X5D988_HUMAN Loading...

Neuronal PAS domain-containing protein 3

May play a broad role in neurogenesis. May control regulatory pathways relevant to schizophrenia and to psychotic illness.

AlphaFold DB , UniProt , Accession X5D988, Species HUMAN (Homo sapiens, Human), Gene NPAS3, Length 903 aa.

						>X5D988_HUMAN|X5D988|NPAS3
MAPTKPSFQQDPSRRERLQALRKEKSRDAARSRRGKENFEFYELAKLLPLPAAITSQLDKASIIRLTISYLKMRDFANQGDPPWNLRMEGPPPNTSVKVIGAQRRRSPSALAIEVFEAHLGSHILQSLDGFVFALNQEGKFLYISETVSIYLGLSQVELTGSSVFDYVHPGDHVEMAEQLGMKLPPGRGLLSQGTAEDGASSASSSSQSETPEPVESTSPSLLTTDNTLERSFFIRMKSTLTKRGVHIKSSGYKVIHITGRLRLRVSLSHGRTVPSQIMGLVVVAHALPPPTINEVRIDCHMFVTRVNMDLNIIYCENRISDYMDLTPVDIVGKRCYHFIHAEDVEGIRHSHLDLLNKGQCVTKYYRWMQKNGGYIWIQSSATIAINAKNANEKNIIWVNYLLSNPEYKDTPMDIAQLPHLPEKTSESSETSDSESDSKDTSGITEDNENSKSDEKGNQSENSEDPEPDRKKSGNACDNDMNCNDDGHSSSNPDSRDSDDSFEHSDFENPKAGEDGFGALGAMQIKVERYVESESDLRLQNCESLTSDSAKDSDSAGEAGAQASSKHQKRKKRRKRQKGGSASRRRLSSASSPGGLDAGLVEPPRLLSSPNSASVLKIKTEISEPINFDNDSSIWNYPPNREISRNESPYSMTKPPSSEHFPSPQGGGGGGGGGGGLHVAIPDSVLTPPGADGAAARKTQFGASATAALAPVASDPLSPPLSASPRDKHPGNGGGGGGGGGGAGGGGPSASNSLLYTGDLEALQRLQAGNVVLPLVHRVTGTLAATSTAAQRVYTTGTIRYAPAEVTLAMQSNLLPNAHAVNFVDVNSPGFGLDPKTPMEMLYHHVHRLNMSGPFGGAVSAASLTQMPAGNVFTTAEGLFSTLPFPVYSNGIHAAQTLERKED
					

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(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	41.3	Very low	50.6	Low	249 Å²	249	145.9 Å²	145.9	100%	1.227	79%	0.79	S	S	*	*				0	144.2	0	-72.9	165.6	165.9	0	0	108.5
2	A	42.6	Very low	51.5	Low	88 Å²	88	140.4 Å²	140.4	73%	0.727	77%	0.768	S	S	*	*			trans	-117.4	137.9	171.7	0	0	0	0	0	109.2	T4	A2-T4 PolarHBondContact O-N 3.34Å
3	P	54.7	Low	52.9	Low	130 Å²	130	134.6 Å²	134.6	84%	0.844	74%	0.744	S	S	*	*			trans	-69.3	119.8	-179.7	27.7	-33.4	0	0	0	110.2	K5	P3-K5 PolarHBondContact O-N 3.49Å
4	T	51.7	Low	54.4	Low	135 Å²	135	137.8 Å²	137.8	83%	0.828	74%	0.739	S	S	*	*			trans	-65.7	115.9	175.3	46.5	0	0	0	0	110	A2	A2-T4 PolarHBondContact O-N 3.34Å
5	K	52.7	Low	55.7	Low	197 Å²	197	137.6 Å²	137.6	86%	0.857	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-53.5	128.3	170.3	-70.9	-176.1	177.3	-179.2	0	109.3	P3 S7	P3-K5 PolarHBondContact O-N 3.49Å; K5-S7 PolarHBondContact O-N 2.97Å
6	P	49.7	Very low	57.1	Low	112 Å²	112	136.3 Å²	136.3	73%	0.727	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-62.5	125.3	174.2	26.1	-33	0	0	0	108.8	F8	P6-F8 PolarHBondContact O-N 2.93Å
7	S	48	Very low	58.5	Low	103 Å²	103	139.5 Å²	139.5	72%	0.72	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-70.9	117.3	176.9	50.1	0	0	0	0	109.1	K5 Q9	K5-S7 PolarHBondContact O-N 2.97Å; S7-Q9 PolarHBondContact O-N 3.46Å
8	F	51.2	Low	59.9	Low	197 Å²	197	136.1 Å²	136.1	86%	0.864	70%	0.696	S	S	*	*			trans	-65	83.7	169.6	-89.6	-89.4	0	0	0	109.8	P6 Q10	P6-F8 PolarHBondContact O-N 2.93Å; F8-Q10 PolarHBondContact O-N 2.9Å
9	Q	49.8	Very low	61.2	Low	175 Å²	175	134 Å²	134	82%	0.818	68%	0.683	S	S	*	*			trans	-60.8	107.8	154.2	-73.1	-174.6	-19.1	0	0	106.5	S7 D11	S7-Q9 PolarHBondContact O-N 3.46Å; Q9-D11 PolarHBondContact O-N 2.8Å
10	Q	57	Low	62.4	Low	136 Å²	136	130 Å²	130	64%	0.636	67%	0.671	S	S	*	*			trans	-64.2	104.5	169.4	-75.6	-172.8	-2.5	0	0	107.6	F8 P12	F8-Q10 PolarHBondContact O-N 2.9Å; Q10-P12 VanDerWaalsContact O-N 3.16Å
11	D	58.5	Low	63.6	Low	83 Å²	83	127.5 Å²	127.5	44%	0.444	66%	0.658	S	S	.	*			trans	-47	118.3	175	-178.8	-16.4	0	0	0	109.9	Q9 S13 R14 R15	Q9-D11 PolarHBondContact O-N 2.8Å; D11-S13 PolarHBondContact O-N 3.5Å; D11-S13 WeakPolarHBondContact OD1-CB 3.48Å; D11-S13 PolarHBondContact OD1-N 3.49Å; D11-S13 PolarHBondContact OD1-OG 2.84Å; D11-S13 PolarHBondContact OD2-OG 3.03Å; D11-R14 HydrophobicContact CB-CB 4.06Å; D11-R14 PolarHBondContact O-N 2.76Å; D11-R14 VanDerWaalsContact O-N 3.13Å; D11-R15 PolarHBondContact O-N 3.46Å; D11-R15 VanDerWaalsContact O-N 3.1Å
12	P	61	Low	65.9	Low	80 Å²	80	123.4 Å²	123.4	52%	0.519	63%	0.629	S	S	.	*	H	α-helix	trans	-60.4	-35.2	-178.1	24.1	-32.6	0	0	0	111.3	Q10 R14 R15 E16	Q10-P12 VanDerWaalsContact O-N 3.16Å; P12-R14 VanDerWaalsContact C-N 3.31Å; P12-R14 PolarHBondContact O-N 2.86Å; P12-R15 CarbonylContact O-C 3.59Å; P12-R15 WeakPolarHBondContact O-CA 3.2Å; P12-R15 WeakPolarHBondContact O-CB 3.07Å; P12-R15 PolarHBondContact O-N 2.92Å; P12-R15 VanDerWaalsContact O-N 3.07Å; P12-E16 WeakPolarHBondContact O-CB 3.45Å; P12-E16 VanDerWaalsContact O-CG 3.32Å; P12-E16 WeakPolarHBondContact O-CG 3.46Å; P12-E16 PolarHBondContact O-N 3.06Å
13	S	69.3	Low	68.3	Low	65 Å²	65	126.6 Å²	126.6	46%	0.455	63%	0.627	S	S	.	*	H	α-helix	trans	-63.7	-36.3	177.9	76.8	0	0	0	0	112	D11 E16 R17	D11-S13 PolarHBondContact O-N 3.5Å; D11-S13 WeakPolarHBondContact OD1-CB 3.48Å; D11-S13 PolarHBondContact OD1-N 3.49Å; D11-S13 PolarHBondContact OD1-OG 2.84Å; D11-S13 PolarHBondContact OD2-OG 3.03Å; S13-E16 PolarHBondContact O-N 3.09Å; S13-R17 VanDerWaalsContact O-CB 3.28Å; S13-R17 WeakPolarHBondContact O-CB 3.4Å; S13-R17 PolarHBondContact O-N 3.06Å
14	R	74.1	Confident	70	Confident	179 Å²	179	124.1 Å²	124.1	68%	0.675	60%	0.604	S	S	*	*	H	α-helix	trans	-69.2	-38.3	173.7	-172.9	177.3	178.5	-176.9	0.6	111.2	D11 P12 L18	D11-R14 HydrophobicContact CB-CB 4.06Å; D11-R14 PolarHBondContact O-N 2.76Å; D11-R14 VanDerWaalsContact O-N 3.13Å; P12-R14 VanDerWaalsContact C-N 3.31Å; P12-R14 PolarHBondContact O-N 2.86Å; R14-L18 HydrophobicContact CG-CD1 4.24Å; R14-L18 WeakPolarHBondContact O-CB 3.35Å; R14-L18 WeakPolarHBondContact O-CD1 3.35Å; R14-L18 WeakPolarHBondContact O-CG 3.37Å; R14-L18 PolarHBondContact O-N 3.26Å
15	R	74.4	Confident	72	Confident	135 Å²	135	125.4 Å²	125.4	51%	0.509	60%	0.598	S	S	.	*	H	α-helix	trans	-65.5	-43.6	175.1	-174.9	-176	-73	-179.8	-3.5	111.1	D11 P12 L18 Q19	D11-R15 PolarHBondContact O-N 3.46Å; D11-R15 VanDerWaalsContact O-N 3.1Å; P12-R15 CarbonylContact O-C 3.59Å; P12-R15 WeakPolarHBondContact O-CA 3.2Å; P12-R15 WeakPolarHBondContact O-CB 3.07Å; P12-R15 PolarHBondContact O-N 2.92Å; P12-R15 VanDerWaalsContact O-N 3.07Å; R15-L18 CarbonylContact O-C 3.55Å; R15-L18 PolarHBondContact O-N 3.12Å; R15-Q19 WeakPolarHBondContact O-CG 3.45Å; R15-Q19 PolarHBondContact O-N 2.7Å
16	E	77.3	Confident	74.1	Confident	117 Å²	117	119.8 Å²	119.8	55%	0.547	58%	0.584	S	S	.	*	H	α-helix	trans	-66.3	-46.9	177.9	-73.8	158	-164.3	0	0	111.7	P12 S13 L18 Q19 A20	P12-E16 WeakPolarHBondContact O-CB 3.45Å; P12-E16 VanDerWaalsContact O-CG 3.32Å; P12-E16 WeakPolarHBondContact O-CG 3.46Å; P12-E16 PolarHBondContact O-N 3.06Å; S13-E16 PolarHBondContact O-N 3.09Å; E16-L18 VanDerWaalsContact C-N 3.28Å; E16-L18 PolarHBondContact O-N 3.11Å; E16-Q19 CarbonylContact O-C 3.6Å; E16-Q19 WeakPolarHBondContact O-CA 3.26Å; E16-Q19 WeakPolarHBondContact O-CB 3.46Å; E16-Q19 PolarHBondContact O-N 3.22Å; E16-A20 PolarHBondContact O-N 3.12Å
17	R	81.4	Confident	76.2	Confident	190 Å²	190	120.5 Å²	120.5	72%	0.717	57%	0.572	S	S	*	*	H	α-helix	trans	-57.6	-40	172.2	-178.5	178.4	-89.3	-165.9	-5.7	111.6	S13 Q19 A20 L21	S13-R17 VanDerWaalsContact O-CB 3.28Å; S13-R17 WeakPolarHBondContact O-CB 3.4Å; S13-R17 PolarHBondContact O-N 3.06Å; R17-Q19 VanDerWaalsContact C-N 3.33Å; R17-Q19 PolarHBondContact O-N 2.72Å; R17-A20 PolarHBondContact O-N 2.85Å; R17-L21 HydrophobicContact CG-CD1 4.25Å; R17-L21 WeakPolarHBondContact O-CB 3.41Å; R17-L21 WeakPolarHBondContact O-CG 3.37Å; R17-L21 PolarHBondContact O-N 2.87Å
18	L	83.9	Confident	78.5	Confident	78 Å²	78	118.4 Å²	118.4	41%	0.408	55%	0.553	S	S	.	*	H	α-helix	trans	-71.7	-21.7	173.7	-72.7	170.3	0	0	0	113.7	R14 R15 E16 R22	R14-L18 HydrophobicContact CG-CD1 4.24Å; R14-L18 WeakPolarHBondContact O-CB 3.35Å; R14-L18 WeakPolarHBondContact O-CD1 3.35Å; R14-L18 WeakPolarHBondContact O-CG 3.37Å; R14-L18 PolarHBondContact O-N 3.26Å; R15-L18 CarbonylContact O-C 3.55Å; R15-L18 PolarHBondContact O-N 3.12Å; E16-L18 VanDerWaalsContact C-N 3.28Å; E16-L18 PolarHBondContact O-N 3.11Å; L18-R22 VanDerWaalsContact C-NH1 3.35Å; L18-R22 VanDerWaalsContact O-CG 3.3Å; L18-R22 WeakPolarHBondContact O-CG 3.35Å; L18-R22 PolarHBondContact O-N 2.93Å; L18-R22 PolarHBondContact O-NH1 3.42Å
19	Q	83.6	Confident	80.7	Confident	97 Å²	97	111.8 Å²	111.8	45%	0.453	53%	0.534	S	S	.	.	H	α-helix	trans	-80.2	-40.3	170.3	-75.1	177.8	0.3	0	0	111.2	R15 E16 R17 R22 K23	R15-Q19 WeakPolarHBondContact O-CG 3.45Å; R15-Q19 PolarHBondContact O-N 2.7Å; E16-Q19 CarbonylContact O-C 3.6Å; E16-Q19 WeakPolarHBondContact O-CA 3.26Å; E16-Q19 WeakPolarHBondContact O-CB 3.46Å; E16-Q19 PolarHBondContact O-N 3.22Å; R17-Q19 VanDerWaalsContact C-N 3.33Å; R17-Q19 PolarHBondContact O-N 2.72Å; Q19-R22 PolarHBondContact O-N 3.35Å; Q19-K23 WeakPolarHBondContact O-CG 3.37Å; Q19-K23 PolarHBondContact O-N 3.38Å
