A0A3Q0KQ73_SCHMA Loading...

C2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQ73, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,154 aa.

						>A0A3Q0KQ73_SCHMA|A0A3Q0KQ73
MEAFIAKIAVYNWTDVKSLFSSTFLNLKVLLKTTNGFVLISTIFLIISVTAYSFQKAWSRELKCRKTTLKTVDYLKHGTSDIERLRRIYKSCSFTASGLCNIWLQKINDCINNSLRETSIHFTPVSEYTLSDVKISDFELRNEDLPGWVALYFTVSIPMLCLHGDVVTIQTESPQKVTLSLKNYHMKMCCMLKVDDLVLLELKMHSESIPQFDLLMDPVIPLSPSKFKQLLIDIISELIVSWSPGGSIHHSKDPSVASIQTDGHSPGQNVLLQREPKDTDSSDSLHNWTDINVKTQLCESDFKDLNRSQSEGHAEAKTAMPGEQSSQSLVQKDKSFTPVVLAHNARLRQSLVARHAPRPFVCKVVRSASCYGEEGTPSLLQERDLGSFESEDVAGANSQDLGCSKIESAVQVRMETISAPSNKSEAISTELAKRKETETSVTESSDHKDLLQEFSHTGPVRKPNTKVDVSPLRERMANNFASKKLLVKVVKAEKLSVKGISGAYCVVELDEPYQRHSTHCSMSGQLFWDQHLLFDLNNNSKRIALEIFELGKRKKSYSRGRAELLLMHLLTNPNSDGDLETNSVNISDTIRRQIPLIDRSGSLLEGTSTSNIVAPPAVQSVSGGNNLSVTNQSISTNTNAAGQPSGNSIASITAEFNFMEKATEDFRARASPSSSQIRFSSRTTQSPSIHNPNQDHQPTDHCCAFSHSASSEFPNAKSTFLTHNKNITEHIMQSVVEHIQTDSGEETDNLSTSKDSDVVRKSSKDTTNEIKVSEILKTGNLSSPISCRRAHYELHTIRSIDEEHLSIPSSPLIYDTTKLSETSSEGHGSSCDLNEHFKESISSNEQQVFQGSSESDGHVKSLTATLVDANSSYGSKIDSKQGDILCKRSALLGSTGANVSNNLESASILLRVDSPVSLDSPSVSSRPHSLASRLKPARILNSSVLRSGKRSTTDEPTGSCSNINSLALLGPSRQLAGVVAGLSSLASDSTTAPSAAALASAMAVVGATGNWQPQLPIDSDTAQLLSGSTVFSDLLSRRDSKLDASNDSPVPPHSNISSFGPPVHFVPPPTYVAADSPGTFTALSQPRRSDASNLSLFRIFRHKKKRFRSVGAEKLVYWETNNLDDLDAISTEGYHRILQDDDCETCDIDQSRNK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	44.5	Very low	146 Å²	146	101.2 Å²	101.2	72%	0.719	56%	0.556	S	S	*	*				0	-71.9	0	-79.3	-61.3	-113.8	0	0	112.1	A3 F4 I5 I46	M1-A3 PolarHBondContact O-N 3.49Å; M1-F4 WeakPolarHBondContact O-CA 3.1Å; M1-F4 VanDerWaalsContact O-CB 3.31Å; M1-F4 WeakPolarHBondContact O-CB 3.36Å; M1-F4 PolarHBondContact O-N 3.45Å; M1-I5 PolarHBondContact O-N 3.22Å; M1-I5 VanDerWaalsContact O-N 3.15Å; M1-I46 HydrophobicContact CE-CD1 4.11Å
2	E	36.2	Very low	45.1	Very low	167 Å²	167	101.7 Å²	101.7	78%	0.78	56%	0.557	S	S	*	*	H	α-helix	trans	-57.1	-45.1	-169.8	-60.4	-177.1	150	0	0	113.9	F4 I5 A6	E2-F4 PolarHBondContact O-N 3.4Å; E2-F4 VanDerWaalsContact O-N 3.1Å; E2-I5 PolarHBondContact O-N 3.32Å; E2-A6 WeakPolarHBondContact O-CB 3.43Å; E2-A6 PolarHBondContact O-N 2.98Å
3	A	42	Very low	45.5	Very low	76 Å²	76	106 Å²	106	63%	0.628	56%	0.56	S	S	*	*	H	α-helix	trans	-64.6	-11.8	175.4	0	0	0	0	0	115.3	M1 K7	M1-A3 PolarHBondContact O-N 3.49Å; A3-K7 VanDerWaalsContact O-CG 3.31Å; A3-K7 WeakPolarHBondContact O-CG 3.48Å
4	F	44.3	Very low	45.8	Very low	83 Å²	83	104.5 Å²	104.5	36%	0.364	56%	0.558	S	S	.	*	H	α-helix	trans	-91	-43.9	172.6	-176.8	-107.5	0	0	0	110.6	M1 E2 A6 K7 I8	M1-F4 WeakPolarHBondContact O-CA 3.1Å; M1-F4 VanDerWaalsContact O-CB 3.31Å; M1-F4 WeakPolarHBondContact O-CB 3.36Å; M1-F4 PolarHBondContact O-N 3.45Å; E2-F4 PolarHBondContact O-N 3.4Å; E2-F4 VanDerWaalsContact O-N 3.1Å; F4-A6 VanDerWaalsContact C-N 3.34Å; F4-A6 PolarHBondContact O-N 3.37Å; F4-K7 WeakPolarHBondContact O-CB 3.44Å; F4-K7 PolarHBondContact O-N 3.47Å; F4-K7 VanDerWaalsContact O-N 3.12Å; F4-I8 HydrophobicContact CD1-CD1 3.88Å; F4-I8 HydrophobicContact CE1-CD1 3.51Å; F4-I8 HydrophobicContact CZ-CD1 3.92Å; F4-I8 PolarHBondContact O-N 3.11Å
5	I	48.6	Very low	46.1	Very low	89 Å²	89	102.3 Å²	102.3	46%	0.456	55%	0.546	S	S	.	.	H	α-helix	trans	-59.6	-45.6	172.7	-61.5	169.1	0	0	0	110.3	M1 E2 K7 I8 A9	M1-I5 PolarHBondContact O-N 3.22Å; M1-I5 VanDerWaalsContact O-N 3.15Å; E2-I5 PolarHBondContact O-N 3.32Å; I5-K7 VanDerWaalsContact C-N 3.26Å; I5-K7 PolarHBondContact O-N 3.25Å; I5-I8 PolarHBondContact O-N 3.45Å; I5-A9 WeakPolarHBondContact O-CB 3.18Å; I5-A9 PolarHBondContact O-N 3.46Å
6	A	46.8	Very low	46.4	Very low	59 Å²	59	96.9 Å²	96.9	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-26.5	176.3	0	0	0	0	0	113.5	E2 F4 V10	E2-A6 WeakPolarHBondContact O-CB 3.43Å; E2-A6 PolarHBondContact O-N 2.98Å; F4-A6 VanDerWaalsContact C-N 3.34Å; F4-A6 PolarHBondContact O-N 3.37Å; A6-V10 WeakPolarHBondContact O-CG2 3.23Å
7	K	46.6	Very low	46.4	Very low	130 Å²	130	98.8 Å²	98.8	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-75.1	-47.1	171.1	-80.5	177	179.1	-175.5	0	111.3	A3 F4 I5 A9 V10 Y11	A3-K7 VanDerWaalsContact O-CG 3.31Å; A3-K7 WeakPolarHBondContact O-CG 3.48Å; F4-K7 WeakPolarHBondContact O-CB 3.44Å; F4-K7 PolarHBondContact O-N 3.47Å; F4-K7 VanDerWaalsContact O-N 3.12Å; I5-K7 VanDerWaalsContact C-N 3.26Å; I5-K7 PolarHBondContact O-N 3.25Å; K7-A9 PolarHBondContact O-N 3.2Å; K7-V10 PolarHBondContact O-N 2.9Å; K7-V10 VanDerWaalsContact O-N 3.08Å; K7-Y11 HydrophobicContact CB-CE2 4.45Å; K7-Y11 WeakPolarHBondContact O-CD2 3.38Å
8	I	46.4	Very low	46.9	Very low	45 Å²	45	97.8 Å²	97.8	23%	0.231	52%	0.523	C	S	.	.	H	α-helix	trans	-57.6	-40.4	177.7	-69.5	171.8	0	0	0	111	F4 I5 V10 Y11	F4-I8 HydrophobicContact CD1-CD1 3.88Å; F4-I8 HydrophobicContact CE1-CD1 3.51Å; F4-I8 HydrophobicContact CZ-CD1 3.92Å; F4-I8 PolarHBondContact O-N 3.11Å; I5-I8 PolarHBondContact O-N 3.45Å; I8-V10 PolarHBondContact O-N 2.92Å; I8-V10 VanDerWaalsContact O-N 3.11Å; I8-Y11 PolarHBondContact O-N 3.34Å
9	A	46.6	Very low	47.3	Very low	87 Å²	87	95.7 Å²	95.7	72%	0.719	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-8.7	178.5	0	0	0	0	0	115.5	I5 K7	I5-A9 WeakPolarHBondContact O-CB 3.18Å; I5-A9 PolarHBondContact O-N 3.46Å; K7-A9 PolarHBondContact O-N 3.2Å
10	V	50.2	Low	47.5	Very low	120 Å²	120	93.9 Å²	93.9	73%	0.727	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-16.3	-177.3	172	0	0	0	0	112.7	A6 K7 I8	A6-V10 WeakPolarHBondContact O-CG2 3.23Å; K7-V10 PolarHBondContact O-N 2.9Å; K7-V10 VanDerWaalsContact O-N 3.08Å; I8-V10 PolarHBondContact O-N 2.92Å; I8-V10 VanDerWaalsContact O-N 3.11Å
11	Y	44.1	Very low	47.8	Very low	111 Å²	111	93.2 Å²	93.2	44%	0.435	50%	0.502	S	S	.	.	S	Bend	trans	-91.4	143.8	-175.1	-80.7	-65.2	0	0	0	113.9	K7 I8 D15	K7-Y11 HydrophobicContact CB-CE2 4.45Å; K7-Y11 WeakPolarHBondContact O-CD2 3.38Å; I8-Y11 PolarHBondContact O-N 3.34Å; Y11-D15 HydrophobicContact CD1-CB 3.61Å; Y11-D15 HydrophobicContact CE1-CB 4.42Å; Y11-D15 HydrophobicContact CG-CB 4.18Å
12	N	51.5	Low	48.5	Very low	107 Å²	107	89.7 Å²	89.7	57%	0.572	49%	0.492	S	S	*	.			trans	-68.5	153.2	169.4	-167.4	0.3	0	0	0	110.2	T14 D15 V16	N12-T14 PolarHBondContact O-N 2.77Å; N12-T14 VanDerWaalsContact O-N 3.11Å; N12-D15 WeakPolarHBondContact O-CA 3.49Å; N12-D15 WeakPolarHBondContact O-CB 3.01Å; N12-D15 PolarHBondContact O-N 3.29Å; N12-V16 WeakPolarHBondContact O-CG2 3.2Å; N12-V16 PolarHBondContact O-N 3.13Å
13	W	51	Low	49.3	Very low	158 Å²	158	84.3 Å²	84.3	60%	0.598	47%	0.47	S	S	*	.	H	α-helix	trans	-57.3	-31.3	-175	179.5	-116.7	0	0	0	113.7	V16 K17	W13-V16 HydrophobicContact CE3-CG1 4.44Å; W13-K17 PolarHBondContact O-N 2.97Å
14	T	48.7	Very low	49.8	Very low	85 Å²	85	86.1 Å²	86.1	52%	0.521	46%	0.464	S	S	.	.	H	α-helix	trans	-61.8	-44.9	171.6	49.4	0	0	0	0	112.3	N12 K17 S18	N12-T14 PolarHBondContact O-N 2.77Å; N12-T14 VanDerWaalsContact O-N 3.11Å; T14-K17 PolarHBondContact O-N 3.05Å; T14-S18 PolarHBondContact O-N 3.06Å
15	D	51.1	Low	50.1	Low	72 Å²	72	88.3 Å²	88.3	39%	0.385	48%	0.479	S	S	.	.	H	α-helix	trans	-75.9	-36.3	-176.5	-49.6	-18.5	0	0	0	109.7	Y11 N12 K17 S18 L19	Y11-D15 HydrophobicContact CD1-CB 3.61Å; Y11-D15 HydrophobicContact CE1-CB 4.42Å; Y11-D15 HydrophobicContact CG-CB 4.18Å; N12-D15 WeakPolarHBondContact O-CA 3.49Å; N12-D15 WeakPolarHBondContact O-CB 3.01Å; N12-D15 PolarHBondContact O-N 3.29Å; D15-K17 PolarHBondContact O-N 2.75Å; D15-S18 WeakPolarHBondContact O-CB 3.1Å; D15-S18 PolarHBondContact O-N 3.49Å; D15-L19 WeakPolarHBondContact O-CB 3.29Å; D15-L19 PolarHBondContact O-N 3.07Å
16	V	49.9	Very low	50.1	Low	16 Å²	16	89.5 Å²	89.5	10%	0.097	49%	0.486	C	S	.	.	H	α-helix	trans	-57.8	-45.9	170.3	173.5	0	0	0	0	110.7	N12 W13 S18 L19 F20	N12-V16 WeakPolarHBondContact O-CG2 3.2Å; N12-V16 PolarHBondContact O-N 3.13Å; W13-V16 HydrophobicContact CE3-CG1 4.44Å; V16-S18 PolarHBondContact O-N 3.29Å; V16-L19 PolarHBondContact O-N 3.5Å; V16-F20 HydrophobicContact CG1-CD2 3.67Å; V16-F20 HydrophobicContact CG1-CE2 3.52Å; V16-F20 WeakPolarHBondContact O-CD2 3.42Å; V16-F20 PolarHBondContact O-N 2.75Å
17	K	47.6	Very low	50.2	Low	128 Å²	128	88.2 Å²	88.2	56%	0.557	47%	0.471	S	S	*	.	H	α-helix	trans	-62.9	-39.5	174	-79.7	-169.7	172.3	-168.7	0	113.1	W13 T14 D15 F20 S21	W13-K17 PolarHBondContact O-N 2.97Å; T14-K17 PolarHBondContact O-N 3.05Å; D15-K17 PolarHBondContact O-N 2.75Å; K17-F20 PolarHBondContact O-N 2.79Å; K17-S21 PolarHBondContact O-N 3.17Å
18	S	54.4	Low	50.2	Low	81 Å²	81	89.5 Å²	89.5	57%	0.566	48%	0.477	S	S	*	.	H	α-helix	trans	-63	-46.1	174.7	-173.7	0	0	0	0	111.6	T14 D15 V16 F20 S21 S22	T14-S18 PolarHBondContact O-N 3.06Å; D15-S18 WeakPolarHBondContact O-CB 3.1Å; D15-S18 PolarHBondContact O-N 3.49Å; V16-S18 PolarHBondContact O-N 3.29Å; S18-F20 VanDerWaalsContact C-N 3.32Å; S18-F20 PolarHBondContact O-N 2.83Å; S18-S21 PolarHBondContact O-N 2.79Å; S18-S22 WeakPolarHBondContact O-CB 3.05Å; S18-S22 PolarHBondContact O-N 3.47Å
19	L	54	Low	50.3	Low	59 Å²	59	92.9 Å²	92.9	31%	0.309	50%	0.499	S	S	.	.	H	α-helix	trans	-60.9	-39.5	175.6	-140.6	81.6	0	0	0	111.7	D15 V16 T23	D15-L19 WeakPolarHBondContact O-CB 3.29Å; D15-L19 PolarHBondContact O-N 3.07Å; V16-L19 PolarHBondContact O-N 3.5Å; L19-T23 WeakPolarHBondContact O-CB 3.34Å; L19-T23 VanDerWaalsContact O-CG2 3.3Å; L19-T23 WeakPolarHBondContact O-CG2 3.41Å; L19-T23 PolarHBondContact O-N 3.08Å; L19-T23 PolarHBondContact O-OG1 3.08Å
20	F	52.6	Low	50.4	Low	59 Å²	59	92.2 Å²	92.2	26%	0.259	48%	0.483	S	S	.	.	H	α-helix	trans	-64.3	-48.7	173.6	-86.3	-58.4	0	0	0	112.5	V16 K17 S18 S22 T23 F24 I47	V16-F20 HydrophobicContact CG1-CD2 3.67Å; V16-F20 HydrophobicContact CG1-CE2 3.52Å; V16-F20 WeakPolarHBondContact O-CD2 3.42Å; V16-F20 PolarHBondContact O-N 2.75Å; K17-F20 PolarHBondContact O-N 2.79Å; S18-F20 VanDerWaalsContact C-N 3.32Å; S18-F20 PolarHBondContact O-N 2.83Å; F20-S22 VanDerWaalsContact C-N 3.34Å; F20-S22 PolarHBondContact O-N 3.14Å; F20-T23 WeakPolarHBondContact CA-OG1 3.28Å; F20-T23 PolarHBondContact O-N 2.85Å; F20-T23 PolarHBondContact O-OG1 3.1Å; F20-F24 VanDerWaalsContact O-CB 3.23Å; F20-F24 WeakPolarHBondContact O-CB 3.49Å; F20-F24 PolarHBondContact O-N 2.82Å; F20-I47 HydrophobicContact CD1-CD1 4.41Å; F20-I47 HydrophobicContact CE1-CD1 3.39Å; F20-I47 HydrophobicContact CE1-CG1 4.23Å; F20-I47 HydrophobicContact CE2-CD1 4.25Å; F20-I47 HydrophobicContact CE2-CG1 4.4Å; F20-I47 HydrophobicContact CZ-CD1 3.3Å; F20-I47 HydrophobicContact CZ-CG1 3.63Å
21	S	53.7	Low	50.4	Low	80 Å²	80	90.2 Å²	90.2	56%	0.559	47%	0.468	S	S	*	.	H	α-helix	trans	-58.2	-46.1	177.1	-173.2	0	0	0	0	112	K17 S18 F24 L25	K17-S21 PolarHBondContact O-N 3.17Å; S18-S21 PolarHBondContact O-N 2.79Å; S21-F24 PolarHBondContact O-N 3.36Å; S21-L25 PolarHBondContact O-N 3.42Å
22	S	52.1	Low	50.8	Low	72 Å²	72	93.8 Å²	93.8	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-40.5	177	-177.4	0	0	0	0	113.3	S18 F20 N26	S18-S22 WeakPolarHBondContact O-CB 3.05Å; S18-S22 PolarHBondContact O-N 3.47Å; F20-S22 VanDerWaalsContact C-N 3.34Å; F20-S22 PolarHBondContact O-N 3.14Å; S22-N26 PolarHBondContact O-ND2 2.86Å
23	T	53.8	Low	50.8	Low	54 Å²	54	92.1 Å²	92.1	33%	0.331	48%	0.479	S	S	.	.	H	α-helix	trans	-77.4	-32.4	178.4	51.4	0	0	0	0	112.6	L19 F20 L25 N26 L27	L19-T23 WeakPolarHBondContact O-CB 3.34Å; L19-T23 VanDerWaalsContact O-CG2 3.3Å; L19-T23 WeakPolarHBondContact O-CG2 3.41Å; L19-T23 PolarHBondContact O-N 3.08Å; L19-T23 PolarHBondContact O-OG1 3.08Å; F20-T23 WeakPolarHBondContact CA-OG1 3.28Å; F20-T23 PolarHBondContact O-N 2.85Å; F20-T23 PolarHBondContact O-OG1 3.1Å; T23-L25 VanDerWaalsContact C-N 3.32Å; T23-L25 PolarHBondContact O-N 3.19Å; T23-N26 CarbonylContact O-C 3.54Å; T23-N26 WeakPolarHBondContact O-CA 3.48Å; T23-N26 WeakPolarHBondContact O-CB 3.4Å; T23-N26 PolarHBondContact O-N 3.42Å; T23-L27 WeakPolarHBondContact O-CB 3.41Å; T23-L27 PolarHBondContact O-N 3.39Å
24	F	51.9	Low	51	Low	114 Å²	114	87.1 Å²	87.1	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-64.1	-35.8	178.9	-153.9	-98	0	0	0	112.4	F20 S21 N26 L27 K28	F20-F24 VanDerWaalsContact O-CB 3.23Å; F20-F24 WeakPolarHBondContact O-CB 3.49Å; F20-F24 PolarHBondContact O-N 2.82Å; S21-F24 PolarHBondContact O-N 3.36Å; F24-N26 VanDerWaalsContact C-N 3.3Å; F24-N26 PolarHBondContact O-N 3.37Å; F24-L27 HydrophobicContact CD2-CD2 4.16Å; F24-L27 WeakPolarHBondContact O-CB 3.28Å; F24-L27 PolarHBondContact O-N 2.79Å; F24-K28 PolarHBondContact O-N 3.3Å
25	L	49.7	Very low	51.3	Low	128 Å²	128	89.1 Å²	89.1	67%	0.67	47%	0.473	S	S	*	.	H	α-helix	trans	-59.8	-37.3	170.2	-83.2	162	0	0	0	113	S21 T23	S21-L25 PolarHBondContact O-N 3.42Å; T23-L25 VanDerWaalsContact C-N 3.32Å; T23-L25 PolarHBondContact O-N 3.19Å
26	N	48.9	Very low	51.2	Low	115 Å²	115	85.8 Å²	85.8	62%	0.615	46%	0.456	S	S	*	.	H	α-helix	trans	-78.7	-32.5	173.9	-71.4	-86.3	0	0	0	111.9	S22 T23 F24 K28 V29	S22-N26 PolarHBondContact O-ND2 2.86Å; T23-N26 CarbonylContact O-C 3.54Å; T23-N26 WeakPolarHBondContact O-CA 3.48Å; T23-N26 WeakPolarHBondContact O-CB 3.4Å; T23-N26 PolarHBondContact O-N 3.42Å; F24-N26 VanDerWaalsContact C-N 3.3Å; F24-N26 PolarHBondContact O-N 3.37Å; N26-K28 VanDerWaalsContact C-N 3.26Å; N26-K28 PolarHBondContact O-N 3.05Å; N26-V29 WeakPolarHBondContact O-CB 3.23Å; N26-V29 PolarHBondContact O-N 3.09Å
27	L	49.3	Very low	51.1	Low	32 Å²	32	88.2 Å²	88.2	17%	0.168	47%	0.466	C	S	.	.	H	α-helix	trans	-65.1	-28.5	-178.5	-158.5	63.2	0	0	0	112.2	T23 F24 V29 L30 L31 I40	T23-L27 WeakPolarHBondContact O-CB 3.41Å; T23-L27 PolarHBondContact O-N 3.39Å; F24-L27 HydrophobicContact CD2-CD2 4.16Å; F24-L27 WeakPolarHBondContact O-CB 3.28Å; F24-L27 PolarHBondContact O-N 2.79Å; L27-V29 PolarHBondContact O-N 3.41Å; L27-V29 VanDerWaalsContact O-N 3.1Å; L27-L30 HydrophobicContact CD1-CB 4.22Å; L27-L30 HydrophobicContact CD1-CD2 3.87Å; L27-L30 WeakPolarHBondContact O-CA 3.5Å; L27-L30 WeakPolarHBondContact O-CB 3.49Å; L27-L30 PolarHBondContact O-N 3.23Å; L27-L31 HydrophobicContact CG-CD1 4.33Å; L27-L31 VanDerWaalsContact O-CD1 3.24Å; L27-L31 WeakPolarHBondContact O-CD1 3.18Å; L27-L31 PolarHBondContact O-N 2.9Å; L27-L31 VanDerWaalsContact O-N 3.1Å; L27-I40 HydrophobicContact CD1-CG1 4.36Å; L27-I40 HydrophobicContact CD2-CD1 4.45Å; L27-I40 HydrophobicContact CD2-CG1 4.07Å; L27-I40 HydrophobicContact CG-CD1 4.29Å; L27-I40 HydrophobicContact CG-CG1 4.23Å
28	K	47.6	Very low	51.5	Low	157 Å²	157	85 Å²	85	68%	0.683	46%	0.457	S	S	*	.	H	α-helix	trans	-53.1	-26.3	169.4	-94.6	-170.2	172.5	-175.7	0	114.2	F24 N26	F24-K28 PolarHBondContact O-N 3.3Å; N26-K28 VanDerWaalsContact C-N 3.26Å; N26-K28 PolarHBondContact O-N 3.05Å
29	V	48.4	Very low	51.5	Low	115 Å²	115	84.7 Å²	84.7	70%	0.697	45%	0.448	S	S	*	.	H	α-helix	trans	-76.1	-32.2	173.9	-174.3	0	0	0	0	111.3	N26 L27	N26-V29 WeakPolarHBondContact O-CB 3.23Å; N26-V29 PolarHBondContact O-N 3.09Å; L27-V29 PolarHBondContact O-N 3.41Å; L27-V29 VanDerWaalsContact O-N 3.1Å
30	L	47.9	Very low	51.6	Low	74 Å²	74	83.4 Å²	83.4	39%	0.387	44%	0.441	S	S	.	.	H	α-helix	trans	-81.7	-27.5	-175.7	-149.6	71.7	0	0	0	113.4	L27 K32 T33 L39	L27-L30 HydrophobicContact CD1-CB 4.22Å; L27-L30 HydrophobicContact CD1-CD2 3.87Å; L27-L30 WeakPolarHBondContact O-CA 3.5Å; L27-L30 WeakPolarHBondContact O-CB 3.49Å; L27-L30 PolarHBondContact O-N 3.23Å; L30-K32 PolarHBondContact O-N 3.41Å; L30-K32 VanDerWaalsContact O-N 3.08Å; L30-T33 PolarHBondContact O-N 3.4Å; L30-T33 PolarHBondContact O-OG1 2.88Å; L30-L39 HydrophobicContact CD2-CD2 3.49Å; L30-L39 VanDerWaalsContact CD2-CD2 3.49Å
31	L	51.4	Low	51.8	Low	78 Å²	78	82.2 Å²	82.2	41%	0.408	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-18.6	174.3	-94.2	93.6	0	0	0	113.9	L27 T33 I40	L27-L31 HydrophobicContact CG-CD1 4.33Å; L27-L31 VanDerWaalsContact O-CD1 3.24Å; L27-L31 WeakPolarHBondContact O-CD1 3.18Å; L27-L31 PolarHBondContact O-N 2.9Å; L27-L31 VanDerWaalsContact O-N 3.1Å; L31-T33 PolarHBondContact O-N 3.47Å; L31-I40 HydrophobicContact CD1-CD1 3.37Å; L31-I40 HydrophobicContact CD2-CD1 4.46Å; L31-I40 HydrophobicContact CG-CD1 3.55Å
32	K	50.7	Low	51.9	Low	186 Å²	186	79.5 Å²	79.5	81%	0.809	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	1.9	176.9	-79.8	-166.9	172.1	-171.7	0	114.8	L30	L30-K32 PolarHBondContact O-N 3.41Å; L30-K32 VanDerWaalsContact O-N 3.08Å
33	T	52.9	Low	52.2	Low	71 Å²	71	78.3 Å²	78.3	44%	0.436	41%	0.408	S	S	.	.	S	Bend	trans	-117	143.1	177.6	64	0	0	0	0	110.6	L30 L31 N35 G36	L30-T33 PolarHBondContact O-N 3.4Å; L30-T33 PolarHBondContact O-OG1 2.88Å; L31-T33 PolarHBondContact O-N 3.47Å; T33-N35 VanDerWaalsContact C-N 3.26Å; T33-N35 PolarHBondContact O-N 3.1Å; T33-G36 VanDerWaalsContact O-CA 3.3Å; T33-G36 WeakPolarHBondContact O-CA 3.39Å; T33-G36 PolarHBondContact O-N 3.06Å; T33-G36 PolarHBondContact OG1-N 3.1Å
34	T	54	Low	52.5	Low	53 Å²	53	78.2 Å²	78.2	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-31	176.4	24	0	0	0	0	112.8	G36 F37 S131 V133	T34-G36 PolarHBondContact O-N 2.76Å; T34-F37 PolarHBondContact O-N 3.38Å; T34-S131 WeakPolarHBondContact CG2-O 3.21Å; T34-S131 PolarHBondContact OG1-O 3.33Å; T34-V133 HydrophobicContact CG2-CB 4.2Å; T34-V133 VanDerWaalsContact CG2-O 3.3Å; T34-V133 WeakPolarHBondContact CG2-O 3.43Å
35	N	54.8	Low	53	Low	127 Å²	127	75.8 Å²	75.8	68%	0.679	40%	0.395	S	S	*	.	H	α-helix	trans	-63.8	-22.9	167.7	-70.4	-16.7	0	0	0	113.2	T33 V38 L39	T33-N35 VanDerWaalsContact C-N 3.26Å; T33-N35 PolarHBondContact O-N 3.1Å; N35-V38 PolarHBondContact O-N 2.91Å; N35-L39 PolarHBondContact O-N 2.88Å
36	G	49	Very low	53.6	Low	2 Å²	2	72.4 Å²	72.4	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-62.1	-39.6	178.3	0	0	0	0	0	112.8	T33 T34 L39 I40	T33-G36 VanDerWaalsContact O-CA 3.3Å; T33-G36 WeakPolarHBondContact O-CA 3.39Å; T33-G36 PolarHBondContact O-N 3.06Å; T33-G36 PolarHBondContact OG1-N 3.1Å; T34-G36 PolarHBondContact O-N 2.76Å; G36-L39 PolarHBondContact O-N 3.03Å; G36-I40 WeakPolarHBondContact O-CB 3.31Å; G36-I40 WeakPolarHBondContact O-CD1 3.23Å; G36-I40 WeakPolarHBondContact O-CG1 3.47Å; G36-I40 PolarHBondContact O-N 2.84Å
37	F	49.3	Very low	54.1	Low	68 Å²	68	69.2 Å²	69.2	30%	0.298	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-43.8	175.5	178.2	-109.4	0	0	0	111.9	T34 L39 I40 S41 L99 I135	T34-F37 PolarHBondContact O-N 3.38Å; F37-L39 VanDerWaalsContact C-N 3.34Å; F37-L39 PolarHBondContact O-N 3.15Å; F37-I40 PolarHBondContact O-N 2.68Å; F37-S41 WeakPolarHBondContact O-CB 3.44Å; F37-S41 PolarHBondContact O-N 3.14Å; F37-L99 HydrophobicContact CE1-CD1 4.07Å; F37-L99 HydrophobicContact CZ-CD1 4.43Å; F37-I135 HydrophobicContact CB-CD1 4.42Å; F37-I135 HydrophobicContact CD1-CD1 4.29Å; F37-I135 HydrophobicContact CD2-CD1 3.43Å; F37-I135 VanDerWaalsContact CD2-CD1 3.43Å; F37-I135 HydrophobicContact CE1-CD1 4.45Å; F37-I135 HydrophobicContact CE2-CD1 3.62Å; F37-I135 HydrophobicContact CG-CD1 3.79Å; F37-I135 HydrophobicContact CZ-CD1 4.13Å
38	V	56	Low	54.5	Low	60 Å²	60	69.9 Å²	69.9	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-63.3	-41.1	176.3	-177.9	0	0	0	0	110.8	N35 T42	N35-V38 PolarHBondContact O-N 2.91Å; V38-T42 WeakPolarHBondContact O-CB 3.42Å; V38-T42 WeakPolarHBondContact O-CG2 3.36Å; V38-T42 PolarHBondContact O-N 3.08Å; V38-T42 PolarHBondContact O-OG1 3.07Å
39	L	54.2	Low	54.9	Low	75 Å²	75	65 Å²	65	39%	0.393	35%	0.35	S	S	.	.	H	α-helix	trans	-67.1	-40.8	176.7	-162.9	77.3	0	0	0	112.3	L30 N35 G36 F37 T42 I43	L30-L39 HydrophobicContact CD2-CD2 3.49Å; L30-L39 VanDerWaalsContact CD2-CD2 3.49Å; N35-L39 PolarHBondContact O-N 2.88Å; G36-L39 PolarHBondContact O-N 3.03Å; F37-L39 VanDerWaalsContact C-N 3.34Å; F37-L39 PolarHBondContact O-N 3.15Å; L39-T42 WeakPolarHBondContact CA-OG1 3.4Å; L39-T42 PolarHBondContact O-OG1 2.86Å; L39-T42 VanDerWaalsContact O-OG1 3.08Å; L39-I43 HydrophobicContact CD2-CD1 4.25Å; L39-I43 HydrophobicContact CG-CD1 3.94Å; L39-I43 VanDerWaalsContact O-CB 3.27Å; L39-I43 WeakPolarHBondContact O-CB 3.25Å; L39-I43 WeakPolarHBondContact O-CD1 3.22Å; L39-I43 WeakPolarHBondContact O-CG1 3.13Å; L39-I43 PolarHBondContact O-N 3.02Å
40	I	56	Low	55.2	Low	31 Å²	31	62.6 Å²	62.6	16%	0.159	34%	0.336	C	S	.	.	H	α-helix	trans	-70.9	-42.9	179.4	-68	162.4	0	0	0	110.7	L27 L31 G36 F37 I43 F44	L27-I40 HydrophobicContact CD1-CG1 4.36Å; L27-I40 HydrophobicContact CD2-CD1 4.45Å; L27-I40 HydrophobicContact CD2-CG1 4.07Å; L27-I40 HydrophobicContact CG-CD1 4.29Å; L27-I40 HydrophobicContact CG-CG1 4.23Å; L31-I40 HydrophobicContact CD1-CD1 3.37Å; L31-I40 HydrophobicContact CD2-CD1 4.46Å; L31-I40 HydrophobicContact CG-CD1 3.55Å; G36-I40 WeakPolarHBondContact O-CB 3.31Å; G36-I40 WeakPolarHBondContact O-CD1 3.23Å; G36-I40 WeakPolarHBondContact O-CG1 3.47Å; G36-I40 PolarHBondContact O-N 2.84Å; F37-I40 PolarHBondContact O-N 2.68Å; I40-I43 PolarHBondContact O-N 3.03Å; I40-F44 VanDerWaalsContact O-CB 3.29Å; I40-F44 WeakPolarHBondContact O-CB 3.37Å; I40-F44 PolarHBondContact O-N 3.47Å
41	S	55.7	Low	55.6	Low	35 Å²	35	60.7 Å²	60.7	25%	0.245	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-45.1	174.6	-179.2	0	0	0	0	111.6	F37 F44 L45	F37-S41 WeakPolarHBondContact O-CB 3.44Å; F37-S41 PolarHBondContact O-N 3.14Å; S41-F44 PolarHBondContact O-N 3.41Å; S41-L45 WeakPolarHBondContact O-CB 3.46Å; S41-L45 PolarHBondContact O-N 3Å
42	T	55.6	Low	55.9	Low	23 Å²	23	60.8 Å²	60.8	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-67.3	-38.4	175	51.1	0	0	0	0	112.8	V38 L39 I46 Y89	V38-T42 WeakPolarHBondContact O-CB 3.42Å; V38-T42 WeakPolarHBondContact O-CG2 3.36Å; V38-T42 PolarHBondContact O-N 3.08Å; V38-T42 PolarHBondContact O-OG1 3.07Å; L39-T42 WeakPolarHBondContact CA-OG1 3.4Å; L39-T42 PolarHBondContact O-OG1 2.86Å; L39-T42 VanDerWaalsContact O-OG1 3.08Å; T42-I46 WeakPolarHBondContact O-CB 3.17Å; T42-I46 WeakPolarHBondContact O-CD1 3.23Å; T42-I46 WeakPolarHBondContact O-CG1 3.43Å; T42-I46 PolarHBondContact O-N 2.83Å; T42-Y89 HydrophobicContact CG2-CE2 4.11Å
43	I	58.8	Low	56.1	Low	46 Å²	46	54.9 Å²	54.9	24%	0.236	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-45.5	171.7	-75.1	167.4	0	0	0	110.7	L39 I40 I46 I47	L39-I43 HydrophobicContact CD2-CD1 4.25Å; L39-I43 HydrophobicContact CG-CD1 3.94Å; L39-I43 VanDerWaalsContact O-CB 3.27Å; L39-I43 WeakPolarHBondContact O-CB 3.25Å; L39-I43 WeakPolarHBondContact O-CD1 3.22Å; L39-I43 WeakPolarHBondContact O-CG1 3.13Å; L39-I43 PolarHBondContact O-N 3.02Å; I40-I43 PolarHBondContact O-N 3.03Å; I43-I46 PolarHBondContact O-N 3.09Å; I43-I47 HydrophobicContact CG2-CD1 3.56Å; I43-I47 HydrophobicContact CG2-CG1 4.38Å; I43-I47 WeakPolarHBondContact O-CB 3.39Å; I43-I47 WeakPolarHBondContact O-CD1 3.23Å; I43-I47 WeakPolarHBondContact O-CG1 3.23Å; I43-I47 PolarHBondContact O-N 2.85Å
44	F	60.4	Low	56.1	Low	53 Å²	53	58.9 Å²	58.9	23%	0.232	32%	0.32	C	S	.	.	H	α-helix	trans	-68.1	-39.3	-179.3	-159	-92.5	0	0	0	111.9	I40 S41 I47 S48 L140 L151	I40-F44 VanDerWaalsContact O-CB 3.29Å; I40-F44 WeakPolarHBondContact O-CB 3.37Å; I40-F44 PolarHBondContact O-N 3.47Å; S41-F44 PolarHBondContact O-N 3.41Å; F44-I47 PolarHBondContact O-N 3.48Å; F44-S48 WeakPolarHBondContact O-CB 3.45Å; F44-S48 PolarHBondContact O-N 2.83Å; F44-S48 PolarHBondContact O-OG 2.87Å; F44-L140 HydrophobicContact CE2-CD2 4.44Å; F44-L140 HydrophobicContact CZ-CD1 4.16Å; F44-L140 HydrophobicContact CZ-CD2 4.12Å; F44-L151 HydrophobicContact CE1-CD2 4.36Å; F44-L151 HydrophobicContact CZ-CD2 4.27Å
45	L	63.3	Low	56.3	Low	62 Å²	62	62.8 Å²	62.8	33%	0.325	33%	0.334	S	S	.	.	H	α-helix	trans	-61.4	-46	170.2	-89.2	163.4	0	0	0	111.9	S41 I47 S48 V49 L200	S41-L45 WeakPolarHBondContact O-CB 3.46Å; S41-L45 PolarHBondContact O-N 3Å; L45-I47 VanDerWaalsContact C-N 3.33Å; L45-I47 PolarHBondContact O-N 3.33Å; L45-S48 PolarHBondContact O-N 3.07Å; L45-V49 VanDerWaalsContact O-CB 3.32Å; L45-V49 WeakPolarHBondContact O-CB 3.19Å; L45-V49 VanDerWaalsContact O-CG2 3.27Å; L45-V49 WeakPolarHBondContact O-CG2 3.5Å; L45-V49 PolarHBondContact O-N 3.49Å; L45-L200 HydrophobicContact CD2-CD2 4.21Å
46	I	61.3	Low	56.2	Low	58 Å²	58	59.3 Å²	59.3	30%	0.297	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-43.7	176.2	-71.9	164.3	0	0	0	110.4	M1 T42 I43 T50	M1-I46 HydrophobicContact CE-CD1 4.11Å; T42-I46 WeakPolarHBondContact O-CB 3.17Å; T42-I46 WeakPolarHBondContact O-CD1 3.23Å; T42-I46 WeakPolarHBondContact O-CG1 3.43Å; T42-I46 PolarHBondContact O-N 2.83Å; I43-I46 PolarHBondContact O-N 3.09Å; I46-T50 WeakPolarHBondContact O-CB 3.46Å; I46-T50 PolarHBondContact O-N 2.89Å; I46-T50 PolarHBondContact O-OG1 2.82Å
47	I	59.3	Low	56.2	Low	48 Å²	48	61.9 Å²	61.9	25%	0.246	33%	0.334	C	S	.	.	H	α-helix	trans	-62.7	-51.1	176.8	-67.9	159.3	0	0	0	110.8	F20 I43 F44 L45 V49 T50 A51	F20-I47 HydrophobicContact CD1-CD1 4.41Å; F20-I47 HydrophobicContact CE1-CD1 3.39Å; F20-I47 HydrophobicContact CE1-CG1 4.23Å; F20-I47 HydrophobicContact CE2-CD1 4.25Å; F20-I47 HydrophobicContact CE2-CG1 4.4Å; F20-I47 HydrophobicContact CZ-CD1 3.3Å; F20-I47 HydrophobicContact CZ-CG1 3.63Å; I43-I47 HydrophobicContact CG2-CD1 3.56Å; I43-I47 HydrophobicContact CG2-CG1 4.38Å; I43-I47 WeakPolarHBondContact O-CB 3.39Å; I43-I47 WeakPolarHBondContact O-CD1 3.23Å; I43-I47 WeakPolarHBondContact O-CG1 3.23Å; I43-I47 PolarHBondContact O-N 2.85Å; F44-I47 PolarHBondContact O-N 3.48Å; L45-I47 VanDerWaalsContact C-N 3.33Å; L45-I47 PolarHBondContact O-N 3.33Å; I47-V49 PolarHBondContact O-N 2.98Å; I47-T50 PolarHBondContact O-N 2.91Å; I47-A51 VanDerWaalsContact O-CB 3.23Å; I47-A51 WeakPolarHBondContact O-CB 3.18Å; I47-A51 PolarHBondContact O-N 2.85Å
48	S	57.5	Low	56.3	Low	45 Å²	45	66.4 Å²	66.4	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-43.7	-178.8	-64.5	0	0	0	0	111.9	F44 L45 Y52	F44-S48 WeakPolarHBondContact O-CB 3.45Å; F44-S48 PolarHBondContact O-N 2.83Å; F44-S48 PolarHBondContact O-OG 2.87Å; L45-S48 PolarHBondContact O-N 3.07Å; S48-Y52 WeakPolarHBondContact O-CB 3.15Å; S48-Y52 PolarHBondContact O-N 3.01Å
49	V	56.9	Low	56.1	Low	54 Å²	54	66.2 Å²	66.2	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-39.8	174.9	171.6	0	0	0	0	111.5	L45 I47 S53 L85	L45-V49 VanDerWaalsContact O-CB 3.32Å; L45-V49 WeakPolarHBondContact O-CB 3.19Å; L45-V49 VanDerWaalsContact O-CG2 3.27Å; L45-V49 WeakPolarHBondContact O-CG2 3.5Å; L45-V49 PolarHBondContact O-N 3.49Å; I47-V49 PolarHBondContact O-N 2.98Å; V49-S53 VanDerWaalsContact O-CB 3.26Å; V49-S53 WeakPolarHBondContact O-CB 3.35Å; V49-S53 PolarHBondContact O-N 2.93Å; V49-S53 PolarHBondContact O-OG 3.49Å; V49-L85 HydrophobicContact CG1-CD1 4Å
50	T	54.9	Low	55.8	Low	66 Å²	66	70.5 Å²	70.5	41%	0.405	36%	0.361	S	S	.	.	H	α-helix	trans	-69.8	-44.5	178.4	-55.1	0	0	0	0	111.2	I46 I47 S53 F54	I46-T50 WeakPolarHBondContact O-CB 3.46Å; I46-T50 PolarHBondContact O-N 2.89Å; I46-T50 PolarHBondContact O-OG1 2.82Å; I47-T50 PolarHBondContact O-N 2.91Å; T50-S53 WeakPolarHBondContact O-CB 3.21Å; T50-S53 PolarHBondContact O-N 3.36Å; T50-F54 WeakPolarHBondContact O-CB 3.44Å; T50-F54 PolarHBondContact O-N 3.49Å
51	A	56.1	Low	55.3	Low	34 Å²	34	74.4 Å²	74.4	28%	0.281	38%	0.379	S	S	.	.	H	α-helix	trans	-65.7	-43.6	177.7	0	0	0	0	0	111.4	I47 S53 F54 Q55	I47-A51 VanDerWaalsContact O-CB 3.23Å; I47-A51 WeakPolarHBondContact O-CB 3.18Å; I47-A51 PolarHBondContact O-N 2.85Å; A51-S53 VanDerWaalsContact C-N 3.34Å; A51-S53 PolarHBondContact O-N 3.18Å; A51-F54 PolarHBondContact O-N 2.95Å; A51-Q55 VanDerWaalsContact O-CB 3.26Å; A51-Q55 WeakPolarHBondContact O-CB 3.44Å; A51-Q55 PolarHBondContact O-N 2.71Å
52	Y	57.9	Low	54.7	Low	80 Å²	80	76.8 Å²	76.8	31%	0.314	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-43.6	172.2	-176.4	-90.2	0	0	0	111.2	S48 F54 Q55 K56 V194 D196	S48-Y52 WeakPolarHBondContact O-CB 3.15Å; S48-Y52 PolarHBondContact O-N 3.01Å; Y52-F54 PolarHBondContact O-N 2.75Å; Y52-Q55 PolarHBondContact O-N 2.89Å; Y52-K56 HydrophobicContact CD1-CD 4.35Å; Y52-K56 HydrophobicContact CE1-CD 3.56Å; Y52-K56 WeakPolarHBondContact O-CB 3.31Å; Y52-K56 PolarHBondContact O-N 2.72Å; Y52-K56 PolarHBondContact OH-NZ 2.76Å; Y52-V194 HydrophobicContact CD2-CG1 4.22Å; Y52-V194 HydrophobicContact CE2-CG1 4.17Å; Y52-V194 HydrophobicContact CG-CG1 4.45Å; Y52-D196 PolarHBondContact OH-OD1 3.35Å
53	S	54.9	Low	54.3	Low	61 Å²	61	82.8 Å²	82.8	43%	0.427	41%	0.413	S	S	.	.	H	α-helix	trans	-61.6	-43.3	175	-60.4	0	0	0	0	112	V49 T50 A51 K56 A57	V49-S53 VanDerWaalsContact O-CB 3.26Å; V49-S53 WeakPolarHBondContact O-CB 3.35Å; V49-S53 PolarHBondContact O-N 2.93Å; V49-S53 PolarHBondContact O-OG 3.49Å; T50-S53 WeakPolarHBondContact O-CB 3.21Å; T50-S53 PolarHBondContact O-N 3.36Å; A51-S53 VanDerWaalsContact C-N 3.34Å; A51-S53 PolarHBondContact O-N 3.18Å; S53-K56 PolarHBondContact O-N 3.11Å; S53-A57 VanDerWaalsContact O-CB 3.27Å; S53-A57 WeakPolarHBondContact O-CB 3.46Å; S53-A57 PolarHBondContact O-N 2.72Å
54	F	53.1	Low	53.4	Low	156 Å²	156	84.7 Å²	84.7	68%	0.684	43%	0.429	S	S	*	.	H	α-helix	trans	-67.2	-43.6	178	-130.6	-86.1	0	0	0	111.9	T50 A51 Y52 A57 W58	T50-F54 WeakPolarHBondContact O-CB 3.44Å; T50-F54 PolarHBondContact O-N 3.49Å; A51-F54 PolarHBondContact O-N 2.95Å; Y52-F54 PolarHBondContact O-N 2.75Å; F54-A57 PolarHBondContact O-N 2.92Å; F54-W58 VanDerWaalsContact O-CB 3.23Å; F54-W58 WeakPolarHBondContact O-CB 3.42Å; F54-W58 PolarHBondContact O-N 3.42Å
55	Q	56.8	Low	52.5	Low	135 Å²	135	92 Å²	92	63%	0.631	46%	0.455	S	S	*	.	H	α-helix	trans	-66.1	-37.3	176.6	-175	174.3	-9.4	0	0	111.4	A51 Y52 S59	A51-Q55 VanDerWaalsContact O-CB 3.26Å; A51-Q55 WeakPolarHBondContact O-CB 3.44Å; A51-Q55 PolarHBondContact O-N 2.71Å; Y52-Q55 PolarHBondContact O-N 2.89Å; Q55-S59 WeakPolarHBondContact O-CB 3.29Å; Q55-S59 PolarHBondContact O-N 3.04Å
56	K	53.8	Low	51.5	Low	53 Å²	53	98 Å²	98	23%	0.23	48%	0.478	C	S	.	.	H	α-helix	trans	-73	-36.3	176.2	-163.6	161.7	-166.3	157.1	0	112.2	Y52 S53 R60 D196	Y52-K56 HydrophobicContact CD1-CD 4.35Å; Y52-K56 HydrophobicContact CE1-CD 3.56Å; Y52-K56 WeakPolarHBondContact O-CB 3.31Å; Y52-K56 PolarHBondContact O-N 2.72Å; Y52-K56 PolarHBondContact OH-NZ 2.76Å; S53-K56 PolarHBondContact O-N 3.11Å; K56-R60 VanDerWaalsContact O-CB 3.28Å; K56-R60 WeakPolarHBondContact O-CB 3.46Å; K56-R60 VanDerWaalsContact O-CG 3.22Å; K56-R60 WeakPolarHBondContact O-CG 3.32Å; K56-R60 PolarHBondContact O-N 3.38Å; K56-D196 IonicContact NZ-OD1 2.67Å; K56-D196 PolarHBondContact NZ-OD1 3.43Å; K56-D196 IonicContact NZ-OD2 2.95Å; K56-D196 PolarHBondContact NZ-OD2 3.43Å
57	A	48.7	Very low	50.4	Low	56 Å²	56	100.1 Å²	100.1	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-64.8	-52.2	170.6	0	0	0	0	0	111.3	S53 F54 S59 R60 E61	S53-A57 VanDerWaalsContact O-CB 3.27Å; S53-A57 WeakPolarHBondContact O-CB 3.46Å; S53-A57 PolarHBondContact O-N 2.72Å; F54-A57 PolarHBondContact O-N 2.92Å; A57-S59 PolarHBondContact O-N 2.84Å; A57-R60 CarbonylContact O-C 3.53Å; A57-R60 WeakPolarHBondContact O-CA 3.09Å; A57-R60 WeakPolarHBondContact O-CB 3.46Å; A57-R60 PolarHBondContact O-N 3.44Å; A57-R60 VanDerWaalsContact O-N 3.13Å; A57-E61 PolarHBondContact O-N 2.89Å
58	W	50.5	Low	49.1	Very low	164 Å²	164	103.1 Å²	103.1	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-66.1	-36.6	-179.2	-169.3	44.4	0	0	0	112.6	F54 E61 L62	F54-W58 VanDerWaalsContact O-CB 3.23Å; F54-W58 WeakPolarHBondContact O-CB 3.42Å; F54-W58 PolarHBondContact O-N 3.42Å; W58-E61 PolarHBondContact O-N 2.95Å; W58-L62 HydrophobicContact CD2-CD1 3.91Å; W58-L62 HydrophobicContact CE3-CD1 4.44Å; W58-L62 HydrophobicContact CG-CD1 4.18Å; W58-L62 HydrophobicContact CZ2-CD1 4.2Å; W58-L62 WeakPolarHBondContact O-CB 3.4Å; W58-L62 WeakPolarHBondContact O-CG 3.39Å; W58-L62 PolarHBondContact O-N 3.15Å
59	S	53	Low	47.9	Very low	55 Å²	55	107.7 Å²	107.7	39%	0.385	54%	0.535	S	S	.	.	H	α-helix	trans	-69.6	-33.1	172.6	-167.6	0	0	0	0	112.3	Q55 A57 K63	Q55-S59 WeakPolarHBondContact O-CB 3.29Å; Q55-S59 PolarHBondContact O-N 3.04Å; A57-S59 PolarHBondContact O-N 2.84Å; S59-K63 WeakPolarHBondContact O-CB 3.32Å; S59-K63 WeakPolarHBondContact O-CG 3.3Å; S59-K63 PolarHBondContact O-N 3.33Å
60	R	47.9	Very low	46.8	Very low	165 Å²	165	113.8 Å²	113.8	62%	0.623	56%	0.557	S	S	*	*	H	α-helix	trans	-66.5	-42.9	169	-79.9	174.7	174.5	177.5	-0.4	111.5	K56 A57 K63 C64	K56-R60 VanDerWaalsContact O-CB 3.28Å; K56-R60 WeakPolarHBondContact O-CB 3.46Å; K56-R60 VanDerWaalsContact O-CG 3.22Å; K56-R60 WeakPolarHBondContact O-CG 3.32Å; K56-R60 PolarHBondContact O-N 3.38Å; A57-R60 CarbonylContact O-C 3.53Å; A57-R60 WeakPolarHBondContact O-CA 3.09Å; A57-R60 WeakPolarHBondContact O-CB 3.46Å; A57-R60 PolarHBondContact O-N 3.44Å; A57-R60 VanDerWaalsContact O-N 3.13Å; R60-K63 PolarHBondContact O-N 2.79Å; R60-C64 WeakPolarHBondContact O-CB 3.27Å; R60-C64 PolarHBondContact O-N 3.06Å
61	E	45.8	Very low	45.7	Very low	113 Å²	113	116.9 Å²	116.9	53%	0.528	58%	0.576	S	S	.	*	H	α-helix	trans	-62.3	-42.6	173	-72.6	-166.2	128.6	0	0	112.4	A57 W58 C64 R65	A57-E61 PolarHBondContact O-N 2.89Å; W58-E61 PolarHBondContact O-N 2.95Å; E61-C64 PolarHBondContact O-N 2.92Å; E61-R65 VanDerWaalsContact O-CB 3.27Å; E61-R65 WeakPolarHBondContact O-CB 3.38Å; E61-R65 WeakPolarHBondContact O-CG 3.44Å; E61-R65 PolarHBondContact O-N 3.28Å
62	L	43.2	Very low	44.6	Very low	86 Å²	86	120.1 Å²	120.1	45%	0.45	59%	0.593	S	S	.	*	H	α-helix	trans	-68.8	-34.1	178.7	-82.7	161	0	0	0	113.1	W58	W58-L62 HydrophobicContact CD2-CD1 3.91Å; W58-L62 HydrophobicContact CE3-CD1 4.44Å; W58-L62 HydrophobicContact CG-CD1 4.18Å; W58-L62 HydrophobicContact CZ2-CD1 4.2Å; W58-L62 WeakPolarHBondContact O-CB 3.4Å; W58-L62 WeakPolarHBondContact O-CG 3.39Å; W58-L62 PolarHBondContact O-N 3.15Å
63	K	46.7	Very low	43.4	Very low	149 Å²	149	123.7 Å²	123.7	65%	0.648	62%	0.617	S	S	*	*	H	α-helix	trans	-73	-44.5	170.6	-75.6	-175.6	175.6	-175.4	0	111.3	S59 R60 R65 K66 T67	S59-K63 WeakPolarHBondContact O-CB 3.32Å; S59-K63 WeakPolarHBondContact O-CG 3.3Å; S59-K63 PolarHBondContact O-N 3.33Å; R60-K63 PolarHBondContact O-N 2.79Å; K63-R65 PolarHBondContact O-N 3.02Å; K63-K66 CarbonylContact O-C 3.53Å; K63-K66 WeakPolarHBondContact O-CA 3.5Å; K63-K66 WeakPolarHBondContact O-CB 3.5Å; K63-K66 PolarHBondContact O-N 3.1Å; K63-T67 PolarHBondContact O-N 2.84Å; K63-T67 PolarHBondContact O-OG1 3.05Å
64	C	40.2	Very low	42.2	Very low	86 Å²	86	130.3 Å²	130.3	58%	0.581	63%	0.634	S	S	*	*	H	α-helix	trans	-66.5	-37.3	-179.2	-166.1	0	0	0	0	112.5	R60 E61 K66 T67	R60-C64 WeakPolarHBondContact O-CB 3.27Å; R60-C64 PolarHBondContact O-N 3.06Å; E61-C64 PolarHBondContact O-N 2.92Å; C64-K66 PolarHBondContact O-N 2.83Å; C64-T67 CarbonylContact O-C 3.46Å; C64-T67 PolarHBondContact O-N 3.39Å; C64-T67 PolarHBondContact O-OG1 2.8Å
65	R	39.9	Very low	41.2	Very low	207 Å²	207	131.1 Å²	131.1	78%	0.781	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-10	169.5	-77.4	-175.1	172.5	-167.1	-0.4	114.4	E61 K63	E61-R65 VanDerWaalsContact O-CB 3.27Å; E61-R65 WeakPolarHBondContact O-CB 3.38Å; E61-R65 WeakPolarHBondContact O-CG 3.44Å; E61-R65 PolarHBondContact O-N 3.28Å; K63-R65 PolarHBondContact O-N 3.02Å
66	K	42.9	Very low	40.2	Very low	186 Å²	186	134.1 Å²	134.1	81%	0.809	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-5.4	170	-76.6	-171.3	172.5	-171.9	0	113.5	K63 C64	K63-K66 CarbonylContact O-C 3.53Å; K63-K66 WeakPolarHBondContact O-CA 3.5Å; K63-K66 WeakPolarHBondContact O-CB 3.5Å; K63-K66 PolarHBondContact O-N 3.1Å; C64-K66 PolarHBondContact O-N 2.83Å
67	T	37.8	Very low	39.4	Very low	103 Å²	103	138.4 Å²	138.4	63%	0.632	68%	0.676	S	S	*	*	S	Bend	trans	-124.7	57.7	178.3	59.3	0	0	0	0	110.6	K63 C64 L69	K63-T67 PolarHBondContact O-N 2.84Å; K63-T67 PolarHBondContact O-OG1 3.05Å; C64-T67 CarbonylContact O-C 3.46Å; C64-T67 PolarHBondContact O-N 3.39Å; C64-T67 PolarHBondContact O-OG1 2.8Å; T67-L69 PolarHBondContact O-N 3.16Å; T67-L69 VanDerWaalsContact O-N 3.12Å
68	T	32.6	Very low	38.8	Very low	111 Å²	111	138.7 Å²	138.7	68%	0.681	68%	0.684	S	S	*	*			trans	-76.6	93.1	-178	-28.7	0	0	0	0	111
69	L	32	Very low	38.2	Very low	141 Å²	141	136 Å²	136	74%	0.738	69%	0.686	S	S	*	*			trans	170.8	154	136.5	-113.5	67.6	0	0	0	112.6	T67	T67-L69 PolarHBondContact O-N 3.16Å; T67-L69 VanDerWaalsContact O-N 3.12Å
70	K	33.4	Very low	37.7	Very low	182 Å²	182	135.7 Å²	135.7	79%	0.791	68%	0.684	S	S	*	*			trans	72.7	95.5	157.7	-69.9	172.6	179.4	179.4	0	120
71	T	31.7	Very low	37.5	Very low	131 Å²	131	131.9 Å²	131.9	80%	0.804	68%	0.676	S	S	*	*				86.9	149.1	127.6	-30.3	0	0	0	0	120.2
72	V	34.1	Very low	37.3	Very low	103 Å²	103	132 Å²	132	62%	0.624	68%	0.679	S	S	*	*			trans	84.3	135.8	165.1	-165.3	0	0	0	0	118.5	Y74	V72-Y74 HydrophobicContact CG1-CD2 4.43Å; V72-Y74 HydrophobicContact CG1-CE2 4.07Å; V72-Y74 PolarHBondContact O-N 2.84Å
73	D	32.2	Very low	37.4	Very low	154 Å²	154	131.4 Å²	131.4	82%	0.824	67%	0.674	S	S	*	*			trans	-65.2	102.1	-173.3	-54.4	-95.5	0	0	0	115.8
74	Y	29	Very low	37.2	Very low	200 Å²	200	131.8 Å²	131.8	78%	0.784	67%	0.671	S	S	*	*			trans	-132.1	49.9	173.7	-79.4	-79.6	0	0	0	114	V72	V72-Y74 HydrophobicContact CG1-CD2 4.43Å; V72-Y74 HydrophobicContact CG1-CE2 4.07Å; V72-Y74 PolarHBondContact O-N 2.84Å
75	L	32.9	Very low	37.1	Very low	174 Å²	174	130.7 Å²	130.7	91%	0.911	66%	0.659	S	S	*	*			trans	-127.8	39.7	-179.3	-142.3	82.8	0	0	0	116
76	K	36.5	Very low	37.2	Very low	197 Å²	197	127.5 Å²	127.5	86%	0.857	65%	0.647	S	S	*	*	S	Bend	trans	-125.3	-1.3	172.6	-85.9	-177	176.6	173.4	0	116.7
77	H	35.9	Very low	37.2	Very low	144 Å²	144	126 Å²	126	67%	0.667	64%	0.637	S	S	*	*			trans	-93.9	-3.1	-177.3	-83.6	-61.7	0	0	0	116.2	T79 S80	H77-T79 PolarHBondContact O-N 2.81Å; H77-T79 VanDerWaalsContact O-N 3.09Å; H77-S80 PolarHBondContact O-N 3.37Å; H77-S80 PolarHBondContact O-OG 2.91Å
78	G	36.1	Very low	37.5	Very low	61 Å²	61	122.7 Å²	122.7	63%	0.629	62%	0.615	S	S	*	*	H	α-helix	trans	-63	-18.6	-176.7	0	0	0	0	0	115.7
79	T	37.4	Very low	37.8	Very low	109 Å²	109	123.5 Å²	123.5	67%	0.669	61%	0.606	S	S	*	*	H	α-helix	trans	-90.6	-22.9	-178.5	50.3	0	0	0	0	114	H77 D81 E83	H77-T79 PolarHBondContact O-N 2.81Å; H77-T79 VanDerWaalsContact O-N 3.09Å; T79-D81 PolarHBondContact O-N 3.13Å; T79-E83 PolarHBondContact O-N 3.18Å
80	S	44.4	Very low	38.4	Very low	47 Å²	47	124.5 Å²	124.5	33%	0.329	60%	0.604	S	S	.	*	H	α-helix	trans	-69	-35.6	-177.6	48.2	0	0	0	0	112.5	H77 E83 R84	H77-S80 PolarHBondContact O-N 3.37Å; H77-S80 PolarHBondContact O-OG 2.91Å; S80-E83 PolarHBondContact O-N 3.5Å; S80-R84 VanDerWaalsContact O-CB 3.23Å; S80-R84 WeakPolarHBondContact O-CB 3.32Å; S80-R84 PolarHBondContact O-N 2.86Å
81	D	42.5	Very low	38.7	Very low	86 Å²	86	120 Å²	120	46%	0.46	60%	0.596	S	S	.	*	H	α-helix	trans	-73	-39.2	-175.1	-63.8	-13.1	0	0	0	111.5	T79 R84 L85	T79-D81 PolarHBondContact O-N 3.13Å; D81-R84 PolarHBondContact O-N 2.81Å; D81-L85 WeakPolarHBondContact O-CB 3.25Å; D81-L85 WeakPolarHBondContact O-CG 3.2Å; D81-L85 PolarHBondContact O-N 2.9Å
82	I	42.2	Very low	39.1	Very low	114 Å²	114	115.7 Å²	115.7	59%	0.585	57%	0.57	S	S	*	*	H	α-helix	trans	-63	-46.5	173.9	-60.5	176.1	0	0	0	110.3	R84 L85 R86	I82-R84 PolarHBondContact O-N 2.96Å; I82-L85 PolarHBondContact O-N 3.09Å; I82-R86 VanDerWaalsContact O-CB 3.25Å; I82-R86 WeakPolarHBondContact O-CB 3.42Å; I82-R86 PolarHBondContact O-N 3.21Å
83	E	44.2	Very low	39.4	Very low	75 Å²	75	115.3 Å²	115.3	35%	0.35	57%	0.572	S	S	.	*	H	α-helix	trans	-77.9	-8.7	-179.8	-156	58.4	-141.1	0	0	112.9	T79 S80 R86 R87	T79-E83 PolarHBondContact O-N 3.18Å; S80-E83 PolarHBondContact O-N 3.5Å; E83-R86 WeakPolarHBondContact OE1-CD 3.47Å; E83-R86 IonicContact OE1-NH1 3.01Å; E83-R86 WeakPolarHBondContact OE2-CD 3.44Å; E83-R86 IonicContact OE2-CZ 3.67Å; E83-R86 IonicContact OE2-NE 3.34Å; E83-R86 IonicContact OE2-NH1 2.65Å; E83-R86 PolarHBondContact OE2-NH1 2.8Å; E83-R87 PolarHBondContact O-N 2.86Å; E83-R87 PolarHBondContact O-NE 3.12Å; E83-R87 PolarHBondContact O-NH2 2.98Å
84	R	42.3	Very low	40.3	Very low	157 Å²	157	111.1 Å²	111.1	59%	0.592	55%	0.547	S	S	*	.	H	α-helix	trans	-83.9	-49	166.7	-166.5	176.5	-171.9	-178.3	0.4	110.1	S80 D81 I82 R86 R87 I88	S80-R84 VanDerWaalsContact O-CB 3.23Å; S80-R84 WeakPolarHBondContact O-CB 3.32Å; S80-R84 PolarHBondContact O-N 2.86Å; D81-R84 PolarHBondContact O-N 2.81Å; I82-R84 PolarHBondContact O-N 2.96Å; R84-R86 VanDerWaalsContact C-N 3.29Å; R84-R86 PolarHBondContact O-N 3.44Å; R84-R87 WeakPolarHBondContact O-CA 3.49Å; R84-R87 WeakPolarHBondContact O-CB 3.15Å; R84-R87 PolarHBondContact O-N 3.27Å; R84-I88 HydrophobicContact CG-CD1 4.18Å; R84-I88 WeakPolarHBondContact O-CD1 3.38Å; R84-I88 VanDerWaalsContact O-CG1 3.31Å; R84-I88 WeakPolarHBondContact O-CG1 3.31Å; R84-I88 PolarHBondContact O-N 3.17Å
85	L	39	Very low	41.6	Very low	62 Å²	62	103.3 Å²	103.3	33%	0.325	52%	0.52	S	S	.	.	H	α-helix	trans	-56.6	-40.5	171.3	-78.1	162.9	0	0	0	112.1	V49 D81 I82 R87 I88 Y89	V49-L85 HydrophobicContact CG1-CD1 4Å; D81-L85 WeakPolarHBondContact O-CB 3.25Å; D81-L85 WeakPolarHBondContact O-CG 3.2Å; D81-L85 PolarHBondContact O-N 2.9Å; I82-L85 PolarHBondContact O-N 3.09Å; L85-R87 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 2.91Å; L85-I88 PolarHBondContact O-N 3.44Å; L85-Y89 WeakPolarHBondContact O-CB 3.41Å; L85-Y89 PolarHBondContact O-N 2.99Å
86	R	42.5	Very low	42.9	Very low	141 Å²	141	97 Å²	97	53%	0.532	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-31.6	175.1	-161.1	-172.8	-145.2	165.9	2.4	113.1	I82 E83 R84 K90	I82-R86 VanDerWaalsContact O-CB 3.25Å; I82-R86 WeakPolarHBondContact O-CB 3.42Å; I82-R86 PolarHBondContact O-N 3.21Å; E83-R86 WeakPolarHBondContact OE1-CD 3.47Å; E83-R86 IonicContact OE1-NH1 3.01Å; E83-R86 WeakPolarHBondContact OE2-CD 3.44Å; E83-R86 IonicContact OE2-CZ 3.67Å; E83-R86 IonicContact OE2-NE 3.34Å; E83-R86 IonicContact OE2-NH1 2.65Å; E83-R86 PolarHBondContact OE2-NH1 2.8Å; R84-R86 VanDerWaalsContact C-N 3.29Å; R84-R86 PolarHBondContact O-N 3.44Å; R86-K90 WeakPolarHBondContact O-CB 3.32Å; R86-K90 WeakPolarHBondContact O-CG 3.25Å; R86-K90 PolarHBondContact O-N 2.8Å; R86-K90 VanDerWaalsContact O-N 3.11Å
87	R	43.4	Very low	44.1	Very low	155 Å²	155	88 Å²	88	59%	0.585	46%	0.455	S	S	*	.	H	α-helix	trans	-70.7	-45.9	170.2	-100.1	173.6	-71.7	173.5	-3.8	111.2	E83 R84 L85 Y89 K90 S91	E83-R87 PolarHBondContact O-N 2.86Å; E83-R87 PolarHBondContact O-NE 3.12Å; E83-R87 PolarHBondContact O-NH2 2.98Å; R84-R87 WeakPolarHBondContact O-CA 3.49Å; R84-R87 WeakPolarHBondContact O-CB 3.15Å; R84-R87 PolarHBondContact O-N 3.27Å; L85-R87 VanDerWaalsContact C-N 3.33Å; L85-R87 PolarHBondContact O-N 2.91Å; R87-Y89 PolarHBondContact O-N 2.96Å; R87-K90 CarbonylContact O-C 3.57Å; R87-K90 WeakPolarHBondContact O-CA 3.19Å; R87-K90 WeakPolarHBondContact O-CB 3.49Å; R87-K90 PolarHBondContact O-N 2.84Å; R87-S91 PolarHBondContact O-N 3.23Å; R87-S91 PolarHBondContact O-OG 3.03Å
