	*			trans	-137.9	137.3	177.2	0	0	0	0	0	112.2
531	A	31.7	Very low	31.2	Very low	109 Å²	109	123.4 Å²	123.4	90%	0.901	80%	0.804	S	S	*	*			trans	-169	146.3	160.9	0	0	0	0	0	111.1
532	G	28.5	Very low	31.6	Very low	73 Å²	73	124.1 Å²	124.1	75%	0.753	81%	0.805	S	S	*	*			trans	115.3	63.2	150.2	0	0	0	0	0	120.8
533	N	31.7	Very low	32.2	Very low	146 Å²	146	125.1 Å²	125.1	78%	0.781	81%	0.811	S	S	*	*			trans	55	132.8	145.3	-71	9	0	0	0	123.8
534	N	30.3	Very low	32.4	Very low	146 Å²	146	123 Å²	123	78%	0.781	81%	0.807	S	S	*	*			trans	69.5	142.6	141.7	-63	5.9	0	0	0	119.1
535	S	32.3	Very low	32.4	Very low	89 Å²	89	125.2 Å²	125.2	62%	0.622	81%	0.81	S	S	*	*			cis	-162.8	152.4	-4.9	40.6	0	0	0	0	111.6
536	E	31.5	Very low	32.6	Very low	189 Å²	189	121.2 Å²	121.2	88%	0.883	80%	0.802	S	S	*	*			trans	65.4	146.9	161.4	-68.5	175.8	112.3	0	0	118.4
537	A	32.4	Very low	33	Very low	85 Å²	85	120.8 Å²	120.8	70%	0.702	80%	0.802	S	S	*	*			cis	-161.5	155	-16.8	0	0	0	0	0	112.5
538	S	30.9	Very low	33.9	Very low	114 Å²	114	121.8 Å²	121.8	80%	0.797	80%	0.8	S	S	*	*			trans	67.6	137.3	150	-157.2	0	0	0	0	122
539	S	35.9	Very low	34	Very low	120 Å²	120	118.5 Å²	118.5	84%	0.839	80%	0.795	S	S	*	*			trans	67.2	138.3	167	74.8	0	0	0	0	118.4
540	G	31.7	Very low	34.4	Very low	65 Å²	65	118.8 Å²	118.8	67%	0.67	80%	0.797	S	S	*	*			cis	165.7	139.7	-12.5	0	0	0	0	0	115.1
541	T	33.1	Very low	34.7	Very low	151 Å²	151	117.5 Å²	117.5	93%	0.926	80%	0.795	S	S	*	*			trans	85	138	170.5	-26	0	0	0	0	116.9
542	M	37.1	Very low	35	Very low	171 Å²	171	115.4 Å²	115.4	84%	0.842	78%	0.783	S	S	*	*			trans	-131.2	-178.4	-171.4	-82.5	-84.9	-149.6	0	0	107.5
543	P	51.9	Low	35.5	Very low	116 Å²	116	120.4 Å²	120.4	75%	0.753	79%	0.793	S	S	*	*			cis	-134.3	-162.6	-42.5	39.2	-21.7	0	0	0	112.6
544	A	34.1	Very low	35.7	Very low	89 Å²	89	116.2 Å²	116.2	74%	0.736	78%	0.784	S	S	*	*			trans	-57.5	161.5	175	0	0	0	0	0	118.7
545	D	30.3	Very low	36	Very low	165 Å²	165	114.5 Å²	114.5	88%	0.882	78%	0.784	S	S	*	*			trans	-164.9	153.8	140.3	-109	-25.4	0	0	0	108
546	A	33.7	Very low	36.6	Very low	89 Å²	89	116.2 Å²	116.2	74%	0.736	79%	0.79	S	S	*	*			cis	-153.2	172.6	-7.1	0	0	0	0	0	112.2
547	M	36.6	Very low	37.1	Very low	173 Å²	173	114.8 Å²	114.8	85%	0.852	79%	0.788	S	S	*	*			trans	-63	-173.6	173.4	-70.6	-110	-71.5	0	0	115.4
548	P	50.1	Low	37.5	Very low	116 Å²	116	124.1 Å²	124.1	75%	0.753	81%	0.814	S	S	*	*				-135.2	-165.7	-55.7	41.1	-24.7	0	0	0	111.8
549	G	32.4	Very low	37.8	Very low	73 Å²	73	124.7 Å²	124.7	75%	0.753	81%	0.814	S	S	*	*			trans	-173.2	130.5	165.2	0	0	0	0	0	116.4
550	A	37.4	Very low	37.9	Very low	108 Å²	108	124.9 Å²	124.9	89%	0.893	81%	0.813	S	S	*	*			trans	-40.7	149.7	173.3	0	0	0	0	0	114.9
551	G	35.8	Very low	38.2	Very low	81 Å²	81	128.2 Å²	128.2	84%	0.835	82%	0.821	S	S	*	*			cis	106.6	151	42.8	0	0	0	0	0	108.6
552	G	36.3	Very low	38.5	Very low	64 Å²	64	126.9 Å²	126.9	66%	0.66	82%	0.815	S	S	*	*			cis	-162.4	-172.3	-4.1	0	0	0	0	0	109.5
553	D	39.4	Very low	38.6	Very low	178 Å²	178	124.1 Å²	124.1	95%	0.952	81%	0.813	S	S	*	*			trans	60.9	153.9	172.9	-49.8	-31	0	0	0	116.9
554	G	36.9	Very low	37.7	Very low	58 Å²	58	124.7 Å²	124.7	60%	0.598	82%	0.817	S	S	*	*			cis	155.4	143.2	-5.8	0	0	0	0	0	110.7
555	S	36.7	Very low	38	Very low	111 Å²	111	127.2 Å²	127.2	78%	0.776	82%	0.823	S	S	*	*			trans	59.5	102.1	175.3	28.5	0	0	0	0	116.8
556	T	45	Very low	38.6	Very low	124 Å²	124	124.3 Å²	124.3	76%	0.761	82%	0.818	S	S	*	*				78	124	80.5	59.6	0	0	0	0	116.7
557	L	41.2	Very low	39	Very low	160 Å²	160	127.3 Å²	127.3	84%	0.838	83%	0.825	S	S	*	*			trans	61.8	101.2	147.3	-62.2	166.7	0	0	0	118.9
558	F	40.2	Very low	39.2	Very low	281 Å²	281	123.1 Å²	123.1	100%	1.232	82%	0.823	S	S	*	*				-153.3	0	101.2	-117	-75.5	0	0	0	111.4

Retrieved 558 of 558 residues in 331.7 ms (Link to these results)

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