20	A	85.8	Confident	82.9	Confident	54 Å²	54	104.2 Å²	104.2	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-57.1	-52	172.7	0	0	0	0	0	110.9	E16 R17 R22 K23 E24	E16-A20 PolarHBondContact O-N 3.12Å; R17-A20 PolarHBondContact O-N 2.85Å; A20-R22 PolarHBondContact O-N 3.26Å; A20-K23 CarbonylContact O-C 3.57Å; A20-K23 PolarHBondContact O-N 3.16Å; A20-E24 VanDerWaalsContact O-CB 3.27Å; A20-E24 WeakPolarHBondContact O-CB 3.48Å; A20-E24 PolarHBondContact O-N 2.83Å
21	L	88.9	Confident	84.8	Confident	77 Å²	77	105.7 Å²	105.7	40%	0.403	50%	0.501	S	S	.	.	H	α-helix	trans	-60.2	-28.9	177	-71.8	167.8	0	0	0	113.8	R17 K25	R17-L21 HydrophobicContact CG-CD1 4.25Å; R17-L21 WeakPolarHBondContact O-CB 3.41Å; R17-L21 WeakPolarHBondContact O-CG 3.37Å; R17-L21 PolarHBondContact O-N 2.87Å; L21-K25 WeakPolarHBondContact O-CB 3.47Å; L21-K25 WeakPolarHBondContact O-CG 3.48Å; L21-K25 PolarHBondContact O-N 3Å; L21-K25 VanDerWaalsContact O-N 3.13Å
22	R	89.3	Confident	86.7	Confident	163 Å²	163	105.1 Å²	105.1	62%	0.615	50%	0.504	S	S	*	.	H	α-helix	trans	-74.7	-43.9	172.2	-74.8	178.4	-170	104.5	-13.8	111.9	L18 Q19 A20 E24 S26	L18-R22 VanDerWaalsContact C-NH1 3.35Å; L18-R22 VanDerWaalsContact O-CG 3.3Å; L18-R22 WeakPolarHBondContact O-CG 3.35Å; L18-R22 PolarHBondContact O-N 2.93Å; L18-R22 PolarHBondContact O-NH1 3.42Å; Q19-R22 PolarHBondContact O-N 3.35Å; A20-R22 PolarHBondContact O-N 3.26Å; R22-E24 VanDerWaalsContact C-N 3.3Å; R22-E24 PolarHBondContact O-N 3.36Å; R22-S26 VanDerWaalsContact O-CB 3.28Å; R22-S26 WeakPolarHBondContact O-CB 3.42Å; R22-S26 PolarHBondContact O-N 3.5Å
23	K	91.3	Very high	88.4	Confident	155 Å²	155	108.5 Å²	108.5	67%	0.674	51%	0.506	S	S	*	.	H	α-helix	trans	-62.1	-39.6	175.4	-73.2	179.3	176.5	-176.4	0	111.3	Q19 A20 S26 R27	Q19-K23 WeakPolarHBondContact O-CG 3.37Å; Q19-K23 PolarHBondContact O-N 3.38Å; A20-K23 CarbonylContact O-C 3.57Å; A20-K23 PolarHBondContact O-N 3.16Å; K23-S26 PolarHBondContact O-N 2.72Å; K23-R27 VanDerWaalsContact O-CB 3.27Å; K23-R27 WeakPolarHBondContact O-CB 3.29Å; K23-R27 PolarHBondContact O-N 3.37Å
24	E	92.1	Very high	89.8	Confident	79 Å²	79	112.3 Å²	112.3	37%	0.369	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-57.8	175.2	-179.9	140.2	-99	0	0	111.9	A20 R22 S26 R27 D28	A20-E24 VanDerWaalsContact O-CB 3.27Å; A20-E24 WeakPolarHBondContact O-CB 3.48Å; A20-E24 PolarHBondContact O-N 2.83Å; R22-E24 VanDerWaalsContact C-N 3.3Å; R22-E24 PolarHBondContact O-N 3.36Å; E24-S26 PolarHBondContact O-N 3.15Å; E24-R27 WeakPolarHBondContact O-CB 3.44Å; E24-R27 PolarHBondContact O-N 2.88Å; E24-R27 IonicContact OE1-CZ 2.82Å; E24-R27 IonicContact OE1-NH1 2.69Å; E24-R27 IonicContact OE1-NH2 2.74Å; E24-R27 PolarHBondContact OE1-NH2 3.03Å; E24-D28 WeakPolarHBondContact O-CB 3.46Å; E24-D28 VanDerWaalsContact O-CG 3.24Å; E24-D28 PolarHBondContact O-N 3.19Å
25	K	93.9	Very high	90.9	Very high	161 Å²	161	105.8 Å²	105.8	70%	0.7	50%	0.499	S	S	*	.	H	α-helix	trans	-55.7	-37.1	174.7	-73.2	-175.8	177.9	-165.2	0	112.7	L21 A29	L21-K25 WeakPolarHBondContact O-CB 3.47Å; L21-K25 WeakPolarHBondContact O-CG 3.48Å; L21-K25 PolarHBondContact O-N 3Å; L21-K25 VanDerWaalsContact O-N 3.13Å; K25-A29 WeakPolarHBondContact O-CB 3.48Å; K25-A29 PolarHBondContact O-N 2.75Å
26	S	95.4	Very high	92	Very high	80 Å²	80	106 Å²	106	56%	0.559	50%	0.504	S	S	*	.	H	α-helix	trans	-68.2	-44.7	175.4	-173.6	0	0	0	0	112.7	R22 K23 E24 D28 A30	R22-S26 VanDerWaalsContact O-CB 3.28Å; R22-S26 WeakPolarHBondContact O-CB 3.42Å; R22-S26 PolarHBondContact O-N 3.5Å; K23-S26 PolarHBondContact O-N 2.72Å; E24-S26 PolarHBondContact O-N 3.15Å; S26-D28 VanDerWaalsContact C-N 3.35Å; S26-D28 PolarHBondContact O-N 2.71Å; S26-A30 WeakPolarHBondContact O-CB 3.48Å; S26-A30 PolarHBondContact O-N 3.41Å
27	R	95.1	Very high	93	Very high	126 Å²	126	104 Å²	104	48%	0.475	49%	0.494	S	S	.	.	H	α-helix	trans	-59.1	-45.9	175.4	178.4	-169.2	69	-153.3	-8.3	111.1	K23 E24 A30 R31	K23-R27 VanDerWaalsContact O-CB 3.27Å; K23-R27 WeakPolarHBondContact O-CB 3.29Å; K23-R27 PolarHBondContact O-N 3.37Å; E24-R27 WeakPolarHBondContact O-CB 3.44Å; E24-R27 PolarHBondContact O-N 2.88Å; E24-R27 IonicContact OE1-CZ 2.82Å; E24-R27 IonicContact OE1-NH1 2.69Å; E24-R27 IonicContact OE1-NH2 2.74Å; E24-R27 PolarHBondContact OE1-NH2 3.03Å; R27-A30 PolarHBondContact O-N 2.96Å; R27-R31 WeakPolarHBondContact O-CB 3.38Å; R27-R31 PolarHBondContact O-N 3.08Å
28	D	96	Very high	93.8	Very high	60 Å²	60	99 Å²	99	32%	0.321	48%	0.481	S	S	.	.	H	α-helix	trans	-79.6	-35.1	-172.2	-57.4	-21	0	0	0	110.9	E24 S26 R31 S32	E24-D28 WeakPolarHBondContact O-CB 3.46Å; E24-D28 VanDerWaalsContact O-CG 3.24Å; E24-D28 PolarHBondContact O-N 3.19Å; S26-D28 VanDerWaalsContact C-N 3.35Å; S26-D28 PolarHBondContact O-N 2.71Å; D28-R31 PolarHBondContact O-N 3.05Å; D28-S32 WeakPolarHBondContact O-CB 3.35Å; D28-S32 PolarHBondContact O-N 2.8Å
29	A	96.6	Very high	94.4	Very high	58 Å²	58	100.6 Å²	100.6	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-38.6	166.6	0	0	0	0	0	112.4	K25 S32 R33	K25-A29 WeakPolarHBondContact O-CB 3.48Å; K25-A29 PolarHBondContact O-N 2.75Å; A29-S32 PolarHBondContact O-N 3.26Å; A29-R33 WeakPolarHBondContact O-CB 3.36Å; A29-R33 PolarHBondContact O-N 2.72Å
30	A	96.8	Very high	95.1	Very high	15 Å²	15	101.6 Å²	101.6	12%	0.124	49%	0.49	C	S	.	.	H	α-helix	trans	-68.9	-37.1	174.8	0	0	0	0	0	112.4	S26 R27 R34	S26-A30 WeakPolarHBondContact O-CB 3.48Å; S26-A30 PolarHBondContact O-N 3.41Å; R27-A30 PolarHBondContact O-N 2.96Å; A30-R34 WeakPolarHBondContact O-CG 3.46Å; A30-R34 PolarHBondContact O-N 2.91Å
31	R	96.8	Very high	95.7	Very high	168 Å²	168	101 Å²	101	63%	0.634	48%	0.478	S	S	*	.	H	α-helix	trans	-65	-46	172.3	-177.5	-176.2	-79.7	163.1	-9.3	111	R27 D28 R33 R34 G35	R27-R31 WeakPolarHBondContact O-CB 3.38Å; R27-R31 PolarHBondContact O-N 3.08Å; D28-R31 PolarHBondContact O-N 3.05Å; R31-R33 PolarHBondContact O-N 3.33Å; R31-R34 PolarHBondContact O-N 3.11Å; R31-G35 PolarHBondContact O-N 3.43Å
32	S	97.6	Very high	96.1	Very high	70 Å²	70	103.3 Å²	103.3	49%	0.49	48%	0.482	S	S	.	.	H	α-helix	trans	-60.5	-44.1	175.7	-177.4	0	0	0	0	111.8	D28 A29 G35 K36	D28-S32 WeakPolarHBondContact O-CB 3.35Å; D28-S32 PolarHBondContact O-N 2.8Å; A29-S32 PolarHBondContact O-N 3.26Å; S32-G35 PolarHBondContact O-N 3.16Å; S32-K36 PolarHBondContact O-N 2.98Å
33	R	97.9	Very high	96.5	Very high	152 Å²	152	98.4 Å²	98.4	57%	0.574	47%	0.466	S	S	*	.	H	α-helix	trans	-59.4	-49.9	174.7	-172.7	178.1	68.9	-112.6	5.4	111.8	A29 R31 G35 K36 E37	A29-R33 WeakPolarHBondContact O-CB 3.36Å; A29-R33 PolarHBondContact O-N 2.72Å; R31-R33 PolarHBondContact O-N 3.33Å; R33-G35 VanDerWaalsContact C-N 3.29Å; R33-G35 PolarHBondContact O-N 3.35Å; R33-K36 PolarHBondContact O-N 2.67Å; R33-E37 VanDerWaalsContact O-CB 3.22Å; R33-E37 WeakPolarHBondContact O-CB 3.45Å; R33-E37 PolarHBondContact O-N 3.08Å
34	R	97.8	Very high	96.8	Very high	145 Å²	145	93.6 Å²	93.6	55%	0.547	45%	0.447	S	S	.	.	H	α-helix	trans	-61.2	-35.4	176.3	-72.3	176	-171.5	135.3	-4.9	112.8	A30 R31 N38	A30-R34 WeakPolarHBondContact O-CG 3.46Å; A30-R34 PolarHBondContact O-N 2.91Å; R31-R34 PolarHBondContact O-N 3.11Å; R34-N38 VanDerWaalsContact O-CB 3.29Å; R34-N38 WeakPolarHBondContact O-CB 3.4Å; R34-N38 PolarHBondContact O-N 3.43Å; R34-N38 PolarHBondContact O-OD1 3.17Å
35	G	97.6	Very high	97.1	Very high	42 Å²	42	90 Å²	90	43%	0.433	43%	0.431	S	S	.	.	H	α-helix	trans	-63.5	-47.6	176	0	0	0	0	0	112.1	R31 S32 R33 F39	R31-G35 PolarHBondContact O-N 3.43Å; S32-G35 PolarHBondContact O-N 3.16Å; R33-G35 VanDerWaalsContact C-N 3.29Å; R33-G35 PolarHBondContact O-N 3.35Å; G35-F39 PolarHBondContact O-N 3.09Å; G35-F39 VanDerWaalsContact O-N 3.12Å
36	K	98.1	Very high	97.2	Very high	140 Å²	140	87.2 Å²	87.2	61%	0.609	42%	0.419	S	S	*	.	H	α-helix	trans	-63.5	-49.4	173.4	-67.3	-169.5	176.4	-162.4	0	111.7	S32 R33 N38 F39 E40	S32-K36 PolarHBondContact O-N 2.98Å; R33-K36 PolarHBondContact O-N 2.67Å; K36-N38 VanDerWaalsContact C-N 3.33Å; K36-N38 PolarHBondContact O-N 3.43Å; K36-F39 WeakPolarHBondContact O-CA 3.44Å; K36-F39 WeakPolarHBondContact O-CB 3.37Å; K36-F39 PolarHBondContact O-N 3.36Å; K36-E40 WeakPolarHBondContact O-CG 3.46Å; K36-E40 PolarHBondContact O-N 3.38Å