88	I	42.6	Very low	45.5	Very low	33 Å²	33	82.3 Å²	82.3	17%	0.169	44%	0.435	C	S	.	.	H	α-helix	trans	-58.6	-48	176.5	-65.1	152.6	0	0	0	109.9	R84 L85 K90 S91 C92 L199	R84-I88 HydrophobicContact CG-CD1 4.18Å; R84-I88 WeakPolarHBondContact O-CD1 3.38Å; R84-I88 VanDerWaalsContact O-CG1 3.31Å; R84-I88 WeakPolarHBondContact O-CG1 3.31Å; R84-I88 PolarHBondContact O-N 3.17Å; L85-I88 PolarHBondContact O-N 3.44Å; I88-K90 VanDerWaalsContact C-N 3.31Å; I88-K90 PolarHBondContact O-N 3.43Å; I88-S91 WeakPolarHBondContact CA-OG 3.38Å; I88-S91 CarbonylContact O-C 3.56Å; I88-S91 PolarHBondContact O-N 2.85Å; I88-S91 PolarHBondContact O-OG 3.41Å; I88-C92 VanDerWaalsContact O-CB 3.28Å; I88-C92 WeakPolarHBondContact O-CB 3.32Å; I88-C92 PolarHBondContact O-N 2.77Å; I88-C92 PolarHBondContact O-SG 3.04Å; I88-L199 HydrophobicContact CD1-CD1 3.46Å; I88-L199 VanDerWaalsContact CD1-CD1 3.46Å; I88-L199 HydrophobicContact CD1-CD2 3.68Å; I88-L199 HydrophobicContact CD1-CG 4.05Å; I88-L199 HydrophobicContact CG1-CD1 4.28Å
89	Y	39.1	Very low	47	Very low	128 Å²	128	80.7 Å²	80.7	50%	0.502	41%	0.411	S	S	.	.	H	α-helix	trans	-58.4	-37.7	173.3	-178.3	-94.5	0	0	0	113.1	T42 L85 R87 S91	T42-Y89 HydrophobicContact CG2-CE2 4.11Å; L85-Y89 WeakPolarHBondContact O-CB 3.41Å; L85-Y89 PolarHBondContact O-N 2.99Å; R87-Y89 PolarHBondContact O-N 2.96Å; Y89-S91 VanDerWaalsContact C-N 3.35Å
90	K	44.1	Very low	48.5	Very low	162 Å²	162	76.7 Å²	76.7	70%	0.704	39%	0.388	S	S	*	.	H	α-helix	trans	-72.4	-21.5	174.3	-80.7	179.9	173.8	-177.8	0	114.2	R86 R87 I88	R86-K90 WeakPolarHBondContact O-CB 3.32Å; R86-K90 WeakPolarHBondContact O-CG 3.25Å; R86-K90 PolarHBondContact O-N 2.8Å; R86-K90 VanDerWaalsContact O-N 3.11Å; R87-K90 CarbonylContact O-C 3.57Å; R87-K90 WeakPolarHBondContact O-CA 3.19Å; R87-K90 WeakPolarHBondContact O-CB 3.49Å; R87-K90 PolarHBondContact O-N 2.84Å; I88-K90 VanDerWaalsContact C-N 3.31Å; I88-K90 PolarHBondContact O-N 3.43Å
91	S	40.4	Very low	49.8	Very low	88 Å²	88	76.4 Å²	76.4	62%	0.615	38%	0.382	S	S	*	.	H	α-helix	trans	-94.6	-25.6	173	49.8	0	0	0	0	113.5	R87 I88 Y89 S93	R87-S91 PolarHBondContact O-N 3.23Å; R87-S91 PolarHBondContact O-OG 3.03Å; I88-S91 WeakPolarHBondContact CA-OG 3.38Å; I88-S91 CarbonylContact O-C 3.56Å; I88-S91 PolarHBondContact O-N 2.85Å; I88-S91 PolarHBondContact O-OG 3.41Å; Y89-S91 VanDerWaalsContact C-N 3.35Å; S91-S93 VanDerWaalsContact C-N 3.29Å; S91-S93 PolarHBondContact O-N 2.94Å; S91-S93 VanDerWaalsContact O-N 3.14Å
92	C	40.2	Very low	51.3	Low	39 Å²	39	73.9 Å²	73.9	26%	0.264	37%	0.369	S	S	.	.			trans	-87.5	68.2	175.7	-65.2	0	0	0	0	109.8	I88 F94	I88-C92 VanDerWaalsContact O-CB 3.28Å; I88-C92 WeakPolarHBondContact O-CB 3.32Å; I88-C92 PolarHBondContact O-N 2.77Å; I88-C92 PolarHBondContact O-SG 3.04Å; C92-F94 PolarHBondContact O-N 3.03Å
93	S	40.7	Very low	52.9	Low	95 Å²	95	69.6 Å²	69.6	66%	0.664	35%	0.345	S	S	*	.			trans	-68.2	72.6	164.2	55.4	0	0	0	0	109.5	S91 T95	S91-S93 VanDerWaalsContact C-N 3.29Å; S91-S93 PolarHBondContact O-N 2.94Å; S91-S93 VanDerWaalsContact O-N 3.14Å; S93-T95 PolarHBondContact O-N 2.8Å
94	F	51.1	Low	54.7	Low	66 Å²	66	66.5 Å²	66.5	29%	0.289	33%	0.331	S	S	.	.			trans	-81.3	70	-173.6	-152.8	-105.8	0	0	0	110.3	C92 L99 I102 L202 W242	C92-F94 PolarHBondContact O-N 3.03Å; F94-L99 HydrophobicContact CD1-CD1 4.35Å; F94-L99 HydrophobicContact CD1-CG 4.27Å; F94-L99 HydrophobicContact CE1-CD1 3.72Å; F94-L99 HydrophobicContact CE1-CD2 3.67Å; F94-L99 HydrophobicContact CE1-CG 3.52Å; F94-L99 HydrophobicContact CE2-CD2 4.47Å; F94-L99 HydrophobicContact CZ-CD1 4.36Å; F94-L99 HydrophobicContact CZ-CD2 3.45Å; F94-L99 VanDerWaalsContact CZ-CD2 3.45Å; F94-L99 HydrophobicContact CZ-CG 3.67Å; F94-I102 HydrophobicContact CE2-CD1 4.48Å; F94-L202 HydrophobicContact CE1-CD2 4.49Å; F94-L202 HydrophobicContact CE2-CD2 4.41Å; F94-L202 HydrophobicContact CZ-CD2 3.64Å; F94-W242 HydrophobicContact CE2-CD2 4.4Å; F94-W242 HydrophobicContact CE2-CE3 4.47Å
95	T	55.9	Low	56.4	Low	37 Å²	37	64 Å²	64	23%	0.227	33%	0.326	C	S	.	.			trans	-86	163.2	179.8	56.6	0	0	0	0	110.9	S93 S97 G98 L99 E127	S93-T95 PolarHBondContact O-N 2.8Å; T95-S97 PolarHBondContact O-N 3.04Å; T95-S97 PolarHBondContact OG1-OG 2.95Å; T95-G98 WeakPolarHBondContact O-CA 3.24Å; T95-G98 PolarHBondContact O-N 2.65Å; T95-L99 PolarHBondContact O-N 2.9Å; T95-L99 VanDerWaalsContact O-N 3.13Å; T95-E127 WeakPolarHBondContact CB-OE1 3.21Å; T95-E127 VanDerWaalsContact CG2-OE1 3.28Å; T95-E127 WeakPolarHBondContact CG2-OE1 3.23Å; T95-E127 PolarHBondContact OG1-OE1 3.36Å
96	A	59.5	Low	58.3	Low	40 Å²	40	63.7 Å²	63.7	33%	0.331	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-33	-177.6	0	0	0	0	0	112.3	C100 L130	A96-C100 VanDerWaalsContact O-CB 3.28Å; A96-C100 WeakPolarHBondContact O-CB 3.44Å; A96-C100 PolarHBondContact O-N 2.89Å; A96-L130 HydrophobicContact CB-CD1 4.06Å
97	S	63	Low	60.2	Low	10 Å²	10	57.6 Å²	57.6	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-43.2	169.1	56.1	0	0	0	0	111.9	T95 L99 C100 N101 V125 E127	T95-S97 PolarHBondContact O-N 3.04Å; T95-S97 PolarHBondContact OG1-OG 2.95Å; S97-L99 PolarHBondContact O-N 2.85Å; S97-C100 PolarHBondContact O-N 3.37Å; S97-N101 VanDerWaalsContact O-CB 3.23Å; S97-N101 WeakPolarHBondContact O-CB 3.49Å; S97-N101 PolarHBondContact O-N 2.9Å; S97-N101 PolarHBondContact O-ND2 3.44Å; S97-V125 WeakPolarHBondContact CB-O 3.47Å; S97-E127 WeakPolarHBondContact OG-CG 3.31Å; S97-E127 PolarHBondContact OG-OE1 3.47Å
98	G	64.8	Low	62.1	Low	23 Å²	23	50.8 Å²	50.8	24%	0.237	28%	0.275	C	S	.	.	H	α-helix	trans	-56.4	-48.4	176.2	0	0	0	0	0	112.4	T95 N101 I102	T95-G98 WeakPolarHBondContact O-CA 3.24Å; T95-G98 PolarHBondContact O-N 2.65Å; G98-N101 PolarHBondContact O-N 2.88Å; G98-I102 WeakPolarHBondContact O-CD1 3.26Å; G98-I102 VanDerWaalsContact O-CG1 3.29Å; G98-I102 WeakPolarHBondContact O-CG1 3.42Å; G98-I102 PolarHBondContact O-N 3.33Å; G98-I102 VanDerWaalsContact O-N 3.15Å
99	L	67.1	Low	63.9	Low	27 Å²	27	53.4 Å²	53.4	14%	0.141	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-50.4	172.4	-90.6	170.7	0	0	0	112.4	F37 F94 T95 S97 N101 I102 W103 L202 M204	F37-L99 HydrophobicContact CE1-CD1 4.07Å; F37-L99 HydrophobicContact CZ-CD1 4.43Å; F94-L99 HydrophobicContact CD1-CD1 4.35Å; F94-L99 HydrophobicContact CD1-CG 4.27Å; F94-L99 HydrophobicContact CE1-CD1 3.72Å; F94-L99 HydrophobicContact CE1-CD2 3.67Å; F94-L99 HydrophobicContact CE1-CG 3.52Å; F94-L99 HydrophobicContact CE2-CD2 4.47Å; F94-L99 HydrophobicContact CZ-CD1 4.36Å; F94-L99 HydrophobicContact CZ-CD2 3.45Å; F94-L99 VanDerWaalsContact CZ-CD2 3.45Å; F94-L99 HydrophobicContact CZ-CG 3.67Å; T95-L99 PolarHBondContact O-N 2.9Å; T95-L99 VanDerWaalsContact O-N 3.13Å; S97-L99 PolarHBondContact O-N 2.85Å; L99-N101 VanDerWaalsContact C-N 3.27Å; L99-N101 PolarHBondContact O-N 3.44Å; L99-I102 PolarHBondContact O-N 2.95Å; L99-W103 PolarHBondContact O-N 2.85Å; L99-L202 HydrophobicContact CD2-CD2 4.45Å; L99-M204 HydrophobicContact CD2-CE 4.46Å; L99-M204 HydrophobicContact CD2-SD 3.7Å
100	C	69.8	Low	65.9	Low	25 Å²	25	49.2 Å²	49.2	17%	0.169	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-38.5	-179.7	-172.5	0	0	0	0	111.6	A96 S97 W103 L104 L130	A96-C100 VanDerWaalsContact O-CB 3.28Å; A96-C100 WeakPolarHBondContact O-CB 3.44Å; A96-C100 PolarHBondContact O-N 2.89Å; S97-C100 PolarHBondContact O-N 3.37Å; C100-W103 PolarHBondContact O-N 3.13Å; C100-L104 WeakPolarHBondContact O-CB 3.39Å; C100-L104 VanDerWaalsContact O-CG 3.29Å; C100-L104 WeakPolarHBondContact O-CG 3.42Å; C100-L104 PolarHBondContact O-N 3.31Å; C100-L130 HydrophobicContact CB-CD1 4.06Å
101	N	72	Confident	67.6	Low	41 Å²	41	41.5 Å²	41.5	22%	0.219	25%	0.245	C	C	.	.	H	α-helix	trans	-72.5	-31.9	179.9	-71	-30.9	0	0	0	113.2	S97 G98 L99 Q105 P124 V125	S97-N101 VanDerWaalsContact O-CB 3.23Å; S97-N101 WeakPolarHBondContact O-CB 3.49Å; S97-N101 PolarHBondContact O-N 2.9Å; S97-N101 PolarHBondContact O-ND2 3.44Å; G98-N101 PolarHBondContact O-N 2.88Å; L99-N101 VanDerWaalsContact C-N 3.27Å; L99-N101 PolarHBondContact O-N 3.44Å; N101-Q105 VanDerWaalsContact O-CB 3.3Å; N101-Q105 WeakPolarHBondContact O-CB 3.49Å; N101-Q105 PolarHBondContact O-N 2.88Å; N101-P124 VanDerWaalsContact OD1-CA 3.25Å; N101-P124 WeakPolarHBondContact OD1-CA 3.28Å; N101-V125 PolarHBondContact ND2-O 2.76Å; N101-V125 VanDerWaalsContact ND2-O 3.08Å; N101-V125 PolarHBondContact OD1-N 3.33Å
102	I	73.9	Confident	69.3	Low	34 Å²	34	40.2 Å²	40.2	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-39.4	171.6	-62.2	157.8	0	0	0	110.4	F94 G98 L99 K106 V240 W242	F94-I102 HydrophobicContact CE2-CD1 4.48Å; G98-I102 WeakPolarHBondContact O-CD1 3.26Å; G98-I102 VanDerWaalsContact O-CG1 3.29Å; G98-I102 WeakPolarHBondContact O-CG1 3.42Å; G98-I102 PolarHBondContact O-N 3.33Å; G98-I102 VanDerWaalsContact O-N 3.15Å; L99-I102 PolarHBondContact O-N 2.95Å; I102-K106 PolarHBondContact O-N 3.42Å; I102-V240 HydrophobicContact CG2-CG1 3.6Å; I102-W242 VanDerWaalsContact CD1-CD1 3.49Å; I102-W242 HydrophobicContact CD1-CG 4.06Å
103	W	76.3	Confident	71.1	Confident	24 Å²	24	44.7 Å²	44.7	9%	0.091	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-49.8	172.1	-87.1	76.3	0	0	0	111.7	L99 C100 Q105 K106 I107 M186 M188 M204 I235 L238 V240	L99-W103 PolarHBondContact O-N 2.85Å; C100-W103 PolarHBondContact O-N 3.13Å; W103-Q105 VanDerWaalsContact C-N 3.33Å; W103-Q105 PolarHBondContact O-N 3.4Å; W103-K106 PolarHBondContact O-N 2.93Å; W103-I107 VanDerWaalsContact O-CG1 3.31Å; W103-I107 WeakPolarHBondContact O-CG1 3.39Å; W103-I107 PolarHBondContact O-N 3.46Å; W103-M186 HydrophobicContact CH2-CE 4.25Å; W103-M186 HydrophobicContact CZ3-CE 4.34Å; W103-M188 HydrophobicContact CD2-CE 4.47Å; W103-M188 HydrophobicContact CH2-CE 3.76Å; W103-M188 HydrophobicContact CZ2-CE 3.16Å; W103-M204 HydrophobicContact CZ2-CB 4.07Å; W103-I235 HydrophobicContact CZ3-CG2 4.31Å; W103-L238 HydrophobicContact CE3-CD2 3.73Å; W103-L238 HydrophobicContact CH2-CB 4.36Å; W103-L238 HydrophobicContact CZ3-CB 3.95Å; W103-L238 HydrophobicContact CZ3-CD2 3.86Å; W103-L238 HydrophobicContact CZ3-CG 4.43Å; W103-V240 HydrophobicContact CD2-CB 4.45Å; W103-V240 HydrophobicContact CD2-CG2 3.57Å; W103-V240 HydrophobicContact CE3-CG2 4.01Å; W103-V240 HydrophobicContact CG-CG2 3.99Å; W103-V240 HydrophobicContact CH2-CG2 3.97Å; W103-V240 HydrophobicContact CZ2-CB 4.01Å; W103-V240 HydrophobicContact CZ2-CG2 3.55Å; W103-V240 HydrophobicContact CZ3-CG2 4.19Å
104	L	80.2	Confident	72.7	Confident	9 Å²	9	43.3 Å²	43.3	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-35.1	-179.7	-74.9	167.4	0	0	0	113.3	C100 I107 N108 F122 V125 L162	C100-L104 WeakPolarHBondContact O-CB 3.39Å; C100-L104 VanDerWaalsContact O-CG 3.29Å; C100-L104 WeakPolarHBondContact O-CG 3.42Å; C100-L104 PolarHBondContact O-N 3.31Å; L104-I107 PolarHBondContact O-N 3.48Å; L104-N108 WeakPolarHBondContact O-CB 3.35Å; L104-N108 PolarHBondContact O-N 3.48Å; L104-F122 HydrophobicContact CD2-CB 4.45Å; L104-F122 HydrophobicContact CD2-CD2 4.47Å; L104-V125 HydrophobicContact CD1-CB 4.06Å; L104-V125 HydrophobicContact CD1-CG2 3.46Å; L104-V125 VanDerWaalsContact CD1-CG2 3.46Å; L104-L162 HydrophobicContact CD1-CD2 4.02Å; L104-L162 HydrophobicContact CD2-CD1 3.87Å; L104-L162 HydrophobicContact CD2-CD2 3.82Å; L104-L162 HydrophobicContact CD2-CG 4.48Å
105	Q	78.5	Confident	73.6	Confident	106 Å²	106	41.5 Å²	41.5	50%	0.495	24%	0.236	S	C	.	.	H	α-helix	trans	-60.4	-50.4	173.5	-177.8	176.9	-5.8	0	0	110.7	N101 W103 I107 N108 D109	N101-Q105 VanDerWaalsContact O-CB 3.3Å; N101-Q105 WeakPolarHBondContact O-CB 3.49Å; N101-Q105 PolarHBondContact O-N 2.88Å; W103-Q105 VanDerWaalsContact C-N 3.33Å; W103-Q105 PolarHBondContact O-N 3.4Å; Q105-I107 VanDerWaalsContact C-N 3.32Å; Q105-I107 PolarHBondContact O-N 2.82Å; Q105-N108 WeakPolarHBondContact O-CB 3.49Å; Q105-N108 PolarHBondContact O-N 3.35Å; Q105-D109 VanDerWaalsContact O-CG 3.27Å; Q105-D109 PolarHBondContact O-N 2.81Å
106	K	79.7	Confident	73.9	Confident	55 Å²	55	51.1 Å²	51.1	24%	0.239	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-33.9	176.6	-79.6	172.7	166	-95.4	0	112.9	I102 W103 D109 C110 L238 I239 V240	I102-K106 PolarHBondContact O-N 3.42Å; W103-K106 PolarHBondContact O-N 2.93Å; K106-D109 PolarHBondContact O-N 2.92Å; K106-C110 PolarHBondContact O-N 3.17Å; K106-C110 PolarHBondContact O-SG 3.26Å; K106-C110 VanDerWaalsContact O-SG 3.35Å; K106-L238 HydrophobicContact CB-CD1 4.2Å; K106-L238 HydrophobicContact CB-CD2 3.92Å; K106-L238 HydrophobicContact CB-CG 4.36Å; K106-I239 PolarHBondContact NZ-O 3.06Å; K106-V240 HydrophobicContact CD-CB 4.13Å; K106-V240 HydrophobicContact CD-CG1 4.05Å; K106-V240 HydrophobicContact CD-CG2 3.75Å
107	I	82.2	Confident	74.1	Confident	13 Å²	13	56.1 Å²	56.1	7%	0.067	29%	0.285	C	S	.	.	H	α-helix	trans	-67	-43.3	173.8	-69.3	165.8	0	0	0	110.9	W103 L104 Q105 D109 C110 I111 F122 I235 L238	W103-I107 VanDerWaalsContact O-CG1 3.31Å; W103-I107 WeakPolarHBondContact O-CG1 3.39Å; W103-I107 PolarHBondContact O-N 3.46Å; L104-I107 PolarHBondContact O-N 3.48Å; Q105-I107 VanDerWaalsContact C-N 3.32Å; Q105-I107 PolarHBondContact O-N 2.82Å; I107-D109 VanDerWaalsContact C-N 3.34Å; I107-D109 PolarHBondContact O-N 3.11Å; I107-C110 PolarHBondContact O-N 2.9Å; I107-I111 HydrophobicContact CG2-CD1 3.55Å; I107-I111 HydrophobicContact CG2-CG1 4.23Å; I107-I111 WeakPolarHBondContact O-CB 3.36Å; I107-I111 VanDerWaalsContact O-CG1 3.31Å; I107-I111 WeakPolarHBondContact O-CG1 3.32Å; I107-I111 PolarHBondContact O-N 3.08Å; I107-F122 HydrophobicContact CG2-CE2 4.46Å; I107-I235 HydrophobicContact CD1-CD1 4.29Å; I107-I235 HydrophobicContact CD1-CG1 4.03Å; I107-I235 HydrophobicContact CG1-CG1 4.46Å; I107-L238 HydrophobicContact CG1-CD2 3.77Å
108	N	83.2	Confident	74.3	Confident	11 Å²	11	56.4 Å²	56.4	6%	0.059	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-46	172.2	-76.9	-8.5	0	0	0	110.4	L104 Q105 C110 I111 N112 F122	L104-N108 WeakPolarHBondContact O-CB 3.35Å; L104-N108 PolarHBondContact O-N 3.48Å; Q105-N108 WeakPolarHBondContact O-CB 3.49Å; Q105-N108 PolarHBondContact O-N 3.35Å; N108-C110 PolarHBondContact O-N 3.1Å; N108-I111 PolarHBondContact O-N 2.74Å; N108-N112 WeakPolarHBondContact O-CB 3.22Å; N108-N112 PolarHBondContact O-N 3.04Å; N108-N112 VanDerWaalsContact O-N 3.11Å; N108-N112 PolarHBondContact O-ND2 2.74Å; N108-F122 PolarHBondContact ND2-N 3.28Å; N108-F122 PolarHBondContact ND2-O 3.26Å; N108-F122 WeakPolarHBondContact OD1-CB 3.21Å; N108-F122 VanDerWaalsContact OD1-CD2 3.26Å; N108-F122 WeakPolarHBondContact OD1-CD2 3.48Å; N108-F122 PolarHBondContact OD1-N 3Å
109	D	81.2	Confident	74.6	Confident	88 Å²	88	58 Å²	58	47%	0.471	29%	0.293	S	S	.	.	H	α-helix	trans	-59.4	-44.9	177.3	-65.4	-29.8	0	0	0	111.3	Q105 K106 I107 N113	Q105-D109 VanDerWaalsContact O-CG 3.27Å; Q105-D109 PolarHBondContact O-N 2.81Å; K106-D109 PolarHBondContact O-N 2.92Å; I107-D109 VanDerWaalsContact C-N 3.34Å; I107-D109 PolarHBondContact O-N 3.11Å; D109-N113 PolarHBondContact O-N 2.55Å; D109-N113 PolarHBondContact O-ND2 3.41Å
110	C	79.8	Confident	74.9	Confident	41 Å²	41	56.8 Å²	56.8	28%	0.277	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-49.4	177.1	-72.8	0	0	0	0	113	K106 I107 N108 N112 N113 S114 I234	K106-C110 PolarHBondContact O-N 3.17Å; K106-C110 PolarHBondContact O-SG 3.26Å; K106-C110 VanDerWaalsContact O-SG 3.35Å; I107-C110 PolarHBondContact O-N 2.9Å; N108-C110 PolarHBondContact O-N 3.1Å; C110-N112 VanDerWaalsContact C-N 3.33Å; C110-N112 PolarHBondContact O-N 3.39Å; C110-N113 WeakPolarHBondContact O-CB 3.46Å; C110-N113 PolarHBondContact O-N 3.41Å; C110-S114 PolarHBondContact O-N 3.4Å; C110-S114 PolarHBondContact O-OG 3.35Å; C110-I234 HydrophobicContact CB-CD1 4.21Å; C110-I234 HydrophobicContact CB-CG1 4.34Å; C110-I234 HydrophobicContact CB-CG2 3.59Å
111	I	79.6	Confident	75.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-41.4	-176.5	-70.7	172.4	0	0	0	111.4	I107 N108 N113 S114 L115 I120 F122 L230 I234	I107-I111 HydrophobicContact CG2-CD1 3.55Å; I107-I111 HydrophobicContact CG2-CG1 4.23Å; I107-I111 WeakPolarHBondContact O-CB 3.36Å; I107-I111 VanDerWaalsContact O-CG1 3.31Å; I107-I111 WeakPolarHBondContact O-CG1 3.32Å; I107-I111 PolarHBondContact O-N 3.08Å; N108-I111 PolarHBondContact O-N 2.74Å; I111-N113 PolarHBondContact O-N 3.49Å; I111-S114 PolarHBondContact O-N 2.92Å; I111-L115 HydrophobicContact CG2-CD1 3.67Å; I111-L115 HydrophobicContact CG2-CG 4.23Å; I111-L115 WeakPolarHBondContact O-CB 3.45Å; I111-L115 PolarHBondContact O-N 3.3Å; I111-I120 HydrophobicContact CG2-CB 4.07Å; I111-I120 HydrophobicContact CG2-CD1 4.42Å; I111-F122 HydrophobicContact CD1-CE2 3.71Å; I111-F122 HydrophobicContact CD1-CZ 4.45Å; I111-L230 HydrophobicContact CG1-CD2 4.38Å; I111-I234 HydrophobicContact CG1-CD1 3.67Å
112	N	76.9	Confident	75.5	Confident	60 Å²	60	59 Å²	59	32%	0.321	29%	0.293	S	S	.	.	H	α-helix	trans	-72.7	-12.7	178.2	-69	-69.7	0	0	0	113.6	N108 C110 S119 I120	N108-N112 WeakPolarHBondContact O-CB 3.22Å; N108-N112 PolarHBondContact O-N 3.04Å; N108-N112 VanDerWaalsContact O-N 3.11Å; N108-N112 PolarHBondContact O-ND2 2.74Å; C110-N112 VanDerWaalsContact C-N 3.33Å; C110-N112 PolarHBondContact O-N 3.39Å; N112-S119 WeakPolarHBondContact OD1-CA 3.27Å; N112-S119 WeakPolarHBondContact OD1-CB 3.31Å; N112-I120 PolarHBondContact ND2-O 2.88Å; N112-I120 PolarHBondContact OD1-N 3.19Å; N112-I120 VanDerWaalsContact OD1-N 3.09Å
113	N	77.3	Confident	75.6	Confident	134 Å²	134	60.6 Å²	60.6	72%	0.717	31%	0.305	S	S	*	.	H	α-helix	trans	-87.8	-33.4	167.9	-77	-62	0	0	0	112.3	D109 C110 I111	D109-N113 PolarHBondContact O-N 2.55Å; D109-N113 PolarHBondContact O-ND2 3.41Å; C110-N113 WeakPolarHBondContact O-CB 3.46Å; C110-N113 PolarHBondContact O-N 3.41Å; I111-N113 PolarHBondContact O-N 3.49Å
114	S	74.7	Confident	75.3	Confident	65 Å²	65	63.7 Å²	63.7	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-77.5	-40.1	178.3	-58.4	0	0	0	0	113.3	C110 I111 R116	C110-S114 PolarHBondContact O-N 3.4Å; C110-S114 PolarHBondContact O-OG 3.35Å; I111-S114 PolarHBondContact O-N 2.92Å; S114-R116 PolarHBondContact O-N 2.93Å
115	L	69.9	Low	74.6	Confident	29 Å²	29	63.8 Å²	63.8	15%	0.152	33%	0.329	C	S	.	.			trans	-94.6	91.3	-176.2	-63.6	-179.4	0	0	0	111.7	I111 E117 T118 I120 L222 L230	I111-L115 HydrophobicContact CG2-CD1 3.67Å; I111-L115 HydrophobicContact CG2-CG 4.23Å; I111-L115 WeakPolarHBondContact O-CB 3.45Å; I111-L115 PolarHBondContact O-N 3.3Å; L115-E117 PolarHBondContact O-N 2.88Å; L115-T118 WeakPolarHBondContact CB-O 3.45Å; L115-I120 HydrophobicContact CD1-CD1 3.62Å; L115-I120 HydrophobicContact CD1-CG1 4.2Å; L115-L222 HydrophobicContact CD1-CD1 4.35Å; L115-L230 HydrophobicContact CD2-CD1 4.09Å
116	R	63.2	Low	73.6	Confident	239 Å²	239	61.6 Å²	61.6	90%	0.902	33%	0.325	S	S	*	.	S	Bend	trans	-63.2	-22.1	179.6	-66.1	-173	178.2	-166	0.8	115.1	S114	S114-R116 PolarHBondContact O-N 2.93Å
117	E	63.2	Low	72.5	Confident	145 Å²	145	64.3 Å²	64.3	68%	0.678	34%	0.339	S	S	*	.	S	Bend	trans	-115.6	-10.1	-169.3	-63	178.1	-179.3	0	0	114.3	L115 I169	L115-E117 PolarHBondContact O-N 2.88Å; E117-I169 HydrophobicContact CB-CD1 4.13Å; E117-I169 HydrophobicContact CG-CD1 4.28Å; E117-I169 PolarHBondContact O-N 3.17Å
118	T	66.7	Low	70.9	Confident	16 Å²	16	73.7 Å²	73.7	10%	0.098	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	109.5	-178.2	43.7	0	0	0	0	109.8	L115 T168	L115-T118 WeakPolarHBondContact CB-O 3.45Å; T118-T168 HydrophobicContact CG2-CG2 3.96Å
119	S	70.2	Confident	69.6	Low	55 Å²	55	75.7 Å²	75.7	39%	0.385	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.4	172.1	57.4	0	0	0	0	109.7	N112 V167	N112-S119 WeakPolarHBondContact OD1-CA 3.27Å; N112-S119 WeakPolarHBondContact OD1-CB 3.31Å; S119-V167 PolarHBondContact N-O 3.44Å; S119-V167 PolarHBondContact O-N 3.33Å; S119-V167 PolarHBondContact OG-O 2.95Å
120	I	74.6	Confident	68.6	Low	2 Å²	2	72.1 Å²	72.1	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.4	-179.6	-57.4	179.1	0	0	0	106.9	I111 N112 L115 F122 V166 F227	I111-I120 HydrophobicContact CG2-CB 4.07Å; I111-I120 HydrophobicContact CG2-CD1 4.42Å; N112-I120 PolarHBondContact ND2-O 2.88Å; N112-I120 PolarHBondContact OD1-N 3.19Å; N112-I120 VanDerWaalsContact OD1-N 3.09Å; L115-I120 HydrophobicContact CD1-CD1 3.62Å; L115-I120 HydrophobicContact CD1-CG1 4.2Å; I120-F122 HydrophobicContact CG2-CD1 4.35Å; I120-F122 HydrophobicContact CG2-CE1 3.72Å; I120-F122 HydrophobicContact CG2-CE2 4.24Å; I120-F122 HydrophobicContact CG2-CZ 3.65Å; I120-V166 HydrophobicContact CG1-CG1 4.31Å; I120-V166 HydrophobicContact CG1-CG2 4.24Å; I120-V166 HydrophobicContact CG2-CG2 4.34Å; I120-F227 HydrophobicContact CD1-CE2 3.76Å; I120-F227 HydrophobicContact CD1-CZ 4.46Å
121	H	75.7	Confident	67.3	Low	107 Å²	107	73.4 Å²	73.4	50%	0.495	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	103.5	-180	-176.9	-75	0	0	0	110.3	G164 D165	H121-G164 VanDerWaalsContact O-CA 3.23Å; H121-G164 WeakPolarHBondContact O-CA 3.35Å; H121-D165 PolarHBondContact N-O 2.97Å; H121-D165 PolarHBondContact O-N 2.89Å; H121-D165 VanDerWaalsContact O-N 3.09Å
122	F	78.3	Confident	66.5	Low	5 Å²	5	77.9 Å²	77.9	2%	0.022	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	135.1	174.4	-59.2	-55.5	0	0	0	111.4	L104 I107 N108 I111 I120 L162 L179 F227	L104-F122 HydrophobicContact CD2-CB 4.45Å; L104-F122 HydrophobicContact CD2-CD2 4.47Å; I107-F122 HydrophobicContact CG2-CE2 4.46Å; N108-F122 PolarHBondContact ND2-N 3.28Å; N108-F122 PolarHBondContact ND2-O 3.26Å; N108-F122 WeakPolarHBondContact OD1-CB 3.21Å; N108-F122 VanDerWaalsContact OD1-CD2 3.26Å; N108-F122 WeakPolarHBondContact OD1-CD2 3.48Å; N108-F122 PolarHBondContact OD1-N 3Å; I111-F122 HydrophobicContact CD1-CE2 3.71Å; I111-F122 HydrophobicContact CD1-CZ 4.45Å; I120-F122 HydrophobicContact CG2-CD1 4.35Å; I120-F122 HydrophobicContact CG2-CE1 3.72Å; I120-F122 HydrophobicContact CG2-CE2 4.24Å; I120-F122 HydrophobicContact CG2-CZ 3.65Å; F122-L162 HydrophobicContact CD1-CB 4.15Å; F122-L179 HydrophobicContact CE1-CD1 3.46Å; F122-L179 VanDerWaalsContact CE1-CD1 3.46Å; F122-L179 HydrophobicContact CE1-CG 4.11Å; F122-L179 HydrophobicContact CZ-CD1 3.44Å; F122-L179 VanDerWaalsContact CZ-CD1 3.44Å; F122-F227 HydrophobicContact CZ-CZ 4.31Å
123	T	76.4	Confident	66.1	Low	68 Å²	68	76.4 Å²	76.4	42%	0.417	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-68.6	138.7	175.1	-48.2	0	0	0	0	109.1	V125 H163	T123-V125 PolarHBondContact O-N 2.82Å; T123-H163 WeakPolarHBondContact CB-O 3.25Å; T123-H163 PolarHBondContact N-O 2.84Å; T123-H163 PolarHBondContact OG1-O 3.28Å
124	P	69	Low	65.8	Low	89 Å²	89	76 Å²	76	58%	0.578	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-56.7	130.8	173.6	22.6	-33.8	0	0	0	111.4	N101	N101-P124 VanDerWaalsContact OD1-CA 3.25Å; N101-P124 WeakPolarHBondContact OD1-CA 3.28Å
125	V	65.3	Low	65.7	Low	12 Å²	12	74.7 Å²	74.7	7%	0.073	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-73.5	128.8	-176.2	165.3	0	0	0	0	110.7	S97 N101 L104 T123 T129 L130 L162	S97-V125 WeakPolarHBondContact CB-O 3.47Å; N101-V125 PolarHBondContact ND2-O 2.76Å; N101-V125 VanDerWaalsContact ND2-O 3.08Å; N101-V125 PolarHBondContact OD1-N 3.33Å; L104-V125 HydrophobicContact CD1-CB 4.06Å; L104-V125 HydrophobicContact CD1-CG2 3.46Å; L104-V125 VanDerWaalsContact CD1-CG2 3.46Å; T123-V125 PolarHBondContact O-N 2.82Å; V125-T129 VanDerWaalsContact CG1-OG1 3.24Å; V125-T129 WeakPolarHBondContact CG1-OG1 3.28Å; V125-L130 HydrophobicContact CG1-CD1 3.97Å; V125-L130 HydrophobicContact CG1-CG 4.09Å; V125-L162 HydrophobicContact CG2-CD2 3.78Å
126	S	59	Low	65.8	Low	60 Å²	60	75.5 Å²	75.5	42%	0.42	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-79.8	151.7	173	68.8	0	0	0	0	111.8	Y128 T129	S126-Y128 PolarHBondContact O-N 2.88Å; S126-T129 PolarHBondContact O-N 3.46Å; S126-T129 PolarHBondContact O-OG1 3.02Å
127	E	55.3	Low	66.2	Low	111 Å²	111	69.4 Å²	69.4	52%	0.519	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-55.5	-26.3	-178.3	-69.8	175.5	-168.7	0	0	114.6	T95 S97 T129 L130	T95-E127 WeakPolarHBondContact CB-OE1 3.21Å; T95-E127 VanDerWaalsContact CG2-OE1 3.28Å; T95-E127 WeakPolarHBondContact CG2-OE1 3.23Å; T95-E127 PolarHBondContact OG1-OE1 3.36Å; S97-E127 WeakPolarHBondContact OG-CG 3.31Å; S97-E127 PolarHBondContact OG-OE1 3.47Å; E127-T129 VanDerWaalsContact C-N 3.32Å; E127-T129 PolarHBondContact O-N 3.21Å; E127-L130 PolarHBondContact O-N 3.11Å
128	Y	48.8	Very low	66.5	Low	211 Å²	211	66.7 Å²	66.7	83%	0.827	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-68.3	-20.1	-176.2	-61	-76	0	0	0	115.3	S126	S126-Y128 PolarHBondContact O-N 2.88Å
129	T	56.3	Low	66.8	Low	52 Å²	52	70.1 Å²	70.1	32%	0.319	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-92.8	-6.8	-178.8	61.5	0	0	0	0	113.9	V125 S126 E127	V125-T129 VanDerWaalsContact CG1-OG1 3.24Å; V125-T129 WeakPolarHBondContact CG1-OG1 3.28Å; S126-T129 PolarHBondContact O-N 3.46Å; S126-T129 PolarHBondContact O-OG1 3.02Å; E127-T129 VanDerWaalsContact C-N 3.32Å; E127-T129 PolarHBondContact O-N 3.21Å
130	L	59.8	Low	66.8	Low	13 Å²	13	71.5 Å²	71.5	7%	0.068	37%	0.371	C	S	.	.			trans	-100.8	27.6	-177.2	-66.5	168.3	0	0	0	112.2	A96 C100 V125 E127 D132 V133 L160	A96-L130 HydrophobicContact CB-CD1 4.06Å; C100-L130 HydrophobicContact CB-CD1 4.06Å; V125-L130 HydrophobicContact CG1-CD1 3.97Å; V125-L130 HydrophobicContact CG1-CG 4.09Å; E127-L130 PolarHBondContact O-N 3.11Å; L130-D132 PolarHBondContact O-N 3.03Å; L130-D132 VanDerWaalsContact O-N 3.16Å; L130-V133 HydrophobicContact CB-CG2 4.04Å; L130-V133 HydrophobicContact CD2-CG2 3.9Å; L130-L160 HydrophobicContact CD2-CD1 4.02Å
131	S	52.1	Low	66.5	Low	68 Å²	68	76.3 Å²	76.3	48%	0.476	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-25	-170.1	52.7	0	0	0	0	115.3	T34	T34-S131 WeakPolarHBondContact CG2-O 3.21Å; T34-S131 PolarHBondContact OG1-O 3.33Å
132	D	63.6	Low	65.8	Low	95 Å²	95	77.5 Å²	77.5	51%	0.508	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	18.9	-168.2	-68.2	-88.1	0	0	0	114.4	L130 K134 P158	L130-D132 PolarHBondContact O-N 3.03Å; L130-D132 VanDerWaalsContact O-N 3.16Å; D132-K134 PolarHBondContact O-N 2.9Å; D132-P158 HydrophobicContact CB-CG 4.1Å; D132-P158 VanDerWaalsContact O-CD 3.29Å; D132-P158 WeakPolarHBondContact O-CD 3.3Å
133	V	68.3	Low	65.1	Low	29 Å²	29	80.9 Å²	80.9	18%	0.176	42%	0.415	C	S	.	.			trans	-61.7	120.7	174.2	179.6	0	0	0	0	110.2	T34 L130 I135 V155 I157	T34-V133 HydrophobicContact CG2-CB 4.2Å; T34-V133 VanDerWaalsContact CG2-O 3.3Å; T34-V133 WeakPolarHBondContact CG2-O 3.43Å; L130-V133 HydrophobicContact CB-CG2 4.04Å; L130-V133 HydrophobicContact CD2-CG2 3.9Å; V133-I135 HydrophobicContact CG1-CG1 4.37Å; V133-V155 HydrophobicContact CG1-CG1 4.31Å; V133-I157 HydrophobicContact CG1-CG1 4.3Å; V133-I157 HydrophobicContact CG2-CD1 4.17Å; V133-I157 HydrophobicContact CG2-CG1 4.08Å; V133-I157 HydrophobicContact CG2-CG2 4.11Å
134	K	70.8	Confident	63.9	Low	125 Å²	125	85.8 Å²	85.8	54%	0.543	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.1	177.3	-70.7	162.9	-170.8	164.4	0	109.6	D132 S156	D132-K134 PolarHBondContact O-N 2.9Å; K134-S156 WeakPolarHBondContact CB-OG 3.23Å; K134-S156 PolarHBondContact N-O 3.39Å; K134-S156 PolarHBondContact O-N 3.27Å; K134-S156 PolarHBondContact O-OG 2.59Å; K134-S156 VanDerWaalsContact O-OG 3.05Å
135	I	72.1	Confident	63.6	Low	37 Å²	37	85.8 Å²	85.8	19%	0.19	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.1	177.2	-64.1	170.5	0	0	0	108.6	F37 V133 F153 T154 V155	F37-I135 HydrophobicContact CB-CD1 4.42Å; F37-I135 HydrophobicContact CD1-CD1 4.29Å; F37-I135 HydrophobicContact CD2-CD1 3.43Å; F37-I135 VanDerWaalsContact CD2-CD1 3.43Å; F37-I135 HydrophobicContact CE1-CD1 4.45Å; F37-I135 HydrophobicContact CE2-CD1 3.62Å; F37-I135 HydrophobicContact CG-CD1 3.79Å; F37-I135 HydrophobicContact CZ-CD1 4.13Å; V133-I135 HydrophobicContact CG1-CG1 4.37Å; I135-F153 HydrophobicContact CG2-CB 3.84Å; I135-F153 HydrophobicContact CG2-CD2 3.8Å; I135-F153 HydrophobicContact CG2-CG 4.05Å; I135-T154 CarbonylContact C-O 3.53Å; I135-T154 VanDerWaalsContact CA-O 3.3Å; I135-T154 WeakPolarHBondContact CA-O 3.43Å; I135-V155 HydrophobicContact CG1-CG2 4.4Å
136	S	73.5	Confident	63.3	Low	46 Å²	46	91 Å²	91	32%	0.322	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	177	-179.9	59.7	0	0	0	0	111.6	F138 T154	S136-F138 PolarHBondContact O-N 3.31Å; S136-F138 VanDerWaalsContact O-N 3.1Å; S136-T154 PolarHBondContact N-O 3Å; S136-T154 PolarHBondContact O-N 3.47Å; S136-T154 WeakPolarHBondContact OG-CB 3.3Å
137	D	71.7	Confident	63.7	Low	112 Å²	112	90.8 Å²	90.8	60%	0.599	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55.8	35.8	167	-38.4	-51.9	0	0	0	114.7	E139 T154	D137-E139 PolarHBondContact O-N 2.82Å; D137-T154 WeakPolarHBondContact CB-OG1 3.14Å; D137-T154 WeakPolarHBondContact OD2-CB 3.4Å; D137-T154 PolarHBondContact OD2-OG1 2.99Å
138	F	69.5	Low	64.6	Low	88 Å²	88	87.2 Å²	87.2	39%	0.386	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	110	179.6	-175.4	-87.9	0	0	0	111.2	S136 L151 Y152 F153	S136-F138 PolarHBondContact O-N 3.31Å; S136-F138 VanDerWaalsContact O-N 3.1Å; F138-L151 HydrophobicContact CE1-CD2 4.3Å; F138-L151 HydrophobicContact CE2-CD2 3.93Å; F138-L151 HydrophobicContact CZ-CD2 3.53Å; F138-Y152 CarbonylContact C-O 3.28Å; F138-Y152 VanDerWaalsContact CA-O 3.31Å; F138-Y152 WeakPolarHBondContact CA-O 3.49Å; F138-F153 HydrophobicContact CD2-CB 4.39Å
139	E	71.9	Confident	65.7	Low	88 Å²	88	79.4 Å²	79.4	41%	0.411	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.7	174.5	-163.4	-172.3	155.4	0	0	110.2	D137 R141 Y152	D137-E139 PolarHBondContact O-N 2.82Å; E139-R141 IonicContact OE1-CZ 3.02Å; E139-R141 VanDerWaalsContact OE1-CZ 3.3Å; E139-R141 IonicContact OE1-NE 2.87Å; E139-R141 PolarHBondContact OE1-NE 2.83Å; E139-R141 IonicContact OE1-NH2 3.87Å; E139-R141 PolarHBondContact OE1-NH2 2.83Å; E139-R141 IonicContact OE2-CZ 2.74Å; E139-R141 IonicContact OE2-NE 3.61Å; E139-R141 IonicContact OE2-NH2 3.23Å; E139-R141 PolarHBondContact OE2-NH2 3.47Å; E139-Y152 PolarHBondContact N-O 2.92Å; E139-Y152 PolarHBondContact O-N 2.83Å
140	L	71.3	Confident	66.7	Low	83 Å²	83	77 Å²	77	44%	0.435	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.9	177.3	172.1	68.4	0	0	0	108.9	F44 V149 L151	F44-L140 HydrophobicContact CE2-CD2 4.44Å; F44-L140 HydrophobicContact CZ-CD1 4.16Å; F44-L140 HydrophobicContact CZ-CD2 4.12Å; L140-V149 HydrophobicContact CD1-CG1 3.43Å; L140-V149 VanDerWaalsContact CD1-CG1 3.43Å; L140-L151 HydrophobicContact CB-CD2 4.49Å; L140-L151 HydrophobicContact CD1-CD2 3.6Å; L140-L151 HydrophobicContact CD1-CG 4.44Å
141	R	67	Low	67.5	Low	103 Å²	103	77 Å²	77	39%	0.389	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.9	172.5	-62.3	-171.7	-178.3	156.8	11.5	110.4	E139 A150 Y152	E139-R141 IonicContact OE1-CZ 3.02Å; E139-R141 VanDerWaalsContact OE1-CZ 3.3Å; E139-R141 IonicContact OE1-NE 2.87Å; E139-R141 PolarHBondContact OE1-NE 2.83Å; E139-R141 IonicContact OE1-NH2 3.87Å; E139-R141 PolarHBondContact OE1-NH2 2.83Å; E139-R141 IonicContact OE2-CZ 2.74Å; E139-R141 IonicContact OE2-NE 3.61Å; E139-R141 IonicContact OE2-NH2 3.23Å; E139-R141 PolarHBondContact OE2-NH2 3.47Å; R141-A150 PolarHBondContact N-O 2.82Å; R141-A150 PolarHBondContact O-N 2.91Å; R141-A150 VanDerWaalsContact O-O 3.13Å; R141-Y152 HydrophobicContact CB-CD2 4.49Å; R141-Y152 HydrophobicContact CB-CE2 4.1Å; R141-Y152 HydrophobicContact CG-CD2 4.22Å; R141-Y152 HydrophobicContact CG-CE2 4.09Å
142	N	62.3	Low	68.8	Low	133 Å²	133	75.4 Å²	75.4	71%	0.711	40%	0.4	S	S	*	.			trans	-84.5	108.6	159	-73.5	-2.8	0	0	0	106.2
143	E	62.7	Low	69.7	Low	76 Å²	76	71.8 Å²	71.8	36%	0.355	38%	0.38	S	S	.	.			trans	-65.7	154.9	164.3	-67.8	-66.1	116.7	0	0	109.5	L145 A150	E143-L145 HydrophobicContact CB-CB 4.37Å; E143-L145 PolarHBondContact O-N 3.14Å; E143-A150 HydrophobicContact CG-CB 3.75Å
144	D	52	Low	70.3	Confident	171 Å²	171	70.5 Å²	70.5	91%	0.914	37%	0.372	S	S	*	.	S	Bend	trans	-68.3	-3	175.9	-69.9	-52	0	0	0	113.3	P146	D144-P146 WeakPolarHBondContact O-CD 3.47Å
145	L	61.8	Low	70.8	Confident	89 Å²	89	65.2 Å²	65.2	47%	0.466	35%	0.35	S	S	.	.	S	Bend	trans	-71.5	114.3	175.6	-73	170.7	0	0	0	111.7	E143 G147 W148 M191	E143-L145 HydrophobicContact CB-CB 4.37Å; E143-L145 PolarHBondContact O-N 3.14Å; L145-G147 PolarHBondContact O-N 3.34Å; L145-G147 VanDerWaalsContact O-N 3.08Å; L145-W148 HydrophobicContact CB-CB 4.17Å; L145-W148 HydrophobicContact CB-CG 4.45Å; L145-W148 PolarHBondContact O-N 3.18Å; L145-M191 HydrophobicContact CD1-CE 3.86Å
146	P	59.6	Low	71.2	Confident	122 Å²	122	64.9 Å²	64.9	79%	0.792	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	114.4	-171.7	25.2	-34.3	0	0	0	112.5	D144	D144-P146 WeakPolarHBondContact O-CD 3.47Å
147	G	66.5	Low	71.7	Confident	55 Å²	55	63.6 Å²	63.6	57%	0.567	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.7	-0.2	176.5	0	0	0	0	0	115.5	L145	L145-G147 PolarHBondContact O-N 3.34Å; L145-G147 VanDerWaalsContact O-N 3.08Å
148	W	74.8	Confident	72.1	Confident	35 Å²	35	60.8 Å²	60.8	13%	0.133	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	148.7	169.6	-72.4	95.4	0	0	0	111.5	L145 M191 L192 K193 E201 K203	L145-W148 HydrophobicContact CB-CB 4.17Å; L145-W148 HydrophobicContact CB-CG 4.45Å; L145-W148 PolarHBondContact O-N 3.18Å; W148-M191 HydrophobicContact CB-CE 4.29Å; W148-M191 HydrophobicContact CD2-CE 4.05Å; W148-M191 HydrophobicContact CE3-CB 3.54Å; W148-M191 HydrophobicContact CE3-CE 4.14Å; W148-M191 HydrophobicContact CG-CE 4.15Å; W148-M191 HydrophobicContact CZ3-CB 3.76Å; W148-L192 CarbonylContact C-O 3.59Å; W148-L192 WeakPolarHBondContact CA-O 3.47Å; W148-K193 HydrophobicContact CD2-CB 3.85Å; W148-K193 HydrophobicContact CD2-CD 4.44Å; W148-K193 HydrophobicContact CD2-CG 4.04Å; W148-K193 HydrophobicContact CE3-CB 3.7Å; W148-K193 HydrophobicContact CE3-CG 4.4Å; W148-K193 HydrophobicContact CG-CG 4.44Å; W148-K193 HydrophobicContact CH2-CB 3.85Å; W148-K193 HydrophobicContact CH2-CD 4.29Å; W148-K193 HydrophobicContact CZ2-CB 3.98Å; W148-K193 HydrophobicContact CZ2-CD 3.71Å; W148-K193 HydrophobicContact CZ2-CG 4.17Å; W148-K193 HydrophobicContact CZ3-CB 3.72Å; W148-E201 HydrophobicContact CH2-CB 4.26Å; W148-E201 HydrophobicContact CH2-CG 4.11Å; W148-E201 WeakPolarHBondContact CH2-OE1 3.41Å; W148-K203 HydrophobicContact CH2-CD 3.69Å; W148-K203 HydrophobicContact CH2-CG 4.05Å; W148-K203 HydrophobicContact CZ2-CD 4.32Å; W148-K203 HydrophobicContact CZ3-CB 4.44Å; W148-K203 HydrophobicContact CZ3-CD 4.3Å; W148-K203 HydrophobicContact CZ3-CG 4.38Å
149	V	71.8	Confident	72.5	Confident	47 Å²	47	61.6 Å²	61.6	29%	0.285	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.8	176.1	178.7	0	0	0	0	108.2	L140 M191 L192	L140-V149 HydrophobicContact CD1-CG1 3.43Å; L140-V149 VanDerWaalsContact CD1-CG1 3.43Å; V149-M191 CarbonylContact O-C 3.57Å; V149-M191 WeakPolarHBondContact O-CA 3.38Å; V149-L192 PolarHBondContact N-O 3.26Å; V149-L192 PolarHBondContact O-N 2.76Å
150	A	78	Confident	72.9	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.7	-176.5	0	0	0	0	0	112	R141 E143 Y152	R141-A150 PolarHBondContact N-O 2.82Å; R141-A150 PolarHBondContact O-N 2.91Å; R141-A150 VanDerWaalsContact O-O 3.13Å; E143-A150 HydrophobicContact CG-CB 3.75Å; A150-Y152 HydrophobicContact CB-CD2 4.46Å; A150-Y152 HydrophobicContact CB-CE2 3.79Å
151	L	76.2	Confident	73.2	Confident	14 Å²	14	55.6 Å²	55.6	7%	0.073	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	107.2	179.1	-66.9	168.8	0	0	0	108.8	F44 F138 L140 C190 L192	F44-L151 HydrophobicContact CE1-CD2 4.36Å; F44-L151 HydrophobicContact CZ-CD2 4.27Å; F138-L151 HydrophobicContact CE1-CD2 4.3Å; F138-L151 HydrophobicContact CE2-CD2 3.93Å; F138-L151 HydrophobicContact CZ-CD2 3.53Å; L140-L151 HydrophobicContact CB-CD2 4.49Å; L140-L151 HydrophobicContact CD1-CD2 3.6Å; L140-L151 HydrophobicContact CD1-CG 4.44Å; L151-C190 HydrophobicContact CB-CB 4.02Å; L151-C190 WeakPolarHBondContact CB-O 3.34Å; L151-C190 PolarHBondContact N-O 3.03Å; L151-C190 PolarHBondContact O-N 2.95Å; L151-L192 HydrophobicContact CD1-CD1 3.55Å; L151-L192 HydrophobicContact CD1-CG 4.14Å
152	Y	80.4	Confident	73.8	Confident	35 Å²	35	51.1 Å²	51.1	14%	0.137	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.1	173.6	-64.7	-99.5	0	0	0	108.8	F138 E139 R141 A150 M188 C189	F138-Y152 CarbonylContact C-O 3.28Å; F138-Y152 VanDerWaalsContact CA-O 3.31Å; F138-Y152 WeakPolarHBondContact CA-O 3.49Å; E139-Y152 PolarHBondContact N-O 2.92Å; E139-Y152 PolarHBondContact O-N 2.83Å; R141-Y152 HydrophobicContact CB-CD2 4.49Å; R141-Y152 HydrophobicContact CB-CE2 4.1Å; R141-Y152 HydrophobicContact CG-CD2 4.22Å; R141-Y152 HydrophobicContact CG-CE2 4.09Å; A150-Y152 HydrophobicContact CB-CD2 4.46Å; A150-Y152 HydrophobicContact CB-CE2 3.79Å; Y152-M188 WeakPolarHBondContact CA-O 3.37Å; Y152-C189 HydrophobicContact CD1-CB 4.04Å; Y152-C189 HydrophobicContact CE1-CB 3.88Å
153	F	81.9	Confident	74.6	Confident	18 Å²	18	49 Å²	49	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	152.4	173.1	54.6	-91.8	0	0	0	112.1	I135 F138 V155 M188 C190 M204	I135-F153 HydrophobicContact CG2-CB 3.84Å; I135-F153 HydrophobicContact CG2-CD2 3.8Å; I135-F153 HydrophobicContact CG2-CG 4.05Å; F138-F153 HydrophobicContact CD2-CB 4.39Å; F153-V155 HydrophobicContact CD2-CG2 3.66Å; F153-V155 HydrophobicContact CE2-CG2 3.49Å; F153-V155 VanDerWaalsContact CE2-CG2 3.49Å; F153-M188 HydrophobicContact CD2-CB 4.35Å; F153-M188 HydrophobicContact CE2-CB 3.98Å; F153-M188 HydrophobicContact CE2-CG 4.37Å; F153-M188 HydrophobicContact CE2-SD 4.09Å; F153-M188 HydrophobicContact CZ-CB 4.2Å; F153-M188 PolarHBondContact N-O 2.99Å; F153-M188 PolarHBondContact O-N 3.5Å; F153-C190 HydrophobicContact CE1-CB 3.67Å; F153-C190 HydrophobicContact CZ-CB 4.28Å; F153-M204 HydrophobicContact CZ-CE 3.93Å
154	T	81.1	Confident	75.3	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.1	171.7	-53.7	0	0	0	0	109.5	I135 S136 D137 H185	I135-T154 CarbonylContact C-O 3.53Å; I135-T154 VanDerWaalsContact CA-O 3.3Å; I135-T154 WeakPolarHBondContact CA-O 3.43Å; S136-T154 PolarHBondContact N-O 3Å; S136-T154 PolarHBondContact O-N 3.47Å; S136-T154 WeakPolarHBondContact OG-CB 3.3Å; D137-T154 WeakPolarHBondContact CB-OG1 3.14Å; D137-T154 WeakPolarHBondContact OD2-CB 3.4Å; D137-T154 PolarHBondContact OD2-OG1 2.99Å; T154-H185 VanDerWaalsContact CG2-NE2 3.25Å; T154-H185 WeakPolarHBondContact CG2-NE2 3.28Å
155	V	81.5	Confident	76.6	Confident	14 Å²	14	40.1 Å²	40.1	9%	0.085	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.7	169.3	-178.5	0	0	0	0	109.2	V133 I135 F153 I157 H185 M186 M188	V133-V155 HydrophobicContact CG1-CG1 4.31Å; I135-V155 HydrophobicContact CG1-CG2 4.4Å; F153-V155 HydrophobicContact CD2-CG2 3.66Å; F153-V155 HydrophobicContact CE2-CG2 3.49Å; F153-V155 VanDerWaalsContact CE2-CG2 3.49Å; V155-I157 HydrophobicContact CG1-CD1 4.2Å; V155-I157 HydrophobicContact CG1-CG1 3.95Å; V155-H185 WeakPolarHBondContact O-CA 3.02Å; V155-M186 PolarHBondContact N-O 3.47Å; V155-M186 PolarHBondContact O-N 3.47Å; V155-M188 HydrophobicContact CB-SD 4.41Å; V155-M188 HydrophobicContact CG2-CG 4.07Å; V155-M188 HydrophobicContact CG2-SD 3.54Å; V155-M188 VanDerWaalsContact CG2-SD 3.54Å
156	S	80.6	Confident	77.3	Confident	29 Å²	29	36.1 Å²	36.1	20%	0.203	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.5	171.8	57.1	0	0	0	0	111.3	K134 Y184	K134-S156 WeakPolarHBondContact CB-OG 3.23Å; K134-S156 PolarHBondContact N-O 3.39Å; K134-S156 PolarHBondContact O-N 3.27Å; K134-S156 PolarHBondContact O-OG 2.59Å; K134-S156 VanDerWaalsContact O-OG 3.05Å; S156-Y184 CarbonylContact C-O 3.58Å; S156-Y184 VanDerWaalsContact CA-O 3.25Å; S156-Y184 WeakPolarHBondContact CA-O 3.45Å
157	I	82.4	Confident	78	Confident	19 Å²	19	32.8 Å²	32.8	10%	0.097	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	113.2	-176.8	-43.7	-179	0	0	0	108	V133 V155 M159 L160 Y184	V133-I157 HydrophobicContact CG1-CG1 4.3Å; V133-I157 HydrophobicContact CG2-CD1 4.17Å; V133-I157 HydrophobicContact CG2-CG1 4.08Å; V133-I157 HydrophobicContact CG2-CG2 4.11Å; V155-I157 HydrophobicContact CG1-CD1 4.2Å; V155-I157 HydrophobicContact CG1-CG1 3.95Å; I157-M159 VanDerWaalsContact C-N 3.28Å; I157-M159 PolarHBondContact O-N 2.79Å; I157-L160 HydrophobicContact CD1-CD2 4.43Å; I157-L160 HydrophobicContact CG2-CB 4.21Å; I157-Y184 HydrophobicContact CD1-CD1 4.14Å; I157-Y184 HydrophobicContact CG1-CD1 4.11Å; I157-Y184 PolarHBondContact N-O 3.46Å; I157-Y184 PolarHBondContact O-N 2.85Å
158	P	80	Confident	78.3	Confident	54 Å²	54	31 Å²	31	35%	0.351	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	-36.9	-175.5	-26.1	35.4	0	0	0	113.7	D132 K182 N183	D132-P158 HydrophobicContact CB-CG 4.1Å; D132-P158 VanDerWaalsContact O-CD 3.29Å; D132-P158 WeakPolarHBondContact O-CD 3.3Å; P158-K182 WeakPolarHBondContact O-CA 3.44Å; P158-N183 PolarHBondContact O-N 3.01Å
159	M	78.8	Confident	77.9	Confident	104 Å²	104	36 Å²	36	51%	0.512	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	129.6	176.7	-172.8	167.1	67.5	0	0	109.3	I157 L181 K182	I157-M159 VanDerWaalsContact C-N 3.28Å; I157-M159 PolarHBondContact O-N 2.79Å; M159-L181 CarbonylContact C-O 3.6Å; M159-L181 WeakPolarHBondContact CA-O 3.48Å; M159-K182 HydrophobicContact CG-CG 4.45Å
160	L	79.6	Confident	77.5	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	107.3	173.8	172.7	61.4	0	0	0	108.4	L130 I157 L162 L181	L130-L160 HydrophobicContact CD2-CD1 4.02Å; I157-L160 HydrophobicContact CD1-CD2 4.43Å; I157-L160 HydrophobicContact CG2-CB 4.21Å; L160-L162 HydrophobicContact CD1-CD2 4.01Å; L160-L162 HydrophobicContact CD2-CD2 4.31Å; L160-L162 HydrophobicContact CG-CD2 4Å; L160-L162 HydrophobicContact CG-CG 4.33Å; L160-L181 HydrophobicContact CB-CB 4.25Å; L160-L181 HydrophobicContact CD2-CD1 4.07Å; L160-L181 HydrophobicContact CG-CD1 4.39Å; L160-L181 PolarHBondContact N-O 2.93Å; L160-L181 PolarHBondContact O-N 3.3Å
161	C	77.7	Confident	76.7	Confident	31 Å²	31	44.6 Å²	44.6	21%	0.209	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.4	175.7	-59.4	0	0	0	0	109.7	T178 L179 S180	C161-T178 HydrophobicContact CB-CG2 4.45Å; C161-L179 CarbonylContact C-O 3.5Å; C161-L179 WeakPolarHBondContact CA-O 3.37Å; C161-S180 PolarHBondContact SG-OG 3.45Å
162	L	79.9	Confident	76.1	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.4	172.8	-56.3	180	0	0	0	108.3	L104 F122 V125 L160 T178 L179 L181	L104-L162 HydrophobicContact CD1-CD2 4.02Å; L104-L162 HydrophobicContact CD2-CD1 3.87Å; L104-L162 HydrophobicContact CD2-CD2 3.82Å; L104-L162 HydrophobicContact CD2-CG 4.48Å; F122-L162 HydrophobicContact CD1-CB 4.15Å; V125-L162 HydrophobicContact CG2-CD2 3.78Å; L160-L162 HydrophobicContact CD1-CD2 4.01Å; L160-L162 HydrophobicContact CD2-CD2 4.31Å; L160-L162 HydrophobicContact CG-CD2 4Å; L160-L162 HydrophobicContact CG-CG 4.33Å; L162-T178 WeakPolarHBondContact O-CA 3.28Å; L162-L179 HydrophobicContact CB-CB 4.49Å; L162-L179 PolarHBondContact N-O 2.89Å; L162-L179 PolarHBondContact O-N 2.99Å; L162-L181 HydrophobicContact CD1-CD1 3.96Å; L162-L181 HydrophobicContact CG-CD1 4.45Å
163	H	79.2	Confident	75.6	Confident	88 Å²	88	55.6 Å²	55.6	41%	0.407	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.3	171.5	-56	-71.8	0	0	0	108.7	T123 T178	T123-H163 WeakPolarHBondContact CB-O 3.25Å; T123-H163 PolarHBondContact N-O 2.84Å; T123-H163 PolarHBondContact OG1-O 3.28Å; H163-T178 PolarHBondContact CE1-OG1 3.35Å; H163-T178 WeakPolarHBondContact ND1-CG2 3.31Å; H163-T178 PolarHBondContact ND1-OG1 2.85Å
164	G	77.8	Confident	75.2	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	159.2	178	0	0	0	0	0	112.3	H121 V177	H121-G164 VanDerWaalsContact O-CA 3.23Å; H121-G164 WeakPolarHBondContact O-CA 3.35Å; G164-V177 PolarHBondContact N-O 2.87Å; G164-V177 PolarHBondContact O-N 2.81Å
165	D	78.7	Confident	74.9	Confident	59 Å²	59	62.5 Å²	62.5	32%	0.316	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.6	165.6	-69.3	-44.2	0	0	0	108.2	H121 P174 K176	H121-D165 PolarHBondContact N-O 2.97Å; H121-D165 PolarHBondContact O-N 2.89Å; H121-D165 VanDerWaalsContact O-N 3.09Å; D165-P174 HydrophobicContact CB-CB 4.08Å; D165-K176 WeakPolarHBondContact OD1-CG 3.44Å
166	V	76.9	Confident	74.6	Confident	4 Å²	4	70 Å²	70	2%	0.024	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.5	174.1	-179.7	0	0	0	0	108.2	I120 T168 Q175 V177 I220	I120-V166 HydrophobicContact CG1-CG1 4.31Å; I120-V166 HydrophobicContact CG1-CG2 4.24Å; I120-V166 HydrophobicContact CG2-CG2 4.34Å; V166-T168 HydrophobicContact CG1-CG2 4.31Å; V166-Q175 PolarHBondContact N-O 3.09Å; V166-Q175 PolarHBondContact O-N 3.09Å; V166-V177 HydrophobicContact CB-CG2 4.42Å; V166-V177 HydrophobicContact CG2-CB 4.13Å; V166-V177 HydrophobicContact CG2-CG2 3.78Å; V166-I220 HydrophobicContact CG2-CD1 4.02Å; V166-I220 HydrophobicContact CG2-CG1 4.23Å
167	V	74.8	Confident	74.4	Confident	52 Å²	52	68.8 Å²	68.8	32%	0.315	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116	171.5	-174.5	0	0	0	0	108.1	S119 P174	S119-V167 PolarHBondContact N-O 3.44Å; S119-V167 PolarHBondContact O-N 3.33Å; S119-V167 PolarHBondContact OG-O 2.95Å; V167-P174 HydrophobicContact CG2-CB 3.93Å
168	T	71.4	Confident	74.3	Confident	19 Å²	19	69.6 Å²	69.6	12%	0.117	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	153.9	171.4	86	0	0	0	0	109.9	T118 V166 Q170 T171 P221	T118-T168 HydrophobicContact CG2-CG2 3.96Å; V166-T168 HydrophobicContact CG1-CG2 4.31Å; T168-Q170 PolarHBondContact O-N 3.26Å; T168-Q170 VanDerWaalsContact O-N 3.09Å; T168-Q170 PolarHBondContact OG1-N 3.1Å; T168-T171 PolarHBondContact N-OG1 2.93Å; T168-T171 PolarHBondContact O-N 2.85Å; T168-T171 PolarHBondContact O-OG1 2.94Å; T168-T171 PolarHBondContact OG1-N 3.06Å; T168-T171 PolarHBondContact OG1-OG1 3.21Å; T168-P221 HydrophobicContact CG2-CG 4.28Å
169	I	67.8	Low	74.3	Confident	138 Å²	138	67.2 Å²	67.2	71%	0.708	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.5	174.2	-70	171.2	0	0	0	112.5	E117	E117-I169 HydrophobicContact CB-CD1 4.13Å; E117-I169 HydrophobicContact CG-CD1 4.28Å; E117-I169 PolarHBondContact O-N 3.17Å
170	Q	62.9	Low	74.4	Confident	186 Å²	186	63.5 Å²	63.5	87%	0.869	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-10	-179.7	-58.5	-175.8	14.8	0	0	113.7	T168	T168-Q170 PolarHBondContact O-N 3.26Å; T168-Q170 VanDerWaalsContact O-N 3.09Å; T168-Q170 PolarHBondContact OG1-N 3.1Å
171	T	61.3	Low	74.7	Confident	43 Å²	43	63 Å²	63	26%	0.264	33%	0.33	S	S	.	.			trans	-132.8	98.5	-171.8	57.3	0	0	0	0	111.1	T168 S173	T168-T171 PolarHBondContact N-OG1 2.93Å; T168-T171 PolarHBondContact O-N 2.85Å; T168-T171 PolarHBondContact O-OG1 2.94Å; T168-T171 PolarHBondContact OG1-N 3.06Å; T168-T171 PolarHBondContact OG1-OG1 3.21Å; T171-S173 PolarHBondContact O-N 2.93Å; T171-S173 VanDerWaalsContact O-N 3.13Å
172	E	63.9	Low	75	Confident	202 Å²	202	65.6 Å²	65.6	94%	0.944	34%	0.338	S	S	*	.	S	Bend	trans	-60.7	-20.9	176.4	-66.1	-163	152.9	0	0	113.7
173	S	69.4	Low	75.1	Confident	79 Å²	79	70.1 Å²	70.1	55%	0.552	36%	0.362	S	S	*	.	S	Bend	trans	-85.3	126.2	175.7	55.4	0	0	0	0	111.6	T171 Q175	T171-S173 PolarHBondContact O-N 2.93Å; T171-S173 VanDerWaalsContact O-N 3.13Å; S173-Q175 PolarHBondContact O-N 3.31Å
174	P	73.3	Confident	75.4	Confident	79 Å²	79	67 Å²	67	51%	0.513	35%	0.347	S	S	.	.			trans	-63.9	128.9	171.6	26.6	-33.1	0	0	0	110.7	D165 V167	D165-P174 HydrophobicContact CB-CB 4.08Å; V167-P174 HydrophobicContact CG2-CB 3.93Å
175	Q	74.3	Confident	75.7	Confident	86 Å²	86	70.3 Å²	70.3	40%	0.402	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.2	-178.5	-162.8	165	26.7	0	0	109.9	V166 S173 V177 V219	V166-Q175 PolarHBondContact N-O 3.09Å; V166-Q175 PolarHBondContact O-N 3.09Å; S173-Q175 PolarHBondContact O-N 3.31Å; Q175-V177 PolarHBondContact O-N 3.1Å; Q175-V219 HydrophobicContact CG-CG1 3.66Å; Q175-V219 VanDerWaalsContact NE2-CG1 3.33Å
176	K	76.2	Confident	76.1	Confident	172 Å²	172	67.5 Å²	67.5	75%	0.748	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	128.8	178.7	-74.3	172.8	-179	173.2	0	110.2	D165	D165-K176 WeakPolarHBondContact OD1-CG 3.44Å
177	V	76.9	Confident	76.5	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.024	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.2	174.8	-179.6	0	0	0	0	110.2	G164 V166 Q175 L179 D217 V219 I220	G164-V177 PolarHBondContact N-O 2.87Å; G164-V177 PolarHBondContact O-N 2.81Å; V166-V177 HydrophobicContact CB-CG2 4.42Å; V166-V177 HydrophobicContact CG2-CB 4.13Å; V166-V177 HydrophobicContact CG2-CG2 3.78Å; Q175-V177 PolarHBondContact O-N 3.1Å; V177-L179 HydrophobicContact CG1-CD2 4.02Å; V177-D217 HydrophobicContact CG1-CB 4.19Å; V177-V219 HydrophobicContact CG2-CB 4.25Å; V177-V219 HydrophobicContact CG2-CG1 4.01Å; V177-I220 HydrophobicContact CB-CD1 4.2Å; V177-I220 HydrophobicContact CB-CG1 4.34Å; V177-I220 HydrophobicContact CG1-CD1 3.68Å; V177-I220 HydrophobicContact CG1-CG1 3.94Å; V177-I220 HydrophobicContact CG2-CD1 4.21Å; V177-I220 HydrophobicContact CG2-CG1 3.84Å
178	T	78.8	Confident	77	Confident	36 Å²	36	69.8 Å²	69.8	22%	0.221	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.6	167.9	-51.9	0	0	0	0	109.8	C161 L162 H163 D217	C161-T178 HydrophobicContact CB-CG2 4.45Å; L162-T178 WeakPolarHBondContact O-CA 3.28Å; H163-T178 PolarHBondContact CE1-OG1 3.35Å; H163-T178 WeakPolarHBondContact ND1-CG2 3.31Å; H163-T178 PolarHBondContact ND1-OG1 2.85Å; T178-D217 WeakPolarHBondContact CA-OD2 3.29Å; T178-D217 WeakPolarHBondContact CB-OD2 3.39Å; T178-D217 PolarHBondContact N-OD2 3.44Å; T178-D217 PolarHBondContact O-N 2.8Å
179	L	80.8	Confident	77.5	Confident	3 Å²	3	69 Å²	69	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.2	166.6	-55.6	-174.2	0	0	0	108.3	F122 C161 L162 V177 M216 I220 F227	F122-L179 HydrophobicContact CE1-CD1 3.46Å; F122-L179 VanDerWaalsContact CE1-CD1 3.46Å; F122-L179 HydrophobicContact CE1-CG 4.11Å; F122-L179 HydrophobicContact CZ-CD1 3.44Å; F122-L179 VanDerWaalsContact CZ-CD1 3.44Å; C161-L179 CarbonylContact C-O 3.5Å; C161-L179 WeakPolarHBondContact CA-O 3.37Å; L162-L179 HydrophobicContact CB-CB 4.49Å; L162-L179 PolarHBondContact N-O 2.89Å; L162-L179 PolarHBondContact O-N 2.99Å; V177-L179 HydrophobicContact CG1-CD2 4.02Å; L179-M216 HydrophobicContact CD2-CB 3.99Å; L179-M216 HydrophobicContact CD2-CE 3.88Å; L179-M216 HydrophobicContact CD2-CG 3.89Å; L179-I220 HydrophobicContact CD2-CD1 4.12Å; L179-F227 HydrophobicContact CD1-CE1 3.63Å; L179-F227 HydrophobicContact CD1-CZ 3.91Å
180	S	81.7	Confident	78.1	Confident	26 Å²	26	63 Å²	63	18%	0.182	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	103.2	177.2	-67.9	0	0	0	0	110	C161 K182 L215	C161-S180 PolarHBondContact SG-OG 3.45Å; S180-K182 PolarHBondContact O-N 3.15Å; S180-L215 PolarHBondContact N-O 2.89Å; S180-L215 PolarHBondContact O-N 3.02Å
181	L	84.3	Confident	78.8	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.031	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	107.1	174.3	-62.7	163.2	0	0	0	108.4	M159 L160 L162 F212 D213 L214 L231	M159-L181 CarbonylContact C-O 3.6Å; M159-L181 WeakPolarHBondContact CA-O 3.48Å; L160-L181 HydrophobicContact CB-CB 4.25Å; L160-L181 HydrophobicContact CD2-CD1 4.07Å; L160-L181 HydrophobicContact CG-CD1 4.39Å; L160-L181 PolarHBondContact N-O 2.93Å; L160-L181 PolarHBondContact O-N 3.3Å; L162-L181 HydrophobicContact CD1-CD1 3.96Å; L162-L181 HydrophobicContact CG-CD1 4.45Å; L181-F212 HydrophobicContact CD2-CB 4.48Å; L181-F212 HydrophobicContact CD2-CD2 3.34Å; L181-F212 HydrophobicContact CD2-CE2 3.59Å; L181-F212 HydrophobicContact CD2-CG 3.93Å; L181-F212 HydrophobicContact CD2-CZ 4.35Å; L181-D213 CarbonylContact C-O 3.53Å; L181-D213 WeakPolarHBondContact CA-O 3.31Å; L181-L214 HydrophobicContact CD2-CD1 3.71Å; L181-L231 HydrophobicContact CD2-CD2 4.29Å
182	K	84.1	Confident	79.4	Confident	85 Å²	85	55.2 Å²	55.2	37%	0.37	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	152.6	174.8	-72.1	-179.2	175.2	174.2	0	110.7	P158 M159 S180 Y184 F212 D213 L215	P158-K182 WeakPolarHBondContact O-CA 3.44Å; M159-K182 HydrophobicContact CG-CG 4.45Å; S180-K182 PolarHBondContact O-N 3.15Å; K182-Y184 PolarHBondContact O-N 3.4Å; K182-Y184 VanDerWaalsContact O-N 3.14Å; K182-F212 WeakPolarHBondContact O-CA 3.34Å; K182-D213 HydrophobicContact CB-CB 4.19Å; K182-D213 PolarHBondContact N-O 3.43Å; K182-D213 PolarHBondContact O-N 2.94Å; K182-L215 HydrophobicContact CD-CD1 3.82Å
183	N	83.1	Confident	79.9	Confident	102 Å²	102	47.8 Å²	47.8	55%	0.545	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.7	33	174.7	-55.2	-43.3	0	0	0	114.4	P158 H185 D213	P158-N183 PolarHBondContact O-N 3.01Å; N183-H185 PolarHBondContact O-N 2.78Å; N183-D213 PolarHBondContact ND2-OD2 2.93Å
184	Y	84.7	Confident	79.7	Confident	23 Å²	23	47 Å²	47	9%	0.09	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	128.4	-177.1	179.7	-85	0	0	0	110.8	S156 I157 K182 M186 P210 Q211 F212	S156-Y184 CarbonylContact C-O 3.58Å; S156-Y184 VanDerWaalsContact CA-O 3.25Å; S156-Y184 WeakPolarHBondContact CA-O 3.45Å; I157-Y184 HydrophobicContact CD1-CD1 4.14Å; I157-Y184 HydrophobicContact CG1-CD1 4.11Å; I157-Y184 PolarHBondContact N-O 3.46Å; I157-Y184 PolarHBondContact O-N 2.85Å; K182-Y184 PolarHBondContact O-N 3.4Å; K182-Y184 VanDerWaalsContact O-N 3.14Å; Y184-M186 HydrophobicContact CE1-CB 4.03Å; Y184-M186 VanDerWaalsContact OH-CE 3.28Å; Y184-M186 WeakPolarHBondContact OH-CE 3.25Å; Y184-M186 PolarHBondContact OH-SD 3.33Å; Y184-M186 VanDerWaalsContact OH-SD 3.38Å; Y184-P210 HydrophobicContact CE2-CB 4.08Å; Y184-Q211 CarbonylContact C-O 3.58Å; Y184-Q211 VanDerWaalsContact CA-O 3.26Å; Y184-Q211 WeakPolarHBondContact CA-O 3.09Å; Y184-F212 HydrophobicContact CD2-CB 4.03Å; Y184-F212 HydrophobicContact CD2-CD1 4.06Å; Y184-F212 HydrophobicContact CD2-CG 4.35Å; Y184-F212 HydrophobicContact CE2-CD1 4.32Å
185	H	85.3	Confident	79.2	Confident	72 Å²	72	45.7 Å²	45.7	33%	0.333	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	124.2	-176.7	-179.8	-81.2	0	0	0	111	T154 V155 N183 Q211	T154-H185 VanDerWaalsContact CG2-NE2 3.25Å; T154-H185 WeakPolarHBondContact CG2-NE2 3.28Å; V155-H185 WeakPolarHBondContact O-CA 3.02Å; N183-H185 PolarHBondContact O-N 2.78Å; H185-Q211 HydrophobicContact CB-CB 4.45Å; H185-Q211 PolarHBondContact N-O 3.35Å; H185-Q211 PolarHBondContact O-N 2.88Å
186	M	87.1	Confident	78.3	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	138.7	-179	-170.3	171	79	0	0	111.7	W103 V155 Y184 M188 S208 P210 I235	W103-M186 HydrophobicContact CH2-CE 4.25Å; W103-M186 HydrophobicContact CZ3-CE 4.34Å; V155-M186 PolarHBondContact N-O 3.47Å; V155-M186 PolarHBondContact O-N 3.47Å; Y184-M186 HydrophobicContact CE1-CB 4.03Å; Y184-M186 VanDerWaalsContact OH-CE 3.28Å; Y184-M186 WeakPolarHBondContact OH-CE 3.25Å; Y184-M186 PolarHBondContact OH-SD 3.33Å; Y184-M186 VanDerWaalsContact OH-SD 3.38Å; M186-M188 HydrophobicContact CE-CE 3.77Å; M186-M188 HydrophobicContact CE-CG 3.82Å; M186-M188 HydrophobicContact CE-SD 4.03Å; M186-S208 WeakPolarHBondContact CG-O 3.22Å; M186-P210 HydrophobicContact CB-CB 4.44Å; M186-P210 HydrophobicContact CG-CB 4.33Å; M186-P210 HydrophobicContact SD-CB 3.79Å; M186-P210 HydrophobicContact SD-CG 4.35Å; M186-I235 HydrophobicContact CE-CG2 4.07Å; M186-I235 HydrophobicContact SD-CG2 3.57Å; M186-I235 VanDerWaalsContact SD-CG2 3.57Å
187	K	85.6	Confident	77.4	Confident	90 Å²	90	47 Å²	47	39%	0.391	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	136.6	166.4	-67.3	-169.4	171.7	-167.1	0	111	E207 S208	K187-E207 HydrophobicContact CB-CB 3.96Å; K187-E207 WeakPolarHBondContact CD-OE2 3.42Å; K187-E207 PolarHBondContact O-N 2.73Å; K187-S208 PolarHBondContact N-OG 3.24Å
188	M	83.4	Confident	76.4	Confident	13 Å²	13	48.9 Å²	48.9	6%	0.064	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.6	-178.8	-54.8	-168.3	79.4	0	0	110.6	W103 Y152 F153 V155 M186 M204 H205	W103-M188 HydrophobicContact CD2-CE 4.47Å; W103-M188 HydrophobicContact CH2-CE 3.76Å; W103-M188 HydrophobicContact CZ2-CE 3.16Å; Y152-M188 WeakPolarHBondContact CA-O 3.37Å; F153-M188 HydrophobicContact CD2-CB 4.35Å; F153-M188 HydrophobicContact CE2-CB 3.98Å; F153-M188 HydrophobicContact CE2-CG 4.37Å; F153-M188 HydrophobicContact CE2-SD 4.09Å; F153-M188 HydrophobicContact CZ-CB 4.2Å; F153-M188 PolarHBondContact N-O 2.99Å; F153-M188 PolarHBondContact O-N 3.5Å; V155-M188 HydrophobicContact CB-SD 4.41Å; V155-M188 HydrophobicContact CG2-CG 4.07Å; V155-M188 HydrophobicContact CG2-SD 3.54Å; V155-M188 VanDerWaalsContact CG2-SD 3.54Å; M186-M188 HydrophobicContact CE-CE 3.77Å; M186-M188 HydrophobicContact CE-CG 3.82Å; M186-M188 HydrophobicContact CE-SD 4.03Å; M188-M204 HydrophobicContact CE-CE 3.83Å; M188-M204 HydrophobicContact SD-CE 4.29Å; M188-H205 WeakPolarHBondContact CA-O 3.42Å
189	C	82.4	Confident	75.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.014	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.5	163.4	179.1	0	0	0	0	109.5	Y152 M204 H205	Y152-C189 HydrophobicContact CD1-CB 4.04Å; Y152-C189 HydrophobicContact CE1-CB 3.88Å; C189-M204 VanDerWaalsContact O-CA 3.32Å; C189-M204 WeakPolarHBondContact O-CA 3.29Å; C189-H205 PolarHBondContact N-O 3.31Å; C189-H205 PolarHBondContact O-N 2.79Å
190	C	80.8	Confident	74.7	Confident	12 Å²	12	51.7 Å²	51.7	8%	0.081	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	104.7	-176.7	168.3	0	0	0	0	108.6	L151 F153 L202 K203 M204	L151-C190 HydrophobicContact CB-CB 4.02Å; L151-C190 WeakPolarHBondContact CB-O 3.34Å; L151-C190 PolarHBondContact N-O 3.03Å; L151-C190 PolarHBondContact O-N 2.95Å; F153-C190 HydrophobicContact CE1-CB 3.67Å; F153-C190 HydrophobicContact CZ-CB 4.28Å; C190-L202 WeakPolarHBondContact SG-CD1 3.48Å; C190-K203 CarbonylContact C-O 3.56Å; C190-K203 WeakPolarHBondContact CA-O 3.46Å; C190-M204 HydrophobicContact CB-CG 4.27Å
191	M	78	Confident	74.2	Confident	33 Å²	33	52.2 Å²	52.2	16%	0.163	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	127	176	-55.4	175.7	70.3	0	0	109.6	L145 W148 V149 K203	L145-M191 HydrophobicContact CD1-CE 3.86Å; W148-M191 HydrophobicContact CB-CE 4.29Å; W148-M191 HydrophobicContact CD2-CE 4.05Å; W148-M191 HydrophobicContact CE3-CB 3.54Å; W148-M191 HydrophobicContact CE3-CE 4.14Å; W148-M191 HydrophobicContact CG-CE 4.15Å; W148-M191 HydrophobicContact CZ3-CB 3.76Å; V149-M191 CarbonylContact O-C 3.57Å; V149-M191 WeakPolarHBondContact O-CA 3.38Å; M191-K203 HydrophobicContact CB-CB 4.34Å; M191-K203 PolarHBondContact N-O 3.45Å; M191-K203 PolarHBondContact O-N 3.22Å
192	L	74.2	Confident	73.8	Confident	33 Å²	33	52.4 Å²	52.4	17%	0.173	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.5	174.8	-63.8	177.3	0	0	0	110.8	W148 V149 L151 L200 L202	W148-L192 CarbonylContact C-O 3.59Å; W148-L192 WeakPolarHBondContact CA-O 3.47Å; V149-L192 PolarHBondContact N-O 3.26Å; V149-L192 PolarHBondContact O-N 2.76Å; L151-L192 HydrophobicContact CD1-CD1 3.55Å; L151-L192 HydrophobicContact CD1-CG 4.14Å; L192-L200 HydrophobicContact CD2-CD1 4.32Å; L192-L202 HydrophobicContact CD2-CB 4.44Å; L192-L202 HydrophobicContact CD2-CD1 3.66Å
193	K	72.8	Confident	73.5	Confident	46 Å²	46	51.6 Å²	51.6	20%	0.2	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.9	171.6	-156.9	-162.9	-173.2	-162.8	0	110.1	W148 D195 L200 E201	W148-K193 HydrophobicContact CD2-CB 3.85Å; W148-K193 HydrophobicContact CD2-CD 4.44Å; W148-K193 HydrophobicContact CD2-CG 4.04Å; W148-K193 HydrophobicContact CE3-CB 3.7Å; W148-K193 HydrophobicContact CE3-CG 4.4Å; W148-K193 HydrophobicContact CG-CG 4.44Å; W148-K193 HydrophobicContact CH2-CB 3.85Å; W148-K193 HydrophobicContact CH2-CD 4.29Å; W148-K193 HydrophobicContact CZ2-CB 3.98Å; W148-K193 HydrophobicContact CZ2-CD 3.71Å; W148-K193 HydrophobicContact CZ2-CG 4.17Å; W148-K193 HydrophobicContact CZ3-CB 3.72Å; K193-D195 WeakPolarHBondContact CD-OD1 3.41Å; K193-D195 WeakPolarHBondContact CE-OD1 3.34Å; K193-D195 WeakPolarHBondContact CE-OD2 3.29Å; K193-D195 VanDerWaalsContact NZ-CG 3.27Å; K193-D195 IonicContact NZ-OD1 3.77Å; K193-D195 PolarHBondContact NZ-OD1 3.15Å; K193-D195 VanDerWaalsContact NZ-OD1 3.14Å; K193-D195 IonicContact NZ-OD2 3.73Å; K193-D195 PolarHBondContact NZ-OD2 2.88Å; K193-L200 WeakPolarHBondContact O-CA 3.35Å; K193-E201 HydrophobicContact CB-CB 3.87Å; K193-E201 HydrophobicContact CD-CB 4.44Å; K193-E201 WeakPolarHBondContact CD-OE2 3.43Å; K193-E201 PolarHBondContact N-O 2.91Å; K193-E201 IonicContact NZ-OE2 2.74Å; K193-E201 PolarHBondContact O-N 2.83Å
194	V	65.7	Low	73.5	Confident	64 Å²	64	47.2 Å²	47.2	39%	0.388	24%	0.239	S	C	.	.			trans	-111.9	80.6	177.9	-175.6	0	0	0	0	109.8	Y52 L200	Y52-V194 HydrophobicContact CD2-CG1 4.22Å; Y52-V194 HydrophobicContact CE2-CG1 4.17Å; Y52-V194 HydrophobicContact CG-CG1 4.45Å; V194-L200 HydrophobicContact CG2-CD1 4.18Å
195	D	63.2	Low	73.4	Confident	51 Å²	51	49 Å²	49	27%	0.273	25%	0.248	S	C	.	.			trans	-84	139.1	176.9	-89.5	3.2	0	0	0	112.1	K193 L197 V198 L199	K193-D195 WeakPolarHBondContact CD-OD1 3.41Å; K193-D195 WeakPolarHBondContact CE-OD1 3.34Å; K193-D195 WeakPolarHBondContact CE-OD2 3.29Å; K193-D195 VanDerWaalsContact NZ-CG 3.27Å; K193-D195 IonicContact NZ-OD1 3.77Å; K193-D195 PolarHBondContact NZ-OD1 3.15Å; K193-D195 VanDerWaalsContact NZ-OD1 3.14Å; K193-D195 IonicContact NZ-OD2 3.73Å; K193-D195 PolarHBondContact NZ-OD2 2.88Å; D195-L197 PolarHBondContact O-N 3.2Å; D195-L197 VanDerWaalsContact O-N 3.11Å; D195-V198 HydrophobicContact CB-CB 4.1Å; D195-V198 HydrophobicContact CB-CG2 4.31Å; D195-V198 PolarHBondContact O-N 3.43Å; D195-L199 VanDerWaalsContact O-CA 3.32Å; D195-L199 WeakPolarHBondContact O-CA 3.26Å; D195-L199 PolarHBondContact O-N 3.26Å
196	D	55.7	Low	73.4	Confident	119 Å²	119	46.4 Å²	46.4	64%	0.636	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.6	177.4	-91.8	-27.1	0	0	0	114.3	Y52 K56	Y52-D196 PolarHBondContact OH-OD1 3.35Å; K56-D196 IonicContact NZ-OD1 2.67Å; K56-D196 PolarHBondContact NZ-OD1 3.43Å; K56-D196 IonicContact NZ-OD2 2.95Å; K56-D196 PolarHBondContact NZ-OD2 3.43Å
197	L	57	Low	73.3	Confident	167 Å²	167	51 Å²	51	87%	0.874	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-38.2	178	-65.2	174.1	0	0	0	113.1	D195	D195-L197 PolarHBondContact O-N 3.2Å; D195-L197 VanDerWaalsContact O-N 3.11Å
198	V	56.5	Low	73.3	Confident	42 Å²	42	48.4 Å²	48.4	26%	0.255	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-17.4	-171	-172.7	0	0	0	0	112.1	D195 L200 E201 P244	D195-V198 HydrophobicContact CB-CB 4.1Å; D195-V198 HydrophobicContact CB-CG2 4.31Å; D195-V198 PolarHBondContact O-N 3.43Å; V198-L200 PolarHBondContact O-N 3.38Å; V198-E201 HydrophobicContact CG1-CB 4.46Å; V198-P244 WeakPolarHBondContact O-CD 3.47Å; V198-P244 WeakPolarHBondContact O-CG 3.48Å
199	L	61	Low	73.3	Confident	62 Å²	62	53.5 Å²	53.5	33%	0.325	28%	0.279	S	S	.	.	S	Bend	trans	68	-39.6	-180	-58.3	139.5	0	0	0	114.7	I88 D195	I88-L199 HydrophobicContact CD1-CD1 3.46Å; I88-L199 VanDerWaalsContact CD1-CD1 3.46Å; I88-L199 HydrophobicContact CD1-CD2 3.68Å; I88-L199 HydrophobicContact CD1-CG 4.05Å; I88-L199 HydrophobicContact CG1-CD1 4.28Å; D195-L199 VanDerWaalsContact O-CA 3.32Å; D195-L199 WeakPolarHBondContact O-CA 3.26Å; D195-L199 PolarHBondContact O-N 3.26Å
200	L	63.2	Low	73.5	Confident	37 Å²	37	53.5 Å²	53.5	19%	0.194	28%	0.279	C	S	.	.			trans	-155.6	115.9	167.4	-169.5	68.2	0	0	0	109.5	L45 L192 K193 V194 V198 W242 P244	L45-L200 HydrophobicContact CD2-CD2 4.21Å; L192-L200 HydrophobicContact CD2-CD1 4.32Å; K193-L200 WeakPolarHBondContact O-CA 3.35Å; V194-L200 HydrophobicContact CG2-CD1 4.18Å; V198-L200 PolarHBondContact O-N 3.38Å; L200-W242 HydrophobicContact CD2-CZ3 4.49Å; L200-P244 WeakPolarHBondContact O-CD 3.35Å
201	E	70.3	Confident	73.8	Confident	37 Å²	37	59.1 Å²	59.1	17%	0.173	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.2	164.9	-155.9	-168	148.2	0	0	108.1	W148 K193 V198 K203	W148-E201 HydrophobicContact CH2-CB 4.26Å; W148-E201 HydrophobicContact CH2-CG 4.11Å; W148-E201 WeakPolarHBondContact CH2-OE1 3.41Å; K193-E201 HydrophobicContact CB-CB 3.87Å; K193-E201 HydrophobicContact CD-CB 4.44Å; K193-E201 WeakPolarHBondContact CD-OE2 3.43Å; K193-E201 PolarHBondContact N-O 2.91Å; K193-E201 IonicContact NZ-OE2 2.74Å; K193-E201 PolarHBondContact O-N 2.83Å; V198-E201 HydrophobicContact CG1-CB 4.46Å; E201-K203 WeakPolarHBondContact OE1-CE 3.29Å; E201-K203 IonicContact OE1-NZ 3.01Å; E201-K203 PolarHBondContact OE1-NZ 3.45Å
202	L	75.4	Confident	74.2	Confident	9 Å²	9	57.9 Å²	57.9	5%	0.047	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.8	177	169.1	65	0	0	0	108.9	F94 L99 C190 L192 M204 S241 W242	F94-L202 HydrophobicContact CE1-CD2 4.49Å; F94-L202 HydrophobicContact CE2-CD2 4.41Å; F94-L202 HydrophobicContact CZ-CD2 3.64Å; L99-L202 HydrophobicContact CD2-CD2 4.45Å; C190-L202 WeakPolarHBondContact SG-CD1 3.48Å; L192-L202 HydrophobicContact CD2-CB 4.44Å; L192-L202 HydrophobicContact CD2-CD1 3.66Å; L202-M204 HydrophobicContact CD1-CG 3.73Å; L202-M204 HydrophobicContact CD1-SD 4.3Å; L202-M204 HydrophobicContact CD2-CG 4.41Å; L202-M204 HydrophobicContact CD2-SD 4.17Å; L202-M204 HydrophobicContact CG-CG 4.07Å; L202-M204 HydrophobicContact CG-SD 4.47Å; L202-S241 CarbonylContact O-C 3.55Å; L202-S241 WeakPolarHBondContact O-CA 3.24Å; L202-W242 HydrophobicContact CB-CB 4.31Å; L202-W242 HydrophobicContact CB-CE3 4.23Å; L202-W242 HydrophobicContact CD2-CB 4.33Å; L202-W242 PolarHBondContact N-O 2.78Å; L202-W242 PolarHBondContact O-N 3.14Å
203	K	79.1	Confident	74.6	Confident	68 Å²	68	60.2 Å²	60.2	30%	0.296	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127	167.7	-72.4	178.6	174.7	131.1	0	109.6	W148 C190 M191 E201 V240	W148-K203 HydrophobicContact CH2-CD 3.69Å; W148-K203 HydrophobicContact CH2-CG 4.05Å; W148-K203 HydrophobicContact CZ2-CD 4.32Å; W148-K203 HydrophobicContact CZ3-CB 4.44Å; W148-K203 HydrophobicContact CZ3-CD 4.3Å; W148-K203 HydrophobicContact CZ3-CG 4.38Å; C190-K203 CarbonylContact C-O 3.56Å; C190-K203 WeakPolarHBondContact CA-O 3.46Å; M191-K203 HydrophobicContact CB-CB 4.34Å; M191-K203 PolarHBondContact N-O 3.45Å; M191-K203 PolarHBondContact O-N 3.22Å; E201-K203 WeakPolarHBondContact OE1-CE 3.29Å; E201-K203 IonicContact OE1-NZ 3.01Å; E201-K203 PolarHBondContact OE1-NZ 3.45Å; K203-V240 CarbonylContact C-O 3.52Å; K203-V240 WeakPolarHBondContact CA-O 3.27Å
204	M	81.3	Confident	75.1	Confident	10 Å²	10	59.2 Å²	59.2	5%	0.049	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.2	177.7	-56.1	179.5	71.1	0	0	110.2	L99 W103 F153 M188 C189 C190 L202 V240	L99-M204 HydrophobicContact CD2-CE 4.46Å; L99-M204 HydrophobicContact CD2-SD 3.7Å; W103-M204 HydrophobicContact CZ2-CB 4.07Å; F153-M204 HydrophobicContact CZ-CE 3.93Å; M188-M204 HydrophobicContact CE-CE 3.83Å; M188-M204 HydrophobicContact SD-CE 4.29Å; C189-M204 VanDerWaalsContact O-CA 3.32Å; C189-M204 WeakPolarHBondContact O-CA 3.29Å; C190-M204 HydrophobicContact CB-CG 4.27Å; L202-M204 HydrophobicContact CD1-CG 3.73Å; L202-M204 HydrophobicContact CD1-SD 4.3Å; L202-M204 HydrophobicContact CD2-CG 4.41Å; L202-M204 HydrophobicContact CD2-SD 4.17Å; L202-M204 HydrophobicContact CG-CG 4.07Å; L202-M204 HydrophobicContact CG-SD 4.47Å; M204-V240 HydrophobicContact CB-CB 4.35Å; M204-V240 PolarHBondContact N-O 3.1Å; M204-V240 PolarHBondContact O-N 2.94Å
205	H	84	Confident	75.7	Confident	60 Å²	60	60.4 Å²	60.4	28%	0.278	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	160	172.6	59.2	-83.9	0	0	0	110.5	M188 C189 I239	M188-H205 WeakPolarHBondContact CA-O 3.42Å; C189-H205 PolarHBondContact N-O 3.31Å; C189-H205 PolarHBondContact O-N 2.79Å; H205-I239 HydrophobicContact CB-CG1 4.39Å
206	S	85.8	Confident	76.2	Confident	18 Å²	18	59.6 Å²	59.6	13%	0.126	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132.9	170.1	28.5	0	0	0	0	111.4	I235 S236	S206-I235 PolarHBondContact OG-O 3.14Å; S206-S236 WeakPolarHBondContact OG-CA 3.21Å; S206-S236 PolarHBondContact OG-O 3.35Å
207	E	84.6	Confident	76.8	Confident	97 Å²	97	57 Å²	57	45%	0.453	29%	0.293	S	S	.	.	S	Bend	trans	-94.4	-23.4	167.1	-170.7	-166.9	-159	0	0	110.9	K187	K187-E207 HydrophobicContact CB-CB 3.96Å; K187-E207 WeakPolarHBondContact CD-OE2 3.42Å; K187-E207 PolarHBondContact O-N 2.73Å
208	S	84.2	Confident	77	Confident	36 Å²	36	55.7 Å²	55.7	25%	0.252	29%	0.294	S	S	.	.	S	Bend	trans	-127	154.5	176.4	77	0	0	0	0	112	M186 K187	M186-S208 WeakPolarHBondContact CG-O 3.22Å; K187-S208 PolarHBondContact N-OG 3.24Å
209	I	85.2	Confident	77.2	Confident	121 Å²	121	56.2 Å²	56.2	62%	0.621	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-53.5	132.6	165.4	-56.2	175.6	0	0	0	108.9	I232	I209-I232 HydrophobicContact CG2-CG2 3.57Å
210	P	86.4	Confident	77.3	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.013	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-68.4	130.9	175.7	27.2	-35.3	0	0	0	111.4	Y184 M186 F212 I232 I235	Y184-P210 HydrophobicContact CE2-CB 4.08Å; M186-P210 HydrophobicContact CB-CB 4.44Å; M186-P210 HydrophobicContact CG-CB 4.33Å; M186-P210 HydrophobicContact SD-CB 3.79Å; M186-P210 HydrophobicContact SD-CG 4.35Å; P210-F212 HydrophobicContact CB-CD1 4.23Å; P210-F212 HydrophobicContact CB-CE1 4.26Å; P210-F212 HydrophobicContact CG-CE1 4.34Å; P210-I232 HydrophobicContact CG-CB 4.35Å; P210-I232 HydrophobicContact CG-CG1 4.31Å; P210-I232 HydrophobicContact CG-CG2 4.17Å; P210-I235 HydrophobicContact CB-CG2 4.08Å; P210-I235 HydrophobicContact CG-CB 4.08Å; P210-I235 HydrophobicContact CG-CG2 3.78Å
211	Q	85.6	Confident	77.2	Confident	129 Å²	129	57 Å²	57	60%	0.603	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	129	172.6	-65.2	179.3	-19.8	0	0	109.2	Y184 H185	Y184-Q211 CarbonylContact C-O 3.58Å; Y184-Q211 VanDerWaalsContact CA-O 3.26Å; Y184-Q211 WeakPolarHBondContact CA-O 3.09Å; H185-Q211 HydrophobicContact CB-CB 4.45Å; H185-Q211 PolarHBondContact N-O 3.35Å; H185-Q211 PolarHBondContact O-N 2.88Å
212	F	86.6	Confident	77	Confident	7 Å²	7	57.8 Å²	57.8	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	156.2	175	56.9	-91.1	0	0	0	111.2	L181 K182 Y184 P210 L214 K228 L231 I232	L181-F212 HydrophobicContact CD2-CB 4.48Å; L181-F212 HydrophobicContact CD2-CD2 3.34Å; L181-F212 HydrophobicContact CD2-CE2 3.59Å; L181-F212 HydrophobicContact CD2-CG 3.93Å; L181-F212 HydrophobicContact CD2-CZ 4.35Å; K182-F212 WeakPolarHBondContact O-CA 3.34Å; Y184-F212 HydrophobicContact CD2-CB 4.03Å; Y184-F212 HydrophobicContact CD2-CD1 4.06Å; Y184-F212 HydrophobicContact CD2-CG 4.35Å; Y184-F212 HydrophobicContact CE2-CD1 4.32Å; P210-F212 HydrophobicContact CB-CD1 4.23Å; P210-F212 HydrophobicContact CB-CE1 4.26Å; P210-F212 HydrophobicContact CG-CE1 4.34Å; F212-L214 HydrophobicContact CD2-CB 4.24Å; F212-L214 HydrophobicContact CE2-CB 4.13Å; F212-K228 HydrophobicContact CE2-CB 4.43Å; F212-K228 HydrophobicContact CE2-CD 4.15Å; F212-K228 HydrophobicContact CE2-CG 3.78Å; F212-K228 HydrophobicContact CZ-CG 4.05Å; F212-K228 VanDerWaalsContact O-CE 3.29Å; F212-K228 WeakPolarHBondContact O-CE 3.42Å; F212-K228 PolarHBondContact O-NZ 3.31Å; F212-L231 HydrophobicContact CE1-CD2 3.78Å; F212-L231 HydrophobicContact CE2-CD2 4.01Å; F212-L231 HydrophobicContact CZ-CB 4.41Å; F212-L231 HydrophobicContact CZ-CD2 3.35Å; F212-L231 HydrophobicContact CZ-CG 4.49Å; F212-I232 HydrophobicContact CE1-CD1 4.39Å; F212-I232 HydrophobicContact CE1-CG1 3.52Å; F212-I232 HydrophobicContact CZ-CD1 4.34Å; F212-I232 HydrophobicContact CZ-CG1 3.65Å
213	D	82.7	Confident	76.8	Confident	82 Å²	82	59.9 Å²	59.9	44%	0.439	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.8	167.5	-60.4	-49.6	0	0	0	109.1	L181 K182 N183	L181-D213 CarbonylContact C-O 3.53Å; L181-D213 WeakPolarHBondContact CA-O 3.31Å; K182-D213 HydrophobicContact CB-CB 4.19Å; K182-D213 PolarHBondContact N-O 3.43Å; K182-D213 PolarHBondContact O-N 2.94Å; N183-D213 PolarHBondContact ND2-OD2 2.93Å
214	L	83	Confident	76.6	Confident	25 Å²	25	60.2 Å²	60.2	13%	0.131	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.6	-176.2	-179.4	67.4	0	0	0	110.3	L181 F212 M216 F227 K228	L181-L214 HydrophobicContact CD2-CD1 3.71Å; F212-L214 HydrophobicContact CD2-CB 4.24Å; F212-L214 HydrophobicContact CE2-CB 4.13Å; L214-M216 HydrophobicContact CD1-CG 4.16Å; L214-M216 HydrophobicContact CD2-CG 3.77Å; L214-M216 HydrophobicContact CD2-SD 3.64Å; L214-M216 HydrophobicContact CG-CG 3.72Å; L214-M216 HydrophobicContact CG-SD 4.28Å; L214-F227 HydrophobicContact CD2-CD1 3.82Å; L214-K228 HydrophobicContact CB-CB 4.41Å; L214-K228 HydrophobicContact CB-CD 4.32Å; L214-K228 HydrophobicContact CD2-CB 3.88Å
215	L	79.1	Confident	76.5	Confident	90 Å²	90	64 Å²	64	47%	0.471	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.3	163.6	-61.6	174.9	0	0	0	108.6	S180 K182	S180-L215 PolarHBondContact N-O 2.89Å; S180-L215 PolarHBondContact O-N 3.02Å; K182-L215 HydrophobicContact CD-CD1 3.82Å
216	M	73	Confident	76.2	Confident	34 Å²	34	68.6 Å²	68.6	17%	0.167	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.5	178.9	-47.3	179.6	64.4	0	0	107.9	L179 L214 I220 P224 F227	L179-M216 HydrophobicContact CD2-CB 3.99Å; L179-M216 HydrophobicContact CD2-CE 3.88Å; L179-M216 HydrophobicContact CD2-CG 3.89Å; L214-M216 HydrophobicContact CD1-CG 4.16Å; L214-M216 HydrophobicContact CD2-CG 3.77Å; L214-M216 HydrophobicContact CD2-SD 3.64Å; L214-M216 HydrophobicContact CG-CG 3.72Å; L214-M216 HydrophobicContact CG-SD 4.28Å; M216-I220 HydrophobicContact CE-CB 4.14Å; M216-I220 HydrophobicContact CE-CD1 3.7Å; M216-I220 HydrophobicContact CE-CG1 4.39Å; M216-I220 HydrophobicContact CE-CG2 4.27Å; M216-P224 HydrophobicContact CG-CB 4.48Å; M216-P224 HydrophobicContact SD-CB 3.7Å; M216-P224 HydrophobicContact SD-CG 3.95Å; M216-F227 HydrophobicContact CE-CB 4.17Å; M216-F227 HydrophobicContact CE-CD1 3.86Å; M216-F227 HydrophobicContact CE-CE1 4.45Å; M216-F227 HydrophobicContact CE-CG 3.89Å; M216-F227 HydrophobicContact SD-CB 4.25Å; M216-F227 HydrophobicContact SD-CD1 4.21Å; M216-F227 HydrophobicContact SD-CG 4.42Å
217	D	68.2	Low	76	Confident	65 Å²	65	67.9 Å²	67.9	35%	0.348	38%	0.377	S	S	.	.			trans	-59.7	147	164.4	-57.5	-36.8	0	0	0	109.3	V177 T178 V219	V177-D217 HydrophobicContact CG1-CB 4.19Å; T178-D217 WeakPolarHBondContact CA-OD2 3.29Å; T178-D217 WeakPolarHBondContact CB-OD2 3.39Å; T178-D217 PolarHBondContact N-OD2 3.44Å; T178-D217 PolarHBondContact O-N 2.8Å; D217-V219 HydrophobicContact CB-CB 4.48Å; D217-V219 HydrophobicContact CB-CG2 4.17Å; D217-V219 PolarHBondContact O-N 2.97Å
218	P	62	Low	75.9	Confident	138 Å²	138	66.4 Å²	66.4	90%	0.896	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	28.6	-172.4	32.4	-38.6	0	0	0	114.2
219	V	60.4	Low	75.9	Confident	53 Å²	53	69.5 Å²	69.5	32%	0.321	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-22.8	-163.3	176.4	0	0	0	0	112.1	Q175 V177 D217	Q175-V219 HydrophobicContact CG-CG1 3.66Å; Q175-V219 VanDerWaalsContact NE2-CG1 3.33Å; V177-V219 HydrophobicContact CG2-CB 4.25Å; V177-V219 HydrophobicContact CG2-CG1 4.01Å; D217-V219 HydrophobicContact CB-CB 4.48Å; D217-V219 HydrophobicContact CB-CG2 4.17Å; D217-V219 PolarHBondContact O-N 2.97Å
220	I	63.9	Low	75.8	Confident	22 Å²	22	65.7 Å²	65.7	11%	0.113	36%	0.361	C	S	.	.	S	Bend	trans	-84.3	131.1	179	-62.2	-176.7	0	0	0	110	V166 V177 L179 M216 L222	V166-I220 HydrophobicContact CG2-CD1 4.02Å; V166-I220 HydrophobicContact CG2-CG1 4.23Å; V177-I220 HydrophobicContact CB-CD1 4.2Å; V177-I220 HydrophobicContact CB-CG1 4.34Å; V177-I220 HydrophobicContact CG1-CD1 3.68Å; V177-I220 HydrophobicContact CG1-CG1 3.94Å; V177-I220 HydrophobicContact CG2-CD1 4.21Å; V177-I220 HydrophobicContact CG2-CG1 3.84Å; L179-I220 HydrophobicContact CD2-CD1 4.12Å; M216-I220 HydrophobicContact CE-CB 4.14Å; M216-I220 HydrophobicContact CE-CD1 3.7Å; M216-I220 HydrophobicContact CE-CG1 4.39Å; M216-I220 HydrophobicContact CE-CG2 4.27Å; I220-L222 HydrophobicContact CG2-CB 3.79Å; I220-L222 HydrophobicContact CG2-CD1 3.93Å; I220-L222 HydrophobicContact CG2-CG 3.9Å; I220-L222 PolarHBondContact O-N 3.01Å
221	P	59.8	Low	75.6	Confident	95 Å²	95	65.9 Å²	65.9	62%	0.617	36%	0.361	S	S	*	.	S	Bend	trans	-74.6	27.7	179.1	33.1	-38.2	0	0	0	114.2	T168	T168-P221 HydrophobicContact CG2-CG 4.28Å
222	L	66.8	Low	75.5	Confident	53 Å²	53	60.6 Å²	60.6	28%	0.277	34%	0.337	S	S	.	.	S	Bend	trans	-120	130.7	-178.4	-65.1	171.2	0	0	0	109.6	L115 I220 P224 F227	L115-L222 HydrophobicContact CD1-CD1 4.35Å; I220-L222 HydrophobicContact CG2-CB 3.79Å; I220-L222 HydrophobicContact CG2-CD1 3.93Å; I220-L222 HydrophobicContact CG2-CG 3.9Å; I220-L222 PolarHBondContact O-N 3.01Å; L222-P224 WeakPolarHBondContact O-CD 3.29Å; L222-F227 HydrophobicContact CD1-CD2 4Å
223	S	72.1	Confident	75.4	Confident	53 Å²	53	63.7 Å²	63.7	37%	0.371	35%	0.354	S	S	.	.			trans	-57.3	124.5	173	54.8	0	0	0	0	110.5	S225 K226 F227	S223-S225 PolarHBondContact O-N 3.07Å; S223-K226 PolarHBondContact O-N 3.16Å; S223-K226 WeakPolarHBondContact OG-CB 3.41Å; S223-K226 WeakPolarHBondContact OG-CD 3.45Å; S223-K226 VanDerWaalsContact OG-CG 3.29Å; S223-K226 WeakPolarHBondContact OG-CG 3.32Å; S223-F227 PolarHBondContact O-N 2.99Å
224	P	73.8	Confident	75.3	Confident	75 Å²	75	60.7 Å²	60.7	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-56.6	-27.6	-173	-30.8	36.4	0	0	0	115.4	M216 L222 K228	M216-P224 HydrophobicContact CG-CB 4.48Å; M216-P224 HydrophobicContact SD-CB 3.7Å; M216-P224 HydrophobicContact SD-CG 3.95Å; L222-P224 WeakPolarHBondContact O-CD 3.29Å; P224-K228 VanDerWaalsContact O-CB 3.25Å; P224-K228 WeakPolarHBondContact O-CB 3.3Å; P224-K228 PolarHBondContact O-N 2.81Å
225	S	78.5	Confident	75.3	Confident	89 Å²	89	59.9 Å²	59.9	62%	0.622	33%	0.333	S	S	*	.	H	α-helix	trans	-63.6	-50.5	174	49.4	0	0	0	0	112.9	S223 F227 K228 Q229	S223-S225 PolarHBondContact O-N 3.07Å; S225-F227 VanDerWaalsContact C-N 3.34Å; S225-F227 PolarHBondContact O-N 2.9Å; S225-K228 PolarHBondContact O-N 3.3Å; S225-Q229 PolarHBondContact O-N 2.96Å
226	K	78.8	Confident	75.4	Confident	156 Å²	156	57.8 Å²	57.8	68%	0.678	33%	0.326	S	S	*	.	H	α-helix	trans	-62.4	-40.7	177	-67.7	-174.8	-177.5	-175.8	0	111.7	S223 Q229 L230	S223-K226 PolarHBondContact O-N 3.16Å; S223-K226 WeakPolarHBondContact OG-CB 3.41Å; S223-K226 WeakPolarHBondContact OG-CD 3.45Å; S223-K226 VanDerWaalsContact OG-CG 3.29Å; S223-K226 WeakPolarHBondContact OG-CG 3.32Å; K226-Q229 PolarHBondContact O-N 2.85Å; K226-L230 WeakPolarHBondContact O-CB 3.35Å; K226-L230 PolarHBondContact O-N 2.87Å
227	F	80.7	Confident	75.7	Confident	3 Å²	3	64 Å²	64	1%	0.013	36%	0.355	C	S	.	.	H	α-helix	trans	-68.3	-40.5	177.2	-171.2	-88.7	0	0	0	112.1	I120 F122 L179 L214 M216 L222 S223 S225 Q229 L230 L231	I120-F227 HydrophobicContact CD1-CE2 3.76Å; I120-F227 HydrophobicContact CD1-CZ 4.46Å; F122-F227 HydrophobicContact CZ-CZ 4.31Å; L179-F227 HydrophobicContact CD1-CE1 3.63Å; L179-F227 HydrophobicContact CD1-CZ 3.91Å; L214-F227 HydrophobicContact CD2-CD1 3.82Å; M216-F227 HydrophobicContact CE-CB 4.17Å; M216-F227 HydrophobicContact CE-CD1 3.86Å; M216-F227 HydrophobicContact CE-CE1 4.45Å; M216-F227 HydrophobicContact CE-CG 3.89Å; M216-F227 HydrophobicContact SD-CB 4.25Å; M216-F227 HydrophobicContact SD-CD1 4.21Å; M216-F227 HydrophobicContact SD-CG 4.42Å; L222-F227 HydrophobicContact CD1-CD2 4Å; S223-F227 PolarHBondContact O-N 2.99Å; S225-F227 VanDerWaalsContact C-N 3.34Å; S225-F227 PolarHBondContact O-N 2.9Å; F227-Q229 VanDerWaalsContact C-N 3.34Å; F227-Q229 PolarHBondContact O-N 2.86Å; F227-L230 PolarHBondContact O-N 2.92Å; F227-L231 HydrophobicContact CE1-CB 4.45Å; F227-L231 HydrophobicContact CE1-CD1 3.77Å; F227-L231 HydrophobicContact CZ-CD1 4.14Å; F227-L231 WeakPolarHBondContact O-CB 3.46Å; F227-L231 PolarHBondContact O-N 2.96Å
228	K	83.9	Confident	76.3	Confident	67 Å²	67	61.5 Å²	61.5	29%	0.291	34%	0.342	S	S	.	.	H	α-helix	trans	-58.4	-44.2	172.1	171.1	163.8	169.7	172	0	111.5	F212 L214 P224 S225 L231 I232	F212-K228 HydrophobicContact CE2-CB 4.43Å; F212-K228 HydrophobicContact CE2-CD 4.15Å; F212-K228 HydrophobicContact CE2-CG 3.78Å; F212-K228 HydrophobicContact CZ-CG 4.05Å; F212-K228 VanDerWaalsContact O-CE 3.29Å; F212-K228 WeakPolarHBondContact O-CE 3.42Å; F212-K228 PolarHBondContact O-NZ 3.31Å; L214-K228 HydrophobicContact CB-CB 4.41Å; L214-K228 HydrophobicContact CB-CD 4.32Å; L214-K228 HydrophobicContact CD2-CB 3.88Å; P224-K228 VanDerWaalsContact O-CB 3.25Å; P224-K228 WeakPolarHBondContact O-CB 3.3Å; P224-K228 PolarHBondContact O-N 2.81Å; S225-K228 PolarHBondContact O-N 3.3Å; K228-L231 PolarHBondContact O-N 2.98Å; K228-I232 HydrophobicContact CG-CD1 3.9Å; K228-I232 VanDerWaalsContact O-CG1 3.29Å; K228-I232 WeakPolarHBondContact O-CG1 3.28Å; K228-I232 PolarHBondContact O-N 3.43Å
229	Q	83.4	Confident	77.2	Confident	100 Å²	100	60 Å²	60	47%	0.467	33%	0.325	S	S	.	.	H	α-helix	trans	-64	-51.8	178.2	-169.1	59.7	46.6	0	0	111.5	S225 K226 F227 L231 I232 D233	S225-Q229 PolarHBondContact O-N 2.96Å; K226-Q229 PolarHBondContact O-N 2.85Å; F227-Q229 VanDerWaalsContact C-N 3.34Å; F227-Q229 PolarHBondContact O-N 2.86Å; Q229-L231 PolarHBondContact O-N 3.15Å; Q229-L231 VanDerWaalsContact O-N 3.15Å; Q229-I232 WeakPolarHBondContact O-CA 3.35Å; Q229-I232 WeakPolarHBondContact O-CB 3.36Å; Q229-I232 PolarHBondContact O-N 2.75Å; Q229-D233 PolarHBondContact NE2-OD1 3.05Å; Q229-D233 PolarHBondContact O-N 3.22Å
230	L	82	Confident	78	Confident	42 Å²	42	57.7 Å²	57.7	22%	0.22	31%	0.311	C	S	.	.	H	α-helix	trans	-56	-35.5	177.6	177.2	144.4	0	0	0	112.7	I111 L115 K226 F227 I234	I111-L230 HydrophobicContact CG1-CD2 4.38Å; L115-L230 HydrophobicContact CD2-CD1 4.09Å; K226-L230 WeakPolarHBondContact O-CB 3.35Å; K226-L230 PolarHBondContact O-N 2.87Å; F227-L230 PolarHBondContact O-N 2.92Å; L230-I234 HydrophobicContact CD2-CD1 3.61Å; L230-I234 HydrophobicContact CG-CD1 4Å; L230-I234 WeakPolarHBondContact O-CB 3.22Å; L230-I234 VanDerWaalsContact O-CG1 3.25Å; L230-I234 WeakPolarHBondContact O-CG1 3.36Å; L230-I234 PolarHBondContact O-N 3.07Å
231	L	82.4	Confident	78.5	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.026	33%	0.327	C	S	.	.	H	α-helix	trans	-77.4	-27.4	176	-167.6	138.6	0	0	0	113.3	L181 F212 F227 K228 Q229 I235	L181-L231 HydrophobicContact CD2-CD2 4.29Å; F212-L231 HydrophobicContact CE1-CD2 3.78Å; F212-L231 HydrophobicContact CE2-CD2 4.01Å; F212-L231 HydrophobicContact CZ-CB 4.41Å; F212-L231 HydrophobicContact CZ-CD2 3.35Å; F212-L231 HydrophobicContact CZ-CG 4.49Å; F227-L231 HydrophobicContact CE1-CB 4.45Å; F227-L231 HydrophobicContact CE1-CD1 3.77Å; F227-L231 HydrophobicContact CZ-CD1 4.14Å; F227-L231 WeakPolarHBondContact O-CB 3.46Å; F227-L231 PolarHBondContact O-N 2.96Å; K228-L231 PolarHBondContact O-N 2.98Å; Q229-L231 PolarHBondContact O-N 3.15Å; Q229-L231 VanDerWaalsContact O-N 3.15Å; L231-I235 HydrophobicContact CD2-CD1 3.56Å; L231-I235 HydrophobicContact CG-CD1 4.11Å; L231-I235 WeakPolarHBondContact O-CB 3.25Å; L231-I235 WeakPolarHBondContact O-CD1 3.47Å; L231-I235 VanDerWaalsContact O-CG1 3.22Å; L231-I235 WeakPolarHBondContact O-CG1 3.35Å; L231-I235 PolarHBondContact O-N 3.26Å
232	I	85	Confident	79.2	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.097	31%	0.309	C	S	.	.	H	α-helix	trans	-66.6	-51.1	168.2	-72.7	164.5	0	0	0	109.8	I209 P210 F212 K228 Q229 I235 S236	I209-I232 HydrophobicContact CG2-CG2 3.57Å; P210-I232 HydrophobicContact CG-CB 4.35Å; P210-I232 HydrophobicContact CG-CG1 4.31Å; P210-I232 HydrophobicContact CG-CG2 4.17Å; F212-I232 HydrophobicContact CE1-CD1 4.39Å; F212-I232 HydrophobicContact CE1-CG1 3.52Å; F212-I232 HydrophobicContact CZ-CD1 4.34Å; F212-I232 HydrophobicContact CZ-CG1 3.65Å; K228-I232 HydrophobicContact CG-CD1 3.9Å; K228-I232 VanDerWaalsContact O-CG1 3.29Å; K228-I232 WeakPolarHBondContact O-CG1 3.28Å; K228-I232 PolarHBondContact O-N 3.43Å; Q229-I232 WeakPolarHBondContact O-CA 3.35Å; Q229-I232 WeakPolarHBondContact O-CB 3.36Å; Q229-I232 PolarHBondContact O-N 2.75Å; I232-I235 PolarHBondContact O-N 2.85Å; I232-S236 WeakPolarHBondContact O-CB 3.37Å; I232-S236 PolarHBondContact O-N 2.85Å; I232-S236 PolarHBondContact O-OG 3.05Å
233	D	82.9	Confident	79	Confident	71 Å²	71	57.8 Å²	57.8	38%	0.38	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-55.2	-176.1	-56.2	-28.3	0	0	0	110.1	Q229 I235 S236 E237	Q229-D233 PolarHBondContact NE2-OD1 3.05Å; Q229-D233 PolarHBondContact O-N 3.22Å; D233-I235 VanDerWaalsContact C-N 3.33Å; D233-I235 PolarHBondContact O-N 2.93Å; D233-S236 PolarHBondContact O-N 2.71Å; D233-S236 PolarHBondContact O-OG 3.47Å; D233-E237 PolarHBondContact O-N 3.09Å
234	I	82.6	Confident	78	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-55.7	-44.2	178.5	-73	172.4	0	0	0	112	C110 I111 L230 S236 L238	C110-I234 HydrophobicContact CB-CD1 4.21Å; C110-I234 HydrophobicContact CB-CG1 4.34Å; C110-I234 HydrophobicContact CB-CG2 3.59Å; I111-I234 HydrophobicContact CG1-CD1 3.67Å; L230-I234 HydrophobicContact CD2-CD1 3.61Å; L230-I234 HydrophobicContact CG-CD1 4Å; L230-I234 WeakPolarHBondContact O-CB 3.22Å; L230-I234 VanDerWaalsContact O-CG1 3.25Å; L230-I234 WeakPolarHBondContact O-CG1 3.36Å; L230-I234 PolarHBondContact O-N 3.07Å; I234-S236 VanDerWaalsContact C-N 3.34Å; I234-L238 WeakPolarHBondContact O-CB 3.26Å; I234-L238 PolarHBondContact O-N 2.85Å