37	E	97.3	Very high	97.3	Very high	75 Å²	75	90 Å²	90	35%	0.35	43%	0.427	S	S	.	.	H	α-helix	trans	-51.1	-49.8	176	-175.2	-157.2	129.6	0	0	111.7	R33 F39 E40 F41 K60	R33-E37 VanDerWaalsContact O-CB 3.22Å; R33-E37 WeakPolarHBondContact O-CB 3.45Å; R33-E37 PolarHBondContact O-N 3.08Å; E37-F39 VanDerWaalsContact C-N 3.31Å; E37-F39 PolarHBondContact O-N 2.84Å; E37-E40 PolarHBondContact O-N 2.96Å; E37-F41 HydrophobicContact CG-CD2 4.03Å; E37-F41 HydrophobicContact CG-CE2 3.89Å; E37-F41 WeakPolarHBondContact O-CD2 3.48Å; E37-F41 PolarHBondContact O-N 2.74Å; E37-K60 IonicContact OE1-NZ 3.68Å; E37-K60 PolarHBondContact OE1-NZ 2.76Å
38	N	97.4	Very high	97.5	Very high	83 Å²	83	84.6 Å²	84.6	44%	0.444	41%	0.407	S	S	.	.	H	α-helix	trans	-61.1	-36.3	176	-73.6	6.8	0	0	0	113	R34 K36 Y42 K60	R34-N38 VanDerWaalsContact O-CB 3.29Å; R34-N38 WeakPolarHBondContact O-CB 3.4Å; R34-N38 PolarHBondContact O-N 3.43Å; R34-N38 PolarHBondContact O-OD1 3.17Å; K36-N38 VanDerWaalsContact C-N 3.33Å; K36-N38 PolarHBondContact O-N 3.43Å; N38-Y42 WeakPolarHBondContact O-CB 3.3Å; N38-Y42 PolarHBondContact O-N 3.04Å; N38-K60 WeakPolarHBondContact OD1-CE 3.44Å; N38-K60 PolarHBondContact OD1-NZ 3.42Å
39	F	97.8	Very high	97.5	Very high	113 Å²	113	85.8 Å²	85.8	50%	0.496	42%	0.418	S	S	.	.	H	α-helix	trans	-67.2	-48.2	175.8	175.3	-96.5	0	0	0	111.5	G35 K36 E37 F41 Y42 E43	G35-F39 PolarHBondContact O-N 3.09Å; G35-F39 VanDerWaalsContact O-N 3.12Å; K36-F39 WeakPolarHBondContact O-CA 3.44Å; K36-F39 WeakPolarHBondContact O-CB 3.37Å; K36-F39 PolarHBondContact O-N 3.36Å; E37-F39 VanDerWaalsContact C-N 3.31Å; E37-F39 PolarHBondContact O-N 2.84Å; F39-F41 VanDerWaalsContact C-N 3.27Å; F39-F41 PolarHBondContact O-N 3.03Å; F39-Y42 PolarHBondContact O-N 2.93Å; F39-E43 HydrophobicContact CD1-CG 4.31Å; F39-E43 HydrophobicContact CD2-CG 4.43Å; F39-E43 HydrophobicContact CE1-CG 3.8Å; F39-E43 HydrophobicContact CE2-CG 3.92Å; F39-E43 HydrophobicContact CZ-CG 3.58Å; F39-E43 PolarHBondContact O-N 2.92Å
40	E	98.2	Very high	97.4	Very high	117 Å²	117	84.7 Å²	84.7	55%	0.547	40%	0.404	S	S	.	.	H	α-helix	trans	-59.5	-38.6	175.5	-53.4	-50.8	144	0	0	111.6	K36 E37 Y42 L44	K36-E40 WeakPolarHBondContact O-CG 3.46Å; K36-E40 PolarHBondContact O-N 3.38Å; E37-E40 PolarHBondContact O-N 2.96Å; E40-Y42 PolarHBondContact O-N 3.05Å; E40-L44 WeakPolarHBondContact O-CB 3.41Å; E40-L44 PolarHBondContact O-N 3.18Å
41	F	98.1	Very high	97.4	Very high	43 Å²	43	88 Å²	88	19%	0.189	42%	0.424	C	S	.	.	H	α-helix	trans	-60.8	-41.3	172.9	-91.4	-70.4	0	0	0	112.8	E37 F39 A45 K60 I63 I64	E37-F41 HydrophobicContact CG-CD2 4.03Å; E37-F41 HydrophobicContact CG-CE2 3.89Å; E37-F41 WeakPolarHBondContact O-CD2 3.48Å; E37-F41 PolarHBondContact O-N 2.74Å; F39-F41 VanDerWaalsContact C-N 3.27Å; F39-F41 PolarHBondContact O-N 3.03Å; F41-A45 WeakPolarHBondContact O-CB 3.46Å; F41-A45 PolarHBondContact O-N 3.14Å; F41-K60 HydrophobicContact CD1-CB 4.09Å; F41-K60 HydrophobicContact CD1-CD 4.43Å; F41-K60 HydrophobicContact CD1-CG 3.84Å; F41-K60 HydrophobicContact CD2-CD 3.75Å; F41-K60 HydrophobicContact CD2-CG 4.02Å; F41-K60 HydrophobicContact CE1-CB 3.7Å; F41-K60 HydrophobicContact CE1-CD 4.27Å; F41-K60 HydrophobicContact CE1-CG 3.87Å; F41-K60 WeakPolarHBondContact CE1-O 3.26Å; F41-K60 HydrophobicContact CE2-CB 4.48Å; F41-K60 HydrophobicContact CE2-CD 3.6Å; F41-K60 HydrophobicContact CE2-CG 4.08Å; F41-K60 HydrophobicContact CG-CD 4.19Å; F41-K60 HydrophobicContact CG-CG 3.93Å; F41-K60 HydrophobicContact CZ-CB 3.94Å; F41-K60 HydrophobicContact CZ-CD 3.88Å; F41-K60 HydrophobicContact CZ-CG 4.01Å; F41-I63 HydrophobicContact CD1-CB 4.36Å; F41-I63 HydrophobicContact CD1-CD1 4.25Å; F41-I63 HydrophobicContact CD1-CG2 4.21Å; F41-I64 HydrophobicContact CE1-CD1 3.76Å; F41-I64 HydrophobicContact CE1-CG1 3.78Å; F41-I64 HydrophobicContact CZ-CD1 4.34Å; F41-I64 HydrophobicContact CZ-CG1 4.33Å
42	Y	96.5	Very high	97.3	Very high	125 Å²	125	83.6 Å²	83.6	49%	0.49	42%	0.424	S	S	.	.	H	α-helix	trans	-71.8	-42.6	-179.2	-177.2	-116.1	0	0	0	112.2	N38 F39 E40 A45 K46	N38-Y42 WeakPolarHBondContact O-CB 3.3Å; N38-Y42 PolarHBondContact O-N 3.04Å; F39-Y42 PolarHBondContact O-N 2.93Å; E40-Y42 PolarHBondContact O-N 3.05Å; Y42-A45 PolarHBondContact O-N 3.3Å; Y42-K46 WeakPolarHBondContact O-CG 3.44Å; Y42-K46 PolarHBondContact O-N 2.97Å
43	E	97.8	Very high	97.2	Very high	59 Å²	59	83.4 Å²	83.4	28%	0.276	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-39.8	173.1	-60.5	-49.1	122.8	0	0	111.4	F39 A45 K46 L47	F39-E43 HydrophobicContact CD1-CG 4.31Å; F39-E43 HydrophobicContact CD2-CG 4.43Å; F39-E43 HydrophobicContact CE1-CG 3.8Å; F39-E43 HydrophobicContact CE2-CG 3.92Å; F39-E43 HydrophobicContact CZ-CG 3.58Å; F39-E43 PolarHBondContact O-N 2.92Å; E43-A45 VanDerWaalsContact C-N 3.32Å; E43-A45 PolarHBondContact O-N 2.78Å; E43-K46 PolarHBondContact O-N 3.47Å; E43-K46 WeakPolarHBondContact OE1-CE 3.43Å; E43-K46 IonicContact OE1-NZ 3.71Å; E43-K46 PolarHBondContact OE1-NZ 3.38Å; E43-K46 IonicContact OE2-NZ 2.89Å; E43-K46 PolarHBondContact OE2-NZ 2.81Å; E43-L47 WeakPolarHBondContact O-CG 3.47Å; E43-L47 PolarHBondContact O-N 3.23Å
44	L	98.1	Very high	97.1	Very high	54 Å²	54	79.6 Å²	79.6	28%	0.283	42%	0.417	S	S	.	.	H	α-helix	trans	-62.2	-37.8	174.4	-178	59.6	0	0	0	112.3	E40 L47 I63 I64 T67	E40-L44 WeakPolarHBondContact O-CB 3.41Å; E40-L44 PolarHBondContact O-N 3.18Å; L44-L47 PolarHBondContact O-N 3.05Å; L44-I63 HydrophobicContact CB-CG2 4.29Å; L44-I63 HydrophobicContact CD2-CG2 3.9Å; L44-I63 HydrophobicContact CG-CG2 3.9Å; L44-I64 HydrophobicContact CD2-CD1 4.07Å; L44-T67 HydrophobicContact CD1-CG2 4Å; L44-T67 HydrophobicContact CD2-CG2 4.5Å
45	A	98.1	Very high	97	Very high	3 Å²	3	73.2 Å²	73.2	3%	0.025	39%	0.394	C	S	.	.	H	α-helix	trans	-63.2	-41	175.6	0	0	0	0	0	112.3	F41 Y42 E43 L47 L48 T55 I63	F41-A45 WeakPolarHBondContact O-CB 3.46Å; F41-A45 PolarHBondContact O-N 3.14Å; Y42-A45 PolarHBondContact O-N 3.3Å; E43-A45 VanDerWaalsContact C-N 3.32Å; E43-A45 PolarHBondContact O-N 2.78Å; A45-L47 PolarHBondContact O-N 3.12Å; A45-L48 WeakPolarHBondContact O-CB 3.31Å; A45-L48 PolarHBondContact O-N 3.47Å; A45-T55 VanDerWaalsContact O-CB 3.27Å; A45-T55 WeakPolarHBondContact O-CB 3.16Å; A45-T55 VanDerWaalsContact O-CG2 3.31Å; A45-T55 WeakPolarHBondContact O-CG2 3.18Å; A45-I63 HydrophobicContact CB-CD1 3.87Å; A45-I63 HydrophobicContact CB-CG1 4Å; A45-I63 HydrophobicContact CB-CG2 4.5Å
46	K	97.4	Very high	96.8	Very high	103 Å²	103	74.6 Å²	74.6	45%	0.448	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-26.3	175	-65.3	176.2	-164.1	165.7	0	113.7	Y42 E43 L48	Y42-K46 WeakPolarHBondContact O-CG 3.44Å; Y42-K46 PolarHBondContact O-N 2.97Å; E43-K46 PolarHBondContact O-N 3.47Å; E43-K46 WeakPolarHBondContact OE1-CE 3.43Å; E43-K46 IonicContact OE1-NZ 3.71Å; E43-K46 PolarHBondContact OE1-NZ 3.38Å; E43-K46 IonicContact OE2-NZ 2.89Å; E43-K46 PolarHBondContact OE2-NZ 2.81Å; K46-L48 VanDerWaalsContact C-N 3.33Å
47	L	97.6	Very high	96.7	Very high	139 Å²	139	75.8 Å²	75.8	73%	0.728	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-2.4	-179.4	-65.6	172.3	0	0	0	113.4	E43 L44 A45	E43-L47 WeakPolarHBondContact O-CG 3.47Å; E43-L47 PolarHBondContact O-N 3.23Å; L44-L47 PolarHBondContact O-N 3.05Å; A45-L47 PolarHBondContact O-N 3.12Å
48	L	97.5	Very high	96.6	Very high	12 Å²	12	73.5 Å²	73.5	6%	0.063	40%	0.395	C	S	.	.	S	Bend	trans	-72.8	144.9	171.5	-65.7	173.3	0	0	0	110.5	A45 K46 L50 T55 L58 L66	A45-L48 WeakPolarHBondContact O-CB 3.31Å; A45-L48 PolarHBondContact O-N 3.47Å; K46-L48 VanDerWaalsContact C-N 3.33Å; L48-L50 PolarHBondContact O-N 3.33Å; L48-T55 HydrophobicContact CB-CG2 4.13Å; L48-L58 HydrophobicContact CD1-CD1 3.55Å; L48-L66 HydrophobicContact CD1-CB 4Å; L48-L66 HydrophobicContact CD1-CD1 3.95Å; L48-L66 HydrophobicContact CD2-CB 3.92Å
49	P	96	Very high	96.6	Very high	86 Å²	86	73.6 Å²	73.6	56%	0.558	40%	0.395	S	S	*	.	S	Bend	trans	-78.2	59	179.4	35.8	-39	0	0	0	111.5	Y70	P49-Y70 HydrophobicContact CB-CE2 4.48Å; P49-Y70 HydrophobicContact CG-CD2 3.7Å; P49-Y70 HydrophobicContact CG-CE2 3.85Å; P49-Y70 HydrophobicContact CG-CG 4.4Å
50	L	95.6	Very high	96.6	Very high	35 Å²	35	71.9 Å²	71.9	18%	0.183	39%	0.388	C	S	.	.	S	Bend	trans	-139.5	150.2	-176.9	-69.6	174.7	0	0	0	110	L48 I54 T55 L66 V157	L48-L50 PolarHBondContact O-N 3.33Å; L50-I54 HydrophobicContact CD1-CG2 4.49Å; L50-T55 HydrophobicContact CB-CG2 3.6Å; L50-L66 HydrophobicContact CD1-CD1 3.91Å; L50-V157 HydrophobicContact CD1-CG2 4.1Å