235	I	82.5	Confident	76.7	Confident	8 Å²	8	57.2 Å²	57.2	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-69.2	-35.1	179.9	-72.2	176.1	0	0	0	111.2	W103 I107 M186 S206 P210 L231 I232 D233 L238	W103-I235 HydrophobicContact CZ3-CG2 4.31Å; I107-I235 HydrophobicContact CD1-CD1 4.29Å; I107-I235 HydrophobicContact CD1-CG1 4.03Å; I107-I235 HydrophobicContact CG1-CG1 4.46Å; M186-I235 HydrophobicContact CE-CG2 4.07Å; M186-I235 HydrophobicContact SD-CG2 3.57Å; M186-I235 VanDerWaalsContact SD-CG2 3.57Å; S206-I235 PolarHBondContact OG-O 3.14Å; P210-I235 HydrophobicContact CB-CG2 4.08Å; P210-I235 HydrophobicContact CG-CB 4.08Å; P210-I235 HydrophobicContact CG-CG2 3.78Å; L231-I235 HydrophobicContact CD2-CD1 3.56Å; L231-I235 HydrophobicContact CG-CD1 4.11Å; L231-I235 WeakPolarHBondContact O-CB 3.25Å; L231-I235 WeakPolarHBondContact O-CD1 3.47Å; L231-I235 VanDerWaalsContact O-CG1 3.22Å; L231-I235 WeakPolarHBondContact O-CG1 3.35Å; L231-I235 PolarHBondContact O-N 3.26Å; I232-I235 PolarHBondContact O-N 2.85Å; D233-I235 VanDerWaalsContact C-N 3.33Å; D233-I235 PolarHBondContact O-N 2.93Å; I235-L238 PolarHBondContact O-N 3.33Å
236	S	80.9	Confident	74.9	Confident	46 Å²	46	55.5 Å²	55.5	32%	0.322	31%	0.313	S	S	.	.	H	α-helix	trans	-70.8	-29	-177	74.3	0	0	0	0	114.1	S206 I232 D233 I234	S206-S236 WeakPolarHBondContact OG-CA 3.21Å; S206-S236 PolarHBondContact OG-O 3.35Å; I232-S236 WeakPolarHBondContact O-CB 3.37Å; I232-S236 PolarHBondContact O-N 2.85Å; I232-S236 PolarHBondContact O-OG 3.05Å; D233-S236 PolarHBondContact O-N 2.71Å; D233-S236 PolarHBondContact O-OG 3.47Å; I234-S236 VanDerWaalsContact C-N 3.34Å
237	E	78.8	Confident	72.6	Confident	165 Å²	165	52.6 Å²	52.6	77%	0.771	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-6.9	176	-61.9	-168.2	148.9	0	0	113.4	D233 I239	D233-E237 PolarHBondContact O-N 3.09Å; E237-I239 PolarHBondContact O-N 3.18Å; E237-I239 VanDerWaalsContact O-N 3.17Å
238	L	81.3	Confident	70.2	Confident	13 Å²	13	58 Å²	58	7%	0.068	34%	0.341	C	S	.	.			trans	-78.7	106.3	-165.3	-153.3	70.4	0	0	0	114	W103 K106 I107 I234 I235 V240	W103-L238 HydrophobicContact CE3-CD2 3.73Å; W103-L238 HydrophobicContact CH2-CB 4.36Å; W103-L238 HydrophobicContact CZ3-CB 3.95Å; W103-L238 HydrophobicContact CZ3-CD2 3.86Å; W103-L238 HydrophobicContact CZ3-CG 4.43Å; K106-L238 HydrophobicContact CB-CD1 4.2Å; K106-L238 HydrophobicContact CB-CD2 3.92Å; K106-L238 HydrophobicContact CB-CG 4.36Å; I107-L238 HydrophobicContact CG1-CD2 3.77Å; I234-L238 WeakPolarHBondContact O-CB 3.26Å; I234-L238 PolarHBondContact O-N 2.85Å; I235-L238 PolarHBondContact O-N 3.33Å; L238-V240 HydrophobicContact CD2-CG2 3.84Å; L238-V240 HydrophobicContact CG-CG2 3.97Å
239	I	80	Confident	67.6	Low	107 Å²	107	63 Å²	63	55%	0.549	37%	0.365	S	S	.	.			trans	-88.4	112.2	168.4	-54.8	-179.6	0	0	0	110.1	K106 H205 E237	K106-I239 PolarHBondContact NZ-O 3.06Å; H205-I239 HydrophobicContact CB-CG1 4.39Å; E237-I239 PolarHBondContact O-N 3.18Å; E237-I239 VanDerWaalsContact O-N 3.17Å
240	V	77.1	Confident	64.9	Low	4 Å²	4	65.9 Å²	65.9	2%	0.024	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	101.1	-177.6	179.3	0	0	0	0	111	I102 W103 K106 K203 M204 L238	I102-V240 HydrophobicContact CG2-CG1 3.6Å; W103-V240 HydrophobicContact CD2-CB 4.45Å; W103-V240 HydrophobicContact CD2-CG2 3.57Å; W103-V240 HydrophobicContact CE3-CG2 4.01Å; W103-V240 HydrophobicContact CG-CG2 3.99Å; W103-V240 HydrophobicContact CH2-CG2 3.97Å; W103-V240 HydrophobicContact CZ2-CB 4.01Å; W103-V240 HydrophobicContact CZ2-CG2 3.55Å; W103-V240 HydrophobicContact CZ3-CG2 4.19Å; K106-V240 HydrophobicContact CD-CB 4.13Å; K106-V240 HydrophobicContact CD-CG1 4.05Å; K106-V240 HydrophobicContact CD-CG2 3.75Å; K203-V240 CarbonylContact C-O 3.52Å; K203-V240 WeakPolarHBondContact CA-O 3.27Å; M204-V240 HydrophobicContact CB-CB 4.35Å; M204-V240 PolarHBondContact N-O 3.1Å; M204-V240 PolarHBondContact O-N 2.94Å; L238-V240 HydrophobicContact CD2-CG2 3.84Å; L238-V240 HydrophobicContact CG-CG2 3.97Å
241	S	76.3	Confident	62.2	Low	63 Å²	63	67.5 Å²	67.5	44%	0.441	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	142.2	173.1	45.8	0	0	0	0	112.2	L202	L202-S241 CarbonylContact O-C 3.55Å; L202-S241 WeakPolarHBondContact O-CA 3.24Å
242	W	72.7	Confident	59.5	Low	66 Å²	66	76.4 Å²	76.4	25%	0.25	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.9	174.8	178.6	87.7	0	0	0	111.9	F94 I102 L200 L202 P244	F94-W242 HydrophobicContact CE2-CD2 4.4Å; F94-W242 HydrophobicContact CE2-CE3 4.47Å; I102-W242 VanDerWaalsContact CD1-CD1 3.49Å; I102-W242 HydrophobicContact CD1-CG 4.06Å; L200-W242 HydrophobicContact CD2-CZ3 4.49Å; L202-W242 HydrophobicContact CB-CB 4.31Å; L202-W242 HydrophobicContact CB-CE3 4.23Å; L202-W242 HydrophobicContact CD2-CB 4.33Å; L202-W242 PolarHBondContact N-O 2.78Å; L202-W242 PolarHBondContact O-N 3.14Å; W242-P244 HydrophobicContact CH2-CB 4.4Å; W242-P244 HydrophobicContact CH2-CG 3.69Å; W242-P244 HydrophobicContact CZ3-CG 3.84Å
243	S	63.7	Low	56.6	Low	43 Å²	43	82.1 Å²	82.1	30%	0.301	46%	0.462	S	S	.	.			trans	-150	144.6	174.9	64.5	0	0	0	0	112.7	G245 G246	S243-G245 PolarHBondContact O-N 2.82Å; S243-G245 VanDerWaalsContact O-N 3.11Å; S243-G246 PolarHBondContact O-N 3.11Å
244	P	51.7	Low	53.9	Low	49 Å²	49	83.5 Å²	83.5	32%	0.318	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.9	177.7	-25.8	32.1	0	0	0	115.7	V198 L200 W242	V198-P244 WeakPolarHBondContact O-CD 3.47Å; V198-P244 WeakPolarHBondContact O-CG 3.48Å; L200-P244 WeakPolarHBondContact O-CD 3.35Å; W242-P244 HydrophobicContact CH2-CB 4.4Å; W242-P244 HydrophobicContact CH2-CG 3.69Å; W242-P244 HydrophobicContact CZ3-CG 3.84Å
245	G	45.1	Very low	51.2	Low	66 Å²	66	87.3 Å²	87.3	68%	0.68	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	1.3	176.7	0	0	0	0	0	114.4	S243 S247	S243-G245 PolarHBondContact O-N 2.82Å; S243-G245 VanDerWaalsContact O-N 3.11Å; G245-S247 VanDerWaalsContact C-N 3.29Å; G245-S247 PolarHBondContact O-N 2.91Å
246	G	42.1	Very low	48.6	Very low	53 Å²	53	94.2 Å²	94.2	55%	0.546	55%	0.546	S	S	.	.			trans	-69.3	68.8	-171.4	0	0	0	0	0	115.7	S243	S243-G246 PolarHBondContact O-N 3.11Å
247	S	29.6	Very low	45.9	Very low	96 Å²	96	96 Å²	96	67%	0.671	56%	0.563	S	S	*	*	S	Bend	trans	-56.9	138.6	139	-178.1	0	0	0	0	107.5	G245 H249	G245-S247 VanDerWaalsContact C-N 3.29Å; G245-S247 PolarHBondContact O-N 2.91Å; S247-H249 VanDerWaalsContact C-N 3.34Å; S247-H249 PolarHBondContact O-N 3.29Å
248	I	30.5	Very low	43.4	Very low	116 Å²	116	93.7 Å²	93.7	60%	0.595	57%	0.565	S	S	*	*			trans	-64.4	95.4	-178	-57.6	174.2	0	0	0	108.7	H250	I248-H250 PolarHBondContact O-N 2.95Å; I248-H250 VanDerWaalsContact O-N 3.11Å
249	H	29.4	Very low	41	Very low	171 Å²	171	99.8 Å²	99.8	79%	0.792	60%	0.596	S	S	*	*			trans	-79.8	92.7	176	-121	-82.5	0	0	0	107.8	S247 S251	S247-H249 VanDerWaalsContact C-N 3.34Å; S247-H249 PolarHBondContact O-N 3.29Å; H249-S251 PolarHBondContact O-N 3.13Å
250	H	26.1	Very low	38.3	Very low	161 Å²	161	104.1 Å²	104.1	75%	0.745	61%	0.614	S	S	*	*			trans	-70.2	68.7	167	-70.2	-70.1	0	0	0	110.6	I248	I248-H250 PolarHBondContact O-N 2.95Å; I248-H250 VanDerWaalsContact O-N 3.11Å
251	S	25.1	Very low	35.9	Very low	76 Å²	76	108.8 Å²	108.8	53%	0.531	64%	0.643	S	S	.	*			trans	-72.5	125.4	133	-104.5	0	0	0	0	105.6	H249 D253	H249-S251 PolarHBondContact O-N 3.13Å; S251-D253 VanDerWaalsContact C-N 3.31Å; S251-D253 WeakPolarHBondContact CB-OD1 3.46Å; S251-D253 PolarHBondContact OG-OD1 2.84Å
252	K	25.5	Very low	33.6	Very low	192 Å²	192	113.5 Å²	113.5	84%	0.835	66%	0.663	S	S	*	*			cis	41.9	54.1	11.7	-84.8	-160.1	173.8	-173.3	0	113.2	P254	K252-P254 WeakPolarHBondContact O-CD 3.39Å
253	D	25	Very low	31.4	Very low	139 Å²	139	113.4 Å²	113.4	74%	0.743	68%	0.682	S	S	*	*			trans	-72.5	106.9	138.5	-64.3	-9	0	0	0	105.2	S251	S251-D253 VanDerWaalsContact C-N 3.31Å; S251-D253 WeakPolarHBondContact CB-OD1 3.46Å; S251-D253 PolarHBondContact OG-OD1 2.84Å
254	P	26.7	Very low	29.8	Very low	101 Å²	101	121 Å²	121	66%	0.656	71%	0.713	S	S	*	*			trans	-77.2	145.1	175.1	34.1	-33.4	0	0	0	109.1	K252	K252-P254 WeakPolarHBondContact O-CD 3.39Å
255	S	25.5	Very low	28.7	Very low	99 Å²	99	124 Å²	124	69%	0.692	74%	0.735	S	S	*	*			trans	42.7	88.5	155.4	58	0	0	0	0	116.7	A257	S255-A257 VanDerWaalsContact C-N 3.27Å; S255-A257 PolarHBondContact O-N 2.74Å
256	V	28.1	Very low	28	Very low	153 Å²	153	127 Å²	127	93%	0.927	74%	0.742	S	S	*	*			trans	-64.9	99.9	143.7	175.9	0	0	0	0	106	S258	V256-S258 PolarHBondContact O-N 3.35Å
257	A	24.4	Very low	27.4	Very low	84 Å²	84	127.7 Å²	127.7	69%	0.694	75%	0.75	S	S	*	*			trans	-74.9	107.5	-169.5	0	0	0	0	0	111.5	S255 I259	S255-A257 VanDerWaalsContact C-N 3.27Å; S255-A257 PolarHBondContact O-N 2.74Å; A257-I259 VanDerWaalsContact C-N 3.28Å; A257-I259 PolarHBondContact O-N 3.02Å
258	S	25.2	Very low	27.5	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	76%	0.757	S	S	*	*			trans	-77.6	80.1	166.6	60.2	0	0	0	0	110.7	V256	V256-S258 PolarHBondContact O-N 3.35Å
259	I	30.3	Very low	27.5	Very low	141 Å²	141	132.8 Å²	132.8	72%	0.723	77%	0.765	S	S	*	*			trans	50.7	105.5	148.5	-55.4	173.3	0	0	0	116.2	A257 T261	A257-I259 VanDerWaalsContact C-N 3.28Å; A257-I259 PolarHBondContact O-N 3.02Å; I259-T261 HydrophobicContact CG2-CG2 4.41Å; I259-T261 PolarHBondContact O-N 2.98Å
260	Q	24.1	Very low	27.5	Very low	198 Å²	198	130.5 Å²	130.5	93%	0.925	76%	0.763	S	S	*	*			trans	-91.3	89.7	176.8	-174.2	177.3	4.1	0	0	111.5
261	T	26.8	Very low	27.7	Very low	103 Å²	103	129.8 Å²	129.8	63%	0.632	76%	0.763	S	S	*	*			trans	-144.2	130.2	170.5	48.9	0	0	0	0	108.2	I259	I259-T261 HydrophobicContact CG2-CG2 4.41Å; I259-T261 PolarHBondContact O-N 2.98Å
262	D	28.3	Very low	27.7	Very low	162 Å²	162	132.9 Å²	132.9	87%	0.866	77%	0.774	S	S	*	*			cis	-127.6	165	2	-76.5	-54.1	0	0	0	111.5
263	G	26.1	Very low	27.8	Very low	63 Å²	63	130.4 Å²	130.4	65%	0.649	77%	0.765	S	S	*	*			trans	-106.7	154.9	-177.6	0	0	0	0	0	113.8
264	H	30.3	Very low	28	Very low	202 Å²	202	132.4 Å²	132.4	94%	0.935	76%	0.762	S	S	*	*			trans	-146.4	104.5	148.1	-96.3	-56	0	0	0	110.6
265	S	28.5	Very low	28.1	Very low	114 Å²	114	135.2 Å²	135.2	80%	0.797	77%	0.766	S	S	*	*			trans	-103.1	125.6	158.5	-171.6	0	0	0	0	107.8
266	P	31.1	Very low	28.6	Very low	127 Å²	127	136 Å²	136	83%	0.825	77%	0.769	S	S	*	*			trans	-87.8	120.8	-174.6	32.4	-32.5	0	0	0	111.7
267	G	29.1	Very low	28.9	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	76%	0.76	S	S	*	*			trans	164.1	102.5	169.7	0	0	0	0	0	116.7
268	Q	32	Very low	29.4	Very low	179 Å²	179	137.9 Å²	137.9	84%	0.836	75%	0.754	S	S	*	*			trans	58.7	96.9	148.7	-61.1	-175.6	-4.7	0	0	119.8
269	N	29.4	Very low	29.9	Very low	140 Å²	140	138.1 Å²	138.1	75%	0.749	75%	0.751	S	S	*	*				85.4	106.2	119.6	-59.1	-17.3	0	0	0	122.1
270	V	30	Very low	30.1	Very low	123 Å²	123	137.6 Å²	137.6	75%	0.745	75%	0.75	S	S	*	*				89.4	120.8	120.1	171.5	0	0	0	0	120.3
271	L	29.6	Very low	30.6	Very low	146 Å²	146	132.9 Å²	132.9	76%	0.764	74%	0.739	S	S	*	*			trans	60.8	111	161.6	-98.6	59.6	0	0	0	118.1
272	L	25.4	Very low	31	Very low	142 Å²	142	132.6 Å²	132.6	74%	0.743	74%	0.74	S	S	*	*				49.4	132.7	77.6	-53.8	174.3	0	0	0	112.8
273	Q	27.6	Very low	31.3	Very low	139 Å²	139	131.7 Å²	131.7	65%	0.65	74%	0.736	S	S	*	*			cis	-170.5	165.1	27.5	-138.1	-178.9	44.9	0	0	112.9
274	R	29	Very low	31.5	Very low	182 Å²	182	133.3 Å²	133.3	69%	0.687	74%	0.737	S	S	*	*			trans	71.8	108.6	145.2	-87.3	-174.9	164.5	115.4	-4.4	124.3
275	E	28.4	Very low	31.4	Very low	160 Å²	160	129.4 Å²	129.4	75%	0.748	72%	0.723	S	S	*	*				78.5	153.8	116.7	-74.5	-172	93.3	0	0	122.9
276	P	37.7	Very low	31.7	Very low	114 Å²	114	132.2 Å²	132.2	74%	0.74	72%	0.723	S	S	*	*			trans	-117.9	-169.6	-161.5	44.8	-32.9	0	0	0	113.8
277	K	32.7	Very low	31.5	Very low	169 Å²	169	131.1 Å²	131.1	74%	0.735	71%	0.71	S	S	*	*			trans	-163.2	146.7	146.4	-113.1	-171	161.7	-71.5	0	116.5
278	D	35.8	Very low	31.3	Very low	108 Å²	108	137.4 Å²	137.4	58%	0.578	71%	0.713	S	S	*	*			trans	66	106.4	142.1	-63.7	-2.7	0	0	0	123.7
279	T	34.9	Very low	31.4	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	71%	0.714	S	S	*	*				55.1	155	127.2	33.2	0	0	0	0	122.7
280	D	35.5	Very low	31.2	Very low	130 Å²	130	134.7 Å²	134.7	70%	0.695	71%	0.709	S	S	*	*			cis	-146	167.3	18.1	-135.6	-53.1	0	0	0	116.1
281	S	34.8	Very low	31.5	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	71%	0.712	S	S	*	*			trans	-26.2	157.6	173.3	50.1	0	0	0	0	120.1
282	S	35.7	Very low	31.4	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	71%	0.712	S	S	*	*			cis	-160.7	142.9	35.5	53.6	0	0	0	0	116
283	D	34.7	Very low	31.7	Very low	143 Å²	143	135.3 Å²	135.3	77%	0.765	71%	0.712	S	S	*	*			trans	46.4	121.8	143.9	-53.9	-48	0	0	0	122.6
284	S	29.1	Very low	31.6	Very low	98 Å²	98	136 Å²	136	69%	0.685	71%	0.713	S	S	*	*			cis	79.4	144.6	29.1	104.8	0	0	0	0	114.9
285	L	27.6	Very low	31.7	Very low	120 Å²	120	133.6 Å²	133.6	63%	0.628	72%	0.719	S	S	*	*			cis	-160.6	163.4	-20.1	-148.8	104.8	0	0	0	109.3	N287	L285-N287 WeakPolarHBondContact CD2-OD1 3.28Å
286	H	34.8	Very low	31.6	Very low	173 Å²	173	132.2 Å²	132.2	80%	0.801	71%	0.713	S	S	*	*			trans	156.7	86.7	135.6	-84.5	-62.2	0	0	0	115.9
287	N	27.6	Very low	31.3	Very low	104 Å²	104	133.3 Å²	133.3	56%	0.556	71%	0.711	S	S	*	*				46.1	123.2	116.3	-67.2	15.8	0	0	0	123.1	L285	L285-N287 WeakPolarHBondContact CD2-OD1 3.28Å
288	W	25.8	Very low	31.2	Very low	199 Å²	199	131.5 Å²	131.5	75%	0.754	72%	0.719	S	S	*	*				54.2	128.4	127.9	-92.8	-54.9	0	0	0	122.2	D290	W288-D290 PolarHBondContact NE1-OD2 3.19Å
289	T	32.4	Very low	30.7	Very low	140 Å²	140	134.8 Å²	134.8	86%	0.859	73%	0.731	S	S	*	*				-151.5	130	104.2	-17.3	0	0	0	0	111.1
290	D	26.9	Very low	30.7	Very low	123 Å²	123	134.2 Å²	134.2	66%	0.658	73%	0.731	S	S	*	*			trans	-86.6	148.8	169.1	-68.4	-69.4	0	0	0	110.5	W288	W288-D290 PolarHBondContact NE1-OD2 3.19Å
291	I	35.2	Very low	30.5	Very low	158 Å²	158	134.3 Å²	134.3	81%	0.81	73%	0.732	S	S	*	*			trans	-124.3	102.3	163.1	-60.3	-177.3	0	0	0	108.7	V293	I291-V293 HydrophobicContact CG2-CG2 4.44Å
292	N	26.9	Very low	30.5	Very low	140 Å²	140	138.3 Å²	138.3	75%	0.749	74%	0.737	S	S	*	*			trans	-92	120.5	176.1	-179.9	-7.9	0	0	0	109.4
293	V	32.2	Very low	30.3	Very low	125 Å²	125	141.2 Å²	141.2	76%	0.758	74%	0.738	S	S	*	*			trans	-102.9	102.3	173.9	-178.9	0	0	0	0	109.1	I291	I291-V293 HydrophobicContact CG2-CG2 4.44Å
294	K	25.4	Very low	30.2	Very low	153 Å²	153	140.1 Å²	140.1	67%	0.665	73%	0.732	S	S	*	*			trans	-105.5	122	179.5	177.9	-172.1	175.9	-170.9	0	110.3
295	T	31.9	Very low	30.5	Very low	133 Å²	133	142.6 Å²	142.6	82%	0.816	74%	0.737	S	S	*	*			trans	-131.3	140.6	168	-40.4	0	0	0	0	108.8
296	Q	27	Very low	30.7	Very low	131 Å²	131	143.7 Å²	143.7	61%	0.612	74%	0.743	S	S	*	*			trans	-112.6	149.3	-168.5	-76	175.8	-119.9	0	0	113.2
297	L	29.9	Very low	30.6	Very low	136 Å²	136	145.9 Å²	145.9	71%	0.712	74%	0.744	S	S	*	*			trans	53.9	131.4	141.8	-72.2	163.1	0	0	0	120.1
298	C	30.2	Very low	30.8	Very low	132 Å²	132	144.8 Å²	144.8	89%	0.892	75%	0.745	S	S	*	*				-157.1	147.4	100.8	-109.4	0	0	0	0	111.8
299	E	26	Very low	31.2	Very low	177 Å²	177	143.7 Å²	143.7	83%	0.827	75%	0.748	S	S	*	*			trans	-135.2	142.9	-178.9	-173.2	174.5	-148.8	0	0	108.4
300	S	34.5	Very low	31.3	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	74%	0.737	S	S	*	*			trans	178.6	146.8	175.7	13.9	0	0	0	0	110.2
301	D	31.9	Very low	31.6	Very low	132 Å²	132	144.5 Å²	144.5	71%	0.706	75%	0.748	S	S	*	*			cis	-164.9	-169.7	-19.1	-149.5	-38.5	0	0	0	108.7
302	F	34.1	Very low	31.6	Very low	183 Å²	183	140.7 Å²	140.7	80%	0.803	75%	0.748	S	S	*	*			trans	97.9	72.4	162.9	-63.5	-80.2	0	0	0	121.2
303	K	32	Very low	32	Very low	157 Å²	157	143 Å²	143	68%	0.683	75%	0.754	S	S	*	*				63.9	143.7	103.8	-83	-173.5	150.7	-147.3	0	126.7
304	D	33.2	Very low	32.1	Very low	121 Å²	121	141.2 Å²	141.2	65%	0.647	75%	0.752	S	S	*	*			trans	72.5	144	144	-61.7	-20.8	0	0	0	119.3
305	L	35.3	Very low	32.5	Very low	149 Å²	149	143.1 Å²	143.1	78%	0.78	76%	0.764	S	S	*	*			cis	-151	173	11.1	-153.8	68.3	0	0	0	114.4
306	N	30.8	Very low	32.5	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	76%	0.756	S	S	*	*			trans	-66.3	179.8	-172.7	-69.7	-75.5	0	0	0	117.9
307	R	32.6	Very low	32.9	Very low	218 Å²	218	143.8 Å²	143.8	82%	0.823	77%	0.768	S	S	*	*			cis	-178	153.4	44.2	-158	-165.8	175.1	171.3	-3.5	118.3
308	S	32.4	Very low	33	Very low	81 Å²	81	143.9 Å²	143.9	57%	0.566	78%	0.775	S	S	*	*			trans	79.7	113	141.3	41.4	0	0	0	0	127.2
309	Q	33.7	Very low	33	Very low	176 Å²	176	141.5 Å²	141.5	82%	0.822	76%	0.764	S	S	*	*				65.6	151.9	118.5	-70.5	177.6	-47.8	0	0	123.3
310	S	34.4	Very low	33.3	Very low	89 Å²	89	141.6 Å²	141.6	62%	0.622	77%	0.767	S	S	*	*			cis	-174.2	154.3	-12.8	50	0	0	0	0	115.7
311	E	33.8	Very low	33.4	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	77%	0.767	S	S	*	*			trans	67.3	146.3	150.1	-74.9	-177.9	112.4	0	0	125.1
312	G	35	Very low	33.3	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	76%	0.764	S	S	*	*			trans	157.4	93.7	166.1	0	0	0	0	0	117.4
313	H	36	Very low	33.2	Very low	189 Å²	189	138.2 Å²	138.2	88%	0.875	76%	0.764	S	S	*	*			trans	-76.3	152.6	-177	-83.8	-105	0	0	0	116.7
314	A	34.5	Very low	33.2	Very low	88 Å²	88	138.5 Å²	138.5	73%	0.727	77%	0.768	S	S	*	*				153.6	125.6	110.5	0	0	0	0	0	118.8
315	E	32.8	Very low	32.8	Very low	193 Å²	193	137.4 Å²	137.4	90%	0.902	77%	0.77	S	S	*	*			trans	71.7	123.3	134.4	-64.9	-156	128.5	0	0	127.8
316	A	32.7	Very low	32.7	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	77%	0.773	S	S	*	*				94.3	82.8	122.4	0	0	0	0	0	124.9
317	K	34.2	Very low	32.5	Very low	198 Å²	198	138.5 Å²	138.5	86%	0.861	78%	0.78	S	S	*	*				59.4	155.7	116.1	-69.7	178.6	175.4	173.3	0	123.6
318	T	32.3	Very low	32.4	Very low	138 Å²	138	134.1 Å²	134.1	85%	0.847	78%	0.782	S	S	*	*			trans	94.9	131.2	150.6	-35.7	0	0	0	0	116.6
319	A	30.9	Very low	32.2	Very low	82 Å²	82	137.9 Å²	137.9	68%	0.678	80%	0.796	S	S	*	*			cis	-165.9	144.8	-23.3	0	0	0	0	0	113.7
320	M	32.4	Very low	31.9	Very low	179 Å²	179	135 Å²	135	88%	0.882	79%	0.789	S	S	*	*			trans	70.3	152.9	147.3	-66.5	-63.3	-76.2	0	0	123.1
321	P	36	Very low	31.7	Very low	118 Å²	118	138.9 Å²	138.9	77%	0.766	80%	0.798	S	S	*	*			trans	-126	-166.6	-174.3	45.2	-29.4	0	0	0	113.9
322	G	31	Very low	31.4	Very low	62 Å²	62	137.9 Å²	137.9	64%	0.639	79%	0.79	S	S	*	*			trans	176.4	136.3	159	0	0	0	0	0	117.1
323	E	31.3	Very low	31.2	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	78%	0.783	S	S	*	*			trans	68.4	149.6	141.4	-50.8	-152.8	121.3	0	0	120.3
324	Q	32.1	Very low	31	Very low	163 Å²	163	140 Å²	140	76%	0.762	78%	0.781	S	S	*	*			cis	-153.2	170.5	-16	-118.7	-169.8	53.1	0	0	111.3
325	S	25.4	Very low	30.9	Very low	98 Å²	98	140.1 Å²	140.1	69%	0.685	78%	0.776	S	S	*	*			trans	-64.8	148.6	-178.5	146.9	0	0	0	0	115.5
326	S	31.6	Very low	30.8	Very low	122 Å²	122	141.3 Å²	141.3	85%	0.853	78%	0.779	S	S	*	*			trans	-162.7	131.1	136.2	-84.2	0	0	0	0	112.8
327	Q	26.8	Very low	31	Very low	195 Å²	195	143.1 Å²	143.1	91%	0.911	78%	0.782	S	S	*	*			trans	-90.4	140.6	170.7	-68.2	178.3	-15.9	0	0	110.5
328	S	31.2	Very low	31.3	Very low	125 Å²	125	136.6 Å²	136.6	87%	0.874	76%	0.76	S	S	*	*			trans	-130.9	121.2	163.4	53.1	0	0	0	0	112.2
329	L	28.5	Very low	31.9	Very low	161 Å²	161	136.4 Å²	136.4	84%	0.843	76%	0.758	S	S	*	*			trans	-64.6	133.5	-174.2	-177.7	72.9	0	0	0	113.2
330	V	27.8	Very low	32.7	Very low	114 Å²	114	137.4 Å²	137.4	69%	0.691	76%	0.756	S	S	*	*			trans	56.5	122.1	152.1	174.3	0	0	0	0	118.1
331	Q	29	Very low	33.5	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.804	74%	0.743	S	S	*	*				-175.3	101.6	101.2	-160.6	154.6	-82.5	0	0	115.6
332	K	28.9	Very low	34.1	Very low	169 Å²	169	131.8 Å²	131.8	74%	0.735	73%	0.73	S	S	*	*				76	113.2	129.5	-156.7	169.7	-169.7	163.4	0	122.6
333	D	29.7	Very low	35	Very low	121 Å²	121	134.3 Å²	134.3	65%	0.647	73%	0.726	S	S	*	*			trans	46.8	128.4	139.7	-41.8	-20.4	0	0	0	121.9
334	K	33	Very low	36.1	Very low	191 Å²	191	129.5 Å²	129.5	83%	0.83	71%	0.705	S	S	*	*				-171.3	124.1	99.1	-97.9	150.5	-169.2	169.4	0	116.4
335	S	31.4	Very low	37.5	Very low	91 Å²	91	124 Å²	124	64%	0.636	69%	0.687	S	S	*	*			trans	43.7	108.4	143.1	61.9	0	0	0	0	120.9
336	F	31.5	Very low	39.4	Very low	217 Å²	217	128.4 Å²	128.4	95%	0.952	69%	0.689	S	S	*	*			trans	-131.5	74.2	141.2	-109.7	-80.8	0	0	0	111.3
337	T	35.9	Very low	40.9	Very low	118 Å²	118	126.6 Å²	126.6	72%	0.724	67%	0.669	S	S	*	*			trans	-168.9	155.4	174.2	7.4	0	0	0	0	106.8
338	P	40.6	Very low	42.6	Very low	61 Å²	61	126.1 Å²	126.1	40%	0.396	66%	0.659	S	S	.	*			cis	-144.1	117.1	2.1	36.2	-14.1	0	0	0	115.8	L341 A342	P338-L341 HydrophobicContact CB-CB 3.7Å; P338-L341 HydrophobicContact CB-CD1 3.88Å; P338-L341 HydrophobicContact CB-CG 3.97Å; P338-L341 HydrophobicContact CG-CB 3.85Å; P338-L341 HydrophobicContact CG-CD1 4.15Å; P338-L341 HydrophobicContact CG-CG 4.46Å; P338-A342 WeakPolarHBondContact O-CB 3.19Å; P338-A342 PolarHBondContact O-N 2.88Å
339	V	45.9	Very low	44.2	Very low	134 Å²	134	126.7 Å²	126.7	81%	0.812	65%	0.648	S	S	*	*	H	α-helix	trans	-67.5	-41	166.7	-179.4	0	0	0	0	111.1	A342 H343	V339-A342 PolarHBondContact O-N 2.87Å; V339-H343 PolarHBondContact O-N 2.69Å
340	V	47.6	Very low	45.9	Very low	104 Å²	104	121.1 Å²	121.1	63%	0.63	62%	0.623	S	S	*	*	H	α-helix	trans	-72.9	-35.3	-173.4	-177.2	0	0	0	0	113.3	N344	V340-N344 PolarHBondContact O-N 3.21Å; V340-N344 PolarHBondContact O-ND2 3.36Å
341	L	48.1	Very low	47.3	Very low	118 Å²	118	120.3 Å²	120.3	62%	0.618	61%	0.614	S	S	*	*	H	α-helix	trans	-74.8	-34.2	174.2	-63.5	170.3	0	0	0	111.8	P338 N344 A345	P338-L341 HydrophobicContact CB-CB 3.7Å; P338-L341 HydrophobicContact CB-CD1 3.88Å; P338-L341 HydrophobicContact CB-CG 3.97Å; P338-L341 HydrophobicContact CG-CB 3.85Å; P338-L341 HydrophobicContact CG-CD1 4.15Å; P338-L341 HydrophobicContact CG-CG 4.46Å; L341-N344 PolarHBondContact O-N 2.78Å; L341-A345 VanDerWaalsContact O-CB 3.32Å; L341-A345 WeakPolarHBondContact O-CB 3.33Å; L341-A345 PolarHBondContact O-N 3.43Å
342	A	48.6	Very low	49	Very low	60 Å²	60	117 Å²	117	50%	0.496	61%	0.605	S	S	.	*	H	α-helix	trans	-62.8	-42.3	172.6	0	0	0	0	0	111.5	P338 V339 A345 R346	P338-A342 WeakPolarHBondContact O-CB 3.19Å; P338-A342 PolarHBondContact O-N 2.88Å; V339-A342 PolarHBondContact O-N 2.87Å; A342-A345 PolarHBondContact O-N 3.19Å; A342-R346 WeakPolarHBondContact O-CB 3.39Å; A342-R346 PolarHBondContact O-N 3.3Å
343	H	49.3	Very low	50.3	Low	116 Å²	116	111.9 Å²	111.9	54%	0.537	59%	0.594	S	S	.	*	H	α-helix	trans	-62.3	-44.9	173.9	-169.9	-113.8	0	0	0	112.3	V339 R346 L347	V339-H343 PolarHBondContact O-N 2.69Å; H343-R346 PolarHBondContact O-N 3.32Å; H343-L347 WeakPolarHBondContact O-CB 3.32Å; H343-L347 PolarHBondContact O-N 2.52Å
344	N	56.2	Low	51.3	Low	70 Å²	70	115.8 Å²	115.8	37%	0.374	60%	0.6	S	S	.	*	H	α-helix	trans	-64.8	-38.7	176	-88.4	-82	0	0	0	113.3	V340 L341 L347 R348	V340-N344 PolarHBondContact O-N 3.21Å; V340-N344 PolarHBondContact O-ND2 3.36Å; L341-N344 PolarHBondContact O-N 2.78Å; N344-L347 PolarHBondContact O-N 2.84Å; N344-R348 WeakPolarHBondContact O-CB 3.4Å; N344-R348 WeakPolarHBondContact O-CG 3.3Å; N344-R348 PolarHBondContact O-N 3.22Å
345	A	61.2	Low	52.3	Low	46 Å²	46	113.9 Å²	113.9	38%	0.38	59%	0.594	S	S	.	*	H	α-helix	trans	-63.8	-44.1	174.3	0	0	0	0	0	111.2	L341 A342 R348 Q349	L341-A345 VanDerWaalsContact O-CB 3.32Å; L341-A345 WeakPolarHBondContact O-CB 3.33Å; L341-A345 PolarHBondContact O-N 3.43Å; A342-A345 PolarHBondContact O-N 3.19Å; A345-R348 PolarHBondContact O-N 3.05Å; A345-Q349 WeakPolarHBondContact O-CB 3.32Å; A345-Q349 WeakPolarHBondContact O-CG 3.42Å; A345-Q349 PolarHBondContact O-N 2.92Å
346	R	63.8	Low	52.9	Low	191 Å²	191	112.1 Å²	112.1	72%	0.721	58%	0.584	S	S	*	*	H	α-helix	trans	-64.8	-38.7	176.4	-164.4	176	-172.3	179.7	2.2	112.2	A342 H343 S350	A342-R346 WeakPolarHBondContact O-CB 3.39Å; A342-R346 PolarHBondContact O-N 3.3Å; H343-R346 PolarHBondContact O-N 3.32Å; R346-S350 WeakPolarHBondContact O-CB 3.4Å; R346-S350 PolarHBondContact O-N 2.86Å; R346-S350 PolarHBondContact O-OG 3.31Å
347	L	64.4	Low	53.3	Low	84 Å²	84	107.8 Å²	107.8	44%	0.44	58%	0.578	S	S	.	*	H	α-helix	trans	-61.5	-50.5	171.8	-86.4	167.6	0	0	0	111.3	H343 N344 Q349 S350 L351	H343-L347 WeakPolarHBondContact O-CB 3.32Å; H343-L347 PolarHBondContact O-N 2.52Å; N344-L347 PolarHBondContact O-N 2.84Å; L347-Q349 PolarHBondContact O-N 3.05Å; L347-S350 PolarHBondContact O-N 3.24Å; L347-S350 VanDerWaalsContact O-N 3.13Å; L347-S350 PolarHBondContact O-OG 2.67Å; L347-L351 PolarHBondContact O-N 2.82Å
348	R	62.4	Low	53.7	Low	186 Å²	186	112 Å²	112	70%	0.702	58%	0.581	S	S	*	*	H	α-helix	trans	-59.5	-43.6	177.3	-72.5	177.9	-178.3	-154	0.7	112.3	N344 A345 L351 V352	N344-R348 WeakPolarHBondContact O-CB 3.4Å; N344-R348 WeakPolarHBondContact O-CG 3.3Å; N344-R348 PolarHBondContact O-N 3.22Å; A345-R348 PolarHBondContact O-N 3.05Å; R348-L351 PolarHBondContact O-N 2.82Å; R348-V352 WeakPolarHBondContact O-CG2 3.2Å; R348-V352 PolarHBondContact O-N 2.86Å
349	Q	65.6	Low	53.7	Low	136 Å²	136	114.6 Å²	114.6	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-62.4	-41.5	173.7	-75.6	177.3	-11.9	0	0	112.1	A345 L347 L351 V352 A353	A345-Q349 WeakPolarHBondContact O-CB 3.32Å; A345-Q349 WeakPolarHBondContact O-CG 3.42Å; A345-Q349 PolarHBondContact O-N 2.92Å; L347-Q349 PolarHBondContact O-N 3.05Å; Q349-L351 VanDerWaalsContact C-N 3.32Å; Q349-L351 PolarHBondContact O-N 3.38Å; Q349-V352 PolarHBondContact O-N 3.25Å; Q349-A353 VanDerWaalsContact O-CB 3.28Å; Q349-A353 WeakPolarHBondContact O-CB 3.36Å; Q349-A353 PolarHBondContact O-N 3.32Å
350	S	64	Low	53.3	Low	45 Å²	45	117.4 Å²	117.4	32%	0.315	60%	0.599	S	S	.	*	H	α-helix	trans	-67.6	-31.1	177	75.3	0	0	0	0	113	R346 L347 R354	R346-S350 WeakPolarHBondContact O-CB 3.4Å; R346-S350 PolarHBondContact O-N 2.86Å; R346-S350 PolarHBondContact O-OG 3.31Å; L347-S350 PolarHBondContact O-N 3.24Å; L347-S350 VanDerWaalsContact O-N 3.13Å; L347-S350 PolarHBondContact O-OG 2.67Å; S350-R354 WeakPolarHBondContact O-CB 3.3Å; S350-R354 WeakPolarHBondContact O-CD 3.29Å; S350-R354 WeakPolarHBondContact O-CG 3.35Å; S350-R354 PolarHBondContact O-N 2.8Å; S350-R354 VanDerWaalsContact O-N 3.1Å
351	L	56.7	Low	52.7	Low	96 Å²	96	118.5 Å²	118.5	50%	0.503	61%	0.606	S	S	.	*	H	α-helix	trans	-67.9	-48	171.8	-129.3	73.7	0	0	0	111.3	L347 R348 Q349 A353 R354 H355	L347-L351 PolarHBondContact O-N 2.82Å; R348-L351 PolarHBondContact O-N 2.82Å; Q349-L351 VanDerWaalsContact C-N 3.32Å; Q349-L351 PolarHBondContact O-N 3.38Å; L351-A353 VanDerWaalsContact C-N 3.34Å; L351-A353 PolarHBondContact O-N 3.18Å; L351-R354 PolarHBondContact O-N 2.91Å; L351-R354 VanDerWaalsContact O-N 3.09Å; L351-H355 PolarHBondContact O-CD2 3.4Å; L351-H355 PolarHBondContact O-N 2.76Å
352	V	64	Low	51.9	Low	103 Å²	103	117.4 Å²	117.4	62%	0.624	61%	0.607	S	S	*	*	H	α-helix	trans	-61.5	-41.7	176.6	173.4	0	0	0	0	111.1	R348 Q349 R354 H355 A356	R348-V352 WeakPolarHBondContact O-CG2 3.2Å; R348-V352 PolarHBondContact O-N 2.86Å; Q349-V352 PolarHBondContact O-N 3.25Å; V352-R354 PolarHBondContact O-N 2.86Å; V352-H355 CarbonylContact O-C 3.57Å; V352-H355 PolarHBondContact O-N 2.71Å; V352-H355 VanDerWaalsContact O-N 3.09Å; V352-A356 PolarHBondContact O-N 2.78Å
353	A	55.6	Low	51.3	Low	61 Å²	61	123.6 Å²	123.6	50%	0.504	62%	0.623	S	S	.	*	H	α-helix	trans	-69.3	-16.5	175.8	0	0	0	0	0	114.4	Q349 L351	Q349-A353 VanDerWaalsContact O-CB 3.28Å; Q349-A353 WeakPolarHBondContact O-CB 3.36Å; Q349-A353 PolarHBondContact O-N 3.32Å; L351-A353 VanDerWaalsContact C-N 3.34Å; L351-A353 PolarHBondContact O-N 3.18Å
354	R	52.6	Low	50.3	Low	203 Å²	203	123.1 Å²	123.1	77%	0.766	63%	0.628	S	S	*	*	H	α-helix	trans	-89.2	-19.5	169.6	-75.5	170.5	178.8	-173.5	-0	113	S350 L351 V352	S350-R354 WeakPolarHBondContact O-CB 3.3Å; S350-R354 WeakPolarHBondContact O-CD 3.29Å; S350-R354 WeakPolarHBondContact O-CG 3.35Å; S350-R354 PolarHBondContact O-N 2.8Å; S350-R354 VanDerWaalsContact O-N 3.1Å; L351-R354 PolarHBondContact O-N 2.91Å; L351-R354 VanDerWaalsContact O-N 3.09Å; V352-R354 PolarHBondContact O-N 2.86Å
355	H	52.1	Low	49.3	Very low	151 Å²	151	126.7 Å²	126.7	70%	0.699	65%	0.652	S	S	*	*	H	α-helix	trans	-98.4	-10.1	176.1	-71.2	-57	0	0	0	114.1	L351 V352	L351-H355 PolarHBondContact O-CD2 3.4Å; L351-H355 PolarHBondContact O-N 2.76Å; V352-H355 CarbonylContact O-C 3.57Å; V352-H355 PolarHBondContact O-N 2.71Å; V352-H355 VanDerWaalsContact O-N 3.09Å
356	A	45.4	Very low	47.9	Very low	54 Å²	54	134.6 Å²	134.6	45%	0.446	67%	0.672	S	S	.	*	S	Bend	trans	-67.5	127.2	169	0	0	0	0	0	110.6	V352 R358	V352-A356 PolarHBondContact O-N 2.78Å; A356-R358 PolarHBondContact O-N 2.79Å; A356-R358 VanDerWaalsContact O-N 3.1Å
357	P	39.7	Very low	46.3	Very low	127 Å²	127	131.1 Å²	131.1	83%	0.825	68%	0.677	S	S	*	*			trans	-67.8	111.2	177.3	27.5	-33.2	0	0	0	109.7
358	R	43.2	Very low	44.8	Very low	206 Å²	206	131.8 Å²	131.8	78%	0.777	70%	0.695	S	S	*	*			trans	-69.7	131.2	172.5	-67.8	-172.9	177.3	-159.5	-1.7	109.2	A356 F360	A356-R358 PolarHBondContact O-N 2.79Å; A356-R358 VanDerWaalsContact O-N 3.1Å; R358-F360 PolarHBondContact O-N 2.88Å
359	P	41.9	Very low	43.4	Very low	115 Å²	115	127.3 Å²	127.3	75%	0.747	69%	0.692	S	S	*	*			trans	-64.3	120.9	170.8	26.7	-32.6	0	0	0	109	V361	P359-V361 PolarHBondContact O-N 2.75Å
360	F	37.1	Very low	41.8	Very low	193 Å²	193	126.1 Å²	126.1	85%	0.846	70%	0.697	S	S	*	*			trans	-70.5	91.4	174.6	-83.2	-95.1	0	0	0	109.7	R358 C362	R358-F360 PolarHBondContact O-N 2.88Å; F360-C362 PolarHBondContact O-N 2.95Å
361	V	35.5	Very low	40.4	Very low	127 Å²	127	135 Å²	135	77%	0.77	73%	0.726	S	S	*	*			trans	-73.7	81.8	162.2	-176.4	0	0	0	0	107.5	P359 K363	P359-V361 PolarHBondContact O-N 2.75Å; V361-K363 VanDerWaalsContact C-N 3.33Å; V361-K363 PolarHBondContact O-N 3.19Å
362	C	31.7	Very low	39.3	Very low	96 Å²	96	133.7 Å²	133.7	65%	0.649	74%	0.735	S	S	*	*			trans	-64	94.5	169.9	-69.5	0	0	0	0	108.9	F360 V364	F360-C362 PolarHBondContact O-N 2.95Å; C362-V364 VanDerWaalsContact C-N 3.32Å; C362-V364 PolarHBondContact O-N 3.27Å
363	K	34.3	Very low	37.8	Very low	190 Å²	190	137.7 Å²	137.7	83%	0.826	75%	0.747	S	S	*	*			trans	-63.7	99.8	160.2	-90.6	-169.9	171.1	-175.4	0	107.4	V361 V365	V361-K363 VanDerWaalsContact C-N 3.33Å; V361-K363 PolarHBondContact O-N 3.19Å; K363-V365 VanDerWaalsContact C-N 3.31Å; K363-V365 PolarHBondContact O-N 2.66Å
364	V	30.1	Very low	37	Very low	106 Å²	106	142.4 Å²	142.4	64%	0.642	76%	0.759	S	S	*	*			trans	-65.9	92	174	-179.5	0	0	0	0	108.2	C362 R366	C362-V364 VanDerWaalsContact C-N 3.32Å; C362-V364 PolarHBondContact O-N 3.27Å; V364-R366 HydrophobicContact CG1-CB 4.01Å; V364-R366 HydrophobicContact CG1-CG 3.83Å
365	V	33.7	Very low	36.1	Very low	144 Å²	144	135.4 Å²	135.4	87%	0.873	75%	0.75	S	S	*	*			trans	-77.3	121.6	157.8	-177.7	0	0	0	0	105.7	K363	K363-V365 VanDerWaalsContact C-N 3.31Å; K363-V365 PolarHBondContact O-N 2.66Å
366	R	31.5	Very low	35.3	Very low	212 Å²	212	134.2 Å²	134.2	80%	0.8	75%	0.753	S	S	*	*			trans	-131.9	155.3	-168.9	-132.9	-179.8	-172.6	158.1	0.4	109.3	V364	V364-R366 HydrophobicContact CG1-CB 4.01Å; V364-R366 HydrophobicContact CG1-CG 3.83Å
367	S	30.1	Very low	34.8	Very low	119 Å²	119	137.7 Å²	137.7	83%	0.832	77%	0.771	S	S	*	*			trans	71.7	150.1	175.7	-46.3	0	0	0	0	113.8
368	A	33.4	Very low	34.6	Very low	98 Å²	98	136.9 Å²	136.9	81%	0.81	77%	0.768	S	S	*	*			cis	-138.4	178.8	6	0	0	0	0	0	109.7
369	S	33.5	Very low	34.1	Very low	92 Å²	92	133.7 Å²	133.7	64%	0.643	77%	0.766	S	S	*	*			cis	-155.4	131.6	-5.1	101.5	0	0	0	0	107.2
370	C	32.1	Very low	33.7	Very low	111 Å²	111	134.9 Å²	134.9	75%	0.75	77%	0.766	S	S	*	*				95.4	161.6	81.5	-69.5	0	0	0	0	113.7
371	Y	34.4	Very low	33.5	Very low	232 Å²	232	131.8 Å²	131.8	91%	0.91	75%	0.754	S	S	*	*			trans	69.1	127.9	-164.7	-52.4	-77.2	0	0	0	114.7
372	G	33.6	Very low	33.5	Very low	68 Å²	68	131 Å²	131	70%	0.701	74%	0.742	S	S	*	*			cis	-162.8	167.9	-4.3	0	0	0	0	0	114.1
373	E	33.4	Very low	33.6	Very low	186 Å²	186	135.1 Å²	135.1	87%	0.869	74%	0.743	S	S	*	*			trans	-25.8	146.1	172.3	-69.9	147.4	130.8	0	0	117.6
374	E	37	Very low	33.7	Very low	160 Å²	160	131.9 Å²	131.9	75%	0.748	74%	0.735	S	S	*	*			cis	-151.8	-179.4	13.5	-114.9	-71.7	91.9	0	0	108.6	T376	E374-T376 PolarHBondContact OE2-N 2.95Å
375	G	35.4	Very low	33.9	Very low	56 Å²	56	134.5 Å²	134.5	58%	0.577	75%	0.745	S	S	*	*			cis	172.1	-146.3	8.9	0	0	0	0	0	120.6
376	T	35.1	Very low	33.9	Very low	126 Å²	126	131 Å²	131	77%	0.773	74%	0.738	S	S	*	*			trans	-52.4	128.5	-158.7	56.9	0	0	0	0	119	E374	E374-T376 PolarHBondContact OE2-N 2.95Å
377	P	35.4	Very low	34	Very low	127 Å²	127	126 Å²	126	83%	0.825	74%	0.736	S	S	*	*			trans	-108	157	169.4	38.6	-32.3	0	0	0	114.8
378	S	33.5	Very low	34.1	Very low	110 Å²	110	124.1 Å²	124.1	77%	0.769	71%	0.713	S	S	*	*			trans	-169.3	151.3	-176.5	176.2	0	0	0	0	111.8
379	L	34.5	Very low	34.1	Very low	140 Å²	140	124.7 Å²	124.7	73%	0.733	70%	0.698	S	S	*	*			cis	-167.1	151.9	-21.9	-99.7	-179.9	0	0	0	108.6
380	L	33.2	Very low	34.1	Very low	140 Å²	140	124 Å²	124	73%	0.733	69%	0.693	S	S	*	*			trans	63.5	154.8	151.6	-68.9	175.1	0	0	0	119.1
381	Q	31.7	Very low	34.2	Very low	128 Å²	128	126.2 Å²	126.2	60%	0.598	69%	0.693	S	S	*	*			cis	-170.8	144.7	-8.3	169.7	172.7	6.6	0	0	112.7
382	E	35.4	Very low	34.1	Very low	110 Å²	110	121.6 Å²	121.6	51%	0.514	68%	0.684	S	S	.	*			trans	66.2	127	154.7	-72.1	167.9	-169.2	0	0	122
383	R	35.3	Very low	34.1	Very low	182 Å²	182	124.1 Å²	124.1	69%	0.687	69%	0.685	S	S	*	*				83.1	148.6	98	-71.8	-177.2	-162.1	124.2	20.5	114.7
384	D	35.7	Very low	34	Very low	122 Å²	122	120 Å²	120	65%	0.652	68%	0.684	S	S	*	*			cis	-150.7	151.4	-2	-113.7	-24.6	0	0	0	114.3
385	L	34.5	Very low	33.8	Very low	162 Å²	162	115.9 Å²	115.9	85%	0.848	68%	0.684	S	S	*	*			trans	12.6	136.7	148.1	-59.8	166.6	0	0	0	123.9
386	G	33.6	Very low	33.5	Very low	70 Å²	70	117.6 Å²	117.6	72%	0.722	69%	0.693	S	S	*	*			trans	114.9	147.1	138.1	0	0	0	0	0	117.8
387	S	32.8	Very low	33.3	Very low	108 Å²	108	118.5 Å²	118.5	76%	0.755	69%	0.693	S	S	*	*			cis	154.2	126.9	-27.5	49.2	0	0	0	0	109.4
388	F	32.6	Very low	32.9	Very low	79 Å²	79	117 Å²	117	35%	0.346	69%	0.685	S	S	.	*			trans	147.6	163.5	148.5	-58.4	-112.6	0	0	0	117.9	R1087 R1088	F388-R1087 HydrophobicContact CE1-CB 3.51Å; F388-R1087 HydrophobicContact CE1-CG 4.29Å; F388-R1087 HydrophobicContact CZ-CB 3.41Å; F388-R1087 VanDerWaalsContact CZ-CB 3.41Å; F388-R1088 VanDerWaalsContact C-NH1 3.35Å; F388-R1088 HydrophobicContact CE1-CB 4.22Å; F388-R1088 HydrophobicContact CE1-CG 3.99Å; F388-R1088 HydrophobicContact CE2-CB 3.8Å; F388-R1088 HydrophobicContact CE2-CG 4.22Å; F388-R1088 HydrophobicContact CZ-CB 3.5Å; F388-R1088 HydrophobicContact CZ-CG 3.79Å; F388-R1088 PolarHBondContact O-NH1 3.22Å; F388-R1088 PolarHBondContact O-NH2 3.48Å
389	E	34.4	Very low	32.7	Very low	109 Å²	109	119.9 Å²	119.9	51%	0.509	69%	0.686	S	S	.	*			trans	-38.2	-177.3	-158.5	-114.9	68.9	-134	0	0	124.3	R1087 R1088	E389-R1087 IonicContact OE1-CZ 2.69Å; E389-R1087 IonicContact OE1-NH1 3.7Å; E389-R1087 PolarHBondContact OE1-NH1 2.81Å; E389-R1088 PolarHBondContact O-NH2 3.15Å
390	S	33.4	Very low	32.4	Very low	77 Å²	77	119 Å²	119	54%	0.538	68%	0.682	S	S	.	*			trans	-144.5	-171.3	-160.7	-69.1	0	0	0	0	111.2	R1088	S390-R1088 PolarHBondContact OG-NH2 3.34Å
391	E	33.5	Very low	32.3	Very low	159 Å²	159	120 Å²	120	74%	0.743	69%	0.688	S	S	*	*			trans	76	150.9	168.7	-58.7	166.1	149.1	0	0	113.4
392	D	32.3	Very low	32.3	Very low	135 Å²	135	117 Å²	117	72%	0.722	69%	0.691	S	S	*	*			cis	-156.1	161.2	9.8	-146.4	5.9	0	0	0	116.6
393	V	32.5	Very low	32.1	Very low	120 Å²	120	118 Å²	118	73%	0.727	71%	0.709	S	S	*	*			trans	57.6	145.8	142.6	154.1	0	0	0	0	125.2
394	A	32.4	Very low	32	Very low	101 Å²	101	114 Å²	114	84%	0.835	71%	0.709	S	S	*	*			trans	76	155.8	160	0	0	0	0	0	120.3
395	G	31.7	Very low	31.8	Very low	73 Å²	73	117 Å²	117	75%	0.753	72%	0.716	S	S	*	*			trans	-176.5	-73.6	179.6	0	0	0	0	0	115.9
396	A	30.1	Very low	31.8	Very low	92 Å²	92	117.6 Å²	117.6	76%	0.76	72%	0.718	S	S	*	*			trans	66.3	172.4	-179	0	0	0	0	0	117.7
397	N	31.2	Very low	31.6	Very low	145 Å²	145	122.2 Å²	122.2	78%	0.775	72%	0.721	S	S	*	*			trans	62	91.7	161.3	-61	-6.4	0	0	0	120.6
398	S	25.6	Very low	31.5	Very low	96 Å²	96	122.9 Å²	122.9	67%	0.671	73%	0.725	S	S	*	*				39.1	154	107.4	68	0	0	0	0	122.7
399	Q	29.6	Very low	31.5	Very low	169 Å²	169	122.8 Å²	122.8	79%	0.79	74%	0.74	S	S	*	*			trans	90	98.6	160.4	-67.7	-172.7	-59.7	0	0	118.4
400	D	28.4	Very low	31.2	Very low	122 Å²	122	123.3 Å²	123.3	65%	0.652	75%	0.75	S	S	*	*				112.7	152.4	104.9	-100.2	-48.2	0	0	0	121.9
401	L	32.3	Very low	31	Very low	161 Å²	161	125.5 Å²	125.5	84%	0.843	75%	0.752	S	S	*	*			trans	51.2	113.9	152.1	-66.6	165.8	0	0	0	120.2
402	G	30.7	Very low	31.1	Very low	64 Å²	64	123.9 Å²	123.9	66%	0.66	75%	0.752	S	S	*	*				138.7	111	105.5	0	0	0	0	0	118
403	C	32.5	Very low	30.9	Very low	132 Å²	132	127.6 Å²	127.6	89%	0.892	76%	0.756	S	S	*	*			trans	60.3	149.1	145.3	-67.7	0	0	0	0	120.2
404	S	32.9	Very low	30.7	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	76%	0.758	S	S	*	*			cis	-163.4	136.4	-14.6	47.8	0	0	0	0	111.2
405	K	31.6	Very low	30.7	Very low	185 Å²	185	131.1 Å²	131.1	80%	0.804	75%	0.749	S	S	*	*				33	116.9	129.1	-165.2	178.6	-170.6	177.3	0	118
406	I	34.2	Very low	30.5	Very low	173 Å²	173	133.2 Å²	133.2	89%	0.887	75%	0.748	S	S	*	*				-156.2	144.3	116	-97.8	149	0	0	0	108.8
407	E	28.8	Very low	30.8	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	75%	0.749	S	S	*	*			trans	-132.1	147.4	-168.5	171.3	-176.1	-160.7	0	0	108.6
408	S	31	Very low	30.7	Very low	122 Å²	122	133.8 Å²	133.8	85%	0.853	74%	0.744	S	S	*	*			trans	-156.1	142.1	153.7	-160.3	0	0	0	0	110.2
409	A	31.8	Very low	30.8	Very low	78 Å²	78	133.4 Å²	133.4	65%	0.645	75%	0.747	S	S	*	*			trans	-129.5	-139.4	-168.5	0	0	0	0	0	111.4
410	V	28.7	Very low	30.7	Very low	120 Å²	120	131.4 Å²	131.4	73%	0.727	75%	0.748	S	S	*	*			trans	83	132.8	173.6	-177	0	0	0	0	115.7
411	Q	29	Very low	30.7	Very low	123 Å²	123	130.8 Å²	130.8	58%	0.575	75%	0.754	S	S	*	*			cis	-160.1	156.9	-27.2	-170.6	169.3	18.8	0	0	109.8
412	V	34.8	Very low	30.4	Very low	125 Å²	125	130.5 Å²	130.5	76%	0.758	75%	0.753	S	S	*	*			trans	-70.9	148.9	176.5	175.8	0	0	0	0	113	M414	V412-M414 HydrophobicContact CG1-CB 4.12Å
413	R	28.5	Very low	30.5	Very low	213 Å²	213	137.6 Å²	137.6	80%	0.804	77%	0.766	S	S	*	*			trans	-128	133.6	144.6	-175.4	170.1	172.4	151.2	-4.5	109.7	E415	R413-E415 IonicContact CZ-OE1 3.5Å; R413-E415 IonicContact NE-OE1 3.3Å; R413-E415 PolarHBondContact NE-OE1 2.94Å; R413-E415 IonicContact NH2-OE1 2.84Å; R413-E415 PolarHBondContact NH2-OE1 3.07Å
414	M	28.2	Very low	30.2	Very low	154 Å²	154	135.9 Å²	135.9	76%	0.759	76%	0.755	S	S	*	*			trans	-132.4	132.2	-178.1	-178.4	175.6	-176.9	0	0	107.1	V412	V412-M414 HydrophobicContact CG1-CB 4.12Å
415	E	33.7	Very low	29.9	Very low	141 Å²	141	139.9 Å²	139.9	66%	0.659	76%	0.763	S	S	*	*			trans	-106	103.8	179.6	-60.8	-155.4	143.9	0	0	110.1	R413	R413-E415 IonicContact CZ-OE1 3.5Å; R413-E415 IonicContact NE-OE1 3.3Å; R413-E415 PolarHBondContact NE-OE1 2.94Å; R413-E415 IonicContact NH2-OE1 2.84Å; R413-E415 PolarHBondContact NH2-OE1 3.07Å
416	T	26.9	Very low	29.7	Very low	116 Å²	116	135.8 Å²	135.8	71%	0.712	76%	0.763	S	S	*	*			trans	-95.6	118.2	170.8	-55.7	0	0	0	0	108.5
417	I	36	Very low	29.6	Very low	153 Å²	153	135 Å²	135	79%	0.785	76%	0.759	S	S	*	*			trans	-138.1	134.9	170.4	-56.3	177.9	0	0	0	106.7
418	S	28.7	Very low	29.5	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	76%	0.758	S	S	*	*			cis	-172.6	150.3	-28.8	-101.2	0	0	0	0	106.6
419	A	27.8	Very low	29.3	Very low	89 Å²	89	131.9 Å²	131.9	74%	0.736	75%	0.751	S	S	*	*			trans	51.8	114.5	160.6	0	0	0	0	0	119.5
420	P	28.1	Very low	29.1	Very low	126 Å²	126	135 Å²	135	82%	0.818	75%	0.752	S	S	*	*			trans	-75	144.3	157.2	33.4	-32.3	0	0	0	110.4
421	S	29.6	Very low	29.2	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	76%	0.757	S	S	*	*			trans	-132.8	88.9	178.3	66.5	0	0	0	0	113.1
422	N	25.3	Very low	29.3	Very low	155 Å²	155	133.6 Å²	133.6	83%	0.829	75%	0.752	S	S	*	*			trans	14.1	108.6	142.7	-51.8	-8	0	0	0	117.1
423	K	32.1	Very low	29.1	Very low	213 Å²	213	134.6 Å²	134.6	93%	0.926	75%	0.746	S	S	*	*			trans	-126.3	135.7	133.2	-83.8	-161.2	171.1	-169.9	0	109.5
424	S	26	Very low	29.2	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	74%	0.744	S	S	*	*			trans	-98.1	-174.1	-176.6	45	0	0	0	0	111.2
425	E	26.7	Very low	29.3	Very low	183 Å²	183	133.9 Å²	133.9	86%	0.855	74%	0.739	S	S	*	*			trans	76.7	135.3	163.9	-58.7	167.1	153.6	0	0	116
426	A	28.9	Very low	29.3	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	74%	0.736	S	S	*	*			cis	-157.3	167.8	-13.9	0	0	0	0	0	110.9
427	I	30.2	Very low	29.3	Very low	156 Å²	156	132.6 Å²	132.6	80%	0.8	73%	0.732	S	S	*	*			trans	-115.8	138.8	-179.2	-61.6	167.2	0	0	0	110.7
428	S	27.4	Very low	29	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	73%	0.729	S	S	*	*			trans	-165	150.4	153.7	-71.4	0	0	0	0	108.7
429	T	27.9	Very low	29	Very low	117 Å²	117	133.9 Å²	133.9	72%	0.718	73%	0.732	S	S	*	*			cis	88.5	147	11.7	75.9	0	0	0	0	118.2
430	E	26.1	Very low	29	Very low	143 Å²	143	134.4 Å²	134.4	67%	0.668	73%	0.73	S	S	*	*			trans	65.9	127.6	-166.3	-69.1	-107.6	125.5	0	0	114.7	A432 K433	E430-A432 WeakPolarHBondContact OE2-CB 3.25Å; E430-K433 IonicContact OE1-NZ 2.67Å; E430-K433 PolarHBondContact OE1-NZ 2.8Å
431	L	32.3	Very low	28.9	Very low	159 Å²	159	133.9 Å²	133.9	83%	0.832	73%	0.725	S	S	*	*			cis	66.5	79.8	-8.9	-145	-176.3	0	0	0	118.4
432	A	29.3	Very low	28.7	Very low	55 Å²	55	133.9 Å²	133.9	46%	0.455	72%	0.72	S	S	.	*			trans	-153.7	122.1	163.9	0	0	0	0	0	110.5	E430	E430-A432 WeakPolarHBondContact OE2-CB 3.25Å
433	K	30.9	Very low	28.8	Very low	146 Å²	146	134.2 Å²	134.2	64%	0.635	72%	0.717	S	S	*	*				79.2	148.1	92.9	-67.4	162.3	-160.1	131.6	0	112.4	E430	E430-K433 IonicContact OE1-NZ 2.67Å; E430-K433 PolarHBondContact OE1-NZ 2.8Å
434	R	31.5	Very low	28.5	Very low	203 Å²	203	129.6 Å²	129.6	77%	0.766	71%	0.711	S	S	*	*			cis	-167.5	162.5	8.3	-129.4	169.4	-178.2	168.2	-1.4	112.5
435	K	30.7	Very low	28.7	Very low	150 Å²	150	129.2 Å²	129.2	65%	0.652	71%	0.708	S	S	*	*			trans	67.4	164.4	145.8	-87.5	175.7	143	-155.5	0	117.4
436	E	32.6	Very low	28.8	Very low	128 Å²	128	126.3 Å²	126.3	60%	0.598	70%	0.699	S	S	*	*			cis	-143.9	136.8	10.3	-136.6	134.8	-177.6	0	0	111.9
437	T	28.5	Very low	28.9	Very low	101 Å²	101	128.9 Å²	128.9	62%	0.62	69%	0.694	S	S	*	*			trans	53.9	155.2	131.4	58.5	0	0	0	0	122
438	E	28.5	Very low	29	Very low	158 Å²	158	129 Å²	129	74%	0.738	69%	0.688	S	S	*	*			cis	-159.6	173	0.1	-126.6	160.8	169.3	0	0	112.8
439	T	28.7	Very low	29.1	Very low	118 Å²	118	128.7 Å²	128.7	72%	0.724	68%	0.678	S	S	*	*			trans	49.2	124.8	155	54	0	0	0	0	120.5
440	S	27.2	Very low	29.2	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	68%	0.678	S	S	*	*			cis	111.4	166.6	19.6	68.2	0	0	0	0	113.5
441	V	26.3	Very low	29.4	Very low	115 Å²	115	129.8 Å²	129.8	70%	0.697	68%	0.683	S	S	*	*			trans	93.3	100.8	159	171.1	0	0	0	0	118.2
442	T	26.8	Very low	29.3	Very low	109 Å²	109	130.1 Å²	130.1	67%	0.669	68%	0.68	S	S	*	*			trans	63.9	156.4	141.1	61.8	0	0	0	0	120.4
443	E	26.2	Very low	29.3	Very low	163 Å²	163	134.1 Å²	134.1	76%	0.762	69%	0.69	S	S	*	*			cis	-163.9	148	-8.3	-118.6	161.3	-174.1	0	0	111.2
444	S	26.9	Very low	29.3	Very low	115 Å²	115	134.9 Å²	134.9	80%	0.804	69%	0.693	S	S	*	*			trans	62.5	168.5	152.6	82.3	0	0	0	0	117.2
445	S	28.4	Very low	29.1	Very low	88 Å²	88	129.6 Å²	129.6	62%	0.615	69%	0.688	S	S	*	*			cis	-153.6	161.1	-12.6	-138.3	0	0	0	0	111.2
446	D	28.7	Very low	29.2	Very low	122 Å²	122	129.5 Å²	129.5	65%	0.652	69%	0.689	S	S	*	*			trans	60.4	104.4	144.6	-56.9	-38	0	0	0	122.8
447	H	31.2	Very low	29.2	Very low	153 Å²	153	130.3 Å²	130.3	71%	0.708	70%	0.703	S	S	*	*				81	116.5	113.2	-73.8	-15.6	0	0	0	122.7
448	K	32.9	Very low	29.4	Very low	157 Å²	157	128.7 Å²	128.7	68%	0.683	71%	0.707	S	S	*	*				57.1	153.4	106.8	-75.4	178	148.2	-77.4	0	119.3
449	D	29.8	Very low	29.7	Very low	102 Å²	102	127 Å²	127	55%	0.545	71%	0.709	S	S	.	*			cis	-161	167	10.6	-124.1	-16.4	0	0	0	110.8
450	L	29.7	Very low	30	Very low	136 Å²	136	126.5 Å²	126.5	71%	0.712	71%	0.706	S	S	*	*			trans	55.2	125.2	150.8	-57.8	169.6	0	0	0	119.5
451	L	29.4	Very low	30.4	Very low	147 Å²	147	132.5 Å²	132.5	77%	0.77	71%	0.713	S	S	*	*				76.3	122.9	59.4	-77.5	-175.5	0	0	0	117
452	Q	30.2	Very low	30.7	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	72%	0.721	S	S	*	*				119.6	155.1	128.6	-161.1	154.3	-30.9	0	0	118.8
453	E	29.6	Very low	31.3	Very low	139 Å²	139	137.4 Å²	137.4	65%	0.65	73%	0.728	S	S	*	*			trans	76	148.1	165.7	-95.5	168.8	169.8	0	0	117.7
454	F	30.6	Very low	31.5	Very low	161 Å²	161	136.8 Å²	136.8	71%	0.706	73%	0.73	S	S	*	*			cis	-126.2	170.7	11.6	-97.7	-77.2	0	0	0	115.3
455	S	27.8	Very low	32.2	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	73%	0.732	S	S	*	*			trans	-88.7	177.8	174.5	-63.1	0	0	0	0	113.1
456	H	33.7	Very low	32.6	Very low	148 Å²	148	143.2 Å²	143.2	69%	0.685	74%	0.744	S	S	*	*				158	124.5	110.4	-78.9	-61.7	0	0	0	115.1
457	T	32.7	Very low	33.1	Very low	144 Å²	144	143.3 Å²	143.3	88%	0.883	75%	0.749	S	S	*	*			trans	55.9	148.9	147	60.8	0	0	0	0	120.3
458	G	32.4	Very low	33.2	Very low	68 Å²	68	142.4 Å²	142.4	70%	0.701	75%	0.749	S	S	*	*			cis	-170.5	-177.1	6.6	0	0	0	0	0	111
459	P	35.4	Very low	33.6	Very low	123 Å²	123	140.4 Å²	140.4	80%	0.799	75%	0.75	S	S	*	*			trans	-122	-168.8	-146	35.5	-20.5	0	0	0	118.2
460	V	33.8	Very low	33.9	Very low	106 Å²	106	138.8 Å²	138.8	64%	0.642	75%	0.747	S	S	*	*			trans	93.5	102.5	154.5	-147.6	0	0	0	0	120
461	R	35.9	Very low	34.4	Very low	227 Å²	227	135.5 Å²	135.5	86%	0.857	73%	0.734	S	S	*	*				172.7	141.8	110.3	-91	172.2	-170	80.1	-2.7	113.3
462	K	33.2	Very low	34.7	Very low	201 Å²	201	134.2 Å²	134.2	87%	0.874	73%	0.727	S	S	*	*			trans	-125.3	140.6	167.2	-76.1	-171.3	176.3	-174.9	0	110.7
463	P	37.7	Very low	35.4	Very low	126 Å²	126	136.4 Å²	136.4	82%	0.818	73%	0.728	S	S	*	*			trans	-92.5	153.1	153.7	-1.1	21.4	0	0	0	111.1
464	N	32.2	Very low	35.8	Very low	150 Å²	150	136.8 Å²	136.8	80%	0.802	73%	0.73	S	S	*	*			trans	-104.7	128.8	172.3	-78.2	-69.1	0	0	0	110.9
465	T	41	Very low	36.2	Very low	136 Å²	136	138 Å²	138	83%	0.834	73%	0.73	S	S	*	*			trans	-132.7	107.9	158.6	39.3	0	0	0	0	109	V467	T465-V467 PolarHBondContact O-N 2.74Å
466	K	36.2	Very low	37	Very low	203 Å²	203	140 Å²	140	88%	0.883	73%	0.73	S	S	*	*			trans	-81.8	114	174.8	-69.5	-177.7	177.3	-177.4	0	109.4
467	V	40.8	Very low	37.5	Very low	123 Å²	123	136.1 Å²	136.1	75%	0.745	72%	0.724	S	S	*	*			trans	-113.1	121	161.8	-175.8	0	0	0	0	107.1	T465 V469	T465-V467 PolarHBondContact O-N 2.74Å; V467-V469 HydrophobicContact CG1-CG2 3.91Å; V467-V469 PolarHBondContact O-N 2.89Å
468	D	32.5	Very low	38.7	Very low	135 Å²	135	132.1 Å²	132.1	72%	0.722	70%	0.697	S	S	*	*			trans	-87.1	95.1	-173.9	-165.7	-27.9	0	0	0	110.4	S470	D468-S470 PolarHBondContact OD1-N 3.04Å; D468-S470 PolarHBondContact OD1-OG 3.34Å
469	V	40.6	Very low	40.3	Very low	115 Å²	115	133.8 Å²	133.8	70%	0.697	69%	0.69	S	S	*	*			trans	-105.9	52.6	179.9	-162.7	0	0	0	0	110.7	V467	V467-V469 HydrophobicContact CG1-CG2 3.91Å; V467-V469 PolarHBondContact O-N 2.89Å
470	S	36.5	Very low	42.6	Very low	68 Å²	68	128.2 Å²	128.2	48%	0.476	65%	0.653	S	S	.	*			trans	-56.4	146.8	162.5	-63.5	0	0	0	0	110.6	D468 L472	D468-S470 PolarHBondContact OD1-N 3.04Å; D468-S470 PolarHBondContact OD1-OG 3.34Å; S470-L472 PolarHBondContact O-N 3.04Å
471	P	39.2	Very low	44.9	Very low	67 Å²	67	125.3 Å²	125.3	44%	0.435	64%	0.64	S	S	.	*			trans	-70.3	123.3	-137.8	24.2	-35.8	0	0	0	115.6	R473 E474	P471-R473 PolarHBondContact O-N 3.28Å; P471-R473 VanDerWaalsContact O-N 3.1Å; P471-E474 HydrophobicContact CG-CB 4.44Å; P471-E474 HydrophobicContact CG-CG 4.01Å; P471-E474 WeakPolarHBondContact CG-OE2 3.21Å; P471-E474 PolarHBondContact O-N 3.11Å; P471-E474 VanDerWaalsContact O-N 3.08Å
472	L	35.9	Very low	47	Very low	120 Å²	120	116.8 Å²	116.8	63%	0.628	62%	0.615	S	S	*	*	H	α-helix	trans	-55.7	-29.9	173.8	-156	76.5	0	0	0	112.7	S470 E474 R475	S470-L472 PolarHBondContact O-N 3.04Å; L472-E474 VanDerWaalsContact C-N 3.29Å; L472-E474 PolarHBondContact O-N 2.65Å; L472-R475 WeakPolarHBondContact O-CB 3.4Å; L472-R475 PolarHBondContact O-N 3Å
473	R	44.7	Very low	49.6	Very low	211 Å²	211	109.9 Å²	109.9	80%	0.796	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-23.8	179.9	-145.5	178.9	-168	-157.6	5.6	113.7	P471	P471-R473 PolarHBondContact O-N 3.28Å; P471-R473 VanDerWaalsContact O-N 3.1Å
474	E	39	Very low	52.2	Low	147 Å²	147	106.7 Å²	106.7	69%	0.687	56%	0.558	S	S	*	*	H	α-helix	trans	-80	-18.1	171	-71.3	-169.9	131.5	0	0	112.6	P471 L472 M476 A477	P471-E474 HydrophobicContact CG-CB 4.44Å; P471-E474 HydrophobicContact CG-CG 4.01Å; P471-E474 WeakPolarHBondContact CG-OE2 3.21Å; P471-E474 PolarHBondContact O-N 3.11Å; P471-E474 VanDerWaalsContact O-N 3.08Å; L472-E474 VanDerWaalsContact C-N 3.29Å; L472-E474 PolarHBondContact O-N 2.65Å; E474-M476 VanDerWaalsContact C-N 3.25Å; E474-M476 PolarHBondContact O-N 2.8Å; E474-A477 WeakPolarHBondContact O-CB 3.49Å; E474-A477 PolarHBondContact O-N 2.99Å
475	R	38.8	Very low	55.1	Low	188 Å²	188	99.5 Å²	99.5	71%	0.709	52%	0.52	S	S	*	.	H	α-helix	trans	-77	-13.7	172.6	-60.7	-174	-174.5	139.2	7.4	113.1	L472 A477	L472-R475 WeakPolarHBondContact O-CB 3.4Å; L472-R475 PolarHBondContact O-N 3Å; R475-A477 VanDerWaalsContact C-N 3.27Å
476	M	44.5	Very low	57.7	Low	133 Å²	133	94.7 Å²	94.7	66%	0.655	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	4	163.6	-69.6	-179.4	170.2	0	0	112.8	E474 N478	E474-M476 VanDerWaalsContact C-N 3.25Å; E474-M476 PolarHBondContact O-N 2.8Å; M476-N478 PolarHBondContact O-N 3.39Å
477	A	45.3	Very low	60.5	Low	67 Å²	67	85 Å²	85	55%	0.554	45%	0.447	S	S	*	.	S	Bend	trans	-60.7	115.6	169.1	0	0	0	0	0	109.2	E474 R475 N479	E474-A477 WeakPolarHBondContact O-CB 3.49Å; E474-A477 PolarHBondContact O-N 2.99Å; R475-A477 VanDerWaalsContact C-N 3.27Å; A477-N479 PolarHBondContact O-N 2.93Å
478	N	57.8	Low	63.1	Low	61 Å²	61	80.7 Å²	80.7	33%	0.326	42%	0.418	S	S	.	.			trans	-62.6	98.2	-163.1	-51	-86.8	0	0	0	111.7	M476 F480 N538 M567 L570	M476-N478 PolarHBondContact O-N 3.39Å; N478-F480 HydrophobicContact CB-CD1 4.46Å; N478-F480 HydrophobicContact CB-CD2 3.9Å; N478-F480 HydrophobicContact CB-CE1 4.47Å; N478-F480 HydrophobicContact CB-CE2 3.93Å; N478-F480 HydrophobicContact CB-CG 4.18Å; N478-F480 HydrophobicContact CB-CZ 4.21Å; N478-F480 PolarHBondContact O-N 3.46Å; N478-N538 PolarHBondContact O-OD1 2.82Å; N478-M567 HydrophobicContact CB-CE 4.13Å; N478-M567 WeakPolarHBondContact ND2-CE 3.18Å; N478-M567 PolarHBondContact ND2-SD 2.74Å; N478-M567 WeakPolarHBondContact OD1-CE 3.21Å; N478-L570 VanDerWaalsContact OD1-CD1 3.28Å; N478-L570 WeakPolarHBondContact OD1-CD1 3.34Å
479	N	66.4	Low	66	Low	102 Å²	102	74.3 Å²	74.3	55%	0.545	38%	0.384	S	S	.	.			trans	-79.8	50.9	177.7	-154.4	20.4	0	0	0	111	A477 A481 S482 N538	A477-N479 PolarHBondContact O-N 2.93Å; N479-A481 PolarHBondContact O-N 2.86Å; N479-S482 PolarHBondContact O-N 2.81Å; N479-S482 VanDerWaalsContact O-N 3.07Å; N479-S482 PolarHBondContact O-OG 3.46Å; N479-N538 VanDerWaalsContact C-OD1 3.32Å; N479-N538 WeakPolarHBondContact CA-OD1 3.43Å; N479-N538 PolarHBondContact OD1-ND2 2.81Å; N479-N538 PolarHBondContact OD1-OD1 3.2Å
480	F	82.4	Confident	68.5	Low	7 Å²	7	69 Å²	69	3%	0.031	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-53.4	-21.7	177.7	-80.7	-33.7	0	0	0	113.1	N478 S482 K483 L536 N537 N538 S540 L566 M567 L570 F658	N478-F480 HydrophobicContact CB-CD1 4.46Å; N478-F480 HydrophobicContact CB-CD2 3.9Å; N478-F480 HydrophobicContact CB-CE1 4.47Å; N478-F480 HydrophobicContact CB-CE2 3.93Å; N478-F480 HydrophobicContact CB-CG 4.18Å; N478-F480 HydrophobicContact CB-CZ 4.21Å; N478-F480 PolarHBondContact O-N 3.46Å; F480-S482 PolarHBondContact O-N 3.33Å; F480-S482 VanDerWaalsContact O-N 3.08Å; F480-K483 PolarHBondContact O-N 3.3Å; F480-L536 HydrophobicContact CB-CB 3.83Å; F480-L536 HydrophobicContact CB-CD1 4.29Å; F480-L536 HydrophobicContact CD1-CD1 3.61Å; F480-L536 HydrophobicContact CE1-CD1 4.08Å; F480-L536 HydrophobicContact CG-CB 4.35Å; F480-L536 HydrophobicContact CG-CD1 4.01Å; F480-L536 WeakPolarHBondContact O-CB 3.25Å; F480-N537 VanDerWaalsContact CB-O 3.23Å; F480-N537 WeakPolarHBondContact CB-O 3.34Å; F480-N538 PolarHBondContact N-OD1 2.97Å; F480-N538 VanDerWaalsContact N-OD1 3.15Å; F480-S540 WeakPolarHBondContact CE2-O 3.38Å; F480-L566 HydrophobicContact CE2-CB 3.95Å; F480-L566 HydrophobicContact CE2-CD1 3.97Å; F480-L566 HydrophobicContact CZ-CB 3.72Å; F480-L566 HydrophobicContact CZ-CD1 4.29Å; F480-M567 HydrophobicContact CE2-CE 3.38Å; F480-M567 HydrophobicContact CZ-CE 3.44Å; F480-M567 VanDerWaalsContact CZ-CE 3.44Å; F480-L570 HydrophobicContact CE1-CD1 3.84Å; F480-L570 HydrophobicContact CZ-CD1 3.86Å; F480-F658 HydrophobicContact CD1-CE1 4.33Å; F480-F658 HydrophobicContact CE1-CD1 4.35Å; F480-F658 AromaticContact CE1-CE1 3.62Å; F480-F658 HydrophobicContact CE1-CE1 3.62Å; F480-F658 HydrophobicContact CE1-CZ 4.21Å; F480-F658 HydrophobicContact CZ-CE1 4.35Å
481	A	81.5	Confident	71.2	Confident	44 Å²	44	69.3 Å²	69.3	36%	0.364	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-49.4	-30.4	170.4	0	0	0	0	0	114.1	N479 N538 K661	N479-A481 PolarHBondContact O-N 2.86Å; A481-N538 VanDerWaalsContact CB-OD1 3.23Å; A481-N538 WeakPolarHBondContact CB-OD1 3.31Å; A481-N538 PolarHBondContact N-OD1 3.33Å; A481-K661 WeakPolarHBondContact O-CD 3.37Å; A481-K661 VanDerWaalsContact O-CE 3.29Å; A481-K661 WeakPolarHBondContact O-CE 3.43Å; A481-K661 PolarHBondContact O-NZ 3.34Å
482	S	81.8	Confident	73.6	Confident	48 Å²	48	66.5 Å²	66.5	34%	0.336	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-90.3	2.1	176.5	71.1	0	0	0	0	115.1	N479 F480 K661	N479-S482 PolarHBondContact O-N 2.81Å; N479-S482 VanDerWaalsContact O-N 3.07Å; N479-S482 PolarHBondContact O-OG 3.46Å; F480-S482 PolarHBondContact O-N 3.33Å; F480-S482 VanDerWaalsContact O-N 3.08Å; S482-K661 PolarHBondContact O-N 3.04Å
483	K	87.1	Confident	76.1	Confident	56 Å²	56	63.6 Å²	63.6	24%	0.243	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	149	-173.4	-60.7	-160.1	177.8	-164.8	0	114.1	F480 L536 F658 M659 K661	F480-K483 PolarHBondContact O-N 3.3Å; K483-L536 HydrophobicContact CB-CD1 4.44Å; K483-L536 WeakPolarHBondContact O-CB 3.34Å; K483-L536 PolarHBondContact O-N 2.82Å; K483-F658 HydrophobicContact CD-CB 4.15Å; K483-F658 HydrophobicContact CD-CD1 4.49Å; K483-M659 CarbonylContact C-O 3.48Å; K483-M659 WeakPolarHBondContact CA-O 3.11Å; K483-M659 WeakPolarHBondContact CB-O 3.27Å; K483-K661 WeakPolarHBondContact O-CE 3.48Å
484	K	92.1	Very high	77.9	Confident	59 Å²	59	59.2 Å²	59.2	26%	0.257	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	154.3	162.1	-54.8	-152.8	-177.8	-147.7	0	109.7	L533 F534 D535 M659 K661	K484-L533 HydrophobicContact CB-CD1 3.82Å; K484-L533 HydrophobicContact CB-CG 4.46Å; K484-L533 HydrophobicContact CD-CD1 4.25Å; K484-L533 HydrophobicContact CD-CD2 3.97Å; K484-L533 HydrophobicContact CD-CG 4.1Å; K484-F534 CarbonylContact C-O 3.57Å; K484-F534 VanDerWaalsContact CA-O 3.28Å; K484-F534 WeakPolarHBondContact CA-O 3.41Å; K484-F534 WeakPolarHBondContact CB-O 2.97Å; K484-D535 WeakPolarHBondContact CD-OD1 3.49Å; K484-D535 WeakPolarHBondContact CE-OD1 3.46Å; K484-D535 WeakPolarHBondContact CE-OD2 3.36Å; K484-D535 VanDerWaalsContact NZ-CG 3.28Å; K484-D535 IonicContact NZ-OD1 3.14Å; K484-D535 PolarHBondContact NZ-OD1 2.81Å; K484-D535 VanDerWaalsContact NZ-OD1 3.14Å; K484-D535 IonicContact NZ-OD2 2.68Å; K484-D535 PolarHBondContact NZ-OD2 2.96Å; K484-M659 PolarHBondContact N-O 3.5Å; K484-M659 PolarHBondContact O-N 3.24Å; K484-K661 HydrophobicContact CG-CD 4.5Å; K484-K661 HydrophobicContact CG-CG 3.65Å
485	L	93.7	Very high	79.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115.1	172.9	178.7	69.3	0	0	0	109.2	V487 F534 L536 I543 L566 F656 F658	L485-V487 HydrophobicContact CD2-CG2 3.85Å; L485-V487 HydrophobicContact CG-CG2 3.78Å; L485-F534 HydrophobicContact CB-CB 4.34Å; L485-F534 PolarHBondContact N-O 3.17Å; L485-F534 PolarHBondContact O-N 2.91Å; L485-L536 HydrophobicContact CB-CD1 4.1Å; L485-L536 HydrophobicContact CB-CD2 3.87Å; L485-L536 HydrophobicContact CB-CG 4.1Å; L485-I543 HydrophobicContact CD2-CD1 3.74Å; L485-L566 HydrophobicContact CD2-CD2 3.77Å; L485-F656 HydrophobicContact CD1-CB 4.28Å; L485-F656 HydrophobicContact CD1-CD1 4.39Å; L485-F658 HydrophobicContact CD1-CD1 4.11Å; L485-F658 HydrophobicContact CD1-CE1 3.91Å; L485-F658 HydrophobicContact CD1-CE2 4.46Å; L485-F658 HydrophobicContact CD1-CG 4.49Å; L485-F658 HydrophobicContact CD1-CZ 4.1Å
486	L	94.7	Very high	81.6	Confident	35 Å²	35	47.8 Å²	47.8	18%	0.183	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.2	170	-178.9	67.4	0	0	0	108.6	H531 L533 N657 M659	L486-H531 HydrophobicContact CD1-CB 4.06Å; L486-L533 HydrophobicContact CB-CD1 4.14Å; L486-L533 HydrophobicContact CD1-CB 4.48Å; L486-L533 HydrophobicContact CD1-CD1 4.23Å; L486-N657 HydrophobicContact CB-CB 4.01Å; L486-N657 HydrophobicContact CD2-CB 4.43Å; L486-N657 PolarHBondContact N-O 3.35Å; L486-N657 PolarHBondContact O-N 3.39Å; L486-M659 HydrophobicContact CB-CG 4.45Å; L486-M659 HydrophobicContact CB-SD 3.9Å; L486-M659 HydrophobicContact CD2-SD 3.99Å; L486-M659 HydrophobicContact CG-SD 4.47Å
487	V	94.8	Very high	83	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.6	178.9	-173.6	0	0	0	0	108.9	L485 V489 H531 L532 F534 I543 E655 F656	L485-V487 HydrophobicContact CD2-CG2 3.85Å; L485-V487 HydrophobicContact CG-CG2 3.78Å; V487-V489 HydrophobicContact CG1-CG2 4.45Å; V487-H531 CarbonylContact O-C 3.59Å; V487-H531 WeakPolarHBondContact O-CA 3.34Å; V487-L532 PolarHBondContact N-O 3.06Å; V487-L532 PolarHBondContact O-N 2.96Å; V487-F534 HydrophobicContact CB-CE2 4.28Å; V487-F534 HydrophobicContact CG2-CD2 3.89Å; V487-F534 HydrophobicContact CG2-CE2 3.92Å; V487-I543 HydrophobicContact CG2-CD1 3.74Å; V487-E655 CarbonylContact C-O 3.52Å; V487-E655 WeakPolarHBondContact CA-O 3.23Å; V487-F656 HydrophobicContact CG1-CD1 4.14Å; V487-F656 HydrophobicContact CG1-CE1 3.83Å; V487-F656 HydrophobicContact CG1-CZ 4.42Å; V487-F656 HydrophobicContact CG2-CD1 3.97Å; V487-F656 HydrophobicContact CG2-CE1 4.15Å
488	K	95.2	Very high	84.2	Confident	32 Å²	32	48.1 Å²	48.1	14%	0.139	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.6	170.1	-160.2	-170.6	-168.6	-162.3	0	109.5	V490 D529 Q530 H531 A654 E655	K488-V490 HydrophobicContact CD-CG2 4.28Å; K488-V490 HydrophobicContact CG-CG2 4.43Å; K488-V490 PolarHBondContact O-N 3.21Å; K488-D529 VanDerWaalsContact CE-O 3.22Å; K488-D529 WeakPolarHBondContact CE-O 3.35Å; K488-D529 WeakPolarHBondContact CE-OD1 3.27Å; K488-D529 VanDerWaalsContact CE-OD2 3.25Å; K488-D529 WeakPolarHBondContact CE-OD2 3.32Å; K488-D529 IonicContact NZ-OD1 2.71Å; K488-D529 PolarHBondContact NZ-OD1 2.76Å; K488-D529 IonicContact NZ-OD2 3.16Å; K488-D529 PolarHBondContact NZ-OD2 2.82Å; K488-Q530 WeakPolarHBondContact CA-O 3.44Å; K488-H531 WeakPolarHBondContact CD-NE2 3Å; K488-H531 WeakPolarHBondContact CE-NE2 3.37Å; K488-A654 CarbonylContact O-C 3.56Å; K488-A654 WeakPolarHBondContact O-CA 3.45Å; K488-E655 HydrophobicContact CB-CB 4.08Å; K488-E655 VanDerWaalsContact CD-OE2 3.31Å; K488-E655 WeakPolarHBondContact CD-OE2 3.48Å; K488-E655 PolarHBondContact N-O 2.99Å; K488-E655 PolarHBondContact O-N 3.32Å
489	V	94.3	Very high	84.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	102.6	173.8	-176.1	0	0	0	0	108	V487 C505 V507 T518 W528 D529 Q530 L532 I652	V487-V489 HydrophobicContact CG1-CG2 4.45Å; V489-C505 HydrophobicContact CG1-CB 4.07Å; V489-V507 HydrophobicContact CG2-CG2 3.76Å; V489-T518 HydrophobicContact CB-CG2 4Å; V489-T518 HydrophobicContact CG1-CG2 4.1Å; V489-T518 HydrophobicContact CG2-CG2 4.18Å; V489-W528 HydrophobicContact CG1-CD2 4.45Å; V489-W528 HydrophobicContact CG1-CE3 3.78Å; V489-W528 HydrophobicContact CG1-CZ3 4.28Å; V489-D529 CarbonylContact O-C 3.55Å; V489-D529 WeakPolarHBondContact O-CA 3.16Å; V489-D529 PolarHBondContact O-N 2.92Å; V489-Q530 PolarHBondContact N-O 2.84Å; V489-Q530 PolarHBondContact O-N 3.1Å; V489-Q530 VanDerWaalsContact O-N 3.12Å; V489-L532 HydrophobicContact CG2-CD1 3.99Å; V489-I652 HydrophobicContact CG1-CD1 4.08Å
490	V	93.1	Very high	84.5	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-67	-170.7	-174.4	0	0	0	0	110.7	K488 F527 W528 D529 T653 E655	K488-V490 HydrophobicContact CD-CG2 4.28Å; K488-V490 HydrophobicContact CG-CG2 4.43Å; K488-V490 PolarHBondContact O-N 3.21Å; V490-F527 HydrophobicContact CG1-CE2 4.22Å; V490-W528 PolarHBondContact O-N 3.33Å; V490-D529 PolarHBondContact O-N 2.84Å; V490-T653 HydrophobicContact CB-CG2 4.3Å; V490-T653 WeakPolarHBondContact CB-O 3.28Å; V490-T653 HydrophobicContact CG2-CG2 4.5Å; V490-T653 PolarHBondContact N-O 3.19Å; V490-E655 HydrophobicContact CG2-CG 4.19Å; V490-E655 WeakPolarHBondContact CG2-OE1 3.05Å
491	K	92.6	Very high	84	Confident	73 Å²	73	48.4 Å²	48.4	32%	0.317	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165.6	-174.8	62.4	170.9	175	169.2	0	112.5	E493 L526 F527 I652 T653	K491-E493 HydrophobicContact CD-CG 4.38Å; K491-E493 WeakPolarHBondContact CE-OE1 3.19Å; K491-E493 IonicContact NZ-OE1 3.91Å; K491-E493 PolarHBondContact NZ-OE1 2.99Å; K491-L526 CarbonylContact C-O 3.59Å; K491-L526 WeakPolarHBondContact CA-O 3.12Å; K491-L526 VanDerWaalsContact CB-O 3.31Å; K491-L526 WeakPolarHBondContact CB-O 3.43Å; K491-F527 HydrophobicContact CB-CD2 4.1Å; K491-I652 CarbonylContact O-C 3.57Å; K491-I652 WeakPolarHBondContact O-CG1 3.16Å; K491-T653 PolarHBondContact N-O 3.08Å; K491-T653 PolarHBondContact O-N 3.08Å
492	A	90.8	Very high	84.1	Confident	9 Å²	9	46.9 Å²	46.9	7%	0.074	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	154.8	163.5	0	0	0	0	0	111.2	L495 L526 W528 I547 S651 I652	A492-L495 HydrophobicContact CB-CD1 3.72Å; A492-L526 HydrophobicContact CB-CB 4.04Å; A492-L526 HydrophobicContact CB-CD1 4.2Å; A492-L526 PolarHBondContact N-O 3Å; A492-L526 WeakPolarHBondContact O-CB 3.38Å; A492-W528 HydrophobicContact CB-CH2 4.19Å; A492-W528 HydrophobicContact CB-CZ3 3.94Å; A492-I547 HydrophobicContact CB-CD1 3.5Å; A492-I547 VanDerWaalsContact CB-CD1 3.5Å; A492-S651 CarbonylContact C-O 3.59Å; A492-S651 VanDerWaalsContact CA-O 3.27Å; A492-S651 WeakPolarHBondContact CA-O 3.27Å; A492-S651 WeakPolarHBondContact CB-O 3.44Å; A492-I652 HydrophobicContact CB-CB 4.35Å; A492-I652 HydrophobicContact CB-CG1 4.3Å
493	E	88.6	Confident	84.4	Confident	58 Å²	58	44.6 Å²	44.6	27%	0.271	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.8	-174.1	-63.5	-170.4	165.9	0	0	111.6	K491 L495 S651	K491-E493 HydrophobicContact CD-CG 4.38Å; K491-E493 WeakPolarHBondContact CE-OE1 3.19Å; K491-E493 IonicContact NZ-OE1 3.91Å; K491-E493 PolarHBondContact NZ-OE1 2.99Å; E493-L495 VanDerWaalsContact C-N 3.26Å; E493-L495 PolarHBondContact O-N 2.89Å; E493-S651 PolarHBondContact N-O 2.91Å; E493-S651 PolarHBondContact O-N 2.91Å; E493-S651 VanDerWaalsContact O-N 3.1Å
494	K	81.8	Confident	84.7	Confident	119 Å²	119	43.8 Å²	43.8	52%	0.517	23%	0.229	S	C	.	.	S	Bend	trans	61.7	28.1	169.3	-51.5	140.8	-179	-150.6	0	114.2	S648 I649	K494-S648 VanDerWaalsContact CD-OG 3.23Å; K494-S648 WeakPolarHBondContact CD-OG 3.18Å; K494-S648 WeakPolarHBondContact CE-OG 3.43Å; K494-S648 PolarHBondContact NZ-OG 3.46Å; K494-I649 VanDerWaalsContact CD-O 3.31Å; K494-I649 WeakPolarHBondContact CD-O 3.49Å
495	L	80.7	Confident	84.8	Confident	25 Å²	25	41 Å²	41	13%	0.131	22%	0.217	C	C	.	.			trans	-98.6	136.1	176.2	-73.8	163.2	0	0	0	112.5	A492 E493 V497 L526 I547 L596 A650	A492-L495 HydrophobicContact CB-CD1 3.72Å; E493-L495 VanDerWaalsContact C-N 3.26Å; E493-L495 PolarHBondContact O-N 2.89Å; L495-V497 VanDerWaalsContact C-N 3.29Å; L495-V497 HydrophobicContact CB-CG2 4.15Å; L495-V497 PolarHBondContact O-N 2.72Å; L495-L526 HydrophobicContact CB-CD1 3.8Å; L495-L526 HydrophobicContact CD1-CD1 3.73Å; L495-L526 HydrophobicContact CG-CD1 4.4Å; L495-I547 HydrophobicContact CD1-CD1 3.49Å; L495-I547 VanDerWaalsContact CD1-CD1 3.49Å; L495-I547 HydrophobicContact CD1-CG2 4.46Å; L495-L596 HydrophobicContact CD1-CD1 3.66Å; L495-L596 HydrophobicContact CD2-CD1 3.93Å; L495-L596 HydrophobicContact CG-CD1 4.09Å; L495-A650 HydrophobicContact CD2-CB 3.69Å; L495-A650 HydrophobicContact CG-CB 4.08Å
496	S	74.5	Confident	84.9	Confident	70 Å²	70	41.1 Å²	41.1	49%	0.49	22%	0.218	S	C	.	.			trans	-84.4	46.6	-174.9	64.1	0	0	0	0	114.7	R559	S496-R559 PolarHBondContact O-NH1 2.85Å; S496-R559 PolarHBondContact O-NH2 3.39Å; S496-R559 PolarHBondContact OG-NH1 3.19Å
497	V	73.4	Confident	85	Confident	16 Å²	16	39.4 Å²	39.4	10%	0.097	21%	0.209	C	C	.	.			trans	-66.5	131.5	-179.9	-171.1	0	0	0	0	110.6	L495 G499 I500 A503 L526 E549	L495-V497 VanDerWaalsContact C-N 3.29Å; L495-V497 HydrophobicContact CB-CG2 4.15Å; L495-V497 PolarHBondContact O-N 2.72Å; V497-G499 WeakPolarHBondContact CG1-O 3.36Å; V497-I500 HydrophobicContact CB-CG1 4.34Å; V497-A503 HydrophobicContact CG1-CB 4.29Å; V497-L526 HydrophobicContact CG2-CD1 3.96Å; V497-L526 HydrophobicContact CG2-CD2 4.25Å; V497-E549 HydrophobicContact CG1-CB 4.06Å; V497-E549 VanDerWaalsContact CG1-CD 3.46Å; V497-E549 HydrophobicContact CG1-CG 3.68Å
498	K	70.2	Confident	85.1	Confident	191 Å²	191	41.1 Å²	41.1	83%	0.83	22%	0.217	S	C	*	.	S	Bend	trans	-84.5	-26.7	-176.1	-71.4	168.4	-179	174.7	0	112.8	E549	K498-E549 VanDerWaalsContact CA-OE1 3.27Å; K498-E549 WeakPolarHBondContact CA-OE1 3.5Å; K498-E549 VanDerWaalsContact CB-OE1 3.26Å; K498-E549 WeakPolarHBondContact CB-OE1 3.33Å; K498-E549 PolarHBondContact N-OE1 3.4Å; K498-E549 PolarHBondContact N-OE2 3.14Å
499	G	66.2	Low	85.1	Confident	26 Å²	26	39.7 Å²	39.7	27%	0.268	21%	0.211	S	C	.	.			trans	-129.7	93.4	167.2	0	0	0	0	0	110.5	V497 S501 G502 E549	V497-G499 WeakPolarHBondContact CG1-O 3.36Å; G499-S501 PolarHBondContact O-N 3.45Å; G499-G502 PolarHBondContact O-N 3.21Å; G499-G502 VanDerWaalsContact O-N 3.07Å; G499-E549 PolarHBondContact N-OE1 3.47Å
500	I	65.8	Low	85	Confident	62 Å²	62	42 Å²	42	32%	0.318	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-61.9	-31.5	-176.3	-51.7	173	0	0	0	111.3	V497 G502 A503 G524 L526	V497-I500 HydrophobicContact CB-CG1 4.34Å; I500-G502 PolarHBondContact O-N 2.85Å; I500-A503 WeakPolarHBondContact O-CB 3.17Å; I500-A503 PolarHBondContact O-N 2.98Å; I500-G524 VanDerWaalsContact CD1-O 3.28Å; I500-G524 WeakPolarHBondContact CD1-O 3.31Å; I500-G524 VanDerWaalsContact CG2-C 3.49Å; I500-L526 HydrophobicContact CG2-CD2 3.76Å; I500-L526 HydrophobicContact CG2-CG 4.11Å
501	S	71.4	Confident	84.9	Confident	89 Å²	89	46.4 Å²	46.4	62%	0.622	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-67.4	4.6	174.5	51	0	0	0	0	115.7	G499 S521	G499-S501 PolarHBondContact O-N 3.45Å; S501-S521 CarbonylContact C-O 3.39Å; S501-S521 VanDerWaalsContact C-O 3.28Å; S501-S521 VanDerWaalsContact CA-O 3.22Å; S501-S521 WeakPolarHBondContact CA-O 3.46Å
502	G	83	Confident	84.7	Confident	11 Å²	11	45.3 Å²	45.3	11%	0.113	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-127.3	18.1	175.2	0	0	0	0	0	113.4	G499 I500 L550	G499-G502 PolarHBondContact O-N 3.21Å; G499-G502 VanDerWaalsContact O-N 3.07Å; I500-G502 PolarHBondContact O-N 2.85Å; G502-L550 WeakPolarHBondContact O-CB 3.2Å; G502-L550 PolarHBondContact O-N 2.78Å
503	A	89.7	Confident	84.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	130.8	-175.2	0	0	0	0	0	112.9	V497 I500 C520 S521 L526 W528 F548	V497-A503 HydrophobicContact CG1-CB 4.29Å; I500-A503 WeakPolarHBondContact O-CB 3.17Å; I500-A503 PolarHBondContact O-N 2.98Å; A503-C520 CarbonylContact O-C 3.47Å; A503-C520 WeakPolarHBondContact O-CA 3.32Å; A503-S521 PolarHBondContact O-N 2.8Å; A503-L526 HydrophobicContact CB-CD2 3.25Å; A503-W528 HydrophobicContact CB-CZ2 4.46Å; A503-W528 PolarHBondContact O-NE1 3.32Å; A503-F548 WeakPolarHBondContact CA-O 3.3Å
504	Y	93.2	Very high	85.1	Confident	40 Å²	40	50.8 Å²	50.8	16%	0.157	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.2	176.1	69.2	-79.4	0	0	0	110.9	V506 F548 L550 S556	Y504-V506 HydrophobicContact CD2-CG2 3.97Å; Y504-V506 HydrophobicContact CE2-CG2 3.55Å; Y504-F548 HydrophobicContact CD1-CB 4.06Å; Y504-F548 HydrophobicContact CE1-CB 3.52Å; Y504-F548 HydrophobicContact CE2-CB 4.1Å; Y504-F548 HydrophobicContact CE2-CD2 4.36Å; Y504-F548 HydrophobicContact CE2-CG 4.48Å; Y504-F548 PolarHBondContact N-O 2.83Å; Y504-F548 PolarHBondContact O-N 2.92Å; Y504-L550 HydrophobicContact CD1-CD1 4.47Å; Y504-L550 HydrophobicContact CD1-CG 4.25Å; Y504-L550 HydrophobicContact CE1-CD2 4.2Å; Y504-L550 HydrophobicContact CE1-CG 3.95Å; Y504-S556 VanDerWaalsContact OH-CB 3.32Å; Y504-S556 WeakPolarHBondContact OH-CB 3.29Å; Y504-S556 PolarHBondContact OH-OG 2.88Å
505	C	94	Very high	85.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139.4	175.3	-173	0	0	0	0	110.1	V489 S517 T518 W528 E546 I547	V489-C505 HydrophobicContact CG1-CB 4.07Å; C505-S517 CarbonylContact O-C 3.56Å; C505-S517 WeakPolarHBondContact O-CA 3.4Å; C505-T518 HydrophobicContact CB-CG2 3.99Å; C505-T518 PolarHBondContact N-OG1 3.36Å; C505-T518 PolarHBondContact O-N 2.83Å; C505-W528 HydrophobicContact CB-CH2 4.25Å; C505-W528 HydrophobicContact CB-CZ2 4.38Å; C505-W528 HydrophobicContact CB-CZ3 4.4Å; C505-E546 CarbonylContact C-O 3.54Å; C505-E546 WeakPolarHBondContact CA-O 3.37Å; C505-I547 HydrophobicContact CB-CG1 4.21Å
506	V	95.9	Very high	86.5	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.8	170.1	-176.5	0	0	0	0	107.9	Y504 E508 R515 H516 L545 E546 F548	Y504-V506 HydrophobicContact CD2-CG2 3.97Å; Y504-V506 HydrophobicContact CE2-CG2 3.55Å; V506-E508 HydrophobicContact CG1-CG 4.01Å; V506-R515 HydrophobicContact CG1-CG 3.92Å; V506-H516 CarbonylContact C-O 3.55Å; V506-H516 WeakPolarHBondContact CA-O 3.42Å; V506-L545 WeakPolarHBondContact O-CA 3.35Å; V506-E546 PolarHBondContact N-O 2.96Å; V506-E546 PolarHBondContact O-N 2.77Å; V506-F548 HydrophobicContact CB-CD2 4.28Å; V506-F548 HydrophobicContact CB-CE2 4.06Å; V506-F548 HydrophobicContact CG2-CD2 3.61Å; V506-F548 HydrophobicContact CG2-CE2 3.71Å
507	V	96.5	Very high	87.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.3	178.9	-175.2	0	0	0	0	108.8	V489 R515 H516 L532 F534 I543 A544 L545	V489-V507 HydrophobicContact CG2-CG2 3.76Å; V507-R515 WeakPolarHBondContact O-CA 3.37Å; V507-H516 PolarHBondContact N-O 2.81Å; V507-H516 PolarHBondContact O-N 3.37Å; V507-L532 HydrophobicContact CB-CD1 4.04Å; V507-L532 HydrophobicContact CG2-CD1 3.75Å; V507-F534 HydrophobicContact CB-CE2 4.43Å; V507-F534 HydrophobicContact CB-CZ 3.87Å; V507-F534 HydrophobicContact CG1-CE2 3.88Å; V507-F534 HydrophobicContact CG1-CZ 3.53Å; V507-I543 HydrophobicContact CG1-CD1 3.69Å; V507-I543 HydrophobicContact CG1-CG1 3.8Å; V507-A544 CarbonylContact C-O 3.57Å; V507-A544 WeakPolarHBondContact CA-O 3.48Å; V507-L545 HydrophobicContact CG1-CG 4.3Å; V507-L545 HydrophobicContact CG2-CD2 4.07Å; V507-L545 HydrophobicContact CG2-CG 4.08Å
508	E	96.1	Very high	88.5	Confident	35 Å²	35	51.2 Å²	51.2	16%	0.164	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.5	-171.6	-67.9	176.2	179.8	0	0	110.8	V506 Q514 R515 I543 A544	V506-E508 HydrophobicContact CG1-CG 4.01Å; E508-Q514 CarbonylContact C-O 3.59Å; E508-Q514 WeakPolarHBondContact CA-O 3.35Å; E508-R515 HydrophobicContact CG-CB 4.33Å; E508-R515 HydrophobicContact CG-CG 3.93Å; E508-R515 IonicContact OE1-CZ 2.72Å; E508-R515 IonicContact OE1-NE 3.14Å; E508-R515 PolarHBondContact OE1-NE 3.47Å; E508-R515 IonicContact OE1-NH2 2.71Å; E508-R515 PolarHBondContact OE1-NH2 3.25Å; E508-I543 CarbonylContact O-C 3.6Å; E508-I543 WeakPolarHBondContact O-CA 3.42Å; E508-A544 HydrophobicContact CB-CB 4.49Å; E508-A544 PolarHBondContact N-O 3.36Å; E508-A544 PolarHBondContact O-N 3.31Å
509	L	94.8	Very high	89.5	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	147	170.1	-168.3	78.4	0	0	0	109.6	Y513 Q514 F534 L536 I543 L566	L509-Y513 VanDerWaalsContact O-CD2 3.3Å; L509-Y513 WeakPolarHBondContact O-CD2 3.48Å; L509-Q514 HydrophobicContact CB-CB 4.24Å; L509-Q514 PolarHBondContact N-O 2.88Å; L509-Q514 PolarHBondContact O-N 3.05Å; L509-F534 HydrophobicContact CB-CD1 3.84Å; L509-F534 HydrophobicContact CB-CE1 4.19Å; L509-F534 HydrophobicContact CD2-CB 4.47Å; L509-L536 HydrophobicContact CD1-CD2 3.96Å; L509-L536 HydrophobicContact CD2-CD2 3.92Å; L509-I543 HydrophobicContact CD1-CB 4.44Å; L509-L566 HydrophobicContact CD1-CD1 4.14Å
510	D	93.4	Very high	90.6	Very high	48 Å²	48	47.5 Å²	47.5	26%	0.257	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-57.3	-178.3	59	-5	0	0	0	114.8	Y513 K541 R542	D510-Y513 WeakPolarHBondContact O-CA 3.39Å; D510-Y513 PolarHBondContact O-N 3.28Å; D510-K541 PolarHBondContact OD1-N 2.79Å; D510-K541 WeakPolarHBondContact OD2-CB 3.49Å; D510-K541 PolarHBondContact OD2-N 3.1Å; D510-R542 HydrophobicContact CB-CB 4.36Å; D510-R542 PolarHBondContact N-O 2.83Å; D510-R542 PolarHBondContact OD1-N 3.11Å; D510-R542 VanDerWaalsContact OD1-N 3.17Å; D510-R542 WeakPolarHBondContact OD2-CB 3.31Å; D510-R542 PolarHBondContact OD2-N 3.28Å
511	E	89.8	Confident	91.6	Very high	98 Å²	98	44.6 Å²	44.6	46%	0.458	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138	121.8	-174	-77.9	-75.6	-174.5	0	0	110.3	N537 N539 S540	E511-N537 PolarHBondContact O-OD1 2.91Å; E511-N539 HydrophobicContact CB-CB 3.76Å; E511-N539 HydrophobicContact CG-CB 4.21Å; E511-S540 WeakPolarHBondContact O-CA 3.46Å; E511-S540 VanDerWaalsContact O-CB 3.25Å; E511-S540 WeakPolarHBondContact O-CB 3.37Å; E511-S540 PolarHBondContact O-N 3.32Å; E511-S540 PolarHBondContact O-OG 2.71Å
512	P	88.8	Confident	91.5	Very high	50 Å²	50	48.6 Å²	48.6	33%	0.325	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	cis	-71.3	137.2	-10.3	28.9	-20.8	0	0	0	109.1	Q514 D535 N537	P512-Q514 PolarHBondContact O-N 2.87Å; P512-Q514 VanDerWaalsContact O-N 3.11Å; P512-Q514 PolarHBondContact O-NE2 3.48Å; P512-D535 WeakPolarHBondContact CD-O 3.24Å; P512-N537 VanDerWaalsContact CD-ND2 3.3Å; P512-N537 WeakPolarHBondContact CD-ND2 3.42Å
513	Y	94.2	Very high	90.6	Very high	146 Å²	146	51.8 Å²	51.8	57%	0.573	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	118.6	-172.8	-178.5	-103.6	0	0	0	111.8	L509 D510 R515	L509-Y513 VanDerWaalsContact O-CD2 3.3Å; L509-Y513 WeakPolarHBondContact O-CD2 3.48Å; D510-Y513 WeakPolarHBondContact O-CA 3.39Å; D510-Y513 PolarHBondContact O-N 3.28Å; Y513-R515 HydrophobicContact CE1-CB 4.26Å; Y513-R515 WeakPolarHBondContact OH-CD 3.23Å
514	Q	94.9	Very high	89.6	Confident	36 Å²	36	53.8 Å²	53.8	17%	0.168	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	141.6	-179.6	-80.7	157	85.8	0	0	109.1	E508 L509 P512 F534 D535	E508-Q514 CarbonylContact C-O 3.59Å; E508-Q514 WeakPolarHBondContact CA-O 3.35Å; L509-Q514 HydrophobicContact CB-CB 4.24Å; L509-Q514 PolarHBondContact N-O 2.88Å; L509-Q514 PolarHBondContact O-N 3.05Å; P512-Q514 PolarHBondContact O-N 2.87Å; P512-Q514 VanDerWaalsContact O-N 3.11Å; P512-Q514 PolarHBondContact O-NE2 3.48Å; Q514-F534 HydrophobicContact CB-CD1 3.72Å; Q514-F534 HydrophobicContact CB-CE1 4.05Å; Q514-D535 PolarHBondContact NE2-O 2.84Å
515	R	96.1	Very high	88.9	Confident	111 Å²	111	58.2 Å²	58.2	42%	0.419	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	111.4	-171.1	179.6	177.8	-147	-116.2	-1.9	110.3	V506 V507 E508 Y513	V506-R515 HydrophobicContact CG1-CG 3.92Å; V507-R515 WeakPolarHBondContact O-CA 3.37Å; E508-R515 HydrophobicContact CG-CB 4.33Å; E508-R515 HydrophobicContact CG-CG 3.93Å; E508-R515 IonicContact OE1-CZ 2.72Å; E508-R515 IonicContact OE1-NE 3.14Å; E508-R515 PolarHBondContact OE1-NE 3.47Å; E508-R515 IonicContact OE1-NH2 2.71Å; E508-R515 PolarHBondContact OE1-NH2 3.25Å; Y513-R515 HydrophobicContact CE1-CB 4.26Å; Y513-R515 WeakPolarHBondContact OH-CD 3.23Å
516	H	95.7	Very high	88.5	Confident	62 Å²	62	59 Å²	59	29%	0.287	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	147.2	178.6	-61.8	128.1	0	0	0	110.6	V506 V507 L532 L533 F534	V506-H516 CarbonylContact C-O 3.55Å; V506-H516 WeakPolarHBondContact CA-O 3.42Å; V507-H516 PolarHBondContact N-O 2.81Å; V507-H516 PolarHBondContact O-N 3.37Å; H516-L532 HydrophobicContact CB-CB 4.27Å; H516-L532 HydrophobicContact CB-CD1 3.97Å; H516-L532 HydrophobicContact CB-CD2 4.03Å; H516-L532 HydrophobicContact CB-CG 4.31Å; H516-L533 PolarHBondContact CE1-O 2.71Å; H516-F534 HydrophobicContact CB-CZ 3.99Å; H516-F534 AromaticContact CE1-CD1 3.88Å; H516-F534 AromaticContact CE1-CE1 3.86Å; H516-F534 AromaticContact CG-CZ 3.92Å; H516-F534 AromaticContact ND1-CD1 3.62Å; H516-F534 AromaticContact ND1-CD2 3.96Å; H516-F534 AromaticContact ND1-CE1 3.19Å; H516-F534 WeakPolarHBondContact ND1-CE1 3.37Å; H516-F534 AromaticContact ND1-CE2 3.56Å; H516-F534 AromaticContact ND1-CG 3.98Å; H516-F534 AromaticContact ND1-CZ 3.15Å; H516-F534 WeakPolarHBondContact ND1-CZ 3.17Å
517	S	94.4	Very high	88.3	Confident	57 Å²	57	63.4 Å²	63.4	40%	0.399	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.6	177.8	-58.8	0	0	0	0	110.1	C505	C505-S517 CarbonylContact O-C 3.56Å; C505-S517 WeakPolarHBondContact O-CA 3.4Å
518	T	94.4	Very high	88	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.055	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-73.1	163.2	169.9	70.2	0	0	0	0	110.7	V489 C505 W528 Q530	V489-T518 HydrophobicContact CB-CG2 4Å; V489-T518 HydrophobicContact CG1-CG2 4.1Å; V489-T518 HydrophobicContact CG2-CG2 4.18Å; C505-T518 HydrophobicContact CB-CG2 3.99Å; C505-T518 PolarHBondContact N-OG1 3.36Å; C505-T518 PolarHBondContact O-N 2.83Å; T518-W528 HydrophobicContact CG2-CB 4.43Å; T518-W528 HydrophobicContact CG2-CG 4.31Å; T518-W528 PolarHBondContact OG1-NE1 2.91Å; T518-Q530 HydrophobicContact CG2-CB 4.39Å
519	H	91.2	Very high	87.9	Confident	92 Å²	92	65.2 Å²	65.2	43%	0.426	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-59.2	163.5	160.6	63.5	-82.9	0	0	0	111.4	W528 Q530	H519-W528 PolarHBondContact CE1-O 3.08Å; H519-W528 VanDerWaalsContact CE1-O 3.23Å; H519-W528 PolarHBondContact O-NE1 3.26Å; H519-W528 VanDerWaalsContact O-NE1 3.14Å; H519-Q530 PolarHBondContact ND1-OE1 3.1Å
520	C	89.2	Confident	87.8	Confident	46 Å²	46	67.5 Å²	67.5	31%	0.311	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-74.6	129	171	-63.1	0	0	0	0	109.4	A503 M522 L550	A503-C520 CarbonylContact O-C 3.47Å; A503-C520 WeakPolarHBondContact O-CA 3.32Å; C520-M522 PolarHBondContact O-N 3.35Å; C520-L550 WeakPolarHBondContact SG-CD1 3.48Å
521	S	86.2	Confident	87.8	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.007	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-61.3	138.8	173.2	175.6	0	0	0	0	110.1	S501 A503 Q525	S501-S521 CarbonylContact C-O 3.39Å; S501-S521 VanDerWaalsContact C-O 3.28Å; S501-S521 VanDerWaalsContact CA-O 3.22Å; S501-S521 WeakPolarHBondContact CA-O 3.46Å; A503-S521 PolarHBondContact O-N 2.8Å; S521-Q525 WeakPolarHBondContact CB-O 3.33Å; S521-Q525 PolarHBondContact OG-O 2.88Å
522	M	69.7	Low	88.1	Confident	174 Å²	174	66 Å²	66	86%	0.857	34%	0.337	S	S	*	.			trans	-106.1	-19.9	-178.8	-59.2	-178.7	70.3	0	0	113.2	C520 G524	C520-M522 PolarHBondContact O-N 3.35Å; M522-G524 PolarHBondContact O-N 2.87Å
523	S	65.2	Low	88.4	Confident	78 Å²	78	67.5 Å²	67.5	55%	0.545	34%	0.342	S	S	.	.	S	Bend	trans	-93.3	8.5	-158	59.2	0	0	0	0	115.9	Q525	S523-Q525 PolarHBondContact O-N 2.67Å
524	G	67.4	Low	88.4	Confident	42 Å²	42	60.6 Å²	60.6	43%	0.433	32%	0.315	S	S	.	.	S	Bend	trans	69.6	4.2	-171.9	0	0	0	0	0	114.1	I500 M522	I500-G524 VanDerWaalsContact CD1-O 3.28Å; I500-G524 WeakPolarHBondContact CD1-O 3.31Å; I500-G524 VanDerWaalsContact CG2-C 3.49Å; M522-G524 PolarHBondContact O-N 2.87Å
525	Q	78.7	Confident	88.3	Confident	133 Å²	133	61.5 Å²	61.5	62%	0.621	32%	0.321	S	S	*	.	S	Bend	trans	-120.6	151.3	172.1	-58.8	-179.5	1.9	0	0	108.8	S521 S523 F527	S521-Q525 WeakPolarHBondContact CB-O 3.33Å; S521-Q525 PolarHBondContact OG-O 2.88Å; S523-Q525 PolarHBondContact O-N 2.67Å; Q525-F527 PolarHBondContact O-N 2.87Å
526	L	86.9	Confident	88.1	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.089	30%	0.301	C	S	.	.			trans	-85	71.2	176	-63	174.6	0	0	0	109.7	K491 A492 L495 V497 I500 A503 W528	K491-L526 CarbonylContact C-O 3.59Å; K491-L526 WeakPolarHBondContact CA-O 3.12Å; K491-L526 VanDerWaalsContact CB-O 3.31Å; K491-L526 WeakPolarHBondContact CB-O 3.43Å; A492-L526 HydrophobicContact CB-CB 4.04Å; A492-L526 HydrophobicContact CB-CD1 4.2Å; A492-L526 PolarHBondContact N-O 3Å; A492-L526 WeakPolarHBondContact O-CB 3.38Å; L495-L526 HydrophobicContact CB-CD1 3.8Å; L495-L526 HydrophobicContact CD1-CD1 3.73Å; L495-L526 HydrophobicContact CG-CD1 4.4Å; V497-L526 HydrophobicContact CG2-CD1 3.96Å; V497-L526 HydrophobicContact CG2-CD2 4.25Å; I500-L526 HydrophobicContact CG2-CD2 3.76Å; I500-L526 HydrophobicContact CG2-CG 4.11Å; A503-L526 HydrophobicContact CB-CD2 3.25Å; L526-W528 HydrophobicContact CB-CH2 4.21Å; L526-W528 HydrophobicContact CB-CZ3 4.48Å; L526-W528 HydrophobicContact CD2-CH2 4.47Å; L526-W528 HydrophobicContact CD2-CZ2 4.41Å
527	F	90.3	Very high	87.8	Confident	93 Å²	93	55.3 Å²	55.3	41%	0.408	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137	-179.6	-176.3	-91.6	0	0	0	109.2	V490 K491 Q525 D529	V490-F527 HydrophobicContact CG1-CE2 4.22Å; K491-F527 HydrophobicContact CB-CD2 4.1Å; Q525-F527 PolarHBondContact O-N 2.87Å; F527-D529 HydrophobicContact CE1-CB 3.71Å; F527-D529 HydrophobicContact CZ-CB 3.67Å
528	W	91.5	Very high	87.5	Confident	10 Å²	10	56.7 Å²	56.7	4%	0.038	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	-40.4	-178.4	-61.3	-76.7	0	0	0	112.5	V489 V490 A492 A503 C505 T518 H519 L526 Q530 I547	V489-W528 HydrophobicContact CG1-CD2 4.45Å; V489-W528 HydrophobicContact CG1-CE3 3.78Å; V489-W528 HydrophobicContact CG1-CZ3 4.28Å; V490-W528 PolarHBondContact O-N 3.33Å; A492-W528 HydrophobicContact CB-CH2 4.19Å; A492-W528 HydrophobicContact CB-CZ3 3.94Å; A503-W528 HydrophobicContact CB-CZ2 4.46Å; A503-W528 PolarHBondContact O-NE1 3.32Å; C505-W528 HydrophobicContact CB-CH2 4.25Å; C505-W528 HydrophobicContact CB-CZ2 4.38Å; C505-W528 HydrophobicContact CB-CZ3 4.4Å; T518-W528 HydrophobicContact CG2-CB 4.43Å; T518-W528 HydrophobicContact CG2-CG 4.31Å; T518-W528 PolarHBondContact OG1-NE1 2.91Å; H519-W528 PolarHBondContact CE1-O 3.08Å; H519-W528 VanDerWaalsContact CE1-O 3.23Å; H519-W528 PolarHBondContact O-NE1 3.26Å; H519-W528 VanDerWaalsContact O-NE1 3.14Å; L526-W528 HydrophobicContact CB-CH2 4.21Å; L526-W528 HydrophobicContact CB-CZ3 4.48Å; L526-W528 HydrophobicContact CD2-CH2 4.47Å; L526-W528 HydrophobicContact CD2-CZ2 4.41Å; W528-Q530 HydrophobicContact CB-CB 4.44Å; W528-Q530 PolarHBondContact O-N 2.82Å; W528-I547 HydrophobicContact CH2-CD1 4.07Å; W528-I547 HydrophobicContact CH2-CG1 4.17Å; W528-I547 HydrophobicContact CH2-CG2 4.36Å
529	D	92.3	Very high	87.2	Confident	63 Å²	63	60.6 Å²	60.6	34%	0.337	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.3	20.4	-175	-140.9	48.2	0	0	0	115.2	K488 V489 V490 F527	K488-D529 VanDerWaalsContact CE-O 3.22Å; K488-D529 WeakPolarHBondContact CE-O 3.35Å; K488-D529 WeakPolarHBondContact CE-OD1 3.27Å; K488-D529 VanDerWaalsContact CE-OD2 3.25Å; K488-D529 WeakPolarHBondContact CE-OD2 3.32Å; K488-D529 IonicContact NZ-OD1 2.71Å; K488-D529 PolarHBondContact NZ-OD1 2.76Å; K488-D529 IonicContact NZ-OD2 3.16Å; K488-D529 PolarHBondContact NZ-OD2 2.82Å; V489-D529 CarbonylContact O-C 3.55Å; V489-D529 WeakPolarHBondContact O-CA 3.16Å; V489-D529 PolarHBondContact O-N 2.92Å; V490-D529 PolarHBondContact O-N 2.84Å; F527-D529 HydrophobicContact CE1-CB 3.71Å; F527-D529 HydrophobicContact CZ-CB 3.67Å
530	Q	93.6	Very high	87.2	Confident	52 Å²	52	56.3 Å²	56.3	24%	0.243	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.4	-169	-176.3	172.1	-19.4	0	0	112.1	K488 V489 T518 H519 W528 L532	K488-Q530 WeakPolarHBondContact CA-O 3.44Å; V489-Q530 PolarHBondContact N-O 2.84Å; V489-Q530 PolarHBondContact O-N 3.1Å; V489-Q530 VanDerWaalsContact O-N 3.12Å; T518-Q530 HydrophobicContact CG2-CB 4.39Å; H519-Q530 PolarHBondContact ND1-OE1 3.1Å; W528-Q530 HydrophobicContact CB-CB 4.44Å; W528-Q530 PolarHBondContact O-N 2.82Å; Q530-L532 HydrophobicContact CG-CD2 4.05Å
531	H	93.8	Very high	87.3	Confident	103 Å²	103	59.9 Å²	59.9	48%	0.477	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.9	171.8	-70.1	-94.8	0	0	0	111.6	L486 V487 K488	L486-H531 HydrophobicContact CD1-CB 4.06Å; V487-H531 CarbonylContact O-C 3.59Å; V487-H531 WeakPolarHBondContact O-CA 3.34Å; K488-H531 WeakPolarHBondContact CD-NE2 3Å; K488-H531 WeakPolarHBondContact CE-NE2 3.37Å
532	L	95.5	Very high	87.6	Confident	12 Å²	12	65.6 Å²	65.6	6%	0.063	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.9	178.3	-53.8	175	0	0	0	108.1	V487 V489 V507 H516 Q530 F534	V487-L532 PolarHBondContact N-O 3.06Å; V487-L532 PolarHBondContact O-N 2.96Å; V489-L532 HydrophobicContact CG2-CD1 3.99Å; V507-L532 HydrophobicContact CB-CD1 4.04Å; V507-L532 HydrophobicContact CG2-CD1 3.75Å; H516-L532 HydrophobicContact CB-CB 4.27Å; H516-L532 HydrophobicContact CB-CD1 3.97Å; H516-L532 HydrophobicContact CB-CD2 4.03Å; H516-L532 HydrophobicContact CB-CG 4.31Å; Q530-L532 HydrophobicContact CG-CD2 4.05Å; L532-F534 HydrophobicContact CB-CE2 3.83Å