51	P	96	Very high	96.6	Very high	84 Å²	84	69.5 Å²	69.5	55%	0.545	39%	0.388	S	S	.	.			trans	-52.6	139.9	174.9	-28.2	34.5	0	0	0	113.6	A53 I54 T55	P51-A53 PolarHBondContact O-N 2.77Å; P51-A53 VanDerWaalsContact O-N 3.11Å; P51-I54 HydrophobicContact CG-CD1 4.35Å; P51-I54 WeakPolarHBondContact O-CA 3.38Å; P51-I54 WeakPolarHBondContact O-CB 3.07Å; P51-I54 PolarHBondContact O-N 2.86Å; P51-T55 PolarHBondContact O-N 2.67Å; P51-T55 VanDerWaalsContact O-N 3.09Å
52	A	94.9	Very high	96.5	Very high	76 Å²	76	68 Å²	68	63%	0.628	38%	0.383	S	S	*	.	H	α-helix	trans	-57.8	-29.1	-178.1	0	0	0	0	0	113.9	I54 T55 S56	A52-I54 PolarHBondContact O-N 2.94Å; A52-T55 WeakPolarHBondContact CA-OG1 3.47Å; A52-S56 VanDerWaalsContact O-CB 3.31Å; A52-S56 WeakPolarHBondContact O-CB 3.45Å; A52-S56 PolarHBondContact O-N 3.4Å; A52-S56 VanDerWaalsContact O-N 3.16Å; A52-S56 PolarHBondContact O-OG 2.81Å
53	A	95.4	Very high	96.6	Very high	66 Å²	66	62.4 Å²	62.4	55%	0.545	36%	0.362	S	S	.	.	H	α-helix	trans	-63.7	-26.9	174	0	0	0	0	0	113.2	P51 Q57	P51-A53 PolarHBondContact O-N 2.77Å; P51-A53 VanDerWaalsContact O-N 3.11Å; A53-Q57 PolarHBondContact O-NE2 2.64Å
54	I	95.3	Very high	96.7	Very high	72 Å²	72	63 Å²	63	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-89.3	-50.1	175.9	-62.6	173.6	0	0	0	109.8	L50 P51 A52 S56 Q57 L58 V157	L50-I54 HydrophobicContact CD1-CG2 4.49Å; P51-I54 HydrophobicContact CG-CD1 4.35Å; P51-I54 WeakPolarHBondContact O-CA 3.38Å; P51-I54 WeakPolarHBondContact O-CB 3.07Å; P51-I54 PolarHBondContact O-N 2.86Å; A52-I54 PolarHBondContact O-N 2.94Å; I54-S56 VanDerWaalsContact C-N 3.26Å; I54-S56 PolarHBondContact O-N 2.82Å; I54-Q57 PolarHBondContact O-N 2.83Å; I54-L58 HydrophobicContact CG2-CD2 4.41Å; I54-V157 HydrophobicContact CG2-CG2 3.93Å
55	T	95.6	Very high	96.7	Very high	10 Å²	10	63.2 Å²	63.2	6%	0.061	36%	0.363	C	S	.	.	H	α-helix	trans	-63.7	-30.7	-173.1	58.8	0	0	0	0	113.6	A45 L48 L50 P51 A52 Q57 L58	A45-T55 VanDerWaalsContact O-CB 3.27Å; A45-T55 WeakPolarHBondContact O-CB 3.16Å; A45-T55 VanDerWaalsContact O-CG2 3.31Å; A45-T55 WeakPolarHBondContact O-CG2 3.18Å; L48-T55 HydrophobicContact CB-CG2 4.13Å; L50-T55 HydrophobicContact CB-CG2 3.6Å; P51-T55 PolarHBondContact O-N 2.67Å; P51-T55 VanDerWaalsContact O-N 3.09Å; A52-T55 WeakPolarHBondContact CA-OG1 3.47Å; T55-Q57 PolarHBondContact O-N 2.77Å; T55-L58 HydrophobicContact CG2-CD1 4.4Å; T55-L58 PolarHBondContact O-N 3.1Å
56	S	94.1	Very high	96.7	Very high	72 Å²	72	63.7 Å²	63.7	50%	0.503	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.1	174.9	53.1	0	0	0	0	114.9	A52 I54	A52-S56 VanDerWaalsContact O-CB 3.31Å; A52-S56 WeakPolarHBondContact O-CB 3.45Å; A52-S56 PolarHBondContact O-N 3.4Å; A52-S56 VanDerWaalsContact O-N 3.16Å; A52-S56 PolarHBondContact O-OG 2.81Å; I54-S56 VanDerWaalsContact C-N 3.26Å; I54-S56 PolarHBondContact O-N 2.82Å
57	Q	95.3	Very high	96.7	Very high	164 Å²	164	59.9 Å²	59.9	77%	0.766	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	0.4	-177.2	-60.3	-174.9	62.8	0	0	113.6	A53 I54 T55	A53-Q57 PolarHBondContact O-NE2 2.64Å; I54-Q57 PolarHBondContact O-N 2.83Å; T55-Q57 PolarHBondContact O-N 2.77Å
58	L	96.8	Very high	96.8	Very high	28 Å²	28	57.6 Å²	57.6	15%	0.147	34%	0.338	C	S	.	.			trans	-71	140.2	-176.8	-65	173.8	0	0	0	112.8	L48 I54 T55 I63 L66 V157	L48-L58 HydrophobicContact CD1-CD1 3.55Å; I54-L58 HydrophobicContact CG2-CD2 4.41Å; T55-L58 HydrophobicContact CG2-CD1 4.4Å; T55-L58 PolarHBondContact O-N 3.1Å; L58-I63 HydrophobicContact CB-CD1 4.19Å; L58-I63 HydrophobicContact CB-CG1 3.67Å; L58-I63 HydrophobicContact CD1-CG1 4.12Å; L58-L66 HydrophobicContact CD1-CD1 3.82Å; L58-L66 HydrophobicContact CD2-CD1 4.11Å; L58-V157 HydrophobicContact CD2-CG1 3.55Å; L58-V157 HydrophobicContact CD2-CG2 4.49Å
59	D	97	Very high	96.8	Very high	84 Å²	84	57.3 Å²	57.3	45%	0.449	34%	0.337	S	S	.	.			trans	-74.4	158.9	166.9	80.4	-88	0	0	0	111.8	A61 S62 I63	D59-A61 VanDerWaalsContact C-N 3.32Å; D59-A61 PolarHBondContact O-N 2.81Å; D59-A61 WeakPolarHBondContact OD2-CA 3.23Å; D59-A61 VanDerWaalsContact OD2-CB 3.29Å; D59-A61 WeakPolarHBondContact OD2-CB 3.4Å; D59-A61 PolarHBondContact OD2-N 3.35Å; D59-S62 PolarHBondContact O-N 2.87Å; D59-S62 WeakPolarHBondContact OD1-CB 3.48Å; D59-S62 PolarHBondContact OD1-OG 3.37Å; D59-S62 PolarHBondContact OD2-N 3.16Å; D59-I63 WeakPolarHBondContact O-CG1 3.2Å; D59-I63 PolarHBondContact O-N 2.74Å
60	K	97.3	Very high	96.9	Very high	77 Å²	77	58.1 Å²	58.1	34%	0.335	33%	0.329	S	S	.	.	H	α-helix	trans	-58.1	-37.1	-177.9	-74.6	-173.3	168.6	-175.9	0	114.5	E37 N38 F41 I64	E37-K60 IonicContact OE1-NZ 3.68Å; E37-K60 PolarHBondContact OE1-NZ 2.76Å; N38-K60 WeakPolarHBondContact OD1-CE 3.44Å; N38-K60 PolarHBondContact OD1-NZ 3.42Å; F41-K60 HydrophobicContact CD1-CB 4.09Å; F41-K60 HydrophobicContact CD1-CD 4.43Å; F41-K60 HydrophobicContact CD1-CG 3.84Å; F41-K60 HydrophobicContact CD2-CD 3.75Å; F41-K60 HydrophobicContact CD2-CG 4.02Å; F41-K60 HydrophobicContact CE1-CB 3.7Å; F41-K60 HydrophobicContact CE1-CD 4.27Å; F41-K60 HydrophobicContact CE1-CG 3.87Å; F41-K60 WeakPolarHBondContact CE1-O 3.26Å; F41-K60 HydrophobicContact CE2-CB 4.48Å; F41-K60 HydrophobicContact CE2-CD 3.6Å; F41-K60 HydrophobicContact CE2-CG 4.08Å; F41-K60 HydrophobicContact CG-CD 4.19Å; F41-K60 HydrophobicContact CG-CG 3.93Å; F41-K60 HydrophobicContact CZ-CB 3.94Å; F41-K60 HydrophobicContact CZ-CD 3.88Å; F41-K60 HydrophobicContact CZ-CG 4.01Å; K60-I64 PolarHBondContact O-N 3.3Å
61	A	97.8	Very high	97	Very high	68 Å²	68	59.9 Å²	59.9	56%	0.562	34%	0.339	S	S	*	.	H	α-helix	trans	-73.1	-40.3	-179.8	0	0	0	0	0	110.5	D59 I64 R65	D59-A61 VanDerWaalsContact C-N 3.32Å; D59-A61 PolarHBondContact O-N 2.81Å; D59-A61 WeakPolarHBondContact OD2-CA 3.23Å; D59-A61 VanDerWaalsContact OD2-CB 3.29Å; D59-A61 WeakPolarHBondContact OD2-CB 3.4Å; D59-A61 PolarHBondContact OD2-N 3.35Å; A61-I64 PolarHBondContact O-N 2.86Å; A61-R65 WeakPolarHBondContact O-CB 3.49Å; A61-R65 PolarHBondContact O-N 2.91Å
62	S	97.6	Very high	97	Very high	11 Å²	11	59.7 Å²	59.7	8%	0.077	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-38.9	172.5	-64.2	0	0	0	0	112.8	D59 I64 R65 L66	D59-S62 PolarHBondContact O-N 2.87Å; D59-S62 WeakPolarHBondContact OD1-CB 3.48Å; D59-S62 PolarHBondContact OD1-OG 3.37Å; D59-S62 PolarHBondContact OD2-N 3.16Å; S62-I64 PolarHBondContact O-N 3.18Å; S62-R65 PolarHBondContact O-N 3.04Å; S62-R65 PolarHBondContact OG-NH2 3.09Å; S62-L66 WeakPolarHBondContact O-CB 3.31Å; S62-L66 WeakPolarHBondContact O-CG 3.25Å; S62-L66 PolarHBondContact O-N 3.01Å
63	I	98.4	Very high	97.1	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-55.8	-54.3	174.2	-66.6	161.7	0	0	0	110.4	F41 L44 A45 L58 D59 R65 L66 T67	F41-I63 HydrophobicContact CD1-CB 4.36Å; F41-I63 HydrophobicContact CD1-CD1 4.25Å; F41-I63 HydrophobicContact CD1-CG2 4.21Å; L44-I63 HydrophobicContact CB-CG2 4.29Å; L44-I63 HydrophobicContact CD2-CG2 3.9Å; L44-I63 HydrophobicContact CG-CG2 3.9Å; A45-I63 HydrophobicContact CB-CD1 3.87Å; A45-I63 HydrophobicContact CB-CG1 4Å; A45-I63 HydrophobicContact CB-CG2 4.5Å; L58-I63 HydrophobicContact CB-CD1 4.19Å; L58-I63 HydrophobicContact CB-CG1 3.67Å; L58-I63 HydrophobicContact CD1-CG1 4.12Å; D59-I63 WeakPolarHBondContact O-CG1 3.2Å; D59-I63 PolarHBondContact O-N 2.74Å; I63-R65 PolarHBondContact O-N 3.31Å; I63-L66 PolarHBondContact O-N 3.14Å; I63-T67 PolarHBondContact O-N 3.43Å; I63-T67 PolarHBondContact O-OG1 3.38Å
64	I	98.4	Very high	97	Very high	70 Å²	70	59.8 Å²	59.8	36%	0.359	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-42.9	178.8	-59.2	-55.8	0	0	0	111.9	F41 L44 K60 A61 S62 L66 T67 I68	F41-I64 HydrophobicContact CE1-CD1 3.76Å; F41-I64 HydrophobicContact CE1-CG1 3.78Å; F41-I64 HydrophobicContact CZ-CD1 4.34Å; F41-I64 HydrophobicContact CZ-CG1 4.33Å; L44-I64 HydrophobicContact CD2-CD1 4.07Å; K60-I64 PolarHBondContact O-N 3.3Å; A61-I64 PolarHBondContact O-N 2.86Å; S62-I64 PolarHBondContact O-N 3.18Å; I64-L66 VanDerWaalsContact C-N 3.35Å; I64-L66 PolarHBondContact O-N 3.04Å; I64-T67 PolarHBondContact O-N 3.31Å; I64-I68 HydrophobicContact CG2-CD1 3.6Å; I64-I68 HydrophobicContact CG2-CG1 4.17Å; I64-I68 WeakPolarHBondContact O-CB 3.41Å; I64-I68 WeakPolarHBondContact O-CG1 3.45Å; I64-I68 PolarHBondContact O-N 2.92Å