533	L	95.2	Very high	88.8	Confident	81 Å²	81	57.3 Å²	57.3	42%	0.424	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.5	-177	-173.4	65.7	0	0	0	110.3	K484 L486 H516 M659	K484-L533 HydrophobicContact CB-CD1 3.82Å; K484-L533 HydrophobicContact CB-CG 4.46Å; K484-L533 HydrophobicContact CD-CD1 4.25Å; K484-L533 HydrophobicContact CD-CD2 3.97Å; K484-L533 HydrophobicContact CD-CG 4.1Å; L486-L533 HydrophobicContact CB-CD1 4.14Å; L486-L533 HydrophobicContact CD1-CB 4.48Å; L486-L533 HydrophobicContact CD1-CD1 4.23Å; H516-L533 PolarHBondContact CE1-O 2.71Å; L533-M659 HydrophobicContact CD1-SD 4.26Å
534	F	94.2	Very high	90.2	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.6	-179.1	-67	-98.4	0	0	0	110.9	K484 L485 V487 V507 L509 Q514 H516 L532 I543	K484-F534 CarbonylContact C-O 3.57Å; K484-F534 VanDerWaalsContact CA-O 3.28Å; K484-F534 WeakPolarHBondContact CA-O 3.41Å; K484-F534 WeakPolarHBondContact CB-O 2.97Å; L485-F534 HydrophobicContact CB-CB 4.34Å; L485-F534 PolarHBondContact N-O 3.17Å; L485-F534 PolarHBondContact O-N 2.91Å; V487-F534 HydrophobicContact CB-CE2 4.28Å; V487-F534 HydrophobicContact CG2-CD2 3.89Å; V487-F534 HydrophobicContact CG2-CE2 3.92Å; V507-F534 HydrophobicContact CB-CE2 4.43Å; V507-F534 HydrophobicContact CB-CZ 3.87Å; V507-F534 HydrophobicContact CG1-CE2 3.88Å; V507-F534 HydrophobicContact CG1-CZ 3.53Å; L509-F534 HydrophobicContact CB-CD1 3.84Å; L509-F534 HydrophobicContact CB-CE1 4.19Å; L509-F534 HydrophobicContact CD2-CB 4.47Å; Q514-F534 HydrophobicContact CB-CD1 3.72Å; Q514-F534 HydrophobicContact CB-CE1 4.05Å; H516-F534 HydrophobicContact CB-CZ 3.99Å; H516-F534 AromaticContact CE1-CD1 3.88Å; H516-F534 AromaticContact CE1-CE1 3.86Å; H516-F534 AromaticContact CG-CZ 3.92Å; H516-F534 AromaticContact ND1-CD1 3.62Å; H516-F534 AromaticContact ND1-CD2 3.96Å; H516-F534 AromaticContact ND1-CE1 3.19Å; H516-F534 WeakPolarHBondContact ND1-CE1 3.37Å; H516-F534 AromaticContact ND1-CE2 3.56Å; H516-F534 AromaticContact ND1-CG 3.98Å; H516-F534 AromaticContact ND1-CZ 3.15Å; H516-F534 WeakPolarHBondContact ND1-CZ 3.17Å; L532-F534 HydrophobicContact CB-CE2 3.83Å; F534-I543 HydrophobicContact CE2-CD1 4.45Å
535	D	92.8	Very high	91.6	Very high	56 Å²	56	52 Å²	52	30%	0.299	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	121.4	171.8	-92.4	-67.5	0	0	0	111.1	K484 P512 Q514 K661	K484-D535 WeakPolarHBondContact CD-OD1 3.49Å; K484-D535 WeakPolarHBondContact CE-OD1 3.46Å; K484-D535 WeakPolarHBondContact CE-OD2 3.36Å; K484-D535 VanDerWaalsContact NZ-CG 3.28Å; K484-D535 IonicContact NZ-OD1 3.14Å; K484-D535 PolarHBondContact NZ-OD1 2.81Å; K484-D535 VanDerWaalsContact NZ-OD1 3.14Å; K484-D535 IonicContact NZ-OD2 2.68Å; K484-D535 PolarHBondContact NZ-OD2 2.96Å; P512-D535 WeakPolarHBondContact CD-O 3.24Å; Q514-D535 PolarHBondContact NE2-O 2.84Å; D535-K661 WeakPolarHBondContact OD1-CE 3.43Å; D535-K661 IonicContact OD1-NZ 3.86Å
536	L	92.6	Very high	92.3	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	22%	0.224	C	C	.	.			trans	-92.5	158.5	178.6	-50	178.4	0	0	0	111.8	F480 K483 L485 L509 L566 F658 K661	F480-L536 HydrophobicContact CB-CB 3.83Å; F480-L536 HydrophobicContact CB-CD1 4.29Å; F480-L536 HydrophobicContact CD1-CD1 3.61Å; F480-L536 HydrophobicContact CE1-CD1 4.08Å; F480-L536 HydrophobicContact CG-CB 4.35Å; F480-L536 HydrophobicContact CG-CD1 4.01Å; F480-L536 WeakPolarHBondContact O-CB 3.25Å; K483-L536 HydrophobicContact CB-CD1 4.44Å; K483-L536 WeakPolarHBondContact O-CB 3.34Å; K483-L536 PolarHBondContact O-N 2.82Å; L485-L536 HydrophobicContact CB-CD1 4.1Å; L485-L536 HydrophobicContact CB-CD2 3.87Å; L485-L536 HydrophobicContact CB-CG 4.1Å; L509-L536 HydrophobicContact CD1-CD2 3.96Å; L509-L536 HydrophobicContact CD2-CD2 3.92Å; L536-L566 HydrophobicContact CD2-CD1 4.37Å; L536-F658 HydrophobicContact CD1-CD1 4.02Å; L536-F658 HydrophobicContact CD1-CE1 3.84Å; L536-K661 PolarHBondContact O-NZ 3.38Å
537	N	88.1	Confident	92.6	Very high	40 Å²	40	45.8 Å²	45.8	21%	0.214	22%	0.22	C	C	.	.			trans	-137.8	175.3	168.9	74.8	21.3	0	0	0	110.1	F480 E511 P512 N539 S540	F480-N537 VanDerWaalsContact CB-O 3.23Å; F480-N537 WeakPolarHBondContact CB-O 3.34Å; E511-N537 PolarHBondContact O-OD1 2.91Å; P512-N537 VanDerWaalsContact CD-ND2 3.3Å; P512-N537 WeakPolarHBondContact CD-ND2 3.42Å; N537-N539 PolarHBondContact O-N 3.32Å; N537-N539 VanDerWaalsContact OD1-CA 3.32Å; N537-N539 WeakPolarHBondContact OD1-CA 3.41Å; N537-N539 VanDerWaalsContact OD1-CB 3.27Å; N537-N539 WeakPolarHBondContact OD1-CB 3.39Å; N537-N539 PolarHBondContact OD1-N 3.48Å; N537-S540 PolarHBondContact N-OG 3.1Å; N537-S540 WeakPolarHBondContact O-CB 3.37Å; N537-S540 PolarHBondContact O-N 3.5Å; N537-S540 VanDerWaalsContact O-N 3.1Å; N537-S540 PolarHBondContact O-OG 2.94Å; N537-S540 PolarHBondContact OD1-N 3.31Å; N537-S540 VanDerWaalsContact OD1-N 3.1Å; N537-S540 PolarHBondContact OD1-OG 3.11Å
538	N	88	Confident	92.7	Very high	87 Å²	87	42.8 Å²	42.8	47%	0.465	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	1.1	-177.1	-66.9	-2.3	0	0	0	114.3	N478 N479 F480 A481	N478-N538 PolarHBondContact O-OD1 2.82Å; N479-N538 VanDerWaalsContact C-OD1 3.32Å; N479-N538 WeakPolarHBondContact CA-OD1 3.43Å; N479-N538 PolarHBondContact OD1-ND2 2.81Å; N479-N538 PolarHBondContact OD1-OD1 3.2Å; F480-N538 PolarHBondContact N-OD1 2.97Å; F480-N538 VanDerWaalsContact N-OD1 3.15Å; A481-N538 VanDerWaalsContact CB-OD1 3.23Å; A481-N538 WeakPolarHBondContact CB-OD1 3.31Å; A481-N538 PolarHBondContact N-OD1 3.33Å
539	N	87.8	Confident	92.6	Very high	90 Å²	90	43 Å²	43	48%	0.481	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-17.8	171.1	-61.8	-31	0	0	0	113.1	E511 N537 K541	E511-N539 HydrophobicContact CB-CB 3.76Å; E511-N539 HydrophobicContact CG-CB 4.21Å; N537-N539 PolarHBondContact O-N 3.32Å; N537-N539 VanDerWaalsContact OD1-CA 3.32Å; N537-N539 WeakPolarHBondContact OD1-CA 3.41Å; N537-N539 VanDerWaalsContact OD1-CB 3.27Å; N537-N539 WeakPolarHBondContact OD1-CB 3.39Å; N537-N539 PolarHBondContact OD1-N 3.48Å; N539-K541 WeakPolarHBondContact O-CD 3.47Å; N539-K541 VanDerWaalsContact O-CE 3.31Å; N539-K541 WeakPolarHBondContact O-CE 3.26Å; N539-K541 WeakPolarHBondContact O-CG 3.31Å; N539-K541 PolarHBondContact O-N 2.88Å
540	S	91.5	Very high	92.4	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.021	21%	0.21	C	C	.	.			trans	-55.1	124.2	179.5	-50.2	0	0	0	0	111.3	F480 E511 N537	F480-S540 WeakPolarHBondContact CE2-O 3.38Å; E511-S540 WeakPolarHBondContact O-CA 3.46Å; E511-S540 VanDerWaalsContact O-CB 3.25Å; E511-S540 WeakPolarHBondContact O-CB 3.37Å; E511-S540 PolarHBondContact O-N 3.32Å; E511-S540 PolarHBondContact O-OG 2.71Å; N537-S540 PolarHBondContact N-OG 3.1Å; N537-S540 WeakPolarHBondContact O-CB 3.37Å; N537-S540 PolarHBondContact O-N 3.5Å; N537-S540 VanDerWaalsContact O-N 3.1Å; N537-S540 PolarHBondContact O-OG 2.94Å; N537-S540 PolarHBondContact OD1-N 3.31Å; N537-S540 VanDerWaalsContact OD1-N 3.1Å; N537-S540 PolarHBondContact OD1-OG 3.11Å
541	K	91.4	Very high	91.8	Very high	120 Å²	120	41.8 Å²	41.8	52%	0.522	21%	0.207	S	C	.	.			trans	-131.4	-31.9	179.8	-68.3	146.3	-170	164.3	0	113.5	D510 N539 L565 L566	D510-K541 PolarHBondContact OD1-N 2.79Å; D510-K541 WeakPolarHBondContact OD2-CB 3.49Å; D510-K541 PolarHBondContact OD2-N 3.1Å; N539-K541 WeakPolarHBondContact O-CD 3.47Å; N539-K541 VanDerWaalsContact O-CE 3.31Å; N539-K541 WeakPolarHBondContact O-CE 3.26Å; N539-K541 WeakPolarHBondContact O-CG 3.31Å; N539-K541 PolarHBondContact O-N 2.88Å; K541-L565 CarbonylContact O-C 3.57Å; K541-L565 WeakPolarHBondContact O-CA 3.47Å; K541-L566 PolarHBondContact O-N 3.19Å
542	R	93.4	Very high	91.1	Very high	121 Å²	121	47.6 Å²	47.6	46%	0.457	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.2	-169.5	-63.3	-179.1	-177.8	-135.7	-1.4	112.8	D510 E563 L564 L565	D510-R542 HydrophobicContact CB-CB 4.36Å; D510-R542 PolarHBondContact N-O 2.83Å; D510-R542 PolarHBondContact OD1-N 3.11Å; D510-R542 VanDerWaalsContact OD1-N 3.17Å; D510-R542 WeakPolarHBondContact OD2-CB 3.31Å; D510-R542 PolarHBondContact OD2-N 3.28Å; R542-E563 IonicContact NH1-OE2 2.67Å; R542-E563 PolarHBondContact NH1-OE2 3.18Å; R542-L564 VanDerWaalsContact CA-O 3.32Å; R542-L564 WeakPolarHBondContact CA-O 3.5Å; R542-L565 HydrophobicContact CG-CD2 3.85Å
543	I	94.5	Very high	90.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.8	166.5	-168.7	161.4	0	0	0	109.6	L485 V487 V507 E508 L509 F534 L564 L566 F656	L485-I543 HydrophobicContact CD2-CD1 3.74Å; V487-I543 HydrophobicContact CG2-CD1 3.74Å; V507-I543 HydrophobicContact CG1-CD1 3.69Å; V507-I543 HydrophobicContact CG1-CG1 3.8Å; E508-I543 CarbonylContact O-C 3.6Å; E508-I543 WeakPolarHBondContact O-CA 3.42Å; L509-I543 HydrophobicContact CD1-CB 4.44Å; F534-I543 HydrophobicContact CE2-CD1 4.45Å; I543-L564 HydrophobicContact CG2-CB 3.98Å; I543-L564 PolarHBondContact N-O 3.19Å; I543-L564 PolarHBondContact O-N 3.43Å; I543-L566 HydrophobicContact CB-CD2 4.31Å; I543-L566 HydrophobicContact CG2-CD2 4.11Å; I543-F656 HydrophobicContact CD1-CE1 4.4Å; I543-F656 HydrophobicContact CG2-CE1 4.2Å
544	A	95	Very high	89.5	Confident	8 Å²	8	61.2 Å²	61.2	7%	0.066	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.3	179.2	0	0	0	0	0	110.6	V507 E508 A562 E563	V507-A544 CarbonylContact C-O 3.57Å; V507-A544 WeakPolarHBondContact CA-O 3.48Å; E508-A544 HydrophobicContact CB-CB 4.49Å; E508-A544 PolarHBondContact N-O 3.36Å; E508-A544 PolarHBondContact O-N 3.31Å; A544-A562 WeakPolarHBondContact CA-O 3.47Å; A544-E563 HydrophobicContact CB-CG 4.14Å
545	L	96	Very high	89	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.8	175.5	-62.5	90.8	0	0	0	108.4	V506 V507 R561 A562 I594 I652 A654 F656	V506-L545 WeakPolarHBondContact O-CA 3.35Å; V507-L545 HydrophobicContact CG1-CG 4.3Å; V507-L545 HydrophobicContact CG2-CD2 4.07Å; V507-L545 HydrophobicContact CG2-CG 4.08Å; L545-R561 CarbonylContact O-C 3.54Å; L545-R561 WeakPolarHBondContact O-CA 3.19Å; L545-A562 PolarHBondContact N-O 3.15Å; L545-A562 PolarHBondContact O-N 2.86Å; L545-I594 HydrophobicContact CD1-CD1 4.17Å; L545-I652 HydrophobicContact CB-CD1 4.33Å; L545-I652 HydrophobicContact CD2-CD1 3.89Å; L545-A654 HydrophobicContact CD2-CB 4.15Å; L545-F656 HydrophobicContact CD1-CZ 4.43Å
546	E	94.6	Very high	88.8	Confident	20 Å²	20	67.1 Å²	67.1	9%	0.093	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.7	177.9	-172.2	159.5	-151.7	0	0	110.8	C505 V506 F548 S558 G560 R561 R599	C505-E546 CarbonylContact C-O 3.54Å; C505-E546 WeakPolarHBondContact CA-O 3.37Å; V506-E546 PolarHBondContact N-O 2.96Å; V506-E546 PolarHBondContact O-N 2.77Å; E546-F548 HydrophobicContact CB-CE2 3.82Å; E546-F548 HydrophobicContact CB-CZ 4.41Å; E546-F548 HydrophobicContact CG-CD2 4.18Å; E546-F548 HydrophobicContact CG-CE2 3.53Å; E546-F548 HydrophobicContact CG-CZ 3.76Å; E546-S558 VanDerWaalsContact OE1-CB 3.22Å; E546-S558 WeakPolarHBondContact OE1-CB 3.33Å; E546-S558 PolarHBondContact OE1-OG 2.78Å; E546-G560 WeakPolarHBondContact CA-O 3.21Å; E546-R561 HydrophobicContact CB-CB 4.18Å; E546-R561 HydrophobicContact CB-CG 3.94Å; E546-R561 HydrophobicContact CG-CB 3.98Å; E546-R561 HydrophobicContact CG-CG 4.2Å; E546-R561 WeakPolarHBondContact OE2-CD 3.11Å; E546-R561 IonicContact OE2-NE 2.72Å; E546-R599 IonicContact OE1-CZ 2.61Å; E546-R599 IonicContact OE1-NH1 3.6Å; E546-R599 PolarHBondContact OE1-NH1 3.26Å; E546-R599 IonicContact OE2-NH1 3.82Å
547	I	93.2	Very high	88.6	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.1	179.7	-64.8	168.1	0	0	0	109.6	A492 L495 C505 W528 R559 G560 L596 I652	A492-I547 HydrophobicContact CB-CD1 3.5Å; A492-I547 VanDerWaalsContact CB-CD1 3.5Å; L495-I547 HydrophobicContact CD1-CD1 3.49Å; L495-I547 VanDerWaalsContact CD1-CD1 3.49Å; L495-I547 HydrophobicContact CD1-CG2 4.46Å; C505-I547 HydrophobicContact CB-CG1 4.21Å; W528-I547 HydrophobicContact CH2-CD1 4.07Å; W528-I547 HydrophobicContact CH2-CG1 4.17Å; W528-I547 HydrophobicContact CH2-CG2 4.36Å; I547-R559 PolarHBondContact O-N 2.91Å; I547-G560 PolarHBondContact N-O 3.3Å; I547-L596 HydrophobicContact CD1-CD1 3.75Å; I547-I652 HydrophobicContact CD1-CB 4.48Å; I547-I652 HydrophobicContact CD1-CD1 4.09Å; I547-I652 HydrophobicContact CD1-CG1 4.49Å; I547-I652 HydrophobicContact CG1-CD1 4.33Å
548	F	92.3	Very high	88.7	Confident	30 Å²	30	72.8 Å²	72.8	13%	0.132	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146.6	-179.4	-70.8	-89.8	0	0	0	111.8	A503 Y504 V506 E546 Y557	A503-F548 WeakPolarHBondContact CA-O 3.3Å; Y504-F548 HydrophobicContact CD1-CB 4.06Å; Y504-F548 HydrophobicContact CE1-CB 3.52Å; Y504-F548 HydrophobicContact CE2-CB 4.1Å; Y504-F548 HydrophobicContact CE2-CD2 4.36Å; Y504-F548 HydrophobicContact CE2-CG 4.48Å; Y504-F548 PolarHBondContact N-O 2.83Å; Y504-F548 PolarHBondContact O-N 2.92Å; V506-F548 HydrophobicContact CB-CD2 4.28Å; V506-F548 HydrophobicContact CB-CE2 4.06Å; V506-F548 HydrophobicContact CG2-CD2 3.61Å; V506-F548 HydrophobicContact CG2-CE2 3.71Å; E546-F548 HydrophobicContact CB-CE2 3.82Å; E546-F548 HydrophobicContact CB-CZ 4.41Å; E546-F548 HydrophobicContact CG-CD2 4.18Å; E546-F548 HydrophobicContact CG-CE2 3.53Å; E546-F548 HydrophobicContact CG-CZ 3.76Å; F548-Y557 CarbonylContact C-O 3.56Å; F548-Y557 WeakPolarHBondContact CA-O 3.23Å
549	E	89.9	Confident	88.7	Confident	15 Å²	15	69.5 Å²	69.5	7%	0.07	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.6	174.7	177.9	-179.6	-177.9	0	0	110.6	V497 K498 G499 G551 S556 Y557 R559	V497-E549 HydrophobicContact CG1-CB 4.06Å; V497-E549 VanDerWaalsContact CG1-CD 3.46Å; V497-E549 HydrophobicContact CG1-CG 3.68Å; K498-E549 VanDerWaalsContact CA-OE1 3.27Å; K498-E549 WeakPolarHBondContact CA-OE1 3.5Å; K498-E549 VanDerWaalsContact CB-OE1 3.26Å; K498-E549 WeakPolarHBondContact CB-OE1 3.33Å; K498-E549 PolarHBondContact N-OE1 3.4Å; K498-E549 PolarHBondContact N-OE2 3.14Å; G499-E549 PolarHBondContact N-OE1 3.47Å; E549-G551 PolarHBondContact O-N 2.87Å; E549-S556 CarbonylContact O-C 3.59Å; E549-S556 WeakPolarHBondContact O-CA 3.15Å; E549-Y557 PolarHBondContact N-O 2.95Å; E549-Y557 PolarHBondContact O-N 2.82Å; E549-R559 HydrophobicContact CB-CG 4.07Å; E549-R559 IonicContact OE2-CZ 3.65Å; E549-R559 IonicContact OE2-NE 2.82Å; E549-R559 PolarHBondContact OE2-NE 2.85Å; E549-R559 IonicContact OE2-NH2 3.3Å; E549-R559 PolarHBondContact OE2-NH2 3.36Å
550	L	86.4	Confident	88.7	Confident	72 Å²	72	65.2 Å²	65.2	38%	0.377	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	98.9	172.7	-73.1	168.2	0	0	0	111.4	G502 Y504 C520	G502-L550 WeakPolarHBondContact O-CB 3.2Å; G502-L550 PolarHBondContact O-N 2.78Å; Y504-L550 HydrophobicContact CD1-CD1 4.47Å; Y504-L550 HydrophobicContact CD1-CG 4.25Å; Y504-L550 HydrophobicContact CE1-CD2 4.2Å; Y504-L550 HydrophobicContact CE1-CG 3.95Å; C520-L550 WeakPolarHBondContact SG-CD1 3.48Å
551	G	81.6	Confident	88.8	Confident	17 Å²	17	67.6 Å²	67.6	18%	0.175	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	156.4	170.6	0	0	0	0	0	112.7	E549 R553 K554 K555	E549-G551 PolarHBondContact O-N 2.87Å; G551-R553 PolarHBondContact O-N 3.02Å; G551-K554 PolarHBondContact O-N 2.83Å; G551-K555 PolarHBondContact N-O 2.89Å; G551-K555 PolarHBondContact O-N 2.89Å
552	K	78.6	Confident	88.8	Confident	224 Å²	224	62.2 Å²	62.2	97%	0.974	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-11.5	-172.7	-59.8	-172	178.4	-172.2	0	118
553	R	78.8	Confident	88.7	Confident	222 Å²	222	60.6 Å²	60.6	84%	0.838	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	29.1	177.5	-63.9	-174.6	177.8	173.2	-0.3	112.8	G551 K555	G551-R553 PolarHBondContact O-N 3.02Å; R553-K555 HydrophobicContact CB-CG 4.45Å; R553-K555 PolarHBondContact O-N 2.86Å
554	K	78.8	Confident	88.6	Confident	157 Å²	157	62.4 Å²	62.4	68%	0.683	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	36.2	-171.3	-64.5	-177	172.2	-179.5	0	112.8	G551 Y1117	G551-K554 PolarHBondContact O-N 2.83Å; K554-Y1117 PolarHBondContact NZ-OH 3.41Å
555	K	84.4	Confident	88.4	Confident	128 Å²	128	64.8 Å²	64.8	56%	0.557	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.3	177.2	-69.3	-158.2	174.7	-160.7	0	109.7	G551 R553 Y557	G551-K555 PolarHBondContact N-O 2.89Å; G551-K555 PolarHBondContact O-N 2.89Å; R553-K555 HydrophobicContact CB-CG 4.45Å; R553-K555 PolarHBondContact O-N 2.86Å; K555-Y557 HydrophobicContact CB-CE2 3.9Å; K555-Y557 WeakPolarHBondContact O-CD2 3.23Å; K555-Y557 VanDerWaalsContact O-CE2 3.29Å; K555-Y557 WeakPolarHBondContact O-CE2 3.27Å
556	S	88	Confident	88.1	Confident	52 Å²	52	64.8 Å²	64.8	36%	0.364	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	128.8	176.2	-55.1	0	0	0	0	111	Y504 E549	Y504-S556 VanDerWaalsContact OH-CB 3.32Å; Y504-S556 WeakPolarHBondContact OH-CB 3.29Å; Y504-S556 PolarHBondContact OH-OG 2.88Å; E549-S556 CarbonylContact O-C 3.59Å; E549-S556 WeakPolarHBondContact O-CA 3.15Å
557	Y	88.5	Confident	87.7	Confident	128 Å²	128	66.8 Å²	66.8	50%	0.502	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.8	176.3	-65.9	-90.2	0	0	0	109.4	F548 E549 K555	F548-Y557 CarbonylContact C-O 3.56Å; F548-Y557 WeakPolarHBondContact CA-O 3.23Å; E549-Y557 PolarHBondContact N-O 2.95Å; E549-Y557 PolarHBondContact O-N 2.82Å; K555-Y557 HydrophobicContact CB-CE2 3.9Å; K555-Y557 WeakPolarHBondContact O-CD2 3.23Å; K555-Y557 VanDerWaalsContact O-CE2 3.29Å; K555-Y557 WeakPolarHBondContact O-CE2 3.27Å
558	S	90.4	Very high	87.2	Confident	33 Å²	33	71.8 Å²	71.8	23%	0.231	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	134.6	173.1	169	0	0	0	0	110.7	E546	E546-S558 VanDerWaalsContact OE1-CB 3.22Å; E546-S558 WeakPolarHBondContact OE1-CB 3.33Å; E546-S558 PolarHBondContact OE1-OG 2.78Å
559	R	87.8	Confident	86.7	Confident	18 Å²	18	70.6 Å²	70.6	7%	0.068	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-22.9	179.5	-65.5	-49.5	-144	110.3	11.9	114.5	S496 I547 E549	S496-R559 PolarHBondContact O-NH1 2.85Å; S496-R559 PolarHBondContact O-NH2 3.39Å; S496-R559 PolarHBondContact OG-NH1 3.19Å; I547-R559 PolarHBondContact O-N 2.91Å; E549-R559 HydrophobicContact CB-CG 4.07Å; E549-R559 IonicContact OE2-CZ 3.65Å; E549-R559 IonicContact OE2-NE 2.82Å; E549-R559 PolarHBondContact OE2-NE 2.85Å; E549-R559 IonicContact OE2-NH2 3.3Å; E549-R559 PolarHBondContact OE2-NH2 3.36Å
560	G	88.3	Confident	85.8	Confident	0 Å²	0	72 Å²	72	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	144	174.9	0	0	0	0	0	111.3	E546 I547 I597	E546-G560 WeakPolarHBondContact CA-O 3.21Å; I547-G560 PolarHBondContact N-O 3.3Å; G560-I597 WeakPolarHBondContact CA-O 3.43Å
561	R	92.4	Very high	84.7	Confident	54 Å²	54	72.7 Å²	72.7	20%	0.204	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144	178.7	-172.5	170.6	-179.2	-85.7	1.5	111.7	L545 E546 E563 I597	L545-R561 CarbonylContact O-C 3.54Å; L545-R561 WeakPolarHBondContact O-CA 3.19Å; E546-R561 HydrophobicContact CB-CB 4.18Å; E546-R561 HydrophobicContact CB-CG 3.94Å; E546-R561 HydrophobicContact CG-CB 3.98Å; E546-R561 HydrophobicContact CG-CG 4.2Å; E546-R561 WeakPolarHBondContact OE2-CD 3.11Å; E546-R561 IonicContact OE2-NE 2.72Å; R561-E563 IonicContact CZ-OE1 2.76Å; R561-E563 VanDerWaalsContact CZ-OE1 3.23Å; R561-E563 IonicContact NH1-OE1 2.68Å; R561-E563 PolarHBondContact NH1-OE1 2.92Å; R561-E563 IonicContact NH2-OE1 3.14Å; R561-E563 PolarHBondContact NH2-OE1 3.32Å; R561-I597 PolarHBondContact N-O 3.02Å; R561-I597 PolarHBondContact O-N 2.87Å
562	A	91.7	Very high	83.2	Confident	6 Å²	6	76.2 Å²	76.2	5%	0.05	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.7	170.3	0	0	0	0	0	110.9	A544 L545 I594 L596	A544-A562 WeakPolarHBondContact CA-O 3.47Å; L545-A562 PolarHBondContact N-O 3.15Å; L545-A562 PolarHBondContact O-N 2.86Å; A562-I594 HydrophobicContact CB-CG2 3.6Å; A562-L596 HydrophobicContact CB-CD2 4.09Å
563	E	92.1	Very high	81.8	Confident	88 Å²	88	69.2 Å²	69.2	41%	0.411	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.6	168	-66.4	-167	177.5	0	0	109.6	R542 A544 R561	R542-E563 IonicContact NH1-OE2 2.67Å; R542-E563 PolarHBondContact NH1-OE2 3.18Å; A544-E563 HydrophobicContact CB-CG 4.14Å; R561-E563 IonicContact CZ-OE1 2.76Å; R561-E563 VanDerWaalsContact CZ-OE1 3.23Å; R561-E563 IonicContact NH1-OE1 2.68Å; R561-E563 PolarHBondContact NH1-OE1 2.92Å; R561-E563 IonicContact NH2-OE1 3.14Å; R561-E563 PolarHBondContact NH2-OE1 3.32Å
564	L	91.4	Very high	80.1	Confident	37 Å²	37	65 Å²	65	19%	0.194	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	143.1	171.2	-69	176.6	0	0	0	110.1	R542 I543 L569 I594 F656	R542-L564 VanDerWaalsContact CA-O 3.32Å; R542-L564 WeakPolarHBondContact CA-O 3.5Å; I543-L564 HydrophobicContact CG2-CB 3.98Å; I543-L564 PolarHBondContact N-O 3.19Å; I543-L564 PolarHBondContact O-N 3.43Å; L564-L569 HydrophobicContact CD1-CD2 4.31Å; L564-I594 HydrophobicContact CD1-CD1 3.58Å; L564-I594 HydrophobicContact CD1-CG1 4.17Å; L564-I594 HydrophobicContact CD2-CG2 4.25Å; L564-I594 HydrophobicContact CG-CD1 4.31Å; L564-I594 HydrophobicContact CG-CG2 4.48Å; L564-F656 HydrophobicContact CD1-CE1 4.41Å; L564-F656 HydrophobicContact CD1-CE2 3.92Å; L564-F656 HydrophobicContact CD1-CZ 3.66Å
565	L	91.3	Very high	78.1	Confident	59 Å²	59	60.7 Å²	60.7	31%	0.309	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.1	164.6	-76.4	158.6	0	0	0	108.7	K541 R542 M567 H568	K541-L565 CarbonylContact O-C 3.57Å; K541-L565 WeakPolarHBondContact O-CA 3.47Å; R542-L565 HydrophobicContact CG-CD2 3.85Å; L565-M567 PolarHBondContact O-N 3.42Å; L565-M567 VanDerWaalsContact O-N 3.13Å; L565-H568 PolarHBondContact O-N 2.87Å
566	L	90	Very high	75.6	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.7	178.8	-64.7	171.8	0	0	0	112.1	F480 L485 L509 L536 K541 I543 H568 L569 L570	F480-L566 HydrophobicContact CE2-CB 3.95Å; F480-L566 HydrophobicContact CE2-CD1 3.97Å; F480-L566 HydrophobicContact CZ-CB 3.72Å; F480-L566 HydrophobicContact CZ-CD1 4.29Å; L485-L566 HydrophobicContact CD2-CD2 3.77Å; L509-L566 HydrophobicContact CD1-CD1 4.14Å; L536-L566 HydrophobicContact CD2-CD1 4.37Å; K541-L566 PolarHBondContact O-N 3.19Å; I543-L566 HydrophobicContact CB-CD2 4.31Å; I543-L566 HydrophobicContact CG2-CD2 4.11Å; L566-H568 VanDerWaalsContact C-N 3.28Å; L566-H568 PolarHBondContact O-N 3.09Å; L566-L569 HydrophobicContact CD2-CD1 4.11Å; L566-L569 WeakPolarHBondContact O-CB 3.46Å; L566-L569 PolarHBondContact O-N 2.68Å; L566-L570 PolarHBondContact O-N 2.61Å
567	M	85.1	Confident	72.9	Confident	61 Å²	61	63.1 Å²	63.1	30%	0.3	35%	0.345	S	S	.	.	H	α-helix	trans	-56.7	-40.8	173.2	-57.1	-60	88.3	0	0	112.3	N478 F480 L565 L569 L570 T571	N478-M567 HydrophobicContact CB-CE 4.13Å; N478-M567 WeakPolarHBondContact ND2-CE 3.18Å; N478-M567 PolarHBondContact ND2-SD 2.74Å; N478-M567 WeakPolarHBondContact OD1-CE 3.21Å; F480-M567 HydrophobicContact CE2-CE 3.38Å; F480-M567 HydrophobicContact CZ-CE 3.44Å; F480-M567 VanDerWaalsContact CZ-CE 3.44Å; L565-M567 PolarHBondContact O-N 3.42Å; L565-M567 VanDerWaalsContact O-N 3.13Å; M567-L569 PolarHBondContact O-N 2.97Å; M567-L570 HydrophobicContact CE-CD1 4.29Å; M567-L570 PolarHBondContact O-N 3.23Å; M567-L570 VanDerWaalsContact O-N 3.11Å; M567-T571 PolarHBondContact O-N 3.12Å
568	H	82.9	Confident	70.1	Confident	106 Å²	106	64.6 Å²	64.6	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-77.4	-5.8	-176.1	-56.2	176	0	0	0	112.6	L565 L566 T571 R592	L565-H568 PolarHBondContact O-N 2.87Å; L566-H568 VanDerWaalsContact C-N 3.28Å; L566-H568 PolarHBondContact O-N 3.09Å; H568-T571 WeakPolarHBondContact CA-OG1 3.26Å; H568-T571 PolarHBondContact O-OG1 3.33Å; H568-R592 PolarHBondContact O-NH2 2.68Å
569	L	82	Confident	67.5	Low	5 Å²	5	69.8 Å²	69.8	3%	0.026	39%	0.386	C	S	.	.	H	α-helix	trans	-84.6	-36.7	167.1	-59	176.3	0	0	0	111	L564 L566 M567 I590 R592 F656 F658	L564-L569 HydrophobicContact CD1-CD2 4.31Å; L566-L569 HydrophobicContact CD2-CD1 4.11Å; L566-L569 WeakPolarHBondContact O-CB 3.46Å; L566-L569 PolarHBondContact O-N 2.68Å; M567-L569 PolarHBondContact O-N 2.97Å; L569-I590 HydrophobicContact CB-CD1 4.5Å; L569-I590 HydrophobicContact CD2-CG2 4.24Å; L569-I590 VanDerWaalsContact O-CD1 3.23Å; L569-I590 WeakPolarHBondContact O-CD1 3.45Å; L569-R592 HydrophobicContact CD2-CG 4.37Å; L569-F656 HydrophobicContact CD1-CB 4.01Å; L569-F656 HydrophobicContact CD1-CD1 3.7Å; L569-F656 HydrophobicContact CD1-CE1 4.32Å; L569-F656 HydrophobicContact CD1-CG 3.83Å; L569-F656 HydrophobicContact CD2-CB 4.23Å; L569-F656 HydrophobicContact CD2-CD1 4.42Å; L569-F656 HydrophobicContact CD2-CD2 3.8Å; L569-F656 HydrophobicContact CD2-CE2 4.28Å; L569-F656 HydrophobicContact CD2-CG 3.89Å; L569-F658 HydrophobicContact CB-CE2 3.8Å; L569-F658 HydrophobicContact CB-CZ 4.04Å; L569-F658 HydrophobicContact CD1-CZ 4.3Å
570	L	72.2	Confident	64.9	Low	46 Å²	46	76.9 Å²	76.9	24%	0.241	42%	0.419	C	S	.	.	H	α-helix	trans	-74.3	-28.7	179.2	-61.4	174.9	0	0	0	113.1	N478 F480 L566 M567 N572 I586 F658	N478-L570 VanDerWaalsContact OD1-CD1 3.28Å; N478-L570 WeakPolarHBondContact OD1-CD1 3.34Å; F480-L570 HydrophobicContact CE1-CD1 3.84Å; F480-L570 HydrophobicContact CZ-CD1 3.86Å; L566-L570 PolarHBondContact O-N 2.61Å; M567-L570 HydrophobicContact CE-CD1 4.29Å; M567-L570 PolarHBondContact O-N 3.23Å; M567-L570 VanDerWaalsContact O-N 3.11Å; L570-N572 PolarHBondContact O-N 3.47Å; L570-I586 HydrophobicContact CD2-CD1 3.78Å; L570-F658 HydrophobicContact CD2-CD2 3.78Å; L570-F658 HydrophobicContact CD2-CE1 4.26Å; L570-F658 HydrophobicContact CD2-CE2 3.46Å; L570-F658 VanDerWaalsContact CD2-CE2 3.46Å; L570-F658 HydrophobicContact CD2-CG 4.3Å; L570-F658 HydrophobicContact CD2-CZ 3.72Å; L570-F658 HydrophobicContact CG-CE2 4.11Å; L570-F658 HydrophobicContact CG-CZ 4.1Å
571	T	62.9	Low	62.1	Low	86 Å²	86	82.8 Å²	82.8	53%	0.528	46%	0.456	S	S	.	.	S	Bend	trans	-77	110.8	171.2	54.7	0	0	0	0	110.2	M567 H568	M567-T571 PolarHBondContact O-N 3.12Å; H568-T571 WeakPolarHBondContact CA-OG1 3.26Å; H568-T571 PolarHBondContact O-OG1 3.33Å
572	N	49.6	Very low	59.2	Low	90 Å²	90	87.3 Å²	87.3	48%	0.481	48%	0.484	S	S	.	.			trans	-63.4	124.3	178.3	-146.6	-13.7	0	0	0	109.4	L570 N574	L570-N572 PolarHBondContact O-N 3.47Å; N572-N574 PolarHBondContact O-N 2.97Å; N572-N574 VanDerWaalsContact O-N 3.1Å
573	P	49.3	Very low	56.3	Low	77 Å²	77	92.2 Å²	92.2	50%	0.5	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-0.1	-171	29	-35.6	0	0	0	115.1
574	N	42.4	Very low	53.5	Low	133 Å²	133	92 Å²	92	71%	0.711	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	4.9	-169.1	-62.6	3.4	0	0	0	113.7	N572	N572-N574 PolarHBondContact O-N 2.97Å; N572-N574 VanDerWaalsContact O-N 3.1Å
575	S	38.1	Very low	50.9	Low	68 Å²	68	96.9 Å²	96.9	48%	0.476	55%	0.549	S	S	.	.			trans	-100	77.2	177.9	61.3	0	0	0	0	111.2
576	D	32.1	Very low	48.6	Very low	175 Å²	175	96.2 Å²	96.2	94%	0.936	55%	0.545	S	S	*	.			trans	-75.6	121.7	156.2	-91.1	-41.5	0	0	0	108.1
577	G	29.7	Very low	46.2	Very low	56 Å²	56	100.5 Å²	100.5	58%	0.577	58%	0.575	S	S	*	*	S	Bend	trans	88.8	154.2	-179.1	0	0	0	0	0	115.6
578	D	29.8	Very low	44.7	Very low	159 Å²	159	101.4 Å²	101.4	85%	0.85	58%	0.581	S	S	*	*			trans	38.5	75.1	160.2	-59.1	-7.7	0	0	0	118.2	E580	D578-E580 PolarHBondContact O-N 2.64Å
579	L	37.2	Very low	43.9	Very low	142 Å²	142	100 Å²	100	74%	0.743	58%	0.58	S	S	*	*			trans	-87.9	42.5	163.2	-153.4	80.6	0	0	0	112.7
580	E	32.7	Very low	43.8	Very low	167 Å²	167	100.8 Å²	100.8	78%	0.78	58%	0.584	S	S	*	*			trans	-75.1	136.4	160.1	-71.7	-141.8	138.6	0	0	109.8	D578	D578-E580 PolarHBondContact O-N 2.64Å
581	T	30.4	Very low	44.4	Very low	124 Å²	124	105.9 Å²	105.9	76%	0.761	60%	0.6	S	S	*	*	S	Bend	trans	42.1	85.3	166.2	56	0	0	0	0	117.3
582	N	31.1	Very low	45.4	Very low	148 Å²	148	105 Å²	105	79%	0.791	59%	0.587	S	S	*	*			trans	-157.2	136.6	131	-104.9	-46.7	0	0	0	113.3	V584	N582-V584 VanDerWaalsContact C-N 3.32Å; N582-V584 PolarHBondContact O-N 2.89Å
583	S	30.5	Very low	46.9	Very low	110 Å²	110	106.2 Å²	106.2	77%	0.769	59%	0.59	S	S	*	*			trans	-78.1	83.4	167.8	53.1	0	0	0	0	108.9	N585	S583-N585 PolarHBondContact O-N 2.75Å
584	V	34	Very low	48.7	Very low	83 Å²	83	103 Å²	103	50%	0.503	57%	0.568	S	S	.	*			trans	-61.7	111.7	179.3	-175.6	0	0	0	0	109.3	N582 I586	N582-V584 VanDerWaalsContact C-N 3.32Å; N582-V584 PolarHBondContact O-N 2.89Å; V584-I586 VanDerWaalsContact C-N 3.3Å; V584-I586 HydrophobicContact CB-CG1 4.29Å; V584-I586 HydrophobicContact CG1-CG1 3.97Å; V584-I586 WeakPolarHBondContact O-CG1 3.38Å; V584-I586 PolarHBondContact O-N 3.21Å
585	N	36	Very low	50.5	Low	140 Å²	140	100.4 Å²	100.4	75%	0.749	56%	0.559	S	S	*	*			trans	-68	93.5	162.2	-80	-30	0	0	0	107	S583 S587	S583-N585 PolarHBondContact O-N 2.75Å; N585-S587 PolarHBondContact O-N 3.48Å
586	I	42.3	Very low	52.5	Low	45 Å²	45	97.7 Å²	97.7	23%	0.231	54%	0.539	C	S	.	.			trans	-72.5	74.2	-176.7	-46.5	178.7	0	0	0	110	L570 V584 F658	L570-I586 HydrophobicContact CD2-CD1 3.78Å; V584-I586 VanDerWaalsContact C-N 3.3Å; V584-I586 HydrophobicContact CB-CG1 4.29Å; V584-I586 HydrophobicContact CG1-CG1 3.97Å; V584-I586 WeakPolarHBondContact O-CG1 3.38Å; V584-I586 PolarHBondContact O-N 3.21Å; I586-F658 HydrophobicContact CG2-CD2 4.3Å
587	S	39.5	Very low	54.9	Low	90 Å²	90	95.4 Å²	95.4	63%	0.629	53%	0.525	S	S	*	.			trans	-96.4	0.8	167.9	-54.3	0	0	0	0	111.5	N585 N657	N585-S587 PolarHBondContact O-N 3.48Å; S587-N657 PolarHBondContact O-OD1 2.84Å
588	D	55.2	Low	56.8	Low	80 Å²	80	96.4 Å²	96.4	43%	0.428	52%	0.517	S	S	.	.			trans	-75.1	128.1	-168.2	-60.8	-32	0	0	0	112.1	I590 N657	D588-I590 PolarHBondContact O-N 3.18Å; D588-I590 VanDerWaalsContact O-N 3.1Å; D588-N657 PolarHBondContact O-OD1 3.49Å
589	T	65.8	Low	58.5	Low	77 Å²	77	95.3 Å²	95.3	47%	0.472	50%	0.501	S	S	.	.			trans	-78.6	94.5	178	-57.4	0	0	0	0	110.6	R591 E655 N657	T589-R591 PolarHBondContact O-N 3.08Å; T589-E655 HydrophobicContact CG2-CB 3.96Å; T589-E655 HydrophobicContact CG2-CG 4.4Å; T589-N657 VanDerWaalsContact CA-OD1 3.23Å; T589-N657 WeakPolarHBondContact CA-OD1 3.47Å; T589-N657 PolarHBondContact N-OD1 3.2Å; T589-N657 VanDerWaalsContact OG1-CG 3.29Å; T589-N657 PolarHBondContact OG1-ND2 2.79Å; T589-N657 PolarHBondContact OG1-OD1 3.05Å
590	I	79.3	Confident	59.3	Low	20 Å²	20	91.6 Å²	91.6	10%	0.103	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	94.4	-174.9	-60.9	136.2	0	0	0	109.6	L569 D588 R592 F656 F658	L569-I590 HydrophobicContact CB-CD1 4.5Å; L569-I590 HydrophobicContact CD2-CG2 4.24Å; L569-I590 VanDerWaalsContact O-CD1 3.23Å; L569-I590 WeakPolarHBondContact O-CD1 3.45Å; D588-I590 PolarHBondContact O-N 3.18Å; D588-I590 VanDerWaalsContact O-N 3.1Å; I590-R592 HydrophobicContact CG2-CG 4.04Å; I590-F656 HydrophobicContact CB-CB 4.43Å; I590-F656 PolarHBondContact N-O 3.42Å; I590-F656 PolarHBondContact O-N 2.88Å; I590-F658 HydrophobicContact CD1-CD2 4.32Å; I590-F658 HydrophobicContact CD1-CE2 4.3Å
591	R	84.7	Confident	59.8	Low	154 Å²	154	87.3 Å²	87.3	58%	0.581	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	125.5	172.8	-170.3	175.1	-126.3	-160.7	5.3	110.6	T589 T653 E655	T589-R591 PolarHBondContact O-N 3.08Å; R591-T653 HydrophobicContact CG-CG2 4.31Å; R591-E655 HydrophobicContact CB-CG 3.86Å; R591-E655 HydrophobicContact CG-CG 3.73Å; R591-E655 IonicContact CZ-OE1 2.78Å; R591-E655 IonicContact NE-OE1 2.79Å; R591-E655 PolarHBondContact NE-OE1 3.4Å; R591-E655 IonicContact NH2-OE1 3.75Å; R591-E655 PolarHBondContact NH2-OE1 2.79Å
592	R	82.8	Confident	60	Low	67 Å²	67	86.9 Å²	86.9	25%	0.253	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.3	175.7	-59.4	-65.7	-167.8	159.3	2.1	110.7	H568 L569 I590 I594 T653 A654 F656	H568-R592 PolarHBondContact O-NH2 2.68Å; L569-R592 HydrophobicContact CD2-CG 4.37Å; I590-R592 HydrophobicContact CG2-CG 4.04Å; R592-I594 HydrophobicContact CB-CG1 4.01Å; R592-T653 WeakPolarHBondContact O-CA 3.22Å; R592-A654 PolarHBondContact N-O 2.84Å; R592-A654 PolarHBondContact O-N 3.11Å; R592-F656 HydrophobicContact CB-CE2 4.3Å; R592-F656 HydrophobicContact CG-CD2 4.38Å; R592-F656 HydrophobicContact CG-CE2 4.39Å
593	Q	82.9	Confident	60.1	Low	115 Å²	115	87.3 Å²	87.3	54%	0.537	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	119.7	159.9	-176.3	165.9	11.9	0	0	107.7	S651	Q593-S651 PolarHBondContact NE2-OG 2.69Å
594	I	87.2	Confident	60.4	Low	10 Å²	10	90.5 Å²	90.5	5%	0.051	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124	-168.4	-44.3	162.5	0	0	0	107.9	L545 A562 L564 R592 S651 I652 A654 F656	L545-I594 HydrophobicContact CD1-CD1 4.17Å; A562-I594 HydrophobicContact CB-CG2 3.6Å; L564-I594 HydrophobicContact CD1-CD1 3.58Å; L564-I594 HydrophobicContact CD1-CG1 4.17Å; L564-I594 HydrophobicContact CD2-CG2 4.25Å; L564-I594 HydrophobicContact CG-CD1 4.31Å; L564-I594 HydrophobicContact CG-CG2 4.48Å; R592-I594 HydrophobicContact CB-CG1 4.01Å; I594-S651 CarbonylContact O-C 3.54Å; I594-S651 WeakPolarHBondContact O-CA 3.42Å; I594-S651 VanDerWaalsContact O-CB 3.31Å; I594-S651 WeakPolarHBondContact O-CB 3.39Å; I594-I652 HydrophobicContact CB-CG2 3.95Å; I594-I652 HydrophobicContact CD1-CG2 4.19Å; I594-I652 HydrophobicContact CG1-CG2 4.49Å; I594-I652 PolarHBondContact N-O 3.43Å; I594-I652 PolarHBondContact O-N 2.82Å; I594-A654 HydrophobicContact CD1-CB 4.42Å; I594-F656 HydrophobicContact CD1-CE2 4.19Å; I594-F656 HydrophobicContact CD1-CZ 4.11Å
595	P	80	Confident	60.4	Low	79 Å²	79	95.3 Å²	95.3	51%	0.513	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	141.3	176.5	28.4	-34	0	0	0	110.7	I649	P595-I649 HydrophobicContact CB-CG2 4.06Å
596	L	80.3	Confident	60	Low	11 Å²	11	92 Å²	92	6%	0.058	52%	0.516	C	S	.	.			trans	-104	132.3	-179.4	-69	167	0	0	0	110.6	L495 I547 A562 D598 A650 I652	L495-L596 HydrophobicContact CD1-CD1 3.66Å; L495-L596 HydrophobicContact CD2-CD1 3.93Å; L495-L596 HydrophobicContact CG-CD1 4.09Å; I547-L596 HydrophobicContact CD1-CD1 3.75Å; A562-L596 HydrophobicContact CB-CD2 4.09Å; L596-D598 PolarHBondContact O-N 2.87Å; L596-A650 HydrophobicContact CB-CB 4.32Å; L596-A650 PolarHBondContact N-O 3.25Å; L596-I652 HydrophobicContact CD1-CB 4.16Å; L596-I652 HydrophobicContact CD2-CB 4.27Å; L596-I652 HydrophobicContact CD2-CG2 3.83Å; L596-I652 HydrophobicContact CG-CB 4.34Å; L596-I652 HydrophobicContact CG-CG2 4.19Å
597	I	80.6	Confident	59.7	Low	127 Å²	127	96.9 Å²	96.9	65%	0.651	55%	0.547	S	S	*	.	B	Isolated β-bridge	trans	-80.7	103.5	170.9	-55.7	175.5	0	0	0	107.7	G560 R561	G560-I597 WeakPolarHBondContact CA-O 3.43Å; R561-I597 PolarHBondContact N-O 3.02Å; R561-I597 PolarHBondContact O-N 2.87Å
598	D	69.8	Low	59.2	Low	77 Å²	77	97.5 Å²	97.5	41%	0.412	55%	0.552	S	S	.	*			trans	-63.8	132.3	174.3	-170.1	-17.6	0	0	0	110.3	L596 S600	L596-D598 PolarHBondContact O-N 2.87Å; D598-S600 VanDerWaalsContact OD1-CB 3.24Å; D598-S600 WeakPolarHBondContact OD1-CB 3.44Å; D598-S600 PolarHBondContact OD1-N 3.36Å; D598-S600 PolarHBondContact OD1-OG 2.91Å; D598-S600 PolarHBondContact OD2-OG 3.47Å
599	R	65.6	Low	58.3	Low	135 Å²	135	100 Å²	100	51%	0.509	57%	0.57	S	S	.	*			trans	-105.1	-2.7	-178.7	-74.9	177.6	159.4	179.9	-9.7	113.4	E546 G601	E546-R599 IonicContact OE1-CZ 2.61Å; E546-R599 IonicContact OE1-NH1 3.6Å; E546-R599 PolarHBondContact OE1-NH1 3.26Å; E546-R599 IonicContact OE2-NH1 3.82Å; R599-G601 PolarHBondContact O-N 2.8Å
600	S	55.7	Low	56.7	Low	64 Å²	64	100.9 Å²	100.9	45%	0.448	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-4.4	-166.4	66.6	0	0	0	0	116	D598	D598-S600 VanDerWaalsContact OD1-CB 3.24Å; D598-S600 WeakPolarHBondContact OD1-CB 3.44Å; D598-S600 PolarHBondContact OD1-N 3.36Å; D598-S600 PolarHBondContact OD1-OG 2.91Å; D598-S600 PolarHBondContact OD2-OG 3.47Å
601	G	43.1	Very low	54.6	Low	78 Å²	78	106.7 Å²	106.7	80%	0.804	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	0.6	-173.9	0	0	0	0	0	117.9	R599	R599-G601 PolarHBondContact O-N 2.8Å
602	S	33.9	Very low	52.2	Low	115 Å²	115	106.7 Å²	106.7	80%	0.804	62%	0.621	S	S	*	*			trans	-111.1	64.1	-168	-160.4	0	0	0	0	114.4
603	L	32.3	Very low	50	Low	157 Å²	157	110.4 Å²	110.4	82%	0.822	65%	0.651	S	S	*	*			trans	-156.1	87.3	168.3	-167	74.5	0	0	0	112.8
604	L	36.9	Very low	47.6	Very low	176 Å²	176	109.3 Å²	109.3	92%	0.921	66%	0.661	S	S	*	*			trans	-149.9	104.2	165.1	-115.1	165	0	0	0	109.6
605	E	33.9	Very low	45.3	Very low	184 Å²	184	114.4 Å²	114.4	86%	0.86	70%	0.695	S	S	*	*			trans	-76.3	149.4	175.7	-66.5	174	108	0	0	110.9
606	G	28.7	Very low	43.2	Very low	72 Å²	72	117 Å²	117	74%	0.742	71%	0.712	S	S	*	*			trans	-86	156.6	-173.7	0	0	0	0	0	114.9
607	T	34.4	Very low	40.6	Very low	146 Å²	146	121.1 Å²	121.1	90%	0.896	75%	0.748	S	S	*	*			trans	-149.3	135.2	157	-58.5	0	0	0	0	109
608	S	30.3	Very low	38.4	Very low	104 Å²	104	121.3 Å²	121.3	73%	0.727	75%	0.754	S	S	*	*			trans	-82.5	156.7	-171.9	-45.8	0	0	0	0	113.8
609	T	36.6	Very low	36.4	Very low	131 Å²	131	125.8 Å²	125.8	80%	0.804	77%	0.773	S	S	*	*				174.9	119.5	109.3	40.8	0	0	0	0	113.4
610	S	31.7	Very low	34.5	Very low	96 Å²	96	124.6 Å²	124.6	67%	0.671	79%	0.785	S	S	*	*			trans	21.5	130.6	142.4	58.8	0	0	0	0	122.7
611	N	35.6	Very low	33.3	Very low	142 Å²	142	127.4 Å²	127.4	76%	0.759	80%	0.799	S	S	*	*				-174.1	112.1	104.5	-91.6	-11.7	0	0	0	115.6
612	I	33.4	Very low	32.5	Very low	154 Å²	154	129 Å²	129	79%	0.79	80%	0.798	S	S	*	*			trans	24.1	122.7	136.4	-48.6	172.5	0	0	0	120.2
613	V	36.2	Very low	32.3	Very low	146 Å²	146	127.6 Å²	127.6	89%	0.885	80%	0.801	S	S	*	*				-169.6	157.9	118.8	147.4	0	0	0	0	108.8
614	A	33.9	Very low	32.2	Very low	91 Å²	91	123.3 Å²	123.3	75%	0.752	80%	0.795	S	S	*	*			trans	-109.1	166	-163.1	0	0	0	0	0	115.4
615	P	38	Very low	31.8	Very low	118 Å²	118	122.9 Å²	122.9	77%	0.766	79%	0.794	S	S	*	*			trans	-109.6	178.9	-169.2	42.6	-35.7	0	0	0	114.9
616	P	35.3	Very low	31.6	Very low	133 Å²	133	121.3 Å²	121.3	86%	0.864	79%	0.791	S	S	*	*			trans	-120.6	171.4	139.9	36.9	-28.3	0	0	0	112.5
617	A	27.2	Very low	31.6	Very low	98 Å²	98	126.3 Å²	126.3	81%	0.81	80%	0.8	S	S	*	*			trans	-118.4	153.3	-161.8	0	0	0	0	0	115.5
618	V	33.6	Very low	31.3	Very low	130 Å²	130	123.1 Å²	123.1	79%	0.788	78%	0.784	S	S	*	*			trans	-143	115.3	158.6	-166.3	0	0	0	0	111.1
619	Q	28.7	Very low	31.5	Very low	172 Å²	172	124.4 Å²	124.4	80%	0.804	79%	0.787	S	S	*	*			trans	36.2	134.3	148.5	-56	171.2	-9.8	0	0	123.9
620	S	24.9	Very low	31.2	Very low	109 Å²	109	122.1 Å²	122.1	76%	0.762	77%	0.773	S	S	*	*			trans	83.3	156.1	141.6	78.7	0	0	0	0	121.5
621	V	30.6	Very low	31.1	Very low	123 Å²	123	124.6 Å²	124.6	75%	0.745	78%	0.779	S	S	*	*			trans	62.8	105.3	173.2	-168.9	0	0	0	0	114
622	S	26.5	Very low	30.9	Very low	112 Å²	112	124.1 Å²	124.1	78%	0.783	77%	0.772	S	S	*	*				74	135.3	54.5	94	0	0	0	0	115.1
623	G	30	Very low	30.7	Very low	85 Å²	85	122.6 Å²	122.6	88%	0.876	78%	0.775	S	S	*	*			trans	84.9	158.6	-171	0	0	0	0	0	114.7
624	G	30.8	Very low	30.5	Very low	67 Å²	67	122.2 Å²	122.2	69%	0.691	77%	0.766	S	S	*	*			cis	177.9	69.8	-4.2	0	0	0	0	0	114.5	N626	G624-N626 PolarHBondContact O-N 3.39Å
625	N	27.3	Very low	30.4	Very low	168 Å²	168	122.9 Å²	122.9	90%	0.898	77%	0.766	S	S	*	*			trans	-95.9	51	-172.5	-70.6	-5.3	0	0	0	114.8
626	N	30.3	Very low	30.1	Very low	151 Å²	151	122.6 Å²	122.6	81%	0.807	76%	0.762	S	S	*	*			trans	-94.8	102.9	175.7	-81.9	-25.9	0	0	0	111.7	G624 S628	G624-N626 PolarHBondContact O-N 3.39Å; N626-S628 PolarHBondContact O-N 2.82Å
627	L	28.8	Very low	29.9	Very low	176 Å²	176	122.8 Å²	122.8	92%	0.921	76%	0.756	S	S	*	*			trans	-71.6	82.2	161.9	-82.7	163.7	0	0	0	109.4
628	S	28.3	Very low	30.3	Very low	80 Å²	80	124.6 Å²	124.6	56%	0.559	76%	0.757	S	S	*	*			trans	-72.2	135	174.3	42.5	0	0	0	0	111.1	N626 T630	N626-S628 PolarHBondContact O-N 2.82Å; S628-T630 PolarHBondContact O-N 3.01Å; S628-T630 VanDerWaalsContact O-N 3.09Å
629	V	33.2	Very low	30	Very low	131 Å²	131	126.6 Å²	126.6	79%	0.794	76%	0.763	S	S	*	*			trans	-76.9	87.4	156.4	177.8	0	0	0	0	105.7	N631	V629-N631 PolarHBondContact O-N 2.86Å
630	T	29.9	Very low	30.2	Very low	83 Å²	83	123.4 Å²	123.4	51%	0.509	77%	0.766	S	S	.	*			trans	-72.9	79.7	177.4	23.3	0	0	0	0	110.5	S628 Q632	S628-T630 PolarHBondContact O-N 3.01Å; S628-T630 VanDerWaalsContact O-N 3.09Å; T630-Q632 HydrophobicContact CG2-CG 4Å; T630-Q632 PolarHBondContact O-N 2.74Å
631	N	31.6	Very low	30.5	Very low	148 Å²	148	123.6 Å²	123.6	79%	0.791	77%	0.774	S	S	*	*			trans	-65.6	68	145.9	-74	-10.7	0	0	0	108.1	V629 S633	V629-N631 PolarHBondContact O-N 2.86Å; N631-S633 PolarHBondContact O-N 3.4Å
632	Q	30.9	Very low	30.6	Very low	132 Å²	132	121 Å²	121	62%	0.617	77%	0.773	S	S	*	*			trans	-70.2	121.8	163.9	-80.4	-178.2	-22.9	0	0	107.2	T630 I634	T630-Q632 HydrophobicContact CG2-CG 4Å; T630-Q632 PolarHBondContact O-N 2.74Å; Q632-I634 HydrophobicContact CB-CD1 4.22Å; Q632-I634 HydrophobicContact CB-CG1 3.83Å; Q632-I634 PolarHBondContact O-N 3.26Å
633	S	28.4	Very low	30.8	Very low	122 Å²	122	125.1 Å²	125.1	85%	0.853	78%	0.78	S	S	*	*			trans	-62.3	82.7	162	48.9	0	0	0	0	108.9	N631	N631-S633 PolarHBondContact O-N 3.4Å
634	I	33.1	Very low	30.9	Very low	137 Å²	137	126.8 Å²	126.8	70%	0.703	78%	0.775	S	S	*	*			trans	-94.4	100.7	171.1	-56.9	-176	0	0	0	106.9	Q632	Q632-I634 HydrophobicContact CB-CD1 4.22Å; Q632-I634 HydrophobicContact CB-CG1 3.83Å; Q632-I634 PolarHBondContact O-N 3.26Å
635	S	31.1	Very low	30.9	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	79%	0.786	S	S	*	*			trans	-56.3	145.8	172.7	32.4	0	0	0	0	111.5	N637	S635-N637 PolarHBondContact O-N 2.84Å
636	T	30.7	Very low	31.4	Very low	111 Å²	111	125 Å²	125	68%	0.681	78%	0.776	S	S	*	*			trans	-70	120.7	166.9	47.1	0	0	0	0	109.6
637	N	32.5	Very low	32.1	Very low	138 Å²	138	126 Å²	126	74%	0.738	78%	0.781	S	S	*	*				174.9	155.4	118.2	-89.7	-25.3	0	0	0	115.9	S635	S635-N637 PolarHBondContact O-N 2.84Å
638	T	34.3	Very low	33.6	Very low	136 Å²	136	121.1 Å²	121.1	83%	0.834	76%	0.762	S	S	*	*			trans	67.3	145.6	154.6	43.7	0	0	0	0	120.5
639	N	29.2	Very low	36	Very low	172 Å²	172	122.5 Å²	122.5	92%	0.92	76%	0.762	S	S	*	*			trans	-100	140.2	-176.3	-55.8	-64.7	0	0	0	111.9
640	A	32.8	Very low	38.6	Very low	105 Å²	105	117 Å²	117	87%	0.868	73%	0.729	S	S	*	*			trans	-145	151.5	152.9	0	0	0	0	0	108.7
641	A	31.1	Very low	41.4	Very low	112 Å²	112	113.3 Å²	113.3	93%	0.926	71%	0.708	S	S	*	*			trans	-100.5	139.5	-170.6	0	0	0	0	0	112.9
642	G	31.3	Very low	44.3	Very low	70 Å²	70	106.3 Å²	106.3	72%	0.722	67%	0.67	S	S	*	*			trans	174.6	90.2	174.4	0	0	0	0	0	116.2
643	Q	31.5	Very low	47.3	Very low	198 Å²	198	100.4 Å²	100.4	93%	0.925	64%	0.643	S	S	*	*			trans	63	159.6	162.4	-64.2	-180	-86.4	0	0	119
644	P	32.6	Very low	50.4	Low	120 Å²	120	94.6 Å²	94.6	78%	0.779	60%	0.602	S	S	*	*			trans	-133	97.1	-155.9	36.6	-15.2	0	0	0	115.9
645	S	31	Very low	53.2	Low	131 Å²	131	89.4 Å²	89.4	92%	0.916	58%	0.575	S	S	*	*			trans	-163.3	81.9	164.7	46	0	0	0	0	113.4
646	G	37.8	Very low	56.2	Low	67 Å²	67	84.4 Å²	84.4	69%	0.691	54%	0.54	S	S	*	.			trans	-148.5	141.6	176	0	0	0	0	0	113	S648	G646-S648 PolarHBondContact O-N 3.48Å