65	R	98.3	Very high	96.8	Very high	60 Å²	60	59.8 Å²	59.8	23%	0.226	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-43.1	180	179.7	171	56.4	89.8	-0.9	111.5	A61 S62 I63 S69 V157 E158 T160 S162	A61-R65 WeakPolarHBondContact O-CB 3.49Å; A61-R65 PolarHBondContact O-N 2.91Å; S62-R65 PolarHBondContact O-N 3.04Å; S62-R65 PolarHBondContact OG-NH2 3.09Å; I63-R65 PolarHBondContact O-N 3.31Å; R65-S69 WeakPolarHBondContact O-CB 3.41Å; R65-S69 PolarHBondContact O-N 3.27Å; R65-S69 PolarHBondContact O-OG 3.24Å; R65-V157 VanDerWaalsContact CZ-O 3.28Å; R65-V157 PolarHBondContact NH1-O 2.9Å; R65-V157 PolarHBondContact NH2-O 3.33Å; R65-E158 PolarHBondContact NH1-O 3.09Å; R65-T160 WeakPolarHBondContact CG-O 3.46Å; R65-T160 PolarHBondContact NH1-O 3.04Å; R65-S162 PolarHBondContact NH1-OG 2.77Å
66	L	98.4	Very high	96.6	Very high	12 Å²	12	59.7 Å²	59.7	6%	0.063	30%	0.3	C	S	.	.	H	α-helix	trans	-68.5	-44.4	174.9	-68	172.4	0	0	0	111.8	L48 L50 L58 S62 I63 I64 I68 S69 Y70 V157 T160	L48-L66 HydrophobicContact CD1-CB 4Å; L48-L66 HydrophobicContact CD1-CD1 3.95Å; L48-L66 HydrophobicContact CD2-CB 3.92Å; L50-L66 HydrophobicContact CD1-CD1 3.91Å; L58-L66 HydrophobicContact CD1-CD1 3.82Å; L58-L66 HydrophobicContact CD2-CD1 4.11Å; S62-L66 WeakPolarHBondContact O-CB 3.31Å; S62-L66 WeakPolarHBondContact O-CG 3.25Å; S62-L66 PolarHBondContact O-N 3.01Å; I63-L66 PolarHBondContact O-N 3.14Å; I64-L66 VanDerWaalsContact C-N 3.35Å; I64-L66 PolarHBondContact O-N 3.04Å; L66-I68 PolarHBondContact O-N 3.01Å; L66-S69 PolarHBondContact O-N 3.37Å; L66-Y70 WeakPolarHBondContact O-CB 3.37Å; L66-Y70 PolarHBondContact O-N 2.81Å; L66-V157 HydrophobicContact CD1-CG1 4.32Å; L66-T160 HydrophobicContact CD2-CG2 3.78Å
67	T	98.4	Very high	96.5	Very high	24 Å²	24	56.9 Å²	56.9	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-58.9	-48	176.2	-57.4	0	0	0	0	111.9	L44 I63 I64 S69 Y70 L71	L44-T67 HydrophobicContact CD1-CG2 4Å; L44-T67 HydrophobicContact CD2-CG2 4.5Å; I63-T67 PolarHBondContact O-N 3.43Å; I63-T67 PolarHBondContact O-OG1 3.38Å; I64-T67 PolarHBondContact O-N 3.31Å; T67-S69 VanDerWaalsContact C-N 3.32Å; T67-S69 PolarHBondContact O-N 3.29Å; T67-Y70 PolarHBondContact O-N 2.95Å; T67-L71 HydrophobicContact CG2-CD1 4.07Å; T67-L71 VanDerWaalsContact O-CG 3.32Å; T67-L71 WeakPolarHBondContact O-CG 3.49Å; T67-L71 PolarHBondContact O-N 2.91Å
68	I	98.3	Very high	96.1	Very high	91 Å²	91	52.1 Å²	52.1	47%	0.467	26%	0.261	S	S	.	.	H	α-helix	trans	-61.7	-42.6	178.3	-70.3	173.2	0	0	0	110.7	I64 L66 L71 K72	I64-I68 HydrophobicContact CG2-CD1 3.6Å; I64-I68 HydrophobicContact CG2-CG1 4.17Å; I64-I68 WeakPolarHBondContact O-CB 3.41Å; I64-I68 WeakPolarHBondContact O-CG1 3.45Å; I64-I68 PolarHBondContact O-N 2.92Å; L66-I68 PolarHBondContact O-N 3.01Å; I68-L71 PolarHBondContact O-N 3.23Å; I68-K72 WeakPolarHBondContact O-CB 3.16Å; I68-K72 PolarHBondContact O-N 3.43Å
69	S	98.3	Very high	95.5	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-43.1	-179.2	-54.5	0	0	0	0	111.6	R65 L66 T67 L71 K72 M73 G161	R65-S69 WeakPolarHBondContact O-CB 3.41Å; R65-S69 PolarHBondContact O-N 3.27Å; R65-S69 PolarHBondContact O-OG 3.24Å; L66-S69 PolarHBondContact O-N 3.37Å; T67-S69 VanDerWaalsContact C-N 3.32Å; T67-S69 PolarHBondContact O-N 3.29Å; S69-L71 PolarHBondContact O-N 2.95Å; S69-K72 PolarHBondContact O-N 3.01Å; S69-M73 WeakPolarHBondContact O-CB 3.46Å; S69-M73 PolarHBondContact O-N 2.8Å; S69-G161 WeakPolarHBondContact OG-CA 3.32Å; S69-G161 PolarHBondContact OG-N 3.35Å
70	Y	98	Very high	94.5	Very high	102 Å²	102	50.7 Å²	50.7	40%	0.4	25%	0.252	S	S	.	.	H	α-helix	trans	-60.6	-44.2	174.7	173.9	-105.1	0	0	0	112.5	P49 L66 T67 M73 R74	P49-Y70 HydrophobicContact CB-CE2 4.48Å; P49-Y70 HydrophobicContact CG-CD2 3.7Å; P49-Y70 HydrophobicContact CG-CE2 3.85Å; P49-Y70 HydrophobicContact CG-CG 4.4Å; L66-Y70 WeakPolarHBondContact O-CB 3.37Å; L66-Y70 PolarHBondContact O-N 2.81Å; T67-Y70 PolarHBondContact O-N 2.95Å; Y70-M73 PolarHBondContact O-N 2.96Å; Y70-R74 PolarHBondContact O-N 3.45Å
71	L	97.7	Very high	93.4	Very high	72 Å²	72	53.2 Å²	53.2	38%	0.377	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-49.2	176	-69.1	172.4	0	0	0	111.3	T67 I68 S69 M73 R74 D75	T67-L71 HydrophobicContact CG2-CD1 4.07Å; T67-L71 VanDerWaalsContact O-CG 3.32Å; T67-L71 WeakPolarHBondContact O-CG 3.49Å; T67-L71 PolarHBondContact O-N 2.91Å; I68-L71 PolarHBondContact O-N 3.23Å; S69-L71 PolarHBondContact O-N 2.95Å; L71-M73 VanDerWaalsContact C-N 3.26Å; L71-M73 PolarHBondContact O-N 3.36Å; L71-R74 PolarHBondContact O-N 2.69Å; L71-D75 VanDerWaalsContact O-CG 3.27Å; L71-D75 PolarHBondContact O-N 3.44Å
72	K	96.2	Very high	92.5	Very high	81 Å²	81	54.3 Å²	54.3	35%	0.352	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-36.5	173.2	-80.2	-166.7	170.4	-166.9	0	112.3	I68 S69 D75 F76 N136 E138 L142	I68-K72 WeakPolarHBondContact O-CB 3.16Å; I68-K72 PolarHBondContact O-N 3.43Å; S69-K72 PolarHBondContact O-N 3.01Å; K72-D75 PolarHBondContact O-N 3.13Å; K72-F76 VanDerWaalsContact O-CB 3.25Å; K72-F76 WeakPolarHBondContact O-CB 3.46Å; K72-F76 PolarHBondContact O-N 3.28Å; K72-N136 PolarHBondContact NZ-ND2 3.33Å; K72-E138 IonicContact NZ-OE2 2.8Å; K72-E138 PolarHBondContact NZ-OE2 2.8Å; K72-L142 HydrophobicContact CB-CD2 3.59Å; K72-L142 HydrophobicContact CD-CD2 4.05Å; K72-L142 HydrophobicContact CG-CD2 4.48Å
73	M	95.5	Very high	91.8	Very high	25 Å²	25	57 Å²	57	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-69.3	-43.1	-179.9	-175	58.3	-172.2	0	0	111.8	S69 Y70 L71 D75 F76 A77 W84 A134 L142 Y143	S69-M73 WeakPolarHBondContact O-CB 3.46Å; S69-M73 PolarHBondContact O-N 2.8Å; Y70-M73 PolarHBondContact O-N 2.96Å; L71-M73 VanDerWaalsContact C-N 3.26Å; L71-M73 PolarHBondContact O-N 3.36Å; M73-D75 VanDerWaalsContact C-N 3.35Å; M73-F76 PolarHBondContact O-N 2.87Å; M73-F76 HydrophobicContact SD-CD1 4.35Å; M73-A77 VanDerWaalsContact O-CB 3.29Å; M73-A77 WeakPolarHBondContact O-CB 3.42Å; M73-A77 PolarHBondContact O-N 3.14Å; M73-W84 HydrophobicContact CE-CE3 4.2Å; M73-W84 HydrophobicContact CE-CH2 4.1Å; M73-W84 HydrophobicContact CE-CZ3 3.37Å; M73-A134 HydrophobicContact CE-CB 3.95Å; M73-A134 HydrophobicContact SD-CB 4.05Å; M73-L142 HydrophobicContact CB-CB 3.99Å; M73-L142 HydrophobicContact CG-CB 4.27Å; M73-L142 HydrophobicContact SD-CB 3.44Å; M73-L142 WeakPolarHBondContact SD-CB 3.07Å; M73-L142 HydrophobicContact SD-CD1 4.32Å; M73-Y143 HydrophobicContact CE-CG 4.18Å
74	R	93.4	Very high	91.2	Very high	118 Å²	118	62 Å²	62	45%	0.445	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-43.7	173.2	-171.9	-175.9	66.8	-173.9	-0.3	110.9	Y70 L71 F76 A77 N78	Y70-R74 PolarHBondContact O-N 3.45Å; L71-R74 PolarHBondContact O-N 2.69Å; R74-F76 VanDerWaalsContact C-N 3.33Å; R74-F76 PolarHBondContact O-N 3.25Å; R74-A77 PolarHBondContact O-N 3.2Å; R74-N78 WeakPolarHBondContact O-CB 3.4Å; R74-N78 PolarHBondContact O-N 2.83Å; R74-N78 PolarHBondContact O-ND2 2.97Å; R74-N78 PolarHBondContact O-OD1 3.43Å
75	D	91.4	Very high	89.9	Confident	73 Å²	73	63.3 Å²	63.3	39%	0.39	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-36.8	177.4	-67	-6.4	0	0	0	111.5	L71 K72 M73 Q79	L71-D75 VanDerWaalsContact O-CG 3.27Å; L71-D75 PolarHBondContact O-N 3.44Å; K72-D75 PolarHBondContact O-N 3.13Å; M73-D75 VanDerWaalsContact C-N 3.35Å; D75-Q79 WeakPolarHBondContact O-CB 3.42Å; D75-Q79 VanDerWaalsContact O-CG 3.28Å; D75-Q79 WeakPolarHBondContact O-CG 3.35Å; D75-Q79 PolarHBondContact O-N 2.92Å; D75-Q79 PolarHBondContact O-NE2 3.11Å
76	F	92.1	Very high	87.7	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.035	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-50.6	172.3	177.8	-88.4	0	0	0	111.4	K72 M73 R74 N78 Q79 W84 A134 L142 R263 M279 V282	K72-F76 VanDerWaalsContact O-CB 3.25Å; K72-F76 WeakPolarHBondContact O-CB 3.46Å; K72-F76 PolarHBondContact O-N 3.28Å; M73-F76 PolarHBondContact O-N 2.87Å; M73-F76 HydrophobicContact SD-CD1 4.35Å; R74-F76 VanDerWaalsContact C-N 3.33Å; R74-F76 PolarHBondContact O-N 3.25Å; F76-N78 PolarHBondContact O-N 3.49Å; F76-Q79 PolarHBondContact O-N 3.26Å; F76-W84 HydrophobicContact CE1-CH2 4.02Å; F76-W84 HydrophobicContact CE1-CZ2 4.13Å; F76-A134 HydrophobicContact CE1-CB 4.25Å; F76-L142 HydrophobicContact CB-CD1 3.56Å; F76-L142 HydrophobicContact CD1-CD1 4.35Å; F76-L142 HydrophobicContact CD2-CD1 3.77Å; F76-L142 HydrophobicContact CG-CD1 3.66Å; F76-R263 HydrophobicContact CE2-CB 4.48Å; F76-R263 HydrophobicContact CZ-CB 4.03Å; F76-R263 PolarHBondContact O-NH1 3.3Å; F76-M279 HydrophobicContact CB-CE 4.4Å; F76-M279 HydrophobicContact CD2-CB 3.95Å; F76-M279 HydrophobicContact CD2-CE 3.75Å; F76-M279 HydrophobicContact CE2-CB 3.71Å; F76-M279 HydrophobicContact CE2-CE 4.29Å; F76-M279 HydrophobicContact CG-CE 4.11Å; F76-M279 WeakPolarHBondContact O-CE 3.5Å; F76-V282 HydrophobicContact CE1-CG2 3.75Å; F76-V282 HydrophobicContact CZ-CG2 3.63Å
77	A	90.9	Very high	85.3	Confident	12 Å²	12	76.9 Å²	76.9	10%	0.099	38%	0.375	C	S	.	.	H	α-helix	trans	-52.1	-41.1	177.3	0	0	0	0	0	112.1	M73 R74 P83 W84 R263	M73-A77 VanDerWaalsContact O-CB 3.29Å; M73-A77 WeakPolarHBondContact O-CB 3.42Å; M73-A77 PolarHBondContact O-N 3.14Å; R74-A77 PolarHBondContact O-N 3.2Å; A77-P83 WeakPolarHBondContact O-CA 3.49Å; A77-W84 HydrophobicContact CB-CB 4.2Å; A77-W84 HydrophobicContact CB-CD2 4.3Å; A77-W84 HydrophobicContact CB-CE3 4.02Å; A77-W84 HydrophobicContact CB-CG 4.41Å; A77-W84 PolarHBondContact O-N 2.9Å; A77-R263 PolarHBondContact O-NH2 3.07Å
78	N	88.1	Confident	82.7	Confident	65 Å²	65	82.8 Å²	82.8	35%	0.348	40%	0.403	S	S	.	.	H	α-helix	trans	-77.2	-22.3	-178.2	-68.6	-15.4	0	0	0	116	R74 F76 N85	R74-N78 WeakPolarHBondContact O-CB 3.4Å; R74-N78 PolarHBondContact O-N 2.83Å; R74-N78 PolarHBondContact O-ND2 2.97Å; R74-N78 PolarHBondContact O-OD1 3.43Å; F76-N78 PolarHBondContact O-N 3.49Å; N78-N85 PolarHBondContact OD1-ND2 3.14Å
79	Q	84.6	Confident	80	Confident	77 Å²	77	85.2 Å²	85.2	36%	0.36	41%	0.412	S	S	.	.	H	α-helix	trans	-106.2	-15.2	-165.7	-80.5	177.2	98.4	0	0	116.3	D75 F76 M279	D75-Q79 WeakPolarHBondContact O-CB 3.42Å; D75-Q79 VanDerWaalsContact O-CG 3.28Å; D75-Q79 WeakPolarHBondContact O-CG 3.35Å; D75-Q79 PolarHBondContact O-N 2.92Å; D75-Q79 PolarHBondContact O-NE2 3.11Å; F76-Q79 PolarHBondContact O-N 3.26Å; Q79-M279 HydrophobicContact CB-CE 3.64Å; Q79-M279 HydrophobicContact CB-SD 4.36Å
80	G	76.1	Confident	77.4	Confident	5 Å²	5	87.3 Å²	87.3	5%	0.052	44%	0.435	C	S	.	.	S	Bend	trans	-96.1	165.9	172.9	0	0	0	0	0	111.5	P82 P83 R263	G80-P82 CarbonylContact O-C 3.57Å; G80-P82 VanDerWaalsContact O-O 3.07Å; G80-P83 WeakPolarHBondContact O-CA 3.33Å; G80-P83 VanDerWaalsContact O-N 3.13Å; G80-R263 VanDerWaalsContact C-NH2 3.26Å; G80-R263 PolarHBondContact O-NH2 3.39Å
81	D	73.8	Confident	74.5	Confident	129 Å²	129	88.1 Å²	88.1	69%	0.69	45%	0.452	S	S	*	.	S	Bend	trans	-98.4	136.2	-177	-163.9	23	0	0	0	111.7
82	P	78.1	Confident	71.8	Confident	91 Å²	91	88.7 Å²	88.7	59%	0.591	46%	0.461	S	S	*	.	S	Bend	cis	-62.8	156.3	-24.3	30.9	-35.3	0	0	0	111.2	G80 R263	G80-P82 CarbonylContact O-C 3.57Å; G80-P82 VanDerWaalsContact O-O 3.07Å; P82-R263 PolarHBondContact O-NH2 3.05Å
83	P	83.4	Confident	69.6	Low	68 Å²	68	91.2 Å²	91.2	44%	0.442	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-66.3	135.2	169.4	28.6	-34	0	0	0	109.2	A77 G80 N85	A77-P83 WeakPolarHBondContact O-CA 3.49Å; G80-P83 WeakPolarHBondContact O-CA 3.33Å; G80-P83 VanDerWaalsContact O-N 3.13Å; P83-N85 PolarHBondContact O-N 3.04Å; P83-N85 VanDerWaalsContact O-N 3.11Å
84	W	84.9	Confident	67	Low	112 Å²	112	96.7 Å²	96.7	42%	0.424	52%	0.515	S	S	.	.	S	Bend	trans	-74.3	-4.1	-170.6	-61.5	-8.1	0	0	0	114.6	M73 F76 A77 L86 R263 V282	M73-W84 HydrophobicContact CE-CE3 4.2Å; M73-W84 HydrophobicContact CE-CH2 4.1Å; M73-W84 HydrophobicContact CE-CZ3 3.37Å; F76-W84 HydrophobicContact CE1-CH2 4.02Å; F76-W84 HydrophobicContact CE1-CZ2 4.13Å; A77-W84 HydrophobicContact CB-CB 4.2Å; A77-W84 HydrophobicContact CB-CD2 4.3Å; A77-W84 HydrophobicContact CB-CE3 4.02Å; A77-W84 HydrophobicContact CB-CG 4.41Å; A77-W84 PolarHBondContact O-N 2.9Å; W84-L86 PolarHBondContact O-N 3.34Å; W84-L86 VanDerWaalsContact O-N 3.07Å; W84-R263 VanDerWaalsContact CD1-NH2 3.32Å; W84-R263 VanDerWaalsContact NE1-CZ 3.26Å; W84-V282 HydrophobicContact CH2-CG1 3.99Å; W84-V282 HydrophobicContact CH2-CG2 4.15Å; W84-V282 HydrophobicContact CZ2-CG1 4.07Å; W84-V282 HydrophobicContact CZ2-CG2 3.97Å
85	N	71.7	Confident	64.9	Low	99 Å²	99	97.3 Å²	97.3	53%	0.529	53%	0.532	S	S	.	.	S	Bend	trans	-73	98.7	167.2	-56.4	-35.4	0	0	0	108.6	N78 P83 R87	N78-N85 PolarHBondContact OD1-ND2 3.14Å; P83-N85 PolarHBondContact O-N 3.04Å; P83-N85 VanDerWaalsContact O-N 3.11Å; N85-R87 PolarHBondContact O-N 3.32Å
86	L	53.1	Low	62.9	Low	149 Å²	149	99 Å²	99	78%	0.78	55%	0.55	S	S	*	.			trans	-51.3	106.2	160.8	-79.8	159.8	0	0	0	108.4	W84 M88	W84-L86 PolarHBondContact O-N 3.34Å; W84-L86 VanDerWaalsContact O-N 3.07Å; L86-M88 PolarHBondContact O-N 2.8Å
87	R	47.7	Very low	60.3	Low	208 Å²	208	105 Å²	105	79%	0.785	59%	0.587	S	S	*	*			trans	-71.5	79.8	168.9	-84.2	-171.6	172.8	-106.6	4.8	108.8	N85 E89	N85-R87 PolarHBondContact O-N 3.32Å; R87-E89 PolarHBondContact O-N 3.37Å
88	M	44.3	Very low	58.2	Low	147 Å²	147	113.6 Å²	113.6	72%	0.724	62%	0.622	S	S	*	*			trans	-68	23.1	159.7	-71.2	-61.5	-157.9	0	0	112.4	L86 E117	L86-M88 PolarHBondContact O-N 2.8Å; M88-E117 WeakPolarHBondContact CE-OE1 3.32Å
89	E	41	Very low	55.7	Low	142 Å²	142	115.8 Å²	115.8	66%	0.664	64%	0.637	S	S	*	*			trans	-123.8	73.1	-178.4	-162	164.6	-138.8	0	0	107.8	R87	R87-E89 PolarHBondContact O-N 3.37Å
90	G	43.2	Very low	54	Low	50 Å²	50	119.4 Å²	119.4	52%	0.515	66%	0.657	S	S	.	*	S	Bend	trans	-57.4	165.4	145.1	0	0	0	0	0	109.7
91	P	36.8	Very low	52.4	Low	119 Å²	119	122.9 Å²	122.9	77%	0.773	69%	0.694	S	S	*	*	S	Bend	trans	-54.5	138.9	-174.4	23.8	-34.2	0	0	0	110.8
92	P	42.4	Very low	50.6	Low	85 Å²	85	120.7 Å²	120.7	55%	0.552	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55.7	145	-179	23.9	-34.5	0	0	0	109.8	N94	P92-N94 VanDerWaalsContact C-N 3.28Å; P92-N94 PolarHBondContact O-N 2.88Å
93	P	49.2	Very low	48.9	Very low	133 Å²	133	125.7 Å²	125.7	86%	0.864	71%	0.708	S	S	*	*			trans	-66.8	89.8	-179.3	27.3	-34.2	0	0	0	109.6
94	N	41.6	Very low	47	Very low	141 Å²	141	133.8 Å²	133.8	75%	0.754	73%	0.73	S	S	*	*			trans	-56.4	144.2	-176.8	-80	-28.8	0	0	0	110.7	P92	P92-N94 VanDerWaalsContact C-N 3.28Å; P92-N94 PolarHBondContact O-N 2.88Å
95	T	49.2	Very low	45.2	Very low	130 Å²	130	140.1 Å²	140.1	80%	0.798	75%	0.754	S	S	*	*	S	Bend	trans	-60.3	150.2	-164.1	44.1	0	0	0	0	114.4
96	S	47.8	Very low	44.3	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	76%	0.762	S	S	*	*			trans	65.5	89	163.8	57.4	0	0	0	0	118.8
97	V	39.1	Very low	44.2	Very low	133 Å²	133	139.5 Å²	139.5	81%	0.806	74%	0.742	S	S	*	*				-131	121.8	112.2	-174.3	0	0	0	0	108.6	V99	V97-V99 HydrophobicContact CG1-CG2 3.81Å; V97-V99 PolarHBondContact O-N 2.9Å
98	K	46.1	Very low	44.5	Very low	193 Å²	193	134 Å²	134	84%	0.839	73%	0.733	S	S	*	*			trans	-90.7	72.1	-179	-166.6	178.5	-176.9	179.8	0	110.5	I100	K98-I100 PolarHBondContact O-N 3.44Å
99	V	36.6	Very low	45	Very low	111 Å²	111	129.1 Å²	129.1	67%	0.673	71%	0.713	S	S	*	*			trans	-68.8	103.5	175.4	-176.2	0	0	0	0	109.4	V97	V97-V99 HydrophobicContact CG1-CG2 3.81Å; V97-V99 PolarHBondContact O-N 2.9Å
100	I	47.1	Very low	45.9	Very low	152 Å²	152	123.8 Å²	123.8	78%	0.779	69%	0.694	S	S	*	*			trans	-76.3	134.4	172	-61.7	171.3	0	0	0	108	K98	K98-I100 PolarHBondContact O-N 3.44Å
101	G	43.1	Very low	46.8	Very low	79 Å²	79	125.4 Å²	125.4	81%	0.814	69%	0.69	S	S	*	*			trans	103.5	31.3	170.4	0	0	0	0	0	117.1
102	A	35.8	Very low	47.9	Very low	82 Å²	82	121.7 Å²	121.7	68%	0.678	67%	0.669	S	S	*	*			trans	-122.2	94	166.2	0	0	0	0	0	110.9	R104	A102-R104 PolarHBondContact O-N 2.94Å
103	Q	42	Very low	48.9	Very low	196 Å²	196	122.4 Å²	122.4	92%	0.916	67%	0.667	S	S	*	*			trans	-70.5	96.9	173.8	-162.7	134.2	-50.5	0	0	108.5	R105	Q103-R105 PolarHBondContact O-N 3.14Å
104	R	45.3	Very low	49.7	Very low	238 Å²	238	121.3 Å²	121.3	90%	0.898	65%	0.651	S	S	*	*			trans	-55	99.8	177.5	-92	-167.7	176.8	-166.4	0.6	109.4	A102 R106	A102-R104 PolarHBondContact O-N 2.94Å; R104-R106 PolarHBondContact O-N 3.44Å
105	R	45.5	Very low	51	Low	246 Å²	246	118.9 Å²	118.9	93%	0.928	64%	0.641	S	S	*	*			trans	-61	105.8	154.8	-70.7	-169.4	179.5	-145.9	2.6	105.8	Q103 S107	Q103-R105 PolarHBondContact O-N 3.14Å; R105-S107 PolarHBondContact O-N 3.42Å; R105-S107 VanDerWaalsContact O-N 3.14Å
106	R	52.4	Low	52.1	Low	184 Å²	184	119 Å²	119	69%	0.694	63%	0.63	S	S	*	*			trans	-57.4	118.1	163.5	-74.9	-174	171.1	101.6	-6.5	105.9	R104	R104-R106 PolarHBondContact O-N 3.44Å
107	S	52	Low	53.5	Low	50 Å²	50	118.7 Å²	118.7	35%	0.35	62%	0.617	S	S	.	*			trans	-67.2	149.1	175.5	56.9	0	0	0	0	109.1	R105 S109 A110 L111	R105-S107 PolarHBondContact O-N 3.42Å; R105-S107 VanDerWaalsContact O-N 3.14Å; S107-S109 VanDerWaalsContact CB-OG 3.32Å; S107-S109 WeakPolarHBondContact CB-OG 3.37Å; S107-S109 PolarHBondContact O-N 3.28Å; S107-S109 PolarHBondContact OG-OG 2.87Å; S107-A110 WeakPolarHBondContact O-CB 3.44Å; S107-A110 PolarHBondContact O-N 2.84Å; S107-A110 WeakPolarHBondContact OG-CB 3.43Å; S107-A110 PolarHBondContact OG-N 3.07Å; S107-A110 VanDerWaalsContact OG-N 3.17Å; S107-L111 PolarHBondContact O-N 2.92Å