647	N	44.7	Very low	59	Low	172 Å²	172	80.7 Å²	80.7	92%	0.92	52%	0.516	S	S	*	.			trans	-65.6	98.4	-176.6	-79	-21.5	0	0	0	111.5	I649	N647-I649 PolarHBondContact O-N 3.49Å
648	S	59.9	Low	61.7	Low	73 Å²	73	74.6 Å²	74.6	51%	0.51	48%	0.483	S	S	.	.			trans	-80.2	98.7	-172.3	-156.4	0	0	0	0	111.3	K494 G646 A650	K494-S648 VanDerWaalsContact CD-OG 3.23Å; K494-S648 WeakPolarHBondContact CD-OG 3.18Å; K494-S648 WeakPolarHBondContact CE-OG 3.43Å; K494-S648 PolarHBondContact NZ-OG 3.46Å; G646-S648 PolarHBondContact O-N 3.48Å; S648-A650 PolarHBondContact O-N 3.29Å
649	I	78.2	Confident	64.2	Low	109 Å²	109	72.6 Å²	72.6	56%	0.559	47%	0.465	S	S	*	.			trans	-61	131.7	-176	-56.5	174.8	0	0	0	111.1	K494 P595 N647	K494-I649 VanDerWaalsContact CD-O 3.31Å; K494-I649 WeakPolarHBondContact CD-O 3.49Å; P595-I649 HydrophobicContact CB-CG2 4.06Å; N647-I649 PolarHBondContact O-N 3.49Å
650	A	87.4	Confident	66.9	Low	14 Å²	14	72.1 Å²	72.1	12%	0.116	46%	0.457	C	S	.	.			trans	-63.3	138.5	173.3	0	0	0	0	0	111.3	L495 L596 S648	L495-A650 HydrophobicContact CD2-CB 3.69Å; L495-A650 HydrophobicContact CG-CB 4.08Å; L596-A650 HydrophobicContact CB-CB 4.32Å; L596-A650 PolarHBondContact N-O 3.25Å; S648-A650 PolarHBondContact O-N 3.29Å
651	S	90.2	Very high	69.2	Low	7 Å²	7	69.7 Å²	69.7	5%	0.049	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	160	-175.6	56.7	0	0	0	0	113.7	A492 E493 Q593 I594	A492-S651 CarbonylContact C-O 3.59Å; A492-S651 VanDerWaalsContact CA-O 3.27Å; A492-S651 WeakPolarHBondContact CA-O 3.27Å; A492-S651 WeakPolarHBondContact CB-O 3.44Å; E493-S651 PolarHBondContact N-O 2.91Å; E493-S651 PolarHBondContact O-N 2.91Å; E493-S651 VanDerWaalsContact O-N 3.1Å; Q593-S651 PolarHBondContact NE2-OG 2.69Å; I594-S651 CarbonylContact O-C 3.54Å; I594-S651 WeakPolarHBondContact O-CA 3.42Å; I594-S651 VanDerWaalsContact O-CB 3.31Å; I594-S651 WeakPolarHBondContact O-CB 3.39Å
652	I	92.3	Very high	71.1	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.4	172.8	-170.5	174.2	0	0	0	109.9	V489 K491 A492 L545 I547 I594 L596	V489-I652 HydrophobicContact CG1-CD1 4.08Å; K491-I652 CarbonylContact O-C 3.57Å; K491-I652 WeakPolarHBondContact O-CG1 3.16Å; A492-I652 HydrophobicContact CB-CB 4.35Å; A492-I652 HydrophobicContact CB-CG1 4.3Å; L545-I652 HydrophobicContact CB-CD1 4.33Å; L545-I652 HydrophobicContact CD2-CD1 3.89Å; I547-I652 HydrophobicContact CD1-CB 4.48Å; I547-I652 HydrophobicContact CD1-CD1 4.09Å; I547-I652 HydrophobicContact CD1-CG1 4.49Å; I547-I652 HydrophobicContact CG1-CD1 4.33Å; I594-I652 HydrophobicContact CB-CG2 3.95Å; I594-I652 HydrophobicContact CD1-CG2 4.19Å; I594-I652 HydrophobicContact CG1-CG2 4.49Å; I594-I652 PolarHBondContact N-O 3.43Å; I594-I652 PolarHBondContact O-N 2.82Å; L596-I652 HydrophobicContact CD1-CB 4.16Å; L596-I652 HydrophobicContact CD2-CB 4.27Å; L596-I652 HydrophobicContact CD2-CG2 3.83Å; L596-I652 HydrophobicContact CG-CB 4.34Å; L596-I652 HydrophobicContact CG-CG2 4.19Å
653	T	93	Very high	72.3	Confident	9 Å²	9	71.1 Å²	71.1	6%	0.055	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.3	172.9	-52	0	0	0	0	109.1	V490 K491 R591 R592	V490-T653 HydrophobicContact CB-CG2 4.3Å; V490-T653 WeakPolarHBondContact CB-O 3.28Å; V490-T653 HydrophobicContact CG2-CG2 4.5Å; V490-T653 PolarHBondContact N-O 3.19Å; K491-T653 PolarHBondContact N-O 3.08Å; K491-T653 PolarHBondContact O-N 3.08Å; R591-T653 HydrophobicContact CG-CG2 4.31Å; R592-T653 WeakPolarHBondContact O-CA 3.22Å
654	A	93.4	Very high	73.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.9	174.8	0	0	0	0	0	111.2	K488 L545 R592 I594 F656	K488-A654 CarbonylContact O-C 3.56Å; K488-A654 WeakPolarHBondContact O-CA 3.45Å; L545-A654 HydrophobicContact CD2-CB 4.15Å; R592-A654 PolarHBondContact N-O 2.84Å; R592-A654 PolarHBondContact O-N 3.11Å; I594-A654 HydrophobicContact CD1-CB 4.42Å; A654-F656 HydrophobicContact CB-CE2 3.79Å; A654-F656 HydrophobicContact CB-CZ 3.87Å
655	E	93.1	Very high	73.3	Confident	28 Å²	28	70.3 Å²	70.3	13%	0.131	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	134.9	176.3	-64.6	153	-164.5	0	0	109	V487 K488 V490 T589 R591	V487-E655 CarbonylContact C-O 3.52Å; V487-E655 WeakPolarHBondContact CA-O 3.23Å; K488-E655 HydrophobicContact CB-CB 4.08Å; K488-E655 VanDerWaalsContact CD-OE2 3.31Å; K488-E655 WeakPolarHBondContact CD-OE2 3.48Å; K488-E655 PolarHBondContact N-O 2.99Å; K488-E655 PolarHBondContact O-N 3.32Å; V490-E655 HydrophobicContact CG2-CG 4.19Å; V490-E655 WeakPolarHBondContact CG2-OE1 3.05Å; T589-E655 HydrophobicContact CG2-CB 3.96Å; T589-E655 HydrophobicContact CG2-CG 4.4Å; R591-E655 HydrophobicContact CB-CG 3.86Å; R591-E655 HydrophobicContact CG-CG 3.73Å; R591-E655 IonicContact CZ-OE1 2.78Å; R591-E655 IonicContact NE-OE1 2.79Å; R591-E655 PolarHBondContact NE-OE1 3.4Å; R591-E655 IonicContact NH2-OE1 3.75Å; R591-E655 PolarHBondContact NH2-OE1 2.79Å
656	F	93	Very high	73.8	Confident	0 Å²	0	72 Å²	72	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.3	-175.5	-59.5	-92	0	0	0	109.7	L485 V487 I543 L545 L564 L569 I590 R592 I594 A654	L485-F656 HydrophobicContact CD1-CB 4.28Å; L485-F656 HydrophobicContact CD1-CD1 4.39Å; V487-F656 HydrophobicContact CG1-CD1 4.14Å; V487-F656 HydrophobicContact CG1-CE1 3.83Å; V487-F656 HydrophobicContact CG1-CZ 4.42Å; V487-F656 HydrophobicContact CG2-CD1 3.97Å; V487-F656 HydrophobicContact CG2-CE1 4.15Å; I543-F656 HydrophobicContact CD1-CE1 4.4Å; I543-F656 HydrophobicContact CG2-CE1 4.2Å; L545-F656 HydrophobicContact CD1-CZ 4.43Å; L564-F656 HydrophobicContact CD1-CE1 4.41Å; L564-F656 HydrophobicContact CD1-CE2 3.92Å; L564-F656 HydrophobicContact CD1-CZ 3.66Å; L569-F656 HydrophobicContact CD1-CB 4.01Å; L569-F656 HydrophobicContact CD1-CD1 3.7Å; L569-F656 HydrophobicContact CD1-CE1 4.32Å; L569-F656 HydrophobicContact CD1-CG 3.83Å; L569-F656 HydrophobicContact CD2-CB 4.23Å; L569-F656 HydrophobicContact CD2-CD1 4.42Å; L569-F656 HydrophobicContact CD2-CD2 3.8Å; L569-F656 HydrophobicContact CD2-CE2 4.28Å; L569-F656 HydrophobicContact CD2-CG 3.89Å; I590-F656 HydrophobicContact CB-CB 4.43Å; I590-F656 PolarHBondContact N-O 3.42Å; I590-F656 PolarHBondContact O-N 2.88Å; R592-F656 HydrophobicContact CB-CE2 4.3Å; R592-F656 HydrophobicContact CG-CD2 4.38Å; R592-F656 HydrophobicContact CG-CE2 4.39Å; I594-F656 HydrophobicContact CD1-CE2 4.19Å; I594-F656 HydrophobicContact CD1-CZ 4.11Å; A654-F656 HydrophobicContact CB-CE2 3.79Å; A654-F656 HydrophobicContact CB-CZ 3.87Å
657	N	90.2	Very high	73.7	Confident	33 Å²	33	79.1 Å²	79.1	18%	0.176	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.5	178.3	-99	-41.6	0	0	0	109.9	L486 S587 D588 T589	L486-N657 HydrophobicContact CB-CB 4.01Å; L486-N657 HydrophobicContact CD2-CB 4.43Å; L486-N657 PolarHBondContact N-O 3.35Å; L486-N657 PolarHBondContact O-N 3.39Å; S587-N657 PolarHBondContact O-OD1 2.84Å; D588-N657 PolarHBondContact O-OD1 3.49Å; T589-N657 VanDerWaalsContact CA-OD1 3.23Å; T589-N657 WeakPolarHBondContact CA-OD1 3.47Å; T589-N657 PolarHBondContact N-OD1 3.2Å; T589-N657 VanDerWaalsContact OG1-CG 3.29Å; T589-N657 PolarHBondContact OG1-ND2 2.79Å; T589-N657 PolarHBondContact OG1-OD1 3.05Å
658	F	89.5	Confident	73.1	Confident	10 Å²	10	75.9 Å²	75.9	4%	0.044	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.5	172	-71.7	-80.3	0	0	0	109.6	F480 K483 L485 L536 L569 L570 I586 I590	F480-F658 HydrophobicContact CD1-CE1 4.33Å; F480-F658 HydrophobicContact CE1-CD1 4.35Å; F480-F658 AromaticContact CE1-CE1 3.62Å; F480-F658 HydrophobicContact CE1-CE1 3.62Å; F480-F658 HydrophobicContact CE1-CZ 4.21Å; F480-F658 HydrophobicContact CZ-CE1 4.35Å; K483-F658 HydrophobicContact CD-CB 4.15Å; K483-F658 HydrophobicContact CD-CD1 4.49Å; L485-F658 HydrophobicContact CD1-CD1 4.11Å; L485-F658 HydrophobicContact CD1-CE1 3.91Å; L485-F658 HydrophobicContact CD1-CE2 4.46Å; L485-F658 HydrophobicContact CD1-CG 4.49Å; L485-F658 HydrophobicContact CD1-CZ 4.1Å; L536-F658 HydrophobicContact CD1-CD1 4.02Å; L536-F658 HydrophobicContact CD1-CE1 3.84Å; L569-F658 HydrophobicContact CB-CE2 3.8Å; L569-F658 HydrophobicContact CB-CZ 4.04Å; L569-F658 HydrophobicContact CD1-CZ 4.3Å; L570-F658 HydrophobicContact CD2-CD2 3.78Å; L570-F658 HydrophobicContact CD2-CE1 4.26Å; L570-F658 HydrophobicContact CD2-CE2 3.46Å; L570-F658 VanDerWaalsContact CD2-CE2 3.46Å; L570-F658 HydrophobicContact CD2-CG 4.3Å; L570-F658 HydrophobicContact CD2-CZ 3.72Å; L570-F658 HydrophobicContact CG-CE2 4.11Å; L570-F658 HydrophobicContact CG-CZ 4.1Å; I586-F658 HydrophobicContact CG2-CD2 4.3Å; I590-F658 HydrophobicContact CD1-CD2 4.32Å; I590-F658 HydrophobicContact CD1-CE2 4.3Å
659	M	85.4	Confident	71.9	Confident	94 Å²	94	82.2 Å²	82.2	46%	0.463	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.3	177.1	-61.7	177.1	69.2	0	0	109.8	K483 K484 L486 L533	K483-M659 CarbonylContact C-O 3.48Å; K483-M659 WeakPolarHBondContact CA-O 3.11Å; K483-M659 WeakPolarHBondContact CB-O 3.27Å; K484-M659 PolarHBondContact N-O 3.5Å; K484-M659 PolarHBondContact O-N 3.24Å; L486-M659 HydrophobicContact CB-CG 4.45Å; L486-M659 HydrophobicContact CB-SD 3.9Å; L486-M659 HydrophobicContact CD2-SD 3.99Å; L486-M659 HydrophobicContact CG-SD 4.47Å; L533-M659 HydrophobicContact CD1-SD 4.26Å
660	E	85.6	Confident	69.8	Low	162 Å²	162	81.6 Å²	81.6	76%	0.757	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	142.9	167.8	-172.5	158.2	-138.7	0	0	110.2	A662	E660-A662 PolarHBondContact O-N 3.05Å
661	K	81.8	Confident	67	Low	55 Å²	55	85.5 Å²	85.5	24%	0.239	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-73	124.6	169.1	-72.4	-178	-168.7	176.3	0	108.3	A481 S482 K483 K484 D535 L536 T663	A481-K661 WeakPolarHBondContact O-CD 3.37Å; A481-K661 VanDerWaalsContact O-CE 3.29Å; A481-K661 WeakPolarHBondContact O-CE 3.43Å; A481-K661 PolarHBondContact O-NZ 3.34Å; S482-K661 PolarHBondContact O-N 3.04Å; K483-K661 WeakPolarHBondContact O-CE 3.48Å; K484-K661 HydrophobicContact CG-CD 4.5Å; K484-K661 HydrophobicContact CG-CG 3.65Å; D535-K661 WeakPolarHBondContact OD1-CE 3.43Å; D535-K661 IonicContact OD1-NZ 3.86Å; L536-K661 PolarHBondContact O-NZ 3.38Å; K661-T663 PolarHBondContact O-N 2.97Å
662	A	71.2	Confident	64.4	Low	93 Å²	93	91 Å²	91	77%	0.769	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-53.8	123.5	165.5	0	0	0	0	0	108.9	E660 E664	E660-A662 PolarHBondContact O-N 3.05Å; A662-E664 PolarHBondContact O-N 3.26Å; A662-E664 VanDerWaalsContact O-N 3.14Å
663	T	57.3	Low	61.6	Low	119 Å²	119	96.3 Å²	96.3	73%	0.73	53%	0.528	S	S	*	.			trans	-69.7	110.3	175.5	33.4	0	0	0	0	109.3	K661 D665	K661-T663 PolarHBondContact O-N 2.97Å; T663-D665 PolarHBondContact O-N 2.99Å
664	E	47.3	Very low	58.8	Low	161 Å²	161	101.8 Å²	101.8	75%	0.752	57%	0.566	S	S	*	*			trans	-72.4	56.7	165.3	-73	-161.3	128.5	0	0	111.2	A662 F666	A662-E664 PolarHBondContact O-N 3.26Å; A662-E664 VanDerWaalsContact O-N 3.14Å; E664-F666 HydrophobicContact CB-CD2 3.96Å; E664-F666 HydrophobicContact CG-CD2 4.07Å; E664-F666 HydrophobicContact CG-CE2 4.14Å; E664-F666 PolarHBondContact O-N 2.95Å; E664-F666 WeakPolarHBondContact OE1-CE2 3.39Å
665	D	37.1	Very low	56	Low	140 Å²	140	106.3 Å²	106.3	75%	0.749	60%	0.598	S	S	*	*			trans	-71	62.4	162.1	-80.9	-53.7	0	0	0	109	T663 R667	T663-D665 PolarHBondContact O-N 2.99Å; D665-R667 PolarHBondContact O-N 2.93Å
666	F	41.1	Very low	53.1	Low	165 Å²	165	112.8 Å²	112.8	72%	0.724	63%	0.628	S	S	*	*			trans	-72.3	70.3	178.2	-97.8	-68	0	0	0	111.3	E664 A668	E664-F666 HydrophobicContact CB-CD2 3.96Å; E664-F666 HydrophobicContact CG-CD2 4.07Å; E664-F666 HydrophobicContact CG-CE2 4.14Å; E664-F666 PolarHBondContact O-N 2.95Å; E664-F666 WeakPolarHBondContact OE1-CE2 3.39Å; F666-A668 PolarHBondContact O-N 2.66Å; F666-A668 VanDerWaalsContact O-N 3.08Å
667	R	35.5	Very low	50.5	Low	217 Å²	217	119.7 Å²	119.7	82%	0.819	66%	0.664	S	S	*	*			trans	55.6	47.5	135.4	-163.1	178.8	-91.2	177	-7.1	114.1	D665 R669	D665-R667 PolarHBondContact O-N 2.93Å; R667-R669 PolarHBondContact O-N 2.67Å
668	A	33.2	Very low	47.6	Very low	104 Å²	104	127.4 Å²	127.4	86%	0.86	69%	0.69	S	S	*	*			trans	-62.3	84.5	155.6	0	0	0	0	0	108.7	F666 A670	F666-A668 PolarHBondContact O-N 2.66Å; F666-A668 VanDerWaalsContact O-N 3.08Å; A668-A670 PolarHBondContact O-N 2.81Å
669	R	34.7	Very low	44.9	Very low	207 Å²	207	136 Å²	136	78%	0.781	73%	0.728	S	S	*	*			trans	-63.1	98	-164.5	-170.2	-175.5	-155.4	154.3	5.7	111.6	R667 S671	R667-R669 PolarHBondContact O-N 2.67Å; R669-S671 PolarHBondContact O-N 3.34Å; R669-S671 PolarHBondContact O-OG 3.07Å
670	A	32.7	Very low	42.4	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	74%	0.741	S	S	*	*			trans	-49.7	113.2	164.3	0	0	0	0	0	108.3	A668 P672	A668-A670 PolarHBondContact O-N 2.81Å; A670-P672 WeakPolarHBondContact O-CD 3.43Å
671	S	29.6	Very low	39.7	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	74%	0.743	S	S	*	*			trans	-104.7	106	-169.4	-69.6	0	0	0	0	109.3	R669 S673	R669-S671 PolarHBondContact O-N 3.34Å; R669-S671 PolarHBondContact O-OG 3.07Å; S671-S673 PolarHBondContact O-N 3.08Å
672	P	34.9	Very low	37.2	Very low	124 Å²	124	143.3 Å²	143.3	81%	0.805	78%	0.775	S	S	*	*			trans	-92.1	92.2	-171	34.4	-32.4	0	0	0	111.3	A670	A670-P672 WeakPolarHBondContact O-CD 3.43Å
673	S	34.4	Very low	35.3	Very low	110 Å²	110	144.5 Å²	144.5	77%	0.769	77%	0.774	S	S	*	*			trans	176.9	151.2	150.7	52.9	0	0	0	0	112.5	S671	S671-S673 PolarHBondContact O-N 3.08Å
674	S	33.1	Very low	34.2	Very low	124 Å²	124	145.6 Å²	145.6	87%	0.867	78%	0.78	S	S	*	*			trans	68	139	169.2	-148.1	0	0	0	0	116.1
675	S	34.4	Very low	33.5	Very low	96 Å²	96	147 Å²	147	67%	0.671	79%	0.786	S	S	*	*			cis	-129.3	149.4	9.6	48	0	0	0	0	112.3
676	Q	33.6	Very low	33.3	Very low	164 Å²	164	145.6 Å²	145.6	77%	0.766	79%	0.788	S	S	*	*			trans	-75.4	128.5	168.1	-67.2	177.1	-13.2	0	0	109.4
677	I	37.1	Very low	33.2	Very low	144 Å²	144	143 Å²	143	74%	0.738	79%	0.788	S	S	*	*			trans	-117.2	103.6	154.9	-62.8	-176.4	0	0	0	107.5	F679	I677-F679 HydrophobicContact CG2-CD2 3.83Å; I677-F679 HydrophobicContact CG2-CE2 3.88Å
678	R	29.5	Very low	33.1	Very low	196 Å²	196	137.4 Å²	137.4	74%	0.74	78%	0.782	S	S	*	*			trans	-93.4	112.5	179.9	179.5	-164.7	-64	171.4	-0.6	108.6
679	F	34.5	Very low	33.3	Very low	190 Å²	190	139.8 Å²	139.8	83%	0.833	78%	0.778	S	S	*	*			trans	-116.4	145.5	161.3	-84.9	-73.4	0	0	0	110.7	I677	I677-F679 HydrophobicContact CG2-CD2 3.83Å; I677-F679 HydrophobicContact CG2-CE2 3.88Å
680	S	31.8	Very low	33.3	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	78%	0.777	S	S	*	*			trans	-98.6	155.6	-151.3	-58.3	0	0	0	0	114.5
681	S	28.9	Very low	33.3	Very low	113 Å²	113	139.5 Å²	139.5	79%	0.79	77%	0.773	S	S	*	*			trans	-53.6	150.9	173.2	44.3	0	0	0	0	115.7
682	R	30.3	Very low	33.6	Very low	246 Å²	246	139.7 Å²	139.7	93%	0.928	77%	0.773	S	S	*	*			trans	-143	141.9	136.2	-176	164.3	-80.6	-138.8	-2.4	110.2
683	T	30.2	Very low	33.5	Very low	119 Å²	119	139.4 Å²	139.4	73%	0.73	76%	0.764	S	S	*	*			trans	-116.5	148.5	-171.1	36.1	0	0	0	0	112.5
684	T	34.8	Very low	33.5	Very low	142 Å²	142	141.4 Å²	141.4	87%	0.871	76%	0.762	S	S	*	*			trans	-176.7	118	153.7	35.9	0	0	0	0	105.9
685	Q	32.2	Very low	33.5	Very low	189 Å²	189	140.6 Å²	140.6	88%	0.883	75%	0.748	S	S	*	*			cis	82.6	107.4	21.3	-159.7	-168.2	54.2	0	0	116.4
686	S	33.7	Very low	33.6	Very low	112 Å²	112	144.3 Å²	144.3	78%	0.783	75%	0.754	S	S	*	*			trans	-174	164.9	147.9	61.5	0	0	0	0	108.6
687	P	38.7	Very low	33.3	Very low	111 Å²	111	145.4 Å²	145.4	72%	0.721	76%	0.759	S	S	*	*			cis	-124.2	175.5	-7.6	41.2	-27	0	0	0	114.3
688	S	33.5	Very low	33.2	Very low	98 Å²	98	143.8 Å²	143.8	69%	0.685	76%	0.758	S	S	*	*			trans	35.9	143.4	142.1	64.1	0	0	0	0	123
689	I	35.5	Very low	33.4	Very low	154 Å²	154	139.7 Å²	139.7	79%	0.79	76%	0.755	S	S	*	*			cis	-162.9	153.3	-1.2	-114.6	163.9	0	0	0	108.8
690	H	34.8	Very low	33.2	Very low	164 Å²	164	138 Å²	138	76%	0.759	75%	0.754	S	S	*	*			trans	58.5	112.8	172.6	-107.1	-113.4	0	0	0	117.7
691	N	33	Very low	33.4	Very low	132 Å²	132	140.9 Å²	140.9	71%	0.706	76%	0.756	S	S	*	*				77.2	143	74.6	-107.9	13.1	0	0	0	114.2
692	P	36.1	Very low	33.5	Very low	101 Å²	101	140.2 Å²	140.2	66%	0.656	75%	0.75	S	S	*	*				-134.9	-119.9	-128.5	37.5	-14	0	0	0	110.9
693	N	33.9	Very low	33.6	Very low	118 Å²	118	134 Å²	134	63%	0.631	74%	0.743	S	S	*	*			trans	75.3	120.5	176.7	-64.1	12.4	0	0	0	113.5
694	Q	33.1	Very low	33.6	Very low	152 Å²	152	132 Å²	132	71%	0.71	74%	0.739	S	S	*	*				80.5	136.6	105.1	-68	-176.1	-87	0	0	112.8
695	D	34.4	Very low	33.4	Very low	107 Å²	107	134.2 Å²	134.2	57%	0.572	74%	0.737	S	S	*	*			cis	-157	-174.1	-7.6	-102.1	-34.1	0	0	0	107.8
696	H	35.5	Very low	33.2	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.806	73%	0.729	S	S	*	*			trans	71.7	105.7	156.6	-54.1	-50.1	0	0	0	120.1
697	Q	27.7	Very low	33.3	Very low	187 Å²	187	133 Å²	133	87%	0.874	73%	0.73	S	S	*	*				-61.2	166.3	129.6	-71.1	-178.4	-41.6	0	0	110.4
698	P	36	Very low	32.9	Very low	110 Å²	110	133.2 Å²	133.2	71%	0.714	73%	0.734	S	S	*	*			cis	-131	-167.6	6.9	42.5	-26.6	0	0	0	113.2
699	T	33	Very low	32.9	Very low	110 Å²	110	133 Å²	133	68%	0.675	74%	0.738	S	S	*	*				177	133.1	121.8	-69.2	0	0	0	0	110
700	D	30	Very low	32.8	Very low	154 Å²	154	130.7 Å²	130.7	82%	0.824	74%	0.736	S	S	*	*			trans	-83.2	128	-178.8	-65.9	-73.3	0	0	0	114
701	H	35.5	Very low	32.7	Very low	165 Å²	165	127.9 Å²	127.9	76%	0.764	73%	0.734	S	S	*	*			trans	-151.7	141.4	164.5	-73.1	-60.2	0	0	0	107.9
702	C	32.3	Very low	32.7	Very low	100 Å²	100	127.6 Å²	127.6	68%	0.676	73%	0.729	S	S	*	*			cis	-160.8	155.5	-2.5	-111.8	0	0	0	0	110.4
703	C	32.2	Very low	32.6	Very low	116 Å²	116	131.9 Å²	131.9	78%	0.784	74%	0.738	S	S	*	*			trans	63.1	131.5	164.8	-55.2	0	0	0	0	117.2
704	A	29.8	Very low	32.5	Very low	77 Å²	77	130.6 Å²	130.6	64%	0.636	74%	0.735	S	S	*	*			cis	65.1	132.5	47.7	0	0	0	0	0	112.6
705	F	31.1	Very low	32.5	Very low	187 Å²	187	129.6 Å²	129.6	82%	0.82	74%	0.735	S	S	*	*			cis	-138.5	171.4	30.1	-85.6	-98.9	0	0	0	114.7
706	S	27.7	Very low	32.5	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	75%	0.747	S	S	*	*			trans	-128.9	137.9	179.6	-49.4	0	0	0	0	113
707	H	35.5	Very low	32.3	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.796	75%	0.746	S	S	*	*			trans	-147.3	124.3	157.3	-62.6	-69.4	0	0	0	106.2
708	S	30.5	Very low	32.3	Very low	115 Å²	115	126 Å²	126	80%	0.804	74%	0.742	S	S	*	*				63.2	125.3	60.2	-52.9	0	0	0	0	111
709	A	33	Very low	32.2	Very low	94 Å²	94	126.8 Å²	126.8	78%	0.777	75%	0.745	S	S	*	*			cis	-164.5	173.8	36.3	0	0	0	0	0	110
710	S	33.9	Very low	31.9	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	75%	0.752	S	S	*	*			cis	-171.5	163.1	-17.2	-93.8	0	0	0	0	110.5
711	S	32	Very low	31.9	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	76%	0.757	S	S	*	*			trans	64.6	139.4	158.1	-66.7	0	0	0	0	119
712	E	33.4	Very low	31.6	Very low	126 Å²	126	129 Å²	129	59%	0.589	75%	0.753	S	S	*	*			cis	-161.8	174.6	-5.1	-105.7	-51.3	82.4	0	0	107.2	P714	E712-P714 WeakPolarHBondContact OE2-CD 3.33Å
713	F	34.1	Very low	31.6	Very low	192 Å²	192	132.5 Å²	132.5	84%	0.842	76%	0.759	S	S	*	*			cis	-135.2	150.4	10.1	-63.2	-90.1	0	0	0	111.9
714	P	32.8	Very low	31.7	Very low	90 Å²	90	133.4 Å²	133.4	58%	0.584	76%	0.756	S	S	*	*			trans	-110.7	178.9	174.2	39.7	-32.8	0	0	0	115.2	E712	E712-P714 WeakPolarHBondContact OE2-CD 3.33Å
715	N	31.7	Very low	31.9	Very low	132 Å²	132	138.1 Å²	138.1	71%	0.706	76%	0.762	S	S	*	*			trans	84.1	95.3	166.5	-71.6	-63	0	0	0	121
716	A	34.4	Very low	31.9	Very low	100 Å²	100	135.5 Å²	135.5	83%	0.826	76%	0.757	S	S	*	*				-166.7	93.7	122.9	0	0	0	0	0	108.5
717	K	32.3	Very low	32.1	Very low	179 Å²	179	137.6 Å²	137.6	78%	0.778	76%	0.758	S	S	*	*				61.6	114.7	79.7	-73.3	-168.7	176.7	179.7	0	116.2
718	S	28.2	Very low	31.9	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	76%	0.759	S	S	*	*			trans	72.2	147.5	156.8	-130.5	0	0	0	0	117.1
719	T	33.2	Very low	31.9	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	76%	0.758	S	S	*	*			cis	-143.6	153.7	2.6	-37.8	0	0	0	0	110.7
720	F	26.8	Very low	31.8	Very low	188 Å²	188	142.2 Å²	142.2	83%	0.825	76%	0.76	S	S	*	*			trans	-72.6	147.2	166.7	-75.2	-107.4	0	0	0	111.5
721	L	30	Very low	31.8	Very low	175 Å²	175	144 Å²	144	92%	0.916	76%	0.76	S	S	*	*			trans	-148.4	136.9	138.5	-161.3	65.4	0	0	0	111.3
722	T	28.7	Very low	31.7	Very low	112 Å²	112	147.3 Å²	147.3	69%	0.687	77%	0.766	S	S	*	*			trans	-130.5	112.9	-179.3	49.1	0	0	0	0	110.3
723	H	32.7	Very low	31.5	Very low	173 Å²	173	149.9 Å²	149.9	80%	0.801	78%	0.778	S	S	*	*			trans	176.2	158.2	154.3	-110.3	-123.1	0	0	0	106.6
724	N	33.1	Very low	31.3	Very low	136 Å²	136	145.6 Å²	145.6	73%	0.727	77%	0.772	S	S	*	*			cis	-139.9	172.7	3.6	-154	-11.3	0	0	0	110.6
725	K	34.2	Very low	31.2	Very low	175 Å²	175	147.3 Å²	147.3	76%	0.761	78%	0.781	S	S	*	*			trans	-101.8	162.6	170.3	-83.6	-176	177.1	176.3	0	111.7
726	N	31.6	Very low	31.3	Very low	132 Å²	132	145.8 Å²	145.8	71%	0.706	78%	0.775	S	S	*	*			trans	78.4	136.3	144.6	-97.8	27.6	0	0	0	119.7
727	I	32	Very low	31.3	Very low	148 Å²	148	148 Å²	148	76%	0.759	77%	0.769	S	S	*	*			trans	72.4	131.6	155.7	-55.2	154.3	0	0	0	112.4
728	T	31.3	Very low	31.3	Very low	131 Å²	131	147.1 Å²	147.1	80%	0.804	77%	0.767	S	S	*	*			cis	-138.2	166.9	20.3	-28.8	0	0	0	0	111.3
729	E	30.1	Very low	31.6	Very low	168 Å²	168	148.2 Å²	148.2	79%	0.785	76%	0.763	S	S	*	*			trans	-74	162.6	156	-62.9	179.2	135.2	0	0	111.4
730	H	30.6	Very low	31.6	Very low	179 Å²	179	150.1 Å²	150.1	83%	0.829	76%	0.763	S	S	*	*			trans	70.6	149.8	164.4	-95.5	-89.9	0	0	0	119.6
731	I	34.1	Very low	31.9	Very low	143 Å²	143	146.2 Å²	146.2	73%	0.733	75%	0.754	S	S	*	*			trans	84.7	109.7	165.1	-61.6	158.2	0	0	0	117.5
732	M	29.5	Very low	32.1	Very low	174 Å²	174	144.8 Å²	144.8	86%	0.857	75%	0.748	S	S	*	*			trans	63.4	111.1	149.9	-69	170.1	172.8	0	0	121
733	Q	30.5	Very low	32.4	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	76%	0.755	S	S	*	*				19.1	145.4	113.8	-136.9	80.1	3.8	0	0	119.5
734	S	30.2	Very low	32.7	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	76%	0.755	S	S	*	*			trans	106.1	122.7	146.6	-143.6	0	0	0	0	117.4
735	V	30.3	Very low	32.8	Very low	127 Å²	127	143.2 Å²	143.2	77%	0.77	76%	0.763	S	S	*	*				66.8	133	129.2	158.4	0	0	0	0	118.6
736	V	34.7	Very low	32.9	Very low	99 Å²	99	143 Å²	143	60%	0.6	77%	0.765	S	S	*	*			cis	-178	170.9	-1.6	70.7	0	0	0	0	110.7
737	E	32.7	Very low	33.1	Very low	148 Å²	148	141.7 Å²	141.7	69%	0.692	76%	0.761	S	S	*	*			trans	63.6	158	151.2	-71.3	168.6	-145.7	0	0	121
738	H	32.7	Very low	33.2	Very low	160 Å²	160	140.7 Å²	140.7	74%	0.741	76%	0.758	S	S	*	*			cis	-161.2	-171.1	-13.9	-119.3	-13.7	0	0	0	111
739	I	34.1	Very low	33.2	Very low	135 Å²	135	140.4 Å²	140.4	69%	0.692	75%	0.751	S	S	*	*			trans	121.1	98.2	140.5	-59.4	-170.5	0	0	0	116.4
740	Q	33.8	Very low	33.2	Very low	168 Å²	168	139.2 Å²	139.2	79%	0.785	75%	0.749	S	S	*	*			trans	64.4	153.6	140.1	-66.6	178.2	-46.3	0	0	120
741	T	32.4	Very low	33.1	Very low	105 Å²	105	135.1 Å²	135.1	64%	0.644	74%	0.741	S	S	*	*			cis	-152	164.4	8.6	-11.7	0	0	0	0	111.6
742	D	34.4	Very low	33.1	Very low	146 Å²	146	134.5 Å²	134.5	78%	0.781	74%	0.744	S	S	*	*			trans	64	144.9	157.6	-61.2	-19.9	0	0	0	120.1
743	S	36	Very low	33.1	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	74%	0.74	S	S	*	*			cis	-163.6	152.6	-17.3	52.2	0	0	0	0	110.2
744	G	39.2	Very low	33.2	Very low	78 Å²	78	131.1 Å²	131.1	80%	0.804	74%	0.735	S	S	*	*			trans	135	82.7	168	0	0	0	0	0	116.5
745	E	35.7	Very low	33.3	Very low	191 Å²	191	131.8 Å²	131.8	89%	0.893	73%	0.731	S	S	*	*			trans	-77.4	169.1	158.3	-62.2	171.4	119.9	0	0	108.4
746	E	36.1	Very low	33.6	Very low	171 Å²	171	130.6 Å²	130.6	80%	0.799	73%	0.729	S	S	*	*			cis	-162.9	154.5	48.7	-119	-178.1	153.1	0	0	112
747	T	34.6	Very low	33.4	Very low	104 Å²	104	132.9 Å²	132.9	64%	0.638	74%	0.738	S	S	*	*			trans	11.4	151.8	136.7	61.9	0	0	0	0	120.8
748	D	34.5	Very low	33.5	Very low	127 Å²	127	131.5 Å²	131.5	68%	0.679	74%	0.739	S	S	*	*			cis	-167.3	158.1	9.7	-127.4	10.3	0	0	0	115.2
749	N	30.9	Very low	33.4	Very low	124 Å²	124	129.6 Å²	129.6	66%	0.663	74%	0.738	S	S	*	*			trans	41.1	143	137.3	-72.8	-42.7	0	0	0	125.8
750	L	31.6	Very low	33.3	Very low	144 Å²	144	133.1 Å²	133.1	75%	0.754	74%	0.743	S	S	*	*			trans	79.2	86.6	141.1	-106	66.6	0	0	0	123.6
751	S	27.2	Very low	33.3	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	74%	0.74	S	S	*	*				77.3	164.9	112.2	79.4	0	0	0	0	123.7
752	T	33.5	Very low	33.1	Very low	129 Å²	129	133.4 Å²	133.4	79%	0.791	75%	0.746	S	S	*	*			trans	71.3	90.9	163.3	56.7	0	0	0	0	120.6
753	S	29.5	Very low	33.1	Very low	112 Å²	112	131.3 Å²	131.3	78%	0.783	74%	0.743	S	S	*	*				-3.2	127.6	127.5	178.6	0	0	0	0	118.1
754	K	32.8	Very low	33	Very low	172 Å²	172	133.9 Å²	133.9	75%	0.748	74%	0.739	S	S	*	*				-172.7	146.3	115.8	-108.5	174.4	167.2	-92.5	0	117.1
755	D	32.2	Very low	32.5	Very low	116 Å²	116	135.3 Å²	135.3	62%	0.62	73%	0.729	S	S	*	*			trans	48.7	137	140.8	-60.9	-29.5	0	0	0	124.8
756	S	37.7	Very low	32.4	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	72%	0.722	S	S	*	*			trans	80.2	112.7	138.7	62.4	0	0	0	0	122
757	D	31	Very low	32.1	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	72%	0.719	S	S	*	*				22.7	137.7	119.8	-59.1	-56.7	0	0	0	120.5
758	V	33.1	Very low	32	Very low	118 Å²	118	131.8 Å²	131.8	72%	0.715	73%	0.727	S	S	*	*				-173.6	117.6	98.8	149.5	0	0	0	0	113
759	V	30.4	Very low	31.8	Very low	121 Å²	121	133.2 Å²	133.2	73%	0.733	73%	0.729	S	S	*	*			trans	-7.6	131.8	149.5	-178.4	0	0	0	0	118
760	R	32.6	Very low	31.9	Very low	208 Å²	208	135.1 Å²	135.1	79%	0.785	74%	0.738	S	S	*	*			trans	-151.6	106.4	141.4	-154.3	159.7	-75.3	123.6	-2.6	115.7
761	K	33.5	Very low	31.8	Very low	169 Å²	169	135.6 Å²	135.6	74%	0.735	73%	0.734	S	S	*	*			trans	43.1	121.3	142.9	-57.1	178.6	-178.9	-177.2	0	119.2
762	S	29.1	Very low	32.1	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	74%	0.74	S	S	*	*			cis	66.8	120.1	47.8	85.2	0	0	0	0	115.9
763	S	34	Very low	32	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	73%	0.731	S	S	*	*			trans	179.4	115.5	146.2	175.4	0	0	0	0	114.3
764	K	32.8	Very low	32.1	Very low	173 Å²	173	137.3 Å²	137.3	75%	0.752	73%	0.728	S	S	*	*			trans	63.3	163.7	139.6	-66.7	-168.3	159.1	-92.7	0	121.2
765	D	29	Very low	32	Very low	109 Å²	109	135.4 Å²	135.4	58%	0.583	73%	0.725	S	S	*	*			cis	-169.6	176.5	-32.2	-98.7	-10.4	0	0	0	108.2
766	T	33.8	Very low	31.9	Very low	124 Å²	124	135.5 Å²	135.5	76%	0.761	72%	0.724	S	S	*	*			trans	71.3	120.2	168.3	63.5	0	0	0	0	116.2
767	T	30.1	Very low	31.6	Very low	117 Å²	117	138.8 Å²	138.8	72%	0.718	73%	0.726	S	S	*	*			cis	87.4	116.7	32	71.6	0	0	0	0	115.9
768	N	33.5	Very low	31.5	Very low	151 Å²	151	137.7 Å²	137.7	81%	0.807	73%	0.725	S	S	*	*			trans	171.5	108.3	138.4	-80.8	-15.3	0	0	0	105.8
769	E	28.5	Very low	31.5	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	73%	0.726	S	S	*	*				41.2	118.8	89.5	-63.2	-144.3	130.2	0	0	112.9
770	I	34.2	Very low	31.5	Very low	164 Å²	164	136.7 Å²	136.7	84%	0.841	73%	0.728	S	S	*	*				-150.9	128.2	73	-75.7	143.4	0	0	0	107.4
771	K	29.8	Very low	31.4	Very low	154 Å²	154	134.1 Å²	134.1	67%	0.67	73%	0.729	S	S	*	*				79.3	105.2	50	-164.9	176.9	-170.1	170.7	0	114.8
772	V	33.3	Very low	31.3	Very low	130 Å²	130	132.1 Å²	132.1	79%	0.788	74%	0.737	S	S	*	*				175.7	111.9	129.6	149.6	0	0	0	0	105.1
773	S	30.1	Very low	31.3	Very low	86 Å²	86	132.2 Å²	132.2	60%	0.601	74%	0.737	S	S	*	*				67.6	134.8	72.8	-67.7	0	0	0	0	112.3
774	E	31.5	Very low	31.5	Very low	155 Å²	155	132.7 Å²	132.7	72%	0.724	74%	0.738	S	S	*	*			cis	-167.5	155.4	11.8	-129	-177.4	160.2	0	0	112.7
775	I	31.2	Very low	31.5	Very low	131 Å²	131	132.9 Å²	132.9	67%	0.672	75%	0.745	S	S	*	*			trans	65	141.6	138.6	-83.6	177	0	0	0	120.3
776	L	31.4	Very low	31.4	Very low	118 Å²	118	132.5 Å²	132.5	62%	0.618	75%	0.751	S	S	*	*			cis	-155.6	146.7	1.1	-101.3	172.1	0	0	0	112.2
777	K	31.4	Very low	31.3	Very low	171 Å²	171	131.6 Å²	131.6	74%	0.743	75%	0.749	S	S	*	*			trans	42.4	151.2	137.4	-75.1	179.5	-163.3	159.8	0	123.9
778	T	29	Very low	31.3	Very low	125 Å²	125	137 Å²	137	77%	0.767	76%	0.756	S	S	*	*			cis	-174.9	129.6	-30.5	22.4	0	0	0	0	109.5
779	G	31.2	Very low	31	Very low	71 Å²	71	141 Å²	141	73%	0.732	76%	0.759	S	S	*	*			trans	70.6	172.4	156.3	0	0	0	0	0	118
780	N	31	Very low	31.2	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	77%	0.765	S	S	*	*			cis	-161.2	144.5	-13.2	-127.6	-0.1	0	0	0	111.7
781	L	30.6	Very low	31	Very low	153 Å²	153	137.3 Å²	137.3	80%	0.801	76%	0.756	S	S	*	*			trans	41.8	107.7	152.9	-57.4	171.9	0	0	0	120.1
782	S	32.2	Very low	30.9	Very low	128 Å²	128	139.2 Å²	139.2	90%	0.895	76%	0.76	S	S	*	*				166.5	160.3	112.9	50.8	0	0	0	0	113.3
783	S	29.2	Very low	30.6	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	76%	0.757	S	S	*	*			trans	-133.1	174.1	-176.6	60.5	0	0	0	0	110.2
784	P	37.2	Very low	30.5	Very low	112 Å²	112	142.6 Å²	142.6	73%	0.727	76%	0.762	S	S	*	*			cis	-128.2	167.7	-40.9	36.1	-23.1	0	0	0	111.8
785	I	33.2	Very low	30.4	Very low	177 Å²	177	142.6 Å²	142.6	91%	0.908	76%	0.761	S	S	*	*			trans	-161.5	156	154.3	-108.6	149.4	0	0	0	111.9
786	S	27.9	Very low	30.3	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	76%	0.757	S	S	*	*			trans	-77.6	137.6	-175.6	176.4	0	0	0	0	114.3
787	C	29.8	Very low	30.5	Very low	105 Å²	105	143.1 Å²	143.1	71%	0.709	77%	0.768	S	S	*	*				179.9	135.4	117.2	-100	0	0	0	0	116.1
788	R	31.2	Very low	30.5	Very low	231 Å²	231	145.2 Å²	145.2	87%	0.872	77%	0.771	S	S	*	*			trans	48.5	107.9	141.8	-62.6	-176.4	174.8	-163.5	-2.6	121.9
789	R	27.5	Very low	30.5	Very low	234 Å²	234	143.7 Å²	143.7	88%	0.883	77%	0.765	S	S	*	*				44.8	103.6	118.6	-164.9	-172.6	-142.3	-178	7.5	118.7
790	A	32	Very low	30.7	Very low	102 Å²	102	147.3 Å²	147.3	84%	0.843	77%	0.766	S	S	*	*			trans	-127.4	174.4	148.1	0	0	0	0	0	109.3
791	H	30.6	Very low	30.8	Very low	141 Å²	141	146.5 Å²	146.5	65%	0.653	76%	0.762	S	S	*	*			trans	-117.6	158.5	-167.6	-122.4	-104.7	0	0	0	113.3
792	Y	27.5	Very low	31	Very low	194 Å²	194	147 Å²	147	76%	0.761	76%	0.76	S	S	*	*			trans	77.9	143.2	153.4	-82.1	-57.2	0	0	0	123
793	E	27.8	Very low	31.1	Very low	153 Å²	153	148.2 Å²	148.2	72%	0.715	75%	0.752	S	S	*	*			trans	77.8	91.1	145.9	-70.9	178.4	-175.8	0	0	122.9
794	L	27.9	Very low	31.3	Very low	134 Å²	134	149.9 Å²	149.9	70%	0.702	75%	0.747	S	S	*	*				88.6	155.6	106.4	-83.7	174.6	0	0	0	122.8
795	H	29.6	Very low	30.8	Very low	156 Å²	156	151.5 Å²	151.5	72%	0.722	75%	0.749	S	S	*	*			trans	82.6	101.1	148.5	-83.5	-54.3	0	0	0	122.5
796	T	27.8	Very low	30.7	Very low	93 Å²	93	149 Å²	149	57%	0.571	75%	0.747	S	S	*	*				117.7	114.3	109.3	-66.7	0	0	0	0	118.7	R798	T796-R798 HydrophobicContact CG2-CG 3.9Å
797	I	35.6	Very low	30.8	Very low	167 Å²	167	152 Å²	152	86%	0.856	75%	0.753	S	S	*	*				-137.6	103.2	129.7	-49.9	-179.2	0	0	0	103.8
798	R	31.7	Very low	30.9	Very low	215 Å²	215	152 Å²	152	81%	0.811	75%	0.752	S	S	*	*				55.5	135	86.6	-82.9	-166.8	169.5	175.6	-3.9	113.9	T796	T796-R798 HydrophobicContact CG2-CG 3.9Å
799	S	28.6	Very low	30.7	Very low	92 Å²	92	146 Å²	146	64%	0.643	75%	0.746	S	S	*	*			cis	-173.1	179.3	-6.4	38.1	0	0	0	0	109.4
800	I	35.7	Very low	30.8	Very low	147 Å²	147	140.3 Å²	140.3	75%	0.754	74%	0.742	S	S	*	*			trans	85.6	125.4	167.8	-53.1	169.5	0	0	0	114.7
801	D	32.9	Very low	31	Very low	130 Å²	130	140.8 Å²	140.8	70%	0.695	74%	0.736	S	S	*	*			cis	-172.7	156.9	-21.8	-101.8	-15.3	0	0	0	109.5
802	E	34.5	Very low	30.8	Very low	163 Å²	163	141.1 Å²	141.1	76%	0.762	74%	0.742	S	S	*	*			trans	55.5	151.5	159.6	-52.6	-68.3	65.9	0	0	119.2
803	E	34.9	Very low	30.9	Very low	154 Å²	154	138.2 Å²	138.2	72%	0.72	74%	0.738	S	S	*	*			cis	-155	-175.3	-5.5	-126	-167.9	141.8	0	0	112.4
804	H	33.2	Very low	31	Very low	146 Å²	146	140.3 Å²	140.3	68%	0.676	74%	0.741	S	S	*	*			trans	-53.4	151	-161.5	-69.9	-73	0	0	0	125.2
805	L	27.7	Very low	31.2	Very low	147 Å²	147	139.8 Å²	139.8	77%	0.77	74%	0.739	S	S	*	*			trans	12.9	131.8	143.9	-69.3	79.4	0	0	0	121
806	S	30	Very low	31.5	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	74%	0.738	S	S	*	*				177.2	165.8	98.4	46.4	0	0	0	0	114.6
807	I	30.7	Very low	31.9	Very low	165 Å²	165	138.1 Å²	138.1	85%	0.846	74%	0.74	S	S	*	*			trans	-102.6	132.9	179.6	-63.3	163.9	0	0	0	106.4
808	P	32.3	Very low	31.8	Very low	105 Å²	105	138.5 Å²	138.5	68%	0.682	74%	0.735	S	S	*	*				-157.3	175	73.6	42.6	-21.6	0	0	0	119.1
809	S	26	Very low	32	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	74%	0.736	S	S	*	*			trans	43.3	137	146.1	59.2	0	0	0	0	123
810	S	30.8	Very low	32.3	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	74%	0.739	S	S	*	*			trans	-40.8	146.9	159.4	-36.8	0	0	0	0	113.3
811	P	34.5	Very low	32.5	Very low	113 Å²	113	137.6 Å²	137.6	73%	0.734	74%	0.742	S	S	*	*				-151.4	176.1	60.1	43.6	-24.3	0	0	0	118.4
812	L	28	Very low	32.6	Very low	148 Å²	148	137.4 Å²	137.4	78%	0.775	75%	0.746	S	S	*	*			trans	22.7	134.1	141.4	-64.5	173.7	0	0	0	122.9
813	I	28.8	Very low	32.7	Very low	132 Å²	132	134.9 Å²	134.9	68%	0.677	75%	0.746	S	S	*	*				92.7	110	126.8	-75.9	173.8	0	0	0	121.5
814	Y	31	Very low	32.7	Very low	198 Å²	198	132.6 Å²	132.6	78%	0.776	75%	0.747	S	S	*	*			trans	82.7	150.8	132.6	-88.1	-117.5	0	0	0	125.7
815	D	30.6	Very low	32.6	Very low	122 Å²	122	134.3 Å²	134.3	65%	0.652	76%	0.756	S	S	*	*			trans	72	138.4	149.5	-97.9	-51.7	0	0	0	118.9	T817	D815-T817 PolarHBondContact OD1-N 2.84Å
816	T	35.7	Very low	32.6	Very low	116 Å²	116	130.2 Å²	130.2	71%	0.712	75%	0.749	S	S	*	*				-155.1	134.4	62	20.7	0	0	0	0	116
817	T	36.1	Very low	32.9	Very low	98 Å²	98	133.7 Å²	133.7	60%	0.601	75%	0.751	S	S	*	*			trans	75	146.2	135.1	65.5	0	0	0	0	121.1	D815	D815-T817 PolarHBondContact OD1-N 2.84Å
818	K	34.6	Very low	32.8	Very low	176 Å²	176	128.9 Å²	128.9	77%	0.765	74%	0.742	S	S	*	*			cis	-165.8	170.1	-12.3	-120.3	173.1	-177.1	176.7	0	112.8
819	L	36.6	Very low	32.5	Very low	158 Å²	158	130.1 Å²	130.1	83%	0.827	75%	0.753	S	S	*	*			trans	72	136	169.6	-42.7	-173	0	0	0	114
820	S	33.6	Very low	32.6	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	75%	0.75	S	S	*	*			cis	-156.4	160.6	-12.1	44.3	0	0	0	0	106.4
821	E	39.7	Very low	32.3	Very low	175 Å²	175	129 Å²	129	82%	0.818	74%	0.744	S	S	*	*			cis	-155	176.7	45.9	-70	177.3	139.5	0	0	112.8
822	T	36.3	Very low	32	Very low	126 Å²	126	129.6 Å²	129.6	77%	0.773	74%	0.742	S	S	*	*			trans	-33	158.2	166	51.3	0	0	0	0	117.1
823	S	35.6	Very low	32	Very low	110 Å²	110	129.3 Å²	129.3	77%	0.769	74%	0.74	S	S	*	*			cis	-171.4	167.9	16.2	18.9	0	0	0	0	108.5
824	S	35.9	Very low	31.8	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	74%	0.742	S	S	*	*			cis	-162	-161.4	-6.6	48.6	0	0	0	0	108.5
825	E	29.6	Very low	31.9	Very low	183 Å²	183	127 Å²	127	86%	0.855	74%	0.738	S	S	*	*			trans	-84.2	170.8	-177.2	-45.7	102.9	115.7	0	0	116.1
826	G	28.8	Very low	31.8	Very low	60 Å²	60	128.1 Å²	128.1	62%	0.619	74%	0.739	S	S	*	*			trans	138.5	139.9	136.2	0	0	0	0	0	117.7
827	H	36.7	Very low	31.7	Very low	196 Å²	196	131.7 Å²	131.7	91%	0.907	75%	0.745	S	S	*	*			trans	58.2	103.3	163.2	-49.6	-74.8	0	0	0	117.3
828	G	27.4	Very low	31.4	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	75%	0.745	S	S	*	*			cis	86.4	112.3	0.6	0	0	0	0	0	114.1
829	S	27.3	Very low	31.2	Very low	130 Å²	130	132 Å²	132	91%	0.909	74%	0.74	S	S	*	*			trans	64.2	160.1	179.2	-74.2	0	0	0	0	115.9
830	S	26.6	Very low	30.7	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	73%	0.731	S	S	*	*			cis	-177.9	168.2	-24.1	-179.9	0	0	0	0	106.1
831	C	24.9	Very low	30.5	Very low	100 Å²	100	130.9 Å²	130.9	68%	0.676	73%	0.733	S	S	*	*			trans	68.4	156.9	165.1	-70.8	0	0	0	0	114.8
832	D	28.2	Very low	29.8	Very low	127 Å²	127	127.3 Å²	127.3	68%	0.679	73%	0.727	S	S	*	*			cis	-153.3	165.7	-1	-121.1	-15.2	0	0	0	112.7
833	L	27.7	Very low	29.3	Very low	142 Å²	142	125.3 Å²	125.3	74%	0.743	72%	0.718	S	S	*	*			trans	33.5	108.6	143.2	-61.6	165.8	0	0	0	121.2
834	N	25	Very low	28.7	Very low	134 Å²	134	126.1 Å²	126.1	72%	0.717	71%	0.714	S	S	*	*				79	166.3	113.7	-156	30.3	0	0	0	121.1
835	E	33.7	Very low	28.3	Very low	148 Å²	148	127.9 Å²	127.9	69%	0.692	71%	0.71	S	S	*	*			trans	86.1	92.8	163.8	-52.4	-152.4	179.3	0	0	120.8
836	H	28.3	Very low	28.2	Very low	144 Å²	144	125.5 Å²	125.5	67%	0.667	70%	0.699	S	S	*	*				55.4	110.6	128	-68.1	-70	0	0	0	121.4
837	F	32.7	Very low	28.2	Very low	192 Å²	192	130.1 Å²	130.1	84%	0.842	70%	0.704	S	S	*	*				-148.4	123.9	86.7	-96.3	-90.9	0	0	0	107.2
838	K	29.3	Very low	27.8	Very low	140 Å²	140	126.1 Å²	126.1	61%	0.609	69%	0.694	S	S	*	*				50.2	128.9	90.7	-88.7	170.1	162.1	-90.5	0	113.2
839	E	31.4	Very low	28	Very low	139 Å²	139	131.3 Å²	131.3	65%	0.65	70%	0.698	S	S	*	*			cis	-143.4	136.2	15.3	-136.3	123	-131.5	0	0	108.3
840	S	25.8	Very low	28	Very low	91 Å²	91	133 Å²	133	64%	0.636	69%	0.691	S	S	*	*				51.1	123.2	83.6	-37.1	0	0	0	0	111.8
841	I	29.1	Very low	28	Very low	146 Å²	146	131.3 Å²	131.3	75%	0.749	69%	0.689	S	S	*	*			cis	-165.9	135.8	42.2	-99.4	133.1	0	0	0	105.5
842	S	25.2	Very low	28	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	69%	0.694	S	S	*	*				67.6	148.6	66.2	-179	0	0	0	0	114.6
843	S	26.1	Very low	27.9	Very low	84 Å²	84	129.5 Å²	129.5	59%	0.587	69%	0.688	S	S	*	*			trans	50.7	128.8	150	53.1	0	0	0	0	121.8
844	N	24	Very low	27.8	Very low	126 Å²	126	131.1 Å²	131.1	67%	0.674	69%	0.691	S	S	*	*			trans	85.1	124.9	138.8	-82.2	32.1	0	0	0	121.2
845	E	26.7	Very low	27.8	Very low	144 Å²	144	129 Å²	129	67%	0.673	69%	0.688	S	S	*	*			trans	76.5	142.8	132.4	-64.9	179.6	112.9	0	0	117.6
846	Q	27.6	Very low	27.5	Very low	133 Å²	133	129.7 Å²	129.7	62%	0.621	70%	0.696	S	S	*	*			cis	-155.9	168.5	5.2	-130.3	171.8	48.7	0	0	111.5
847	Q	28.4	Very low	27.5	Very low	156 Å²	156	126.8 Å²	126.8	73%	0.729	71%	0.705	S	S	*	*			trans	71.5	114.7	149.6	-72.2	-179.7	34.3	0	0	121.4
848	V	28.2	Very low	27.2	Very low	113 Å²	113	125.7 Å²	125.7	69%	0.685	70%	0.702	S	S	*	*				108.3	100.8	117.1	165.4	0	0	0	0	119.3
849	F	31.4	Very low	27.1	Very low	174 Å²	174	123.3 Å²	123.3	76%	0.763	70%	0.699	S	S	*	*			trans	67.6	122	147.3	-76.6	-115.2	0	0	0	119.5
850	Q	27.3	Very low	27	Very low	164 Å²	164	125.2 Å²	125.2	77%	0.766	71%	0.705	S	S	*	*			cis	110.4	139.1	18.7	-178.8	178.7	3.9	0	0	112.3
851	G	26.7	Very low	27	Very low	60 Å²	60	126 Å²	126	62%	0.619	71%	0.711	S	S	*	*			trans	100.6	94.9	-176.3	0	0	0	0	0	110.4
852	S	25.9	Very low	27	Very low	112 Å²	112	126.1 Å²	126.1	78%	0.783	71%	0.712	S	S	*	*			cis	60.2	142	38.9	114.4	0	0	0	0	112.1
853	S	24.7	Very low	27.2	Very low	77 Å²	77	126.9 Å²	126.9	54%	0.538	71%	0.713	S	S	.	*			cis	-179.6	168.4	-12.2	39.5	0	0	0	0	106.6
854	E	25.7	Very low	27.3	Very low	176 Å²	176	127.1 Å²	127.1	82%	0.822	72%	0.72	S	S	*	*			trans	61.8	177.1	159	-68.8	146.8	134.4	0	0	115.5
855	S	25.8	Very low	27.5	Very low	91 Å²	91	127 Å²	127	64%	0.636	72%	0.724	S	S	*	*			cis	-154	174	-44.7	56.3	0	0	0	0	109.1	G857	S855-G857 PolarHBondContact O-N 3.45Å
856	D	26.5	Very low	27.6	Very low	161 Å²	161	126.9 Å²	126.9	86%	0.861	73%	0.727	S	S	*	*			trans	36	68.4	152.4	-59.2	-29.4	0	0	0	119.2	H858	D856-H858 PolarHBondContact O-N 3.13Å
857	G	29.2	Very low	27.8	Very low	84 Å²	84	126.6 Å²	126.6	87%	0.866	73%	0.734	S	S	*	*			trans	-96.7	57.1	-178.7	0	0	0	0	0	116.2	S855	S855-G857 PolarHBondContact O-N 3.45Å
858	H	26.9	Very low	27.7	Very low	169 Å²	169	125.1 Å²	125.1	78%	0.782	73%	0.731	S	S	*	*			trans	-47.4	134.1	-176.5	-162.6	-120.3	0	0	0	117	D856	D856-H858 PolarHBondContact O-N 3.13Å
859	V	27.4	Very low	27.9	Very low	90 Å²	90	123.4 Å²	123.4	55%	0.545	73%	0.729	S	S	.	*			trans	78.3	118.7	146.9	151.2	0	0	0	0	121.4
860	K	27.9	Very low	27.6	Very low	179 Å²	179	122.1 Å²	122.1	78%	0.778	73%	0.73	S	S	*	*			trans	51.5	120.7	143.2	-54.9	172.2	-164.5	170.5	0	118.2
861	S	27.3	Very low	27.7	Very low	107 Å²	107	119.8 Å²	119.8	75%	0.748	73%	0.732	S	S	*	*				48.6	116.9	78.9	-178	0	0	0	0	114.4
862	L	28.8	Very low	27.8	Very low	149 Å²	149	121.7 Å²	121.7	78%	0.78	74%	0.736	S	S	*	*				-172.9	122.1	128	-102	172.5	0	0	0	114.1
863	T	28.7	Very low	28.1	Very low	116 Å²	116	127.8 Å²	127.8	71%	0.712	74%	0.743	S	S	*	*			trans	52.5	137	139.8	48	0	0	0	0	125.1
864	A	29.1	Very low	28.4	Very low	89 Å²	89	127.3 Å²	127.3	74%	0.736	75%	0.751	S	S	*	*			trans	74	168.7	135.9	0	0	0	0	0	116.5
865	T	28.1	Very low	28.6	Very low	123 Å²	123	123.7 Å²	123.7	76%	0.755	75%	0.745	S	S	*	*			cis	-138.7	138.9	21	28	0	0	0	0	111.2
866	L	27.5	Very low	28.7	Very low	141 Å²	141	128.1 Å²	128.1	74%	0.738	75%	0.752	S	S	*	*				104.5	173.1	68.2	-157.5	142.2	0	0	0	109.7
867	V	31.6	Very low	29.1	Very low	127 Å²	127	126.7 Å²	126.7	77%	0.77	74%	0.743	S	S	*	*			trans	80.9	127.5	170.3	-175.1	0	0	0	0	115.5
868	D	27.7	Very low	29.1	Very low	125 Å²	125	129.2 Å²	129.2	67%	0.668	74%	0.737	S	S	*	*			cis	-169.3	-172.8	-23.8	-130.8	-57.1	0	0	0	112.9
869	A	31.9	Very low	29.4	Very low	77 Å²	77	125.5 Å²	125.5	64%	0.636	73%	0.73	S	S	*	*			trans	79.9	84.8	148.1	0	0	0	0	0	121.4
870	N	25.4	Very low	29.8	Very low	147 Å²	147	129.8 Å²	129.8	79%	0.786	74%	0.741	S	S	*	*				43	158.7	103.4	-67.7	-41.2	0	0	0	123.5
871	S	29	Very low	29.8	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	74%	0.742	S	S	*	*			trans	79.7	118.9	172.9	76.5	0	0	0	0	115
872	S	28	Very low	29.9	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	74%	0.742	S	S	*	*			cis	94.6	105.8	40.1	173.8	0	0	0	0	112.9
873	Y	33.1	Very low	29.9	Very low	240 Å²	240	125.5 Å²	125.5	94%	0.941	73%	0.732	S	S	*	*				-169.1	175.6	123.5	-108.1	-73	0	0	0	108.9
874	G	30.6	Very low	29.9	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	73%	0.732	S	S	*	*			trans	130.1	2.3	150	0	0	0	0	0	120.6
875	S	29.2	Very low	29.8	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	73%	0.729	S	S	*	*			trans	50.6	98.6	146	-178.7	0	0	0	0	120.6
876	K	29.8	Very low	29.9	Very low	184 Å²	184	127 Å²	127	80%	0.8	72%	0.722	S	S	*	*				85.5	160.4	119.6	-75.8	-176	174.3	177.9	0	122.7
877	I	32.9	Very low	29.9	Very low	131 Å²	131	128.7 Å²	128.7	67%	0.672	72%	0.723	S	S	*	*			trans	73.2	87.5	156.5	-71.9	150.3	0	0	0	112.6
878	D	30.8	Very low	29.8	Very low	137 Å²	137	133 Å²	133	73%	0.733	73%	0.726	S	S	*	*				70.9	131.5	83.3	-62.9	-44.2	0	0	0	110.8
879	S	32.7	Very low	29.8	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	72%	0.723	S	S	*	*			cis	-150.9	141	42.2	-61.7	0	0	0	0	113.9
880	K	34.9	Very low	29.7	Very low	179 Å²	179	130.2 Å²	130.2	78%	0.778	72%	0.715	S	S	*	*			trans	60.9	109.8	133.5	-65.3	169.2	-172.5	170.5	0	116.4
881	Q	28.4	Very low	29.9	Very low	167 Å²	167	130.1 Å²	130.1	78%	0.78	71%	0.714	S	S	*	*				55	119.8	53.7	-159.1	-175.3	-1.9	0	0	112.7	D883	Q881-D883 HydrophobicContact CG-CB 3.92Å; Q881-D883 PolarHBondContact NE2-OD2 2.99Å