108	P	54.3	Low	55.4	Low	92 Å²	92	116 Å²	116	60%	0.597	61%	0.608	S	S	*	*	H	α-helix	trans	-55.2	-31.8	170.6	-26.8	35.9	0	0	0	112.2	L111 A112	P108-L111 PolarHBondContact O-N 2.88Å; P108-A112 WeakPolarHBondContact O-CB 3.24Å; P108-A112 PolarHBondContact O-N 2.94Å
109	S	54.8	Low	57.2	Low	45 Å²	45	111.6 Å²	111.6	32%	0.315	59%	0.591	S	S	.	*	H	α-helix	trans	-62.4	-37.4	172.9	50.8	0	0	0	0	113.9	S107 A112 I113	S107-S109 VanDerWaalsContact CB-OG 3.32Å; S107-S109 WeakPolarHBondContact CB-OG 3.37Å; S107-S109 PolarHBondContact O-N 3.28Å; S107-S109 PolarHBondContact OG-OG 2.87Å; S109-A112 PolarHBondContact O-N 2.81Å; S109-I113 WeakPolarHBondContact O-CB 3.5Å; S109-I113 WeakPolarHBondContact O-CD1 3.39Å; S109-I113 WeakPolarHBondContact O-CG1 3.19Å; S109-I113 PolarHBondContact O-N 2.84Å
110	A	60.6	Low	59.6	Low	31 Å²	31	110.5 Å²	110.5	26%	0.256	58%	0.58	S	S	.	*	H	α-helix	trans	-66.8	-42.5	178	0	0	0	0	0	111.4	S107 I113 E114	S107-A110 WeakPolarHBondContact O-CB 3.44Å; S107-A110 PolarHBondContact O-N 2.84Å; S107-A110 WeakPolarHBondContact OG-CB 3.43Å; S107-A110 PolarHBondContact OG-N 3.07Å; S107-A110 VanDerWaalsContact OG-N 3.17Å; A110-I113 PolarHBondContact O-N 2.74Å; A110-E114 WeakPolarHBondContact O-CB 3.48Å; A110-E114 WeakPolarHBondContact O-CG 3.33Å; A110-E114 PolarHBondContact O-N 2.66Å
111	L	60.2	Low	61.6	Low	84 Å²	84	105.5 Å²	105.5	44%	0.44	57%	0.567	S	S	.	*	H	α-helix	trans	-68.6	-36.7	175.7	-71.2	168.9	0	0	0	112.3	S107 P108 E114 V115	S107-L111 PolarHBondContact O-N 2.92Å; P108-L111 PolarHBondContact O-N 2.88Å; L111-E114 PolarHBondContact O-N 3.06Å; L111-V115 WeakPolarHBondContact O-CB 3.48Å; L111-V115 VanDerWaalsContact O-CG2 3.29Å; L111-V115 WeakPolarHBondContact O-CG2 3.39Å; L111-V115 PolarHBondContact O-N 3.15Å
112	A	60	Low	63.8	Low	40 Å²	40	104.5 Å²	104.5	33%	0.331	55%	0.547	S	S	.	.	H	α-helix	trans	-63.1	-44.5	173.5	0	0	0	0	0	111.4	P108 S109 V115 F116	P108-A112 WeakPolarHBondContact O-CB 3.24Å; P108-A112 PolarHBondContact O-N 2.94Å; S109-A112 PolarHBondContact O-N 2.81Å; A112-V115 PolarHBondContact O-N 3.2Å; A112-F116 HydrophobicContact CB-CD2 4.36Å; A112-F116 HydrophobicContact CB-CE2 4.34Å; A112-F116 WeakPolarHBondContact O-CB 3.2Å; A112-F116 WeakPolarHBondContact O-CD2 3.34Å; A112-F116 PolarHBondContact O-N 2.65Å
113	I	63.6	Low	66.4	Low	100 Å²	100	104.4 Å²	104.4	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-60.4	-52.2	174.2	-68.9	162.8	0	0	0	110.1	S109 A110 V115 F116 E117	S109-I113 WeakPolarHBondContact O-CB 3.5Å; S109-I113 WeakPolarHBondContact O-CD1 3.39Å; S109-I113 WeakPolarHBondContact O-CG1 3.19Å; S109-I113 PolarHBondContact O-N 2.84Å; A110-I113 PolarHBondContact O-N 2.74Å; I113-V115 PolarHBondContact O-N 2.88Å; I113-F116 PolarHBondContact O-N 3.09Å; I113-E117 WeakPolarHBondContact O-CB 3.33Å; I113-E117 PolarHBondContact O-N 3.21Å
114	E	67.1	Low	68.8	Low	111 Å²	111	99.3 Å²	99.3	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-54.6	-36.8	178.2	-75	171.9	-170.1	0	0	112.7	A110 L111 A118	A110-E114 WeakPolarHBondContact O-CB 3.48Å; A110-E114 WeakPolarHBondContact O-CG 3.33Å; A110-E114 PolarHBondContact O-N 2.66Å; L111-E114 PolarHBondContact O-N 3.06Å; E114-A118 WeakPolarHBondContact O-CB 3.33Å; E114-A118 PolarHBondContact O-N 3.22Å
115	V	69.4	Low	71.1	Confident	90 Å²	90	89.1 Å²	89.1	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-77.8	-45	179.1	169.3	0	0	0	0	113.2	L111 A112 I113 H119	L111-V115 WeakPolarHBondContact O-CB 3.48Å; L111-V115 VanDerWaalsContact O-CG2 3.29Å; L111-V115 WeakPolarHBondContact O-CG2 3.39Å; L111-V115 PolarHBondContact O-N 3.15Å; A112-V115 PolarHBondContact O-N 3.2Å; I113-V115 PolarHBondContact O-N 2.88Å; V115-H119 PolarHBondContact O-ND1 3.36Å
116	F	71.2	Confident	73.3	Confident	132 Å²	132	84.7 Å²	84.7	58%	0.579	46%	0.464	S	S	*	.	H	α-helix	trans	-73.9	-36.5	-179.6	-72	-57.6	0	0	0	112.3	A112 I113 H119 L120	A112-F116 HydrophobicContact CB-CD2 4.36Å; A112-F116 HydrophobicContact CB-CE2 4.34Å; A112-F116 WeakPolarHBondContact O-CB 3.2Å; A112-F116 WeakPolarHBondContact O-CD2 3.34Å; A112-F116 PolarHBondContact O-N 2.65Å; I113-F116 PolarHBondContact O-N 3.09Å; F116-H119 PolarHBondContact O-N 3.4Å; F116-L120 WeakPolarHBondContact O-CA 3.44Å; F116-L120 WeakPolarHBondContact O-CB 3.46Å; F116-L120 PolarHBondContact O-N 2.89Å
117	E	77.9	Confident	75.3	Confident	104 Å²	104	81 Å²	81	49%	0.486	47%	0.466	S	S	.	.	H	α-helix	trans	-64.9	-41.2	178.3	-172.5	168	-155.5	0	0	111.4	M88 I113 H119 L120	M88-E117 WeakPolarHBondContact CE-OE1 3.32Å; I113-E117 WeakPolarHBondContact O-CB 3.33Å; I113-E117 PolarHBondContact O-N 3.21Å; E117-H119 PolarHBondContact O-N 2.83Å; E117-H119 VanDerWaalsContact O-N 3.15Å; E117-L120 WeakPolarHBondContact O-CB 3.4Å; E117-L120 PolarHBondContact O-N 2.83Å
118	A	78.6	Confident	77.2	Confident	75 Å²	75	81 Å²	81	62%	0.62	46%	0.462	S	S	*	.	H	α-helix	trans	-60.1	-24.4	177.6	0	0	0	0	0	114.4	E114	E114-A118 WeakPolarHBondContact O-CB 3.33Å; E114-A118 PolarHBondContact O-N 3.22Å
119	H	84.3	Confident	78.9	Confident	102 Å²	102	82 Å²	82	47%	0.472	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	8.2	-177.5	-55.8	93.1	0	0	0	113.1	V115 F116 E117 G121 S122 H123	V115-H119 PolarHBondContact O-ND1 3.36Å; F116-H119 PolarHBondContact O-N 3.4Å; E117-H119 PolarHBondContact O-N 2.83Å; E117-H119 VanDerWaalsContact O-N 3.15Å; H119-G121 VanDerWaalsContact C-N 3.31Å; H119-G121 PolarHBondContact O-N 3.28Å; H119-S122 WeakPolarHBondContact O-CB 3.27Å; H119-S122 PolarHBondContact O-N 3Å; H119-H123 PolarHBondContact O-CD2 2.98Å; H119-H123 PolarHBondContact O-N 2.8Å
120	L	86.8	Confident	80.8	Confident	87 Å²	87	79.9 Å²	79.9	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-55.6	-42	-169.5	-179.7	59.8	0	0	0	113.1	F116 E117 S122 H123 I124	F116-L120 WeakPolarHBondContact O-CA 3.44Å; F116-L120 WeakPolarHBondContact O-CB 3.46Å; F116-L120 PolarHBondContact O-N 2.89Å; E117-L120 WeakPolarHBondContact O-CB 3.4Å; E117-L120 PolarHBondContact O-N 2.83Å; L120-S122 PolarHBondContact O-N 2.82Å; L120-H123 PolarHBondContact O-N 3.02Å; L120-I124 HydrophobicContact CD1-CD1 3.94Å; L120-I124 HydrophobicContact CD1-CG1 4.17Å; L120-I124 HydrophobicContact CG-CD1 3.83Å; L120-I124 HydrophobicContact CG-CG1 4.48Å; L120-I124 WeakPolarHBondContact O-CB 3.41Å; L120-I124 VanDerWaalsContact O-CG1 3.26Å; L120-I124 WeakPolarHBondContact O-CG1 3.3Å; L120-I124 PolarHBondContact O-N 2.71Å
121	G	87.9	Confident	82.6	Confident	48 Å²	48	78.4 Å²	78.4	50%	0.495	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-42.4	177.4	0	0	0	0	0	113.1	H119 L125	H119-G121 VanDerWaalsContact C-N 3.31Å; H119-G121 PolarHBondContact O-N 3.28Å; G121-L125 WeakPolarHBondContact O-CG 3.44Å; G121-L125 PolarHBondContact O-N 2.81Å; G121-L125 VanDerWaalsContact O-N 3.12Å
122	S	89.3	Confident	84.4	Confident	57 Å²	57	75.8 Å²	75.8	40%	0.399	42%	0.423	S	S	.	.	H	α-helix	trans	-67.8	-42.2	177	-53.3	0	0	0	0	111.4	H119 L120 L125 Q126	H119-S122 WeakPolarHBondContact O-CB 3.27Å; H119-S122 PolarHBondContact O-N 3Å; L120-S122 PolarHBondContact O-N 2.82Å; S122-L125 PolarHBondContact O-N 2.88Å; S122-Q126 VanDerWaalsContact O-CB 3.3Å; S122-Q126 WeakPolarHBondContact O-CB 3.41Å; S122-Q126 VanDerWaalsContact O-CG 3.22Å; S122-Q126 WeakPolarHBondContact O-CG 3.36Å; S122-Q126 PolarHBondContact O-N 2.88Å
123	H	90.8	Very high	86.2	Confident	80 Å²	80	74 Å²	74	37%	0.37	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175.8	-70.4	-48.4	0	0	0	112.1	H119 L120 L125 Q126 S127	H119-H123 PolarHBondContact O-CD2 2.98Å; H119-H123 PolarHBondContact O-N 2.8Å; L120-H123 PolarHBondContact O-N 3.02Å; H123-L125 VanDerWaalsContact C-N 3.33Å; H123-L125 PolarHBondContact O-N 2.87Å; H123-Q126 PolarHBondContact O-N 3.13Å; H123-S127 WeakPolarHBondContact O-CB 3.44Å; H123-S127 PolarHBondContact O-N 2.86Å; H123-S127 PolarHBondContact O-OG 2.88Å
124	I	93.1	Very high	87.9	Confident	89 Å²	89	69.2 Å²	69.2	46%	0.456	38%	0.383	S	S	.	.	H	α-helix	trans	-56.4	-47.6	175.6	-71.3	165.4	0	0	0	110.8	L120 L128	L120-I124 HydrophobicContact CD1-CD1 3.94Å; L120-I124 HydrophobicContact CD1-CG1 4.17Å; L120-I124 HydrophobicContact CG-CD1 3.83Å; L120-I124 HydrophobicContact CG-CG1 4.48Å; L120-I124 WeakPolarHBondContact O-CB 3.41Å; L120-I124 VanDerWaalsContact O-CG1 3.26Å; L120-I124 WeakPolarHBondContact O-CG1 3.3Å; L120-I124 PolarHBondContact O-N 2.71Å; I124-L128 HydrophobicContact CG2-CD1 4.17Å; I124-L128 WeakPolarHBondContact O-CD1 3.34Å; I124-L128 VanDerWaalsContact O-CG 3.3Å; I124-L128 WeakPolarHBondContact O-CG 3.41Å; I124-L128 PolarHBondContact O-N 2.9Å
125	L	94.4	Very high	89.4	Confident	25 Å²	25	64 Å²	64	13%	0.131	36%	0.358	C	S	.	.	H	α-helix	trans	-72.1	-30.5	-178.3	-67.3	-178.5	0	0	0	113.5	G121 S122 H123 V132 T147	G121-L125 WeakPolarHBondContact O-CG 3.44Å; G121-L125 PolarHBondContact O-N 2.81Å; G121-L125 VanDerWaalsContact O-N 3.12Å; S122-L125 PolarHBondContact O-N 2.88Å; H123-L125 VanDerWaalsContact C-N 3.33Å; H123-L125 PolarHBondContact O-N 2.87Å; L125-V132 HydrophobicContact CD2-CG2 4.21Å; L125-T147 HydrophobicContact CB-CG2 4.15Å
126	Q	91.8	Very high	90.6	Very high	153 Å²	153	59.9 Å²	59.9	72%	0.715	33%	0.333	S	S	*	.	H	α-helix	trans	-82	-22.8	178.4	-71.4	172.8	-3.6	0	0	113.6	S122 H123	S122-Q126 VanDerWaalsContact O-CB 3.3Å; S122-Q126 WeakPolarHBondContact O-CB 3.41Å; S122-Q126 VanDerWaalsContact O-CG 3.22Å; S122-Q126 WeakPolarHBondContact O-CG 3.36Å; S122-Q126 PolarHBondContact O-N 2.88Å; H123-Q126 PolarHBondContact O-N 3.13Å
127	S	92.9	Very high	91.6	Very high	106 Å²	106	57.5 Å²	57.5	74%	0.741	32%	0.324	S	S	*	.	H	α-helix	trans	-88.9	-9.8	176.1	-64.2	0	0	0	0	114.2	H123	H123-S127 WeakPolarHBondContact O-CB 3.44Å; H123-S127 PolarHBondContact O-N 2.86Å; H123-S127 PolarHBondContact O-OG 2.88Å
128	L	92.9	Very high	92.4	Very high	51 Å²	51	56.6 Å²	56.6	27%	0.267	32%	0.32	S	S	.	.	S	Bend	trans	-89.6	122.4	173.7	-73.2	169.7	0	0	0	110.3	I124 G130 V132 V284	I124-L128 HydrophobicContact CG2-CD1 4.17Å; I124-L128 WeakPolarHBondContact O-CD1 3.34Å; I124-L128 VanDerWaalsContact O-CG 3.3Å; I124-L128 WeakPolarHBondContact O-CG 3.41Å; I124-L128 PolarHBondContact O-N 2.9Å; L128-G130 PolarHBondContact O-N 3.08Å; L128-V132 HydrophobicContact CD1-CG2 3.52Å; L128-V284 HydrophobicContact CD2-CG1 4.22Å
129	D	90.1	Very high	93.3	Very high	112 Å²	112	53 Å²	53	60%	0.599	29%	0.29	S	S	*	.	S	Bend	trans	-77.3	69.4	169.4	-168.5	23.7	0	0	0	110.8	Y151 H286	D129-Y151 WeakPolarHBondContact CA-OH 3.27Å; D129-Y151 VanDerWaalsContact OD1-CE1 3.25Å; D129-Y151 WeakPolarHBondContact OD1-CE1 3.21Å; D129-Y151 VanDerWaalsContact OD1-CZ 3.31Å; D129-Y151 PolarHBondContact OD1-OH 3.34Å; D129-H286 PolarHBondContact O-ND1 3.16Å
130	G	94.4	Very high	94	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	166.1	-156.1	-177.1	0	0	0	0	0	114.2	L128 T147 Y151 A285	L128-G130 PolarHBondContact O-N 3.08Å; G130-T147 PolarHBondContact O-OG1 3.22Å; G130-Y151 VanDerWaalsContact CA-CE2 3.45Å; G130-Y151 VanDerWaalsContact N-CZ 3.26Å; G130-Y151 PolarHBondContact N-OH 2.9Å; G130-Y151 VanDerWaalsContact N-OH 3.15Å; G130-Y151 WeakPolarHBondContact O-CE2 3.44Å; G130-A285 CarbonylContact C-O 3.59Å; G130-A285 VanDerWaalsContact CA-O 3.25Å; G130-A285 WeakPolarHBondContact CA-O 3.32Å
131	F	97.8	Very high	94.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	147.1	178.5	58.6	-83	0	0	0	111.8	F133 I144 S145 T147 V148 Y151 L152 M237 I256 A285	F131-F133 AromaticContact CD2-CD1 3.91Å; F131-F133 HydrophobicContact CD2-CD1 3.91Å; F131-F133 HydrophobicContact CD2-CE1 4.46Å; F131-F133 AromaticContact CE2-CD1 3.75Å; F131-F133 HydrophobicContact CE2-CD1 3.75Å; F131-F133 AromaticContact CE2-CE1 3.88Å; F131-F133 HydrophobicContact CE2-CE1 3.88Å; F131-I144 HydrophobicContact CD2-CD1 3.79Å; F131-I144 HydrophobicContact CD2-CG1 4.15Å; F131-I144 HydrophobicContact CE2-CD1 4Å; F131-S145 WeakPolarHBondContact CA-OG 3.38Å; F131-S145 WeakPolarHBondContact CB-OG 3.39Å; F131-T147 WeakPolarHBondContact CA-OG1 3.35Å; F131-T147 WeakPolarHBondContact CB-OG1 3.14Å; F131-V148 HydrophobicContact CB-CB 4Å; F131-V148 HydrophobicContact CD1-CB 4.48Å; F131-V148 HydrophobicContact CD1-CG2 4.26Å; F131-V148 HydrophobicContact CD2-CB 4Å; F131-V148 HydrophobicContact CD2-CG2 3.77Å; F131-V148 HydrophobicContact CE1-CG2 4.39Å; F131-V148 HydrophobicContact CE2-CG2 3.9Å; F131-V148 HydrophobicContact CG-CB 3.92Å; F131-V148 HydrophobicContact CG-CG2 3.96Å; F131-V148 HydrophobicContact CZ-CG2 4.22Å; F131-Y151 HydrophobicContact CD1-CD2 4.19Å; F131-Y151 HydrophobicContact CD1-CG 4.33Å; F131-L152 HydrophobicContact CE1-CD1 4.29Å; F131-L152 HydrophobicContact CE1-CG 4.4Å; F131-L152 HydrophobicContact CZ-CD1 3.9Å; F131-L152 HydrophobicContact CZ-CG 4.49Å; F131-M237 HydrophobicContact CE2-SD 4.43Å; F131-M237 HydrophobicContact CZ-SD 4.1Å; F131-I256 HydrophobicContact CE1-CD1 4.07Å; F131-I256 HydrophobicContact CE1-CG2 4.5Å; F131-I256 HydrophobicContact CZ-CD1 4.29Å; F131-I256 HydrophobicContact CZ-CG1 4.39Å; F131-I256 HydrophobicContact CZ-CG2 4.13Å; F131-A285 HydrophobicContact CD1-CB 4.35Å; F131-A285 HydrophobicContact CD2-CB 4.01Å; F131-A285 HydrophobicContact CE1-CB 4.05Å; F131-A285 HydrophobicContact CE2-CB 3.69Å; F131-A285 HydrophobicContact CG-CB 4.33Å; F131-A285 HydrophobicContact CZ-CB 3.71Å; F131-A285 PolarHBondContact N-O 3.13Å; F131-A285 WeakPolarHBondContact O-CB 3.38Å; F131-A285 PolarHBondContact O-N 3.5Å
132	V	98.3	Very high	95	Very high	30 Å²	30	46 Å²	46	18%	0.182	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136.2	-177.2	-178.7	0	0	0	0	108.6	L125 L128 Y143 I144 S145 V283 V284	L125-V132 HydrophobicContact CD2-CG2 4.21Å; L128-V132 HydrophobicContact CD1-CG2 3.52Å; V132-Y143 HydrophobicContact CB-CE1 4.48Å; V132-Y143 HydrophobicContact CG1-CE1 4.44Å; V132-I144 CarbonylContact O-C 3.52Å; V132-I144 VanDerWaalsContact O-CA 3.3Å; V132-I144 WeakPolarHBondContact O-CA 3.35Å; V132-S145 PolarHBondContact N-OG 3.11Å; V132-S145 PolarHBondContact O-N 3.11Å; V132-V283 WeakPolarHBondContact CA-O 3.3Å; V132-V283 WeakPolarHBondContact CG1-O 3.45Å; V132-V284 HydrophobicContact CG2-CG2 4.43Å
133	F	98.4	Very high	95.4	Very high	1 Å²	1	47 Å²	47	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	157.4	172.8	66.2	-103.7	0	0	0	114.2	F131 L135 F141 Y143 I144 I258 V283 A285	F131-F133 AromaticContact CD2-CD1 3.91Å; F131-F133 HydrophobicContact CD2-CD1 3.91Å; F131-F133 HydrophobicContact CD2-CE1 4.46Å; F131-F133 AromaticContact CE2-CD1 3.75Å; F131-F133 HydrophobicContact CE2-CD1 3.75Å; F131-F133 AromaticContact CE2-CE1 3.88Å; F131-F133 HydrophobicContact CE2-CE1 3.88Å; F133-L135 HydrophobicContact CD2-CD1 4.46Å; F133-L135 HydrophobicContact CD2-CD2 4.02Å; F133-L135 HydrophobicContact CD2-CG 3.82Å; F133-L135 HydrophobicContact CE2-CD1 3.86Å; F133-L135 HydrophobicContact CE2-CD2 4.16Å; F133-L135 HydrophobicContact CE2-CG 3.73Å; F133-F141 HydrophobicContact CB-CD1 4.15Å; F133-F141 HydrophobicContact CB-CE1 4.29Å; F133-F141 HydrophobicContact CD1-CE1 4.4Å; F133-F141 HydrophobicContact CD2-CD1 4.28Å; F133-F141 HydrophobicContact CD2-CE1 4.04Å; F133-F141 HydrophobicContact CE2-CE1 4.42Å; F133-F141 HydrophobicContact CG-CD1 4.31Å; F133-F141 HydrophobicContact CG-CE1 4.03Å; F133-Y143 VanDerWaalsContact CA-O 3.31Å; F133-Y143 WeakPolarHBondContact CA-O 3.45Å; F133-Y143 WeakPolarHBondContact CB-O 3.36Å; F133-I144 HydrophobicContact CB-CB 3.93Å; F133-I144 HydrophobicContact CB-CD1 3.9Å; F133-I144 HydrophobicContact CB-CG1 3.87Å; F133-I144 HydrophobicContact CD1-CD1 4.18Å; F133-I144 HydrophobicContact CG-CD1 4.36Å; F133-I258 HydrophobicContact CZ-CD1 3.85Å; F133-I258 HydrophobicContact CZ-CG1 4.27Å; F133-V283 HydrophobicContact CD1-CB 4.24Å; F133-V283 HydrophobicContact CD1-CG1 4.13Å; F133-V283 HydrophobicContact CD2-CB 3.93Å; F133-V283 HydrophobicContact CD2-CG2 4.12Å; F133-V283 HydrophobicContact CE1-CB 4.06Å; F133-V283 HydrophobicContact CE1-CG1 3.63Å; F133-V283 HydrophobicContact CE2-CB 3.7Å; F133-V283 HydrophobicContact CE2-CG1 4.09Å; F133-V283 HydrophobicContact CE2-CG2 3.55Å; F133-V283 HydrophobicContact CG-CB 4.2Å; F133-V283 HydrophobicContact CZ-CB 3.79Å; F133-V283 HydrophobicContact CZ-CG1 3.61Å; F133-V283 HydrophobicContact CZ-CG2 3.85Å; F133-V283 PolarHBondContact N-O 2.73Å; F133-V283 PolarHBondContact O-N 2.7Å; F133-A285 HydrophobicContact CD1-CB 4.16Å; F133-A285 HydrophobicContact CE1-CB 3.7Å
134	A	98.3	Very high	95.8	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.1	172.2	0	0	0	0	0	109.2	M73 F76 L142 Y143 L281	M73-A134 HydrophobicContact CE-CB 3.95Å; M73-A134 HydrophobicContact SD-CB 4.05Å; F76-A134 HydrophobicContact CE1-CB 4.25Å; A134