882	G	29.2	Very low	30	Very low	73 Å²	73	132.3 Å²	132.3	75%	0.753	72%	0.716	S	S	*	*			trans	149	47.1	-174.3	0	0	0	0	0	109
883	D	28.5	Very low	30.1	Very low	106 Å²	106	131.2 Å²	131.2	57%	0.567	72%	0.72	S	S	*	*				61.5	158.5	55.9	-161.1	0.2	0	0	0	110.9	Q881	Q881-D883 HydrophobicContact CG-CB 3.92Å; Q881-D883 PolarHBondContact NE2-OD2 2.99Å
884	I	29.6	Very low	30.1	Very low	141 Å²	141	125 Å²	125	72%	0.723	71%	0.712	S	S	*	*			trans	64.1	117.9	170	-58.5	169	0	0	0	114.4
885	L	27.9	Very low	30.2	Very low	127 Å²	127	128.3 Å²	128.3	67%	0.665	72%	0.719	S	S	*	*			cis	164.1	-170.8	-1.6	-120.7	169.3	0	0	0	104.5
886	C	28.9	Very low	30.5	Very low	91 Å²	91	127 Å²	127	62%	0.615	72%	0.721	S	S	*	*			trans	70.5	111.8	157.2	-70.2	0	0	0	0	116.5
887	K	28.7	Very low	30.7	Very low	176 Å²	176	122.5 Å²	122.5	77%	0.765	72%	0.718	S	S	*	*				70.6	160.3	62.8	-65.1	168.8	-176.6	172.4	0	112.6
888	R	28.3	Very low	30.8	Very low	218 Å²	218	123.2 Å²	123.2	82%	0.823	72%	0.723	S	S	*	*			trans	77.4	102.1	158.2	-85.2	178.6	170.5	165.7	-4.4	117.8
889	S	27.7	Very low	30.9	Very low	86 Å²	86	122.9 Å²	122.9	60%	0.601	73%	0.726	S	S	*	*				51.9	114.4	112.5	66.5	0	0	0	0	118.3
890	A	29.8	Very low	30.8	Very low	58 Å²	58	122.3 Å²	122.3	48%	0.479	72%	0.721	S	S	.	*				109.1	-176	63.2	0	0	0	0	0	110.9
891	L	30.9	Very low	30.8	Very low	144 Å²	144	119.9 Å²	119.9	75%	0.754	72%	0.717	S	S	*	*			trans	90.5	100.3	162	-56.9	156.2	0	0	0	118.1
892	L	30.2	Very low	30.8	Very low	163 Å²	163	118.8 Å²	118.8	85%	0.853	72%	0.716	S	S	*	*			trans	72.2	128.2	134.7	-86.7	75.4	0	0	0	122.6
893	G	31	Very low	30.9	Very low	76 Å²	76	121.6 Å²	121.6	78%	0.784	71%	0.714	S	S	*	*				115.7	141.2	123.7	0	0	0	0	0	116.4
894	S	32.4	Very low	31.1	Very low	109 Å²	109	123.7 Å²	123.7	76%	0.762	72%	0.72	S	S	*	*			cis	-162.6	169.4	-13.7	-164.8	0	0	0	0	110.6
895	T	33	Very low	30.9	Very low	138 Å²	138	122.3 Å²	122.3	85%	0.847	72%	0.723	S	S	*	*			trans	68.2	131.6	175	73.5	0	0	0	0	116.6
896	G	34.5	Very low	30.9	Very low	72 Å²	72	120.2 Å²	120.2	74%	0.742	72%	0.724	S	S	*	*			cis	-177.7	175.2	-8.4	0	0	0	0	0	114.9
897	A	35.1	Very low	30.9	Very low	89 Å²	89	121.5 Å²	121.5	74%	0.736	73%	0.734	S	S	*	*			trans	67.2	80.6	165.2	0	0	0	0	0	119.4
898	N	33.6	Very low	31	Very low	146 Å²	146	119.9 Å²	119.9	78%	0.781	73%	0.732	S	S	*	*				92.8	111.4	113.7	-66.9	-4.6	0	0	0	122.6
899	V	33.6	Very low	31	Very low	130 Å²	130	115.2 Å²	115.2	79%	0.788	72%	0.723	S	S	*	*				65.7	132.2	114.5	173.3	0	0	0	0	119.2
900	S	30.6	Very low	31.3	Very low	79 Å²	79	118.2 Å²	118.2	55%	0.552	73%	0.731	S	S	*	*			cis	-175.7	167.3	-23.5	57	0	0	0	0	109
901	N	34.4	Very low	31.3	Very low	129 Å²	129	124.7 Å²	124.7	69%	0.69	74%	0.743	S	S	*	*			trans	76.1	130.9	165.4	-51.2	-27.8	0	0	0	114
902	N	28.4	Very low	31.3	Very low	143 Å²	143	124.3 Å²	124.3	77%	0.765	75%	0.746	S	S	*	*				64.2	140	54	-54.6	-28	0	0	0	110.6
903	L	32.2	Very low	31.4	Very low	133 Å²	133	123.7 Å²	123.7	70%	0.696	74%	0.744	S	S	*	*			cis	-158.1	171.4	36.5	-165.4	63	0	0	0	111.3
904	E	31.5	Very low	31.5	Very low	150 Å²	150	124.7 Å²	124.7	70%	0.701	74%	0.739	S	S	*	*			trans	19.5	133	154.7	-72.8	152.4	-173.4	0	0	121.3
905	S	26.4	Very low	31.8	Very low	112 Å²	112	125 Å²	125	78%	0.783	74%	0.738	S	S	*	*				77.7	153.5	56	-58.7	0	0	0	0	114.8
906	A	28.6	Very low	31.7	Very low	83 Å²	83	124.2 Å²	124.2	69%	0.686	73%	0.733	S	S	*	*			trans	67	112.1	176.1	0	0	0	0	0	116
907	S	28.6	Very low	31.5	Very low	117 Å²	117	125.5 Å²	125.5	82%	0.818	73%	0.731	S	S	*	*				84.8	169.6	52.1	-64.3	0	0	0	0	113.8
908	I	30.1	Very low	31.4	Very low	142 Å²	142	128.4 Å²	128.4	73%	0.728	73%	0.733	S	S	*	*			trans	86.1	101.3	158.4	-67	159	0	0	0	117.4
909	L	29.6	Very low	31.4	Very low	120 Å²	120	127.5 Å²	127.5	63%	0.628	73%	0.728	S	S	*	*			trans	64.6	156.8	138	-57.4	-176.8	0	0	0	117.1
910	L	32.6	Very low	31.5	Very low	149 Å²	149	126.2 Å²	126.2	78%	0.78	73%	0.725	S	S	*	*			cis	-131.6	142.4	38	-69.8	151.9	0	0	0	110.4
911	R	30.2	Very low	31.9	Very low	195 Å²	195	127.9 Å²	127.9	74%	0.736	73%	0.734	S	S	*	*				47.7	125.8	74.7	-71.2	-173.1	-176.9	159	-0.6	113.2
912	V	31.4	Very low	31.9	Very low	135 Å²	135	126.6 Å²	126.6	82%	0.818	74%	0.735	S	S	*	*				-165.4	139.8	99.5	147.9	0	0	0	0	107
913	D	32.5	Very low	32.3	Very low	151 Å²	151	126.5 Å²	126.5	81%	0.807	74%	0.739	S	S	*	*			trans	-145.1	100.5	149.7	-142.6	-26.6	0	0	0	109.5
914	S	31.7	Very low	32.6	Very low	96 Å²	96	124.4 Å²	124.4	67%	0.671	74%	0.736	S	S	*	*			trans	57.7	163.2	163.2	-66.9	0	0	0	0	120.7
915	P	38.5	Very low	33	Very low	115 Å²	115	122.1 Å²	122.1	75%	0.747	74%	0.737	S	S	*	*			cis	-126.2	-168.1	-16.8	24.2	-0.5	0	0	0	112.8
916	V	31.8	Very low	33.5	Very low	123 Å²	123	127.7 Å²	127.7	75%	0.745	74%	0.741	S	S	*	*			trans	82.9	92.9	158.8	-166.9	0	0	0	0	118.3
917	S	30.5	Very low	34.3	Very low	99 Å²	99	127.9 Å²	127.9	69%	0.692	73%	0.734	S	S	*	*			trans	75.2	126.1	130.8	-59.1	0	0	0	0	124
918	L	33.3	Very low	35	Very low	150 Å²	150	129.8 Å²	129.8	79%	0.785	73%	0.73	S	S	*	*			trans	72.4	116.1	141.7	-88.9	74.7	0	0	0	121.5
919	D	33.5	Very low	35.4	Very low	127 Å²	127	127.6 Å²	127.6	68%	0.679	73%	0.728	S	S	*	*				71	101.1	128.8	-77.6	-48.8	0	0	0	123.5
920	S	35.7	Very low	35.8	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	74%	0.737	S	S	*	*				82.8	155.7	113.6	-67.6	0	0	0	0	119.2
921	P	38.9	Very low	35.8	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	73%	0.732	S	S	*	*			trans	-127.7	-179.7	-139.1	43	-30.6	0	0	0	117
922	S	33.4	Very low	36.1	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	73%	0.73	S	S	*	*			trans	124	144.8	131.5	77.8	0	0	0	0	118.1
923	V	37.8	Very low	36.4	Very low	141 Å²	141	125.2 Å²	125.2	86%	0.855	73%	0.729	S	S	*	*			trans	69.8	141.2	148.6	166.9	0	0	0	0	115.8
924	S	38.6	Very low	36.7	Very low	90 Å²	90	124.2 Å²	124.2	63%	0.629	72%	0.723	S	S	*	*			cis	-151.5	158	21.2	85.2	0	0	0	0	114.7
925	S	39.9	Very low	37	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	73%	0.728	S	S	*	*				60	156.2	129.1	93.9	0	0	0	0	121.4
926	R	35.6	Very low	36.8	Very low	229 Å²	229	128.9 Å²	128.9	86%	0.864	73%	0.733	S	S	*	*			cis	-155.2	-175.1	-11.7	-124.7	-166.9	171.9	-168.4	-0.8	109.5
927	P	47	Very low	37	Very low	86 Å²	86	127.8 Å²	127.8	56%	0.558	74%	0.737	S	S	*	*			trans	-129.6	-163.9	-137.6	41	-18.3	0	0	0	114.3
928	H	41.9	Very low	37.1	Very low	157 Å²	157	134.6 Å²	134.6	73%	0.727	75%	0.747	S	S	*	*				168.2	118	124	-87.4	-58.1	0	0	0	110.4
929	S	39.5	Very low	37.3	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	75%	0.75	S	S	*	*				84.6	131.8	104.6	-65.7	0	0	0	0	114.1
930	L	37.9	Very low	37.2	Very low	156 Å²	156	136.6 Å²	136.6	82%	0.817	76%	0.756	S	S	*	*			cis	-149.4	141.1	-5.7	-91.4	158.8	0	0	0	106.4
931	A	32.1	Very low	37.2	Very low	82 Å²	82	138.4 Å²	138.4	68%	0.678	76%	0.758	S	S	*	*				37.3	130.4	96.1	0	0	0	0	0	114.8
932	S	36.7	Very low	36.8	Very low	101 Å²	101	137.6 Å²	137.6	71%	0.706	76%	0.755	S	S	*	*			cis	-169.6	-156.8	9.5	46.3	0	0	0	0	108.4
933	R	36.9	Very low	36.8	Very low	209 Å²	209	137.4 Å²	137.4	79%	0.789	75%	0.753	S	S	*	*			cis	-177.3	153.6	29.3	-144.3	174.6	-171.9	-161.1	2.1	112
934	L	40.6	Very low	36.7	Very low	131 Å²	131	136.5 Å²	136.5	69%	0.686	75%	0.748	S	S	*	*			trans	70.3	144.6	162.9	-46.5	-174.7	0	0	0	117
935	K	36.8	Very low	36.6	Very low	179 Å²	179	138.9 Å²	138.9	78%	0.778	75%	0.753	S	S	*	*			cis	-156.8	129.4	-6.9	-122.5	167.8	-176.5	-178.8	0	110.4
936	P	35.1	Very low	36.4	Very low	129 Å²	129	144.6 Å²	144.6	84%	0.838	76%	0.759	S	S	*	*			trans	-106.5	161.7	170.3	38.5	-32.1	0	0	0	112.8
937	A	35.9	Very low	36.3	Very low	100 Å²	100	139.2 Å²	139.2	83%	0.826	76%	0.756	S	S	*	*			trans	-155.1	139.1	158.8	0	0	0	0	0	111.2
938	R	31.3	Very low	35.5	Very low	242 Å²	242	137.9 Å²	137.9	91%	0.913	76%	0.758	S	S	*	*			trans	-100.7	150	160.9	-60.2	179.1	-175.6	119.3	-2.9	107.8
939	I	37.3	Very low	35.1	Very low	167 Å²	167	140.6 Å²	140.6	86%	0.856	77%	0.768	S	S	*	*			trans	-125.7	133.2	158	-65.3	-177.5	0	0	0	107.8
940	L	32.7	Very low	34.6	Very low	152 Å²	152	146.4 Å²	146.4	80%	0.796	78%	0.775	S	S	*	*			trans	-97.2	143.1	175.4	-71	160.8	0	0	0	109.2
941	N	34.4	Very low	34.2	Very low	142 Å²	142	142.5 Å²	142.5	76%	0.759	76%	0.761	S	S	*	*			trans	-173.1	132.3	149.9	-96.8	-27.6	0	0	0	106.5
942	S	32.1	Very low	34.4	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	76%	0.761	S	S	*	*			cis	66.6	132	40.8	117.2	0	0	0	0	111.7
943	S	32.7	Very low	34.1	Very low	98 Å²	98	144.5 Å²	144.5	69%	0.685	76%	0.76	S	S	*	*			cis	-167.6	167.5	4.8	54.2	0	0	0	0	112.9
944	V	35.4	Very low	33.9	Very low	123 Å²	123	141.7 Å²	141.7	75%	0.745	76%	0.761	S	S	*	*			trans	75.4	142.1	134.7	151	0	0	0	0	121.7
945	L	36.4	Very low	33.2	Very low	139 Å²	139	143.8 Å²	143.8	73%	0.728	77%	0.767	S	S	*	*			trans	77.1	144.5	175.9	-53.5	-168.3	0	0	0	119
946	R	35.7	Very low	33.2	Very low	223 Å²	223	139.8 Å²	139.8	84%	0.842	76%	0.76	S	S	*	*			cis	-169	147.7	-35.2	-123.5	-173.4	-158.7	-178.4	2.9	110.3
947	S	33.2	Very low	32.9	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	76%	0.758	S	S	*	*			trans	43.5	140	149.4	-163.7	0	0	0	0	121.5
948	G	31.7	Very low	32.5	Very low	59 Å²	59	138.9 Å²	138.9	61%	0.608	76%	0.758	S	S	*	*			cis	139.6	165.1	0.8	0	0	0	0	0	112.8
949	K	32.9	Very low	32.3	Very low	213 Å²	213	132.7 Å²	132.7	93%	0.926	75%	0.751	S	S	*	*			trans	69.9	162.5	-175.6	-63.2	178.3	-179.2	178.1	0	114.1
950	R	29.2	Very low	31.9	Very low	219 Å²	219	130.5 Å²	130.5	83%	0.826	75%	0.75	S	S	*	*			cis	-167.5	147.1	-23.3	169.9	-167.9	173.4	-162.7	-8	105.2
951	S	30.1	Very low	31.8	Very low	74 Å²	74	128 Å²	128	52%	0.517	75%	0.745	S	S	.	*			cis	-174.7	-171.6	-22.8	63.1	0	0	0	0	108.2
952	T	34.4	Very low	31.6	Very low	112 Å²	112	128.5 Å²	128.5	69%	0.687	75%	0.748	S	S	*	*			trans	68	124.5	152.3	36.2	0	0	0	0	119.2
953	T	31.1	Very low	31.7	Very low	113 Å²	113	130.9 Å²	130.9	69%	0.693	75%	0.752	S	S	*	*			trans	-46.1	156.9	156.2	49.6	0	0	0	0	113.7
954	D	32	Very low	31.6	Very low	150 Å²	150	132.6 Å²	132.6	80%	0.802	75%	0.753	S	S	*	*				-168.7	155.4	97.7	-78.5	-20.4	0	0	0	111.5
955	E	27.7	Very low	31.5	Very low	175 Å²	175	131.7 Å²	131.7	82%	0.818	75%	0.752	S	S	*	*			trans	-78.7	171.2	165	-92.5	-93.8	142.1	0	0	109.5
956	P	34.8	Very low	31.4	Very low	95 Å²	95	132.8 Å²	132.8	62%	0.617	76%	0.758	S	S	*	*			cis	-144.6	-174.1	22.8	37.3	-14	0	0	0	117.3
957	T	29.3	Very low	31.4	Very low	131 Å²	131	126.3 Å²	126.3	80%	0.804	75%	0.752	S	S	*	*			trans	47.1	120.7	149	50.7	0	0	0	0	121.2
958	G	29	Very low	31.5	Very low	80 Å²	80	129.1 Å²	129.1	83%	0.825	76%	0.757	S	S	*	*			trans	-175.6	93.9	166	0	0	0	0	0	118.2
959	S	26.8	Very low	31.6	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	77%	0.771	S	S	*	*			trans	7.1	119.7	153.9	-175.7	0	0	0	0	122.1
960	C	28	Very low	31.7	Very low	121 Å²	121	127.2 Å²	127.2	82%	0.818	76%	0.756	S	S	*	*			trans	35.2	127.4	130.4	-53.3	0	0	0	0	122.9
961	S	30.5	Very low	32	Very low	100 Å²	100	123.1 Å²	123.1	70%	0.699	76%	0.758	S	S	*	*			trans	-163.2	120.8	130.1	51.8	0	0	0	0	113.4
962	N	29.8	Very low	32.3	Very low	152 Å²	152	125.2 Å²	125.2	81%	0.813	77%	0.772	S	S	*	*				62.5	164.6	129.4	-53.3	-18.3	0	0	0	118.9
963	I	34.8	Very low	32.3	Very low	146 Å²	146	131.7 Å²	131.7	75%	0.749	78%	0.784	S	S	*	*			cis	-145.6	135.3	27.3	-61.7	162.2	0	0	0	111.5
964	N	30	Very low	32.6	Very low	134 Å²	134	135.3 Å²	135.3	72%	0.717	79%	0.793	S	S	*	*			trans	35.1	146.7	151.5	-49	-12.7	0	0	0	121.3
965	S	33.5	Very low	32.7	Very low	103 Å²	103	136.4 Å²	136.4	72%	0.72	80%	0.798	S	S	*	*			cis	-157.8	138.3	45	-56.1	0	0	0	0	111
966	L	33.9	Very low	32.8	Very low	163 Å²	163	132.9 Å²	132.9	85%	0.853	80%	0.799	S	S	*	*				48.6	131.9	92.1	-55.5	175.1	0	0	0	115.1
967	A	35.5	Very low	32.6	Very low	86 Å²	86	131.8 Å²	131.8	71%	0.711	81%	0.805	S	S	*	*			cis	-156	159	-9.2	0	0	0	0	0	108.2
968	L	35.9	Very low	32.8	Very low	175 Å²	175	132.1 Å²	132.1	92%	0.916	81%	0.807	S	S	*	*				-170.4	158.5	76.4	-99.6	161.7	0	0	0	110.2
969	L	33.9	Very low	33	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	81%	0.806	S	S	*	*			trans	-113.8	144.4	-169.8	-89.2	155.6	0	0	0	114.6
970	G	35.3	Very low	33.2	Very low	60 Å²	60	134.4 Å²	134.4	62%	0.619	81%	0.81	S	S	*	*			trans	-107.7	147.8	154.9	0	0	0	0	0	110.3
971	P	35.3	Very low	33.2	Very low	132 Å²	132	131.8 Å²	131.8	86%	0.857	80%	0.804	S	S	*	*	S	Bend	trans	-94.8	117.5	-159.5	34	-34.7	0	0	0	115.7
972	S	37.2	Very low	33.4	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	81%	0.812	S	S	*	*			trans	-172.2	70.6	151.7	41.3	0	0	0	0	113.4
973	R	33.3	Very low	33.5	Very low	248 Å²	248	132.5 Å²	132.5	94%	0.936	81%	0.807	S	S	*	*			trans	-140.9	90.4	165.2	-81.9	-168	176.7	-129	2.5	111.5
974	Q	37	Very low	33.2	Very low	189 Å²	189	130.9 Å²	130.9	88%	0.883	81%	0.809	S	S	*	*			trans	-142.8	147.3	165.5	-67.9	-171.3	-15.1	0	0	108.4
975	L	34.7	Very low	33.2	Very low	174 Å²	174	132.4 Å²	132.4	91%	0.911	82%	0.816	S	S	*	*			trans	72.6	99	-154	-56.2	164	0	0	0	111
976	A	30.9	Very low	33.1	Very low	100 Å²	100	131.2 Å²	131.2	83%	0.826	81%	0.813	S	S	*	*			cis	69.9	134.7	38.6	0	0	0	0	0	113.9
977	G	29.3	Very low	33	Very low	73 Å²	73	128.2 Å²	128.2	75%	0.753	81%	0.805	S	S	*	*			cis	149.9	44.2	-2.4	0	0	0	0	0	115.4
978	V	33.4	Very low	32.7	Very low	137 Å²	137	131.5 Å²	131.5	83%	0.83	81%	0.811	S	S	*	*			trans	-141.7	160.3	-179.3	-165.5	0	0	0	0	110
979	V	33.8	Very low	32.5	Very low	134 Å²	134	128.3 Å²	128.3	81%	0.812	80%	0.803	S	S	*	*			trans	71.3	64.7	176.9	-159.2	0	0	0	0	114.8
980	A	30.8	Very low	32.4	Very low	105 Å²	105	126.2 Å²	126.2	87%	0.868	80%	0.798	S	S	*	*			trans	-94.9	139.5	139.2	0	0	0	0	0	108.5
981	G	29.2	Very low	32.4	Very low	67 Å²	67	129.8 Å²	129.8	69%	0.691	81%	0.808	S	S	*	*			trans	98	102.9	170.7	0	0	0	0	0	116.1
982	L	33.1	Very low	32.1	Very low	164 Å²	164	127.8 Å²	127.8	86%	0.859	80%	0.803	S	S	*	*			trans	-171.2	145.8	130.1	-100.9	170.5	0	0	0	109.2
983	S	32	Very low	32.2	Very low	102 Å²	102	127.4 Å²	127.4	71%	0.713	80%	0.797	S	S	*	*			trans	32.1	116.3	160.9	-52.4	0	0	0	0	118.9
984	S	29.2	Very low	32.5	Very low	112 Å²	112	120.4 Å²	120.4	78%	0.783	79%	0.786	S	S	*	*			cis	56.4	69.9	27.2	-179.2	0	0	0	0	115
985	L	30.9	Very low	32.4	Very low	167 Å²	167	115.1 Å²	115.1	87%	0.874	78%	0.775	S	S	*	*			trans	163.7	159.8	150.7	-110.5	63.3	0	0	0	106.8
986	A	31.2	Very low	32.5	Very low	78 Å²	78	110 Å²	110	65%	0.645	76%	0.758	S	S	*	*			cis	-168.2	145	-40.8	0	0	0	0	0	107.4
987	S	31.6	Very low	33	Very low	100 Å²	100	108.6 Å²	108.6	70%	0.699	75%	0.746	S	S	*	*			trans	45.5	116.4	160.8	52.9	0	0	0	0	121.4
988	D	28.8	Very low	33.3	Very low	154 Å²	154	110.1 Å²	110.1	82%	0.824	74%	0.736	S	S	*	*			trans	79.9	152.7	134.6	-56.8	-25.8	0	0	0	123.6
989	S	32.5	Very low	33.4	Very low	108 Å²	108	106.8 Å²	106.8	76%	0.755	72%	0.723	S	S	*	*			trans	71	99.3	172.5	66.9	0	0	0	0	119.6
990	T	30.9	Very low	33.6	Very low	128 Å²	128	104.6 Å²	104.6	79%	0.785	71%	0.714	S	S	*	*			trans	43.4	123.6	132.7	55.7	0	0	0	0	122.1
991	T	34.7	Very low	33.8	Very low	135 Å²	135	102.8 Å²	102.8	83%	0.828	70%	0.699	S	S	*	*			trans	101.9	116.2	147	-41.6	0	0	0	0	117.9
992	A	30.6	Very low	34.2	Very low	91 Å²	91	106.3 Å²	106.3	75%	0.752	70%	0.699	S	S	*	*			trans	65.9	145.3	171.7	0	0	0	0	0	115.6
993	P	37.9	Very low	34.4	Very low	110 Å²	110	102.5 Å²	102.5	71%	0.714	69%	0.691	S	S	*	*				-140.2	114.4	72.8	34	-15.4	0	0	0	114.7	A995	P993-A995 VanDerWaalsContact C-N 3.29Å; P993-A995 PolarHBondContact O-N 2.82Å
994	S	39.3	Very low	34.8	Very low	101 Å²	101	103.6 Å²	103.6	71%	0.706	69%	0.694	S	S	*	*			trans	-76.1	-16.6	171	-155.1	0	0	0	0	113.2
995	A	35.3	Very low	35.2	Very low	77 Å²	77	104.3 Å²	104.3	64%	0.636	69%	0.693	S	S	*	*	H	α-helix	trans	-68.7	-38.9	-170.8	0	0	0	0	0	114.8	P993 L998 A999	P993-A995 VanDerWaalsContact C-N 3.29Å; P993-A995 PolarHBondContact O-N 2.82Å; A995-L998 PolarHBondContact O-N 2.82Å; A995-A999 PolarHBondContact O-N 2.89Å
996	A	36.8	Very low	35.2	Very low	67 Å²	67	100.1 Å²	100.1	55%	0.554	69%	0.69	S	S	*	*	H	α-helix	trans	-70.9	-33.5	-174.7	0	0	0	0	0	113.3	S1000	A996-S1000 PolarHBondContact O-N 3.11Å; A996-S1000 PolarHBondContact O-OG 3.33Å; A996-S1000 VanDerWaalsContact O-OG 3.07Å
997	A	41.2	Very low	35.3	Very low	71 Å²	71	100.3 Å²	100.3	59%	0.587	69%	0.692	S	S	*	*	H	α-helix	trans	-69.8	-35.9	178.1	0	0	0	0	0	112	S1000 A1001	A997-S1000 PolarHBondContact O-N 3.26Å; A997-A1001 PolarHBondContact O-N 3.48Å
998	L	35.8	Very low	35.6	Very low	104 Å²	104	102.7 Å²	102.7	55%	0.545	70%	0.702	S	S	.	*	H	α-helix	trans	-72.5	-41.2	-178	-151.3	160.3	0	0	0	111.5	A995 S1000 A1001 M1002	A995-L998 PolarHBondContact O-N 2.82Å; L998-S1000 VanDerWaalsContact C-N 3.3Å; L998-S1000 PolarHBondContact O-N 2.74Å; L998-A1001 PolarHBondContact O-N 3.41Å; L998-A1001 VanDerWaalsContact O-N 3.11Å; L998-M1002 HydrophobicContact CD2-CE 4.39Å; L998-M1002 HydrophobicContact CD2-CG 4.24Å; L998-M1002 HydrophobicContact CD2-SD 3.89Å; L998-M1002 PolarHBondContact O-N 2.82Å
999	A	36	Very low	35.7	Very low	68 Å²	68	98.5 Å²	98.5	56%	0.562	70%	0.696	S	S	*	*	H	α-helix	trans	-59.4	-39.5	173.6	0	0	0	0	0	112.7	A995 A1001	A995-A999 PolarHBondContact O-N 2.89Å; A999-A1001 VanDerWaalsContact C-N 3.32Å; A999-A1001 PolarHBondContact O-N 2.88Å
1000	S	37.3	Very low	35.5	Very low	87 Å²	87	101.2 Å²	101.2	61%	0.608	70%	0.702	S	S	*	*	H	α-helix	trans	-68.9	-27.7	176.2	-55.7	0	0	0	0	113.3	A996 A997 L998	A996-S1000 PolarHBondContact O-N 3.11Å; A996-S1000 PolarHBondContact O-OG 3.33Å; A996-S1000 VanDerWaalsContact O-OG 3.07Å; A997-S1000 PolarHBondContact O-N 3.26Å; L998-S1000 VanDerWaalsContact C-N 3.3Å; L998-S1000 PolarHBondContact O-N 2.74Å
1001	A	36	Very low	35.4	Very low	68 Å²	68	107.2 Å²	107.2	56%	0.562	71%	0.71	S	S	*	*	H	α-helix	trans	-77.2	-31	179.6	0	0	0	0	0	113.3	A997 L998 A999	A997-A1001 PolarHBondContact O-N 3.48Å; L998-A1001 PolarHBondContact O-N 3.41Å; L998-A1001 VanDerWaalsContact O-N 3.11Å; A999-A1001 VanDerWaalsContact C-N 3.32Å; A999-A1001 PolarHBondContact O-N 2.88Å
1002	M	36.2	Very low	35.4	Very low	141 Å²	141	109.2 Å²	109.2	70%	0.695	71%	0.71	S	S	*	*	H	α-helix	trans	-78.3	-17.7	-179.5	-69.6	-174.5	135.6	0	0	113.9	L998 V1004	L998-M1002 HydrophobicContact CD2-CE 4.39Å; L998-M1002 HydrophobicContact CD2-CG 4.24Å; L998-M1002 HydrophobicContact CD2-SD 3.89Å; L998-M1002 PolarHBondContact O-N 2.82Å; M1002-V1004 PolarHBondContact O-N 3.45Å
1003	A	38.6	Very low	35.5	Very low	83 Å²	83	110.7 Å²	110.7	69%	0.686	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-5.2	-172.4	0	0	0	0	0	115.7
1004	V	40.3	Very low	35.2	Very low	126 Å²	126	114.3 Å²	114.3	76%	0.764	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	5.4	-174.2	-168	0	0	0	0	112.8	M1002 G1006	M1002-V1004 PolarHBondContact O-N 3.45Å; V1004-G1006 PolarHBondContact O-N 2.91Å
1005	V	37.1	Very low	35	Very low	127 Å²	127	117 Å²	117	77%	0.77	73%	0.725	S	S	*	*			trans	-80.4	6.3	178.8	-171.3	0	0	0	0	112.3
1006	G	31.7	Very low	34.9	Very low	79 Å²	79	119 Å²	119	81%	0.814	73%	0.732	S	S	*	*			trans	-95.3	18.3	-165.3	0	0	0	0	0	118.1	V1004	V1004-G1006 PolarHBondContact O-N 2.91Å
1007	A	33.6	Very low	34.7	Very low	82 Å²	82	123.5 Å²	123.5	68%	0.678	74%	0.744	S	S	*	*	S	Bend	trans	-154.4	109.6	174.9	0	0	0	0	0	112.8
1008	T	36	Very low	34.1	Very low	149 Å²	149	127.3 Å²	127.3	91%	0.914	76%	0.755	S	S	*	*	S	Bend	trans	45.9	117.6	164.6	59.6	0	0	0	0	118.2
1009	G	31.1	Very low	34	Very low	67 Å²	67	128.1 Å²	128.1	69%	0.691	77%	0.769	S	S	*	*			cis	167	137.9	-1.9	0	0	0	0	0	109.5
1010	N	29.3	Very low	33.7	Very low	165 Å²	165	132.3 Å²	132.3	88%	0.882	78%	0.782	S	S	*	*			trans	46.5	91.4	-179.8	-76.4	18.5	0	0	0	118
1011	W	29.7	Very low	33.5	Very low	253 Å²	253	134.9 Å²	134.9	96%	0.958	79%	0.794	S	S	*	*			trans	-135.8	136	142.9	-86.6	96.6	0	0	0	109.4
1012	Q	33.5	Very low	33.3	Very low	178 Å²	178	135.8 Å²	135.8	83%	0.832	80%	0.802	S	S	*	*			trans	-134.4	98.1	-173.2	-174.7	176	2.5	0	0	109.8
1013	P	33.2	Very low	33.1	Very low	121 Å²	121	137.3 Å²	137.3	79%	0.786	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85.2	125.6	-179.2	31.9	-31.7	0	0	0	111.3
1014	Q	32	Very low	32.7	Very low	186 Å²	186	140.6 Å²	140.6	87%	0.869	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93	139.4	163.1	-81.6	-170.9	-30.7	0	0	110.5
1015	L	34.3	Very low	32.3	Very low	158 Å²	158	141.9 Å²	141.9	83%	0.827	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-100.9	128.3	175.8	-71	159.6	0	0	0	109.2
1016	P	32.4	Very low	32	Very low	120 Å²	120	141.4 Å²	141.4	78%	0.779	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-72.4	143.7	161.4	-11.4	28.1	0	0	0	110.2
1017	I	33.8	Very low	31.9	Very low	160 Å²	160	141.2 Å²	141.2	82%	0.821	81%	0.814	S	S	*	*			trans	-123.4	120.6	168.2	-64.4	176.1	0	0	0	106.9
1018	D	28.6	Very low	31.7	Very low	151 Å²	151	142.8 Å²	142.8	81%	0.807	82%	0.82	S	S	*	*			trans	-77.7	137.4	173.8	-67.3	-46.7	0	0	0	111.5
1019	S	33.6	Very low	31.4	Very low	121 Å²	121	142 Å²	142	85%	0.846	82%	0.816	S	S	*	*			trans	-168.2	140.2	146.1	-79.9	0	0	0	0	110.5
1020	D	30.1	Very low	31.4	Very low	156 Å²	156	144.8 Å²	144.8	83%	0.834	82%	0.819	S	S	*	*			trans	-69.2	169	-176.8	-75.1	-70.9	0	0	0	115.2
1021	T	32	Very low	31.4	Very low	141 Å²	141	146.2 Å²	146.2	87%	0.865	82%	0.818	S	S	*	*			trans	108.3	152.2	153.8	-41.5	0	0	0	0	116.1
1022	A	31.9	Very low	31.4	Very low	87 Å²	87	138.6 Å²	138.6	72%	0.719	80%	0.803	S	S	*	*			trans	78.3	69.5	172.8	0	0	0	0	0	118.1
1023	Q	31.8	Very low	31.3	Very low	173 Å²	173	137 Å²	137	81%	0.808	80%	0.801	S	S	*	*				23.8	138	120.3	-68.8	-175.3	-4.4	0	0	121.1
1024	L	30.1	Very low	31.3	Very low	152 Å²	152	137.9 Å²	137.9	80%	0.796	80%	0.798	S	S	*	*			trans	82.2	149.7	146.6	-69.1	160.7	0	0	0	120.1
1025	L	32.9	Very low	31.5	Very low	153 Å²	153	136.6 Å²	136.6	80%	0.801	80%	0.796	S	S	*	*			trans	75.8	92.6	168.7	-58.4	176.4	0	0	0	119.3
1026	S	31.5	Very low	31.4	Very low	118 Å²	118	133.5 Å²	133.5	83%	0.825	79%	0.787	S	S	*	*				48.2	126.1	115.3	-53.2	0	0	0	0	121.5
1027	G	29.6	Very low	31.6	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	79%	0.791	S	S	*	*				116.1	99.8	126.9	0	0	0	0	0	117.8
1028	S	27.5	Very low	31.6	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	79%	0.791	S	S	*	*			trans	-35.7	131.8	160.5	143.8	0	0	0	0	115.3
1029	T	31.6	Very low	31.9	Very low	134 Å²	134	140.6 Å²	140.6	82%	0.822	79%	0.787	S	S	*	*			trans	-137.4	144	143.1	46	0	0	0	0	111.6
1030	V	29.5	Very low	32	Very low	125 Å²	125	139.9 Å²	139.9	76%	0.758	78%	0.783	S	S	*	*			trans	-125.3	119.3	172.4	173.6	0	0	0	0	107.7
1031	F	29.4	Very low	32.3	Very low	195 Å²	195	141.7 Å²	141.7	86%	0.855	78%	0.783	S	S	*	*			trans	-171.2	152.1	165.9	-82.3	-69.5	0	0	0	107.1
1032	S	30.2	Very low	32.4	Very low	93 Å²	93	141.5 Å²	141.5	65%	0.65	78%	0.776	S	S	*	*			cis	-175.7	167.6	-28.1	-112.8	0	0	0	0	108.1
1033	D	32	Very low	32.7	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	78%	0.78	S	S	*	*			trans	-158.6	108.2	138	-98.8	-19.4	0	0	0	108.3
1034	L	33.6	Very low	32.8	Very low	138 Å²	138	140.4 Å²	140.4	72%	0.723	78%	0.775	S	S	*	*				86.1	110.7	89.3	-81.7	-175.3	0	0	0	113.6
1035	L	34.9	Very low	33	Very low	159 Å²	159	138.1 Å²	138.1	83%	0.832	77%	0.772	S	S	*	*				-172.2	107.1	100.9	-96.5	173.2	0	0	0	114.8
1036	S	33.7	Very low	33.2	Very low	93 Å²	93	137.4 Å²	137.4	65%	0.65	77%	0.769	S	S	*	*			trans	82.3	133.6	131.7	-140.5	0	0	0	0	122.9
1037	R	34.6	Very low	33.5	Very low	225 Å²	225	138 Å²	138	85%	0.849	76%	0.763	S	S	*	*			trans	73	117.9	167.7	-54.7	-174.7	178.4	-164.9	-2.7	116.4
1038	R	34.3	Very low	33.7	Very low	217 Å²	217	139.9 Å²	139.9	82%	0.819	76%	0.764	S	S	*	*			cis	70.6	131.1	48.6	-69.1	-165.8	142	115.4	1	113.5
1039	D	36.2	Very low	34.3	Very low	138 Å²	138	139.7 Å²	139.7	74%	0.738	76%	0.761	S	S	*	*			cis	-144.9	176	0.2	-99.8	-37.6	0	0	0	111.4
1040	S	35.5	Very low	34.6	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	76%	0.759	S	S	*	*			trans	-84.2	159.3	-167.5	57.7	0	0	0	0	116.2
1041	K	35.1	Very low	35.3	Very low	194 Å²	194	138.8 Å²	138.8	84%	0.843	76%	0.757	S	S	*	*				-162.9	161.4	116.2	-134.2	178.7	176	-176.1	0	114.2
1042	L	35.7	Very low	35.8	Very low	137 Å²	137	134.1 Å²	134.1	72%	0.717	75%	0.746	S	S	*	*			trans	-66.9	159.4	167.3	-67.3	74.1	0	0	0	109.7
1043	D	36.4	Very low	36	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	76%	0.755	S	S	*	*				-162.2	177.3	63.2	-101.9	-57.7	0	0	0	114.5
1044	A	33.8	Very low	36.2	Very low	85 Å²	85	137 Å²	137	70%	0.702	76%	0.758	S	S	*	*			trans	-95.9	161.2	-169.1	0	0	0	0	0	115
1045	S	36.4	Very low	36	Very low	105 Å²	105	137.9 Å²	137.9	73%	0.734	76%	0.763	S	S	*	*				155.5	142.3	123	56.1	0	0	0	0	115.5
1046	N	36.1	Very low	36	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	77%	0.766	S	S	*	*			trans	77.6	137.9	141.6	-70.7	20.9	0	0	0	125.2
1047	D	37.9	Very low	35.9	Very low	131 Å²	131	138.9 Å²	138.9	70%	0.701	77%	0.768	S	S	*	*			trans	74.7	95.2	142.2	-60.2	-28.9	0	0	0	123.9
1048	S	34.6	Very low	35.8	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	76%	0.757	S	S	*	*				67.4	158.3	102.4	-80.8	0	0	0	0	121.8
1049	P	39.1	Very low	35.9	Very low	112 Å²	112	132.1 Å²	132.1	73%	0.727	76%	0.762	S	S	*	*			trans	-133.3	-163.4	-133	37.2	-16.3	0	0	0	116.6
1050	V	37.5	Very low	35.8	Very low	130 Å²	130	128.7 Å²	128.7	79%	0.788	76%	0.759	S	S	*	*			trans	98.2	126.1	162.5	-169.6	0	0	0	0	116.6
1051	P	44.6	Very low	36	Very low	110 Å²	110	129.6 Å²	129.6	71%	0.714	76%	0.763	S	S	*	*			trans	-90.3	-171.4	174.1	40.5	-38.1	0	0	0	112
1052	P	40.5	Very low	36.2	Very low	97 Å²	97	125.9 Å²	125.9	63%	0.63	76%	0.758	S	S	*	*				-163.8	-179.3	94.2	45.2	-25.1	0	0	0	118.9
1053	H	33.6	Very low	36.3	Very low	178 Å²	178	125.7 Å²	125.7	82%	0.824	76%	0.763	S	S	*	*			trans	55.3	126.5	149.9	-54.6	-39.3	0	0	0	123.5
1054	S	35.3	Very low	36.2	Very low	120 Å²	120	125.9 Å²	125.9	84%	0.839	76%	0.758	S	S	*	*				-172.7	157	105	37.8	0	0	0	0	112.5
1055	N	29.3	Very low	36.2	Very low	157 Å²	157	132 Å²	132	84%	0.84	77%	0.77	S	S	*	*			trans	-114.3	152.2	-179	-64.8	-48.6	0	0	0	111
1056	I	35.6	Very low	36.5	Very low	173 Å²	173	131.9 Å²	131.9	89%	0.887	76%	0.764	S	S	*	*			trans	172	154	150.8	-96.6	150.7	0	0	0	108.3
1057	S	32.2	Very low	36.7	Very low	100 Å²	100	130.5 Å²	130.5	70%	0.699	76%	0.763	S	S	*	*			cis	173.3	133.3	-37.8	173.4	0	0	0	0	107
1058	S	32.9	Very low	37.1	Very low	88 Å²	88	130.5 Å²	130.5	62%	0.615	77%	0.77	S	S	*	*			trans	61.5	122.7	166	-174.2	0	0	0	0	119.3
1059	F	35.3	Very low	37.1	Very low	211 Å²	211	130.3 Å²	130.3	93%	0.925	77%	0.766	S	S	*	*				-173.7	150.9	102.6	-95.3	-66.6	0	0	0	111.1
1060	G	35.3	Very low	36.7	Very low	66 Å²	66	130.5 Å²	130.5	68%	0.68	77%	0.765	S	S	*	*			trans	-102.3	166.6	-171.3	0	0	0	0	0	115.8
1061	P	39.6	Very low	36.4	Very low	127 Å²	127	135.7 Å²	135.7	83%	0.825	77%	0.772	S	S	*	*			trans	-101	170.5	-169.8	40.1	-36.9	0	0	0	114.4
1062	P	38.9	Very low	35.8	Very low	115 Å²	115	136.1 Å²	136.1	75%	0.747	77%	0.773	S	S	*	*			trans	-135.3	160.1	166.1	42.4	-28.9	0	0	0	117
1063	V	38.3	Very low	35.5	Very low	133 Å²	133	136 Å²	136	81%	0.806	78%	0.78	S	S	*	*			trans	82.9	131.6	159.9	-156.2	0	0	0	0	119.7
1064	H	33.3	Very low	35.6	Very low	155 Å²	155	131.3 Å²	131.3	72%	0.718	77%	0.772	S	S	*	*			trans	-87.8	169.1	175.8	-72.1	-132.8	0	0	0	113	V1066	H1064-V1066 HydrophobicContact CB-CG2 4.09Å
1065	F	34.4	Very low	35.5	Very low	214 Å²	214	132.5 Å²	132.5	94%	0.939	77%	0.769	S	S	*	*			trans	-124.5	153.3	136.7	-108.2	-88.9	0	0	0	111.2
1066	V	43	Very low	35.7	Very low	102 Å²	102	130.2 Å²	130.2	62%	0.618	77%	0.765	S	S	*	*			trans	-130.4	137.9	-159.6	175.3	0	0	0	0	110.5	H1064	H1064-V1066 HydrophobicContact CB-CG2 4.09Å
1067	P	39.9	Very low	35.7	Very low	109 Å²	109	128.1 Å²	128.1	71%	0.708	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-71.7	145.5	174	29.8	-34.8	0	0	0	111.8
1068	P	45.2	Very low	35.8	Very low	130 Å²	130	127.1 Å²	127.1	84%	0.844	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.3	134.8	-169.6	-20.3	33	0	0	0	114
1069	P	35.6	Very low	35.6	Very low	110 Å²	110	128.8 Å²	128.8	71%	0.714	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-87.8	149	175.9	34.6	-34.4	0	0	0	113.5
1070	T	30.8	Very low	35.5	Very low	116 Å²	116	127.9 Å²	127.9	71%	0.712	77%	0.771	S	S	*	*			trans	9	134.7	153.2	51.8	0	0	0	0	120.6	V1072	T1070-V1072 HydrophobicContact CG2-CG2 4.2Å
1071	Y	30.6	Very low	35.2	Very low	238 Å²	238	130.8 Å²	130.8	93%	0.933	78%	0.776	S	S	*	*			trans	-103.1	131.9	135.7	-130.9	-91.7	0	0	0	109.2
1072	V	31.6	Very low	34.9	Very low	119 Å²	119	129.6 Å²	129.6	72%	0.721	78%	0.777	S	S	*	*			trans	-123.2	128.5	177.5	169.3	0	0	0	0	108.8	T1070	T1070-V1072 HydrophobicContact CG2-CG2 4.2Å
1073	A	35.2	Very low	34.6	Very low	94 Å²	94	132.1 Å²	132.1	78%	0.777	78%	0.783	S	S	*	*			trans	-163.8	151	158.8	0	0	0	0	0	108.9
1074	A	34.7	Very low	34.5	Very low	80 Å²	80	131.6 Å²	131.6	66%	0.661	79%	0.785	S	S	*	*			cis	-164.6	141.5	-30.3	0	0	0	0	0	107
1075	D	34.1	Very low	34.7	Very low	145 Å²	145	132 Å²	132	78%	0.775	79%	0.787	S	S	*	*			trans	40.6	111.5	146.5	-61.6	-53.3	0	0	0	122.7
1076	S	33	Very low	34.8	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	77%	0.771	S	S	*	*				92.1	156.5	114.6	-68.1	0	0	0	0	120.6
1077	P	36.2	Very low	34.4	Very low	129 Å²	129	128.4 Å²	128.4	84%	0.838	77%	0.769	S	S	*	*			trans	-110	164.5	-152.3	40.7	-33.5	0	0	0	115.2
1078	G	34.4	Very low	34.1	Very low	80 Å²	80	128.1 Å²	128.1	83%	0.825	75%	0.754	S	S	*	*			trans	-154.3	119	172.9	0	0	0	0	0	113.6
1079	T	29	Very low	33.5	Very low	123 Å²	123	126.2 Å²	126.2	76%	0.755	74%	0.743	S	S	*	*			trans	-78.3	140.3	174.7	-47.8	0	0	0	0	110.8
1080	F	31.7	Very low	33.3	Very low	192 Å²	192	127.6 Å²	127.6	84%	0.842	74%	0.744	S	S	*	*				172.5	159.7	117.5	-102	-76.3	0	0	0	114.4
1081	T	30.1	Very low	33.4	Very low	126 Å²	126	126 Å²	126	77%	0.773	74%	0.743	S	S	*	*			trans	-95.2	147.6	-175.5	50.3	0	0	0	0	113.5
1082	A	33.3	Very low	33.3	Very low	102 Å²	102	120.1 Å²	120.1	84%	0.843	74%	0.737	S	S	*	*			trans	-149.2	152.1	150.7	0	0	0	0	0	111
1083	L	32.3	Very low	33.6	Very low	168 Å²	168	121.4 Å²	121.4	88%	0.88	74%	0.74	S	S	*	*			trans	-91.3	149.7	-176.2	-69.9	69.4	0	0	0	111.6
1084	S	36	Very low	33.8	Very low	122 Å²	122	122.9 Å²	122.9	85%	0.853	73%	0.734	S	S	*	*				-160.3	108.4	129.1	52.9	0	0	0	0	111.7
1085	Q	38.3	Very low	33.6	Very low	163 Å²	163	124.3 Å²	124.3	76%	0.762	74%	0.739	S	S	*	*			trans	-84.9	-171.8	160	-118.4	-171.5	32.7	0	0	108.4
1086	P	36.1	Very low	33.8	Very low	93 Å²	93	122.5 Å²	122.5	60%	0.604	73%	0.729	S	S	*	*			cis	-147	161.2	26.5	43	-23.1	0	0	0	119.5
1087	R	34.5	Very low	34.1	Very low	148 Å²	148	127.9 Å²	127.9	56%	0.558	74%	0.739	S	S	*	*			trans	54.6	162.4	137.7	-63.7	167.6	179.1	179.4	-7.4	118.2	F388 E389	F388-R1087 HydrophobicContact CE1-CB 3.51Å; F388-R1087 HydrophobicContact CE1-CG 4.29Å; F388-R1087 HydrophobicContact CZ-CB 3.41Å; F388-R1087 VanDerWaalsContact CZ-CB 3.41Å; E389-R1087 IonicContact OE1-CZ 2.69Å; E389-R1087 IonicContact OE1-NH1 3.7Å; E389-R1087 PolarHBondContact OE1-NH1 2.81Å
1088	R	32.8	Very low	34.3	Very low	104 Å²	104	133.2 Å²	133.2	39%	0.392	74%	0.742	S	S	.	*			cis	-151.2	170.8	20.3	-144	-170.5	-174.2	173.7	9.7	113.8	F388 E389 S390	F388-R1088 VanDerWaalsContact C-NH1 3.35Å; F388-R1088 HydrophobicContact CE1-CB 4.22Å; F388-R1088 HydrophobicContact CE1-CG 3.99Å; F388-R1088 HydrophobicContact CE2-CB 3.8Å; F388-R1088 HydrophobicContact CE2-CG 4.22Å; F388-R1088 HydrophobicContact CZ-CB 3.5Å; F388-R1088 HydrophobicContact CZ-CG 3.79Å; F388-R1088 PolarHBondContact O-NH1 3.22Å; F388-R1088 PolarHBondContact O-NH2 3.48Å; E389-R1088 PolarHBondContact O-NH2 3.15Å; S390-R1088 PolarHBondContact OG-NH2 3.34Å
1089	S	33.2	Very low	34.4	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	73%	0.734	S	S	*	*			trans	-66.3	162.1	166.5	-39.7	0	0	0	0	114.1
1090	D	31.3	Very low	34.8	Very low	139 Å²	139	139.1 Å²	139.1	74%	0.743	74%	0.74	S	S	*	*				172.2	171.9	90	-100.9	-41.7	0	0	0	116.3
1091	A	32.4	Very low	35.2	Very low	83 Å²	83	141.7 Å²	141.7	69%	0.686	74%	0.744	S	S	*	*			trans	64.2	106.5	151.7	0	0	0	0	0	121.7
1092	S	30.4	Very low	35.6	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	75%	0.745	S	S	*	*			trans	-28	128.1	149.5	52.6	0	0	0	0	118.4
1093	N	36.6	Very low	35.7	Very low	147 Å²	147	148.4 Å²	148.4	79%	0.786	75%	0.746	S	S	*	*			trans	-162.4	147.8	154.3	-87.2	-51.3	0	0	0	108.2
1094	L	39.8	Very low	36	Very low	124 Å²	124	149.6 Å²	149.6	65%	0.649	74%	0.744	S	S	*	*			cis	-154.3	148.9	-13.8	-131.6	169.8	0	0	0	109.2	L1096	L1094-L1096 PolarHBondContact O-N 2.97Å; L1094-L1096 VanDerWaalsContact O-N 3.07Å
1095	S	31.1	Very low	36.1	Very low	110 Å²	110	152.3 Å²	152.3	77%	0.769	74%	0.74	S	S	*	*			trans	-81.4	79.6	-179.9	58.3	0	0	0	0	112.9
1096	L	38	Very low	35.7	Very low	108 Å²	108	156.1 Å²	156.1	57%	0.565	75%	0.748	S	S	*	*			trans	-131	86.9	178.6	-75.5	177.7	0	0	0	113.7	L1094 I1099	L1094-L1096 PolarHBondContact O-N 2.97Å; L1094-L1096 VanDerWaalsContact O-N 3.07Å; L1096-I1099 HydrophobicContact CD2-CD1 4Å
1097	F	39.5	Very low	35.6	Very low	222 Å²	222	160.5 Å²	160.5	97%	0.974	76%	0.758	S	S	*	*	S	Bend	trans	-161.9	61.3	132.3	-91.8	-57.7	0	0	0	109.7
1098	R	39.5	Very low	35.6	Very low	240 Å²	240	165.4 Å²	165.4	91%	0.906	78%	0.776	S	S	*	*			trans	-128.2	24	178.9	-138.6	-178.8	-156.6	-174.2	8.6	113.5
1099	I	37.1	Very low	35.8	Very low	129 Å²	129	165 Å²	165	66%	0.662	79%	0.789	S	S	*	*			trans	-125.7	78.2	-173.3	-48.9	179	0	0	0	110.5	L1096	L1096-I1099 HydrophobicContact CD2-CD1 4Å
1100	F	37.6	Very low	35.7	Very low	198 Å²	198	167.4 Å²	167.4	87%	0.868	80%	0.8	S	S	*	*			trans	-151.5	48.4	150.1	-94.3	-57.7	0	0	0	111.3	H1102	F1100-H1102 PolarHBondContact O-N 3.48Å; F1100-H1102 VanDerWaalsContact O-N 3.08Å
1101	R	39.3	Very low	35.8	Very low	246 Å²	246	163.9 Å²	163.9	93%	0.928	80%	0.796	S	S	*	*			trans	-85.8	55.8	177.8	-154.7	-177.8	-165.6	-170.3	5.4	112.3
1102	H	39.2	Very low	35.8	Very low	172 Å²	172	165 Å²	165	80%	0.796	81%	0.806	S	S	*	*			trans	-85.2	120.9	178.3	-96	-90.2	0	0	0	112.9	F1100	F1100-H1102 PolarHBondContact O-N 3.48Å; F1100-H1102 VanDerWaalsContact O-N 3.08Å
1103	K	35	Very low	36	Very low	198 Å²	198	167.8 Å²	167.8	86%	0.861	81%	0.806	S	S	*	*			trans	-68.8	127.8	173.4	-60.3	171.2	-180	173.3	0	110.4
1104	K	38.8	Very low	36	Very low	193 Å²	193	170.4 Å²	170.4	84%	0.839	81%	0.811	S	S	*	*			trans	-164.7	127.6	137.8	-112.2	161.6	-174.3	175	0	114.2
1105	K	37.8	Very low	35.7	Very low	179 Å²	179	172.7 Å²	172.7	78%	0.778	82%	0.823	S	S	*	*			trans	52.2	129.1	150.9	-66	-177.3	174.6	-173.4	0	120.2
1106	R	30.4	Very low	35.9	Very low	243 Å²	243	174.2 Å²	174.2	92%	0.917	83%	0.827	S	S	*	*			trans	-51.3	137.3	156.7	-65	172.5	173.2	173.8	-3.4	110.3
1107	F	33.9	Very low	35.7	Very low	185 Å²	185	177.6 Å²	177.6	81%	0.811	83%	0.833	S	S	*	*			trans	-131.3	134	140.1	-89.3	-83.7	0	0	0	109
1108	R	34.3	Very low	35.4	Very low	251 Å²	251	178.7 Å²	178.7	95%	0.947	83%	0.831	S	S	*	*			trans	-115.3	107.6	167.5	-91.8	-174.9	168.6	-125.2	4.1	106.3
1109	S	36.6	Very low	35.1	Very low	95 Å²	95	176 Å²	176	66%	0.664	83%	0.829	S	S	*	*			trans	-168.2	124.3	166.6	43.7	0	0	0	0	111.1
1110	V	32.2	Very low	35.1	Very low	139 Å²	139	176.7 Å²	176.7	84%	0.842	84%	0.839	S	S	*	*			trans	26.7	123.9	134	-167.8	0	0	0	0	117.4
1111	G	33.3	Very low	35.1	Very low	65 Å²	65	174.6 Å²	174.6	67%	0.67	84%	0.837	S	S	*	*			trans	163.7	-24.1	166.9	0	0	0	0	0	116.5	E1113	G1111-E1113 PolarHBondContact O-N 2.83Å
1112	A	31	Very low	35.1	Very low	108 Å²	108	168.6 Å²	168.6	89%	0.893	82%	0.823	S	S	*	*			trans	-80.2	51.8	-173.7	0	0	0	0	0	114.1
1113	E	34.5	Very low	35.2	Very low	172 Å²	172	167.5 Å²	167.5	80%	0.804	82%	0.823	S	S	*	*			trans	-127.4	38.6	-175.1	-65.2	-172.5	-111	0	0	112.6	G1111	G1111-E1113 PolarHBondContact O-N 2.83Å
1114	K	36.6	Very low	35.9	Very low	202 Å²	202	164.9 Å²	164.9	88%	0.878	82%	0.818	S	S	*	*	S	Bend	trans	-151.1	5.4	174.5	-126.9	179.8	-176.7	-172.8	0	117.8
1115	L	33.9	Very low	36.3	Very low	172 Å²	172	163.1 Å²	163.1	90%	0.901	82%	0.818	S	S	*	*			trans	-130.3	63.2	-176.8	-69.2	174.1	0	0	0	112.2
1116	V	36.3	Very low	36.5	Very low	142 Å²	142	160.7 Å²	160.7	86%	0.861	81%	0.813	S	S	*	*			trans	-141.9	83.1	162.7	-174	0	0	0	0	108.7
1117	Y	32.9	Very low	37	Very low	178 Å²	178	157.3 Å²	157.3	70%	0.698	81%	0.813	S	S	*	*			trans	-157.7	148.3	169.4	-125.8	-90.6	0	0	0	105.7	K554	K554-Y1117 PolarHBondContact NZ-OH 3.41Å
1118	W	33.4	Very low	37.5	Very low	246 Å²	246	153.1 Å²	153.1	93%	0.932	81%	0.813	S	S	*	*	S	Bend	trans	70.7	61.9	-175.1	-59.5	57.4	0	0	0	116.7
1119	E	33.9	Very low	37.7	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	80%	0.799	S	S	*	*			trans	-154.8	50.2	159.4	-152.4	171.9	-141.5	0	0	112.8
1120	T	36.1	Very low	37.8	Very low	143 Å²	143	147 Å²	147	88%	0.877	80%	0.797	S	S	*	*			trans	-168.6	51.1	168.8	2	0	0	0	0	114.2
1121	N	37.3	Very low	38.4	Very low	155 Å²	155	146.4 Å²	146.4	83%	0.829	79%	0.793	S	S	*	*	S	Bend	trans	-117.6	141.3	159.6	-82.9	-2	0	0	0	108
1122	N	40.3	Very low	38.8	Very low	119 Å²	119	149.4 Å²	149.4	64%	0.636	79%	0.79	S	S	*	*			trans	-65.9	148.6	175.5	-62.5	-12.7	0	0	0	109.8
1123	L	41.3	Very low	39.5	Very low	149 Å²	149	145.8 Å²	145.8	78%	0.78	76%	0.763	S	S	*	*	S	Bend	trans	-101.4	6.8	-172.3	-132.3	80.1	0	0	0	113.5
1124	D	48.7	Very low	39.6	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	76%	0.759	S	S	*	*	S	Bend	trans	-96.8	-5.3	-163.4	-49.4	-76.7	0	0	0	114.4
1125	D	48.5	Very low	39.9	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	75%	0.747	S	S	*	*	S	Bend	trans	-95.8	14.5	-178.7	-75.7	-45.3	0	0	0	114
1126	L	40.4	Very low	40.7	Very low	128 Å²	128	143.3 Å²	143.3	67%	0.67	74%	0.736	S	S	*	*			trans	-116.2	40.7	-166	-97.5	169.5	0	0	0	115.5	I1129	L1126-I1129 HydrophobicContact CD2-CD1 3.97Å
1127	D	41.1	Very low	41.2	Very low	171 Å²	171	143.6 Å²	143.6	91%	0.914	73%	0.731	S	S	*	*	S	Bend	trans	-119.4	22.8	-177.1	-135.8	5.1	0	0	0	114.1
1128	A	44.2	Very low	42	Very low	98 Å²	98	141.5 Å²	141.5	81%	0.81	73%	0.731	S	S	*	*			trans	-132.3	1	-175.5	0	0	0	0	0	115.9	S1130	A1128-S1130 PolarHBondContact O-N 3.12Å
1129	I	38.5	Very low	42.6	Very low	130 Å²	130	136.9 Å²	136.9	67%	0.667	72%	0.72	S	S	*	*			trans	-83.7	108	177.7	-65.2	-178.6	0	0	0	109.7	L1126	L1126-I1129 HydrophobicContact CD2-CD1 3.97Å
1130	S	38.8	Very low	42.9	Very low	87 Å²	87	135.5 Å²	135.5	61%	0.608	72%	0.719	S	S	*	*			trans	-57.1	152.1	173.3	-172.9	0	0	0	0	112.3	A1128 E1132 G1133	A1128-S1130 PolarHBondContact O-N 3.12Å; S1130-E1132 PolarHBondContact O-N 3.06Å; S1130-G1133 PolarHBondContact O-N 3.19Å; S1130-G1133 VanDerWaalsContact O-N 3.15Å
1131	T	44.8	Very low	43	Very low	126 Å²	126	136 Å²	136	77%	0.773	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-58.7	-15.6	-173.8	45.9	0	0	0	0	115.2	G1133	T1131-G1133 PolarHBondContact O-N 3.22Å
1132	E	43.2	Very low	43.2	Very low	129 Å²	129	136.4 Å²	136.4	60%	0.603	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-53.4	-34.3	171.2	-167.1	71.9	-153.9	0	0	113.6	S1130 R1136	S1130-E1132 PolarHBondContact O-N 3.06Å; E1132-R1136 IonicContact OE1-NH2 2.71Å
1133	G	44	Very low	43	Very low	32 Å²	32	136.1 Å²	136.1	33%	0.33	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-74.1	-29.6	-171	0	0	0	0	0	115.1	S1130 T1131 H1135	S1130-G1133 PolarHBondContact O-N 3.19Å; S1130-G1133 VanDerWaalsContact O-N 3.15Å; T1131-G1133 PolarHBondContact O-N 3.22Å; G1133-H1135 PolarHBondContact O-N 2.84Å
1134	Y	38	Very low	42.8	Very low	183 Å²	183	137.3 Å²	137.3	72%	0.718	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-75.6	-26.5	-168.8	-127.2	-88.2	0	0	0	113.6
1135	H	42.5	Very low	42.2	Very low	135 Å²	135	135.8 Å²	135.8	63%	0.625	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-74.5	-24.8	-176.3	-90.7	-75	0	0	0	114.4	G1133 I1137	G1133-H1135 PolarHBondContact O-N 2.84Å; H1135-I1137 VanDerWaalsContact C-N 3.32Å; H1135-I1137 PolarHBondContact O-N 3.3Å
1136	R	49.6	Very low	41.7	Very low	175 Å²	175	134.3 Å²	134.3	66%	0.66	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-79.3	-12.7	-177.1	-58.6	-174.5	-168.1	-130.2	-1.5	114.1	E1132	E1132-R1136 IonicContact OE1-NH2 2.71Å
1137	I	47.5	Very low	41.5	Very low	148 Å²	148	134.7 Å²	134.7	76%	0.759	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-95.9	0.1	-177.5	-55.7	177.2	0	0	0	111.1	H1135	H1135-I1137 VanDerWaalsContact C-N 3.32Å; H1135-I1137 PolarHBondContact O-N 3.3Å
1138	L	49.6	Very low	41.5	Very low	134 Å²	134	133.8 Å²	133.8	70%	0.702	72%	0.718	S	S	*	*	S	Bend	trans	-126.6	20.5	-176	-68.6	171	0	0	0	113.3
1139	Q	46.4	Very low	41.2	Very low	149 Å²	149	134.9 Å²	134.9	70%	0.696	71%	0.71	S	S	*	*	S	Bend	trans	-130.2	-11.1	-178.2	-70	-169.3	-39	0	0	115.4	D1141	Q1139-D1141 PolarHBondContact O-N 3Å
1140	D	40.5	Very low	41.1	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	71%	0.71	S	S	*	*			trans	-99.1	57.8	178.8	-67.8	-18.2	0	0	0	111.4
1141	D	37.9	Very low	41	Very low	154 Å²	154	136 Å²	136	82%	0.824	71%	0.714	S	S	*	*			trans	-136.9	63.2	179.7	-135.3	-2.9	0	0	0	110.3	Q1139	Q1139-D1141 PolarHBondContact O-N 3Å
1142	D	40.7	Very low	40.7	Very low	163 Å²	163	140 Å²	140	87%	0.872	72%	0.715	S	S	*	*			trans	-169.7	154.1	162.5	-111.8	-28.8	0	0	0	111.2
1143	C	35.9	Very low	40.4	Very low	112 Å²	112	140.9 Å²	140.9	76%	0.757	72%	0.724	S	S	*	*			trans	69.1	127	167.1	-152.6	0	0	0	0	117.5
1144	E	37.9	Very low	39.8	Very low	175 Å²	175	152.9 Å²	152.9	82%	0.818	77%	0.767	S	S	*	*			cis	-152.7	158.2	-9.1	-129.9	176.3	-151.3	0	0	113.6
1145	T	36.9	Very low	39.9	Very low	111 Å²	111	151.4 Å²	151.4	68%	0.681	77%	0.77	S	S	*	*			trans	-31.3	125.6	164.9	-46.2	0	0	0	0	118.3
1146	C	36.8	Very low	39.7	Very low	126 Å²	126	152.2 Å²	152.2	85%	0.851	78%	0.777	S	S	*	*			trans	179.5	93.6	134.8	-93.3	0	0	0	0	108.4
1147	D	37.6	Very low	39.2	Very low	135 Å²	135	150.9 Å²	150.9	72%	0.722	78%	0.784	S	S	*	*				82	138.4	61.1	-150	5.9	0	0	0	114
1148	I	39.6	Very low	38.7	Very low	153 Å²	153	151.1 Å²	151.1	79%	0.785	79%	0.785	S	S	*	*			trans	66.2	139.7	172.7	-56.9	161.2	0	0	0	119.3
1149	D	37.9	Very low	38	Very low	120 Å²	120	152.2 Å²	152.2	64%	0.642	79%	0.79	S	S	*	*			cis	-165.8	169.4	-49	-150.9	-13.8	0	0	0	109.3
1150	Q	36.3	Very low	37.4	Very low	142 Å²	142	152.4 Å²	152.4	66%	0.664	80%	0.797	S	S	*	*			trans	43.2	101	145.9	-80.3	171.4	74.4	0	0	121
1151	S	38.2	Very low	37.2	Very low	99 Å²	99	152.2 Å²	152.2	69%	0.692	79%	0.794	S	S	*	*				81.6	165.4	118.7	88.9	0	0	0	0	118.8
1152	R	37	Very low	37.2	Very low	209 Å²	209	152.1 Å²	152.1	79%	0.789	79%	0.792	S	S	*	*			cis	-152.6	138.3	2.1	-146.2	156.6	-174.8	159.5	-0.5	112.1
1153	N	38.4	Very low	36.9	Very low	148 Å²	148	151.2 Å²	151.2	79%	0.791	79%	0.785	S	S	*	*			trans	31.6	125.1	154.3	-58.9	19.3	0	0	0	120.7
1154	K	30	Very low	37	Very low	284 Å²	284	154.7 Å²	154.7	100%	1.235	79%	0.788	S	S	*	*				-120.4	0	125.8	-136.9	-178.4	-173.1	-178.1	0	109.4

Retrieved 1,154 of 1,154 residues in 422.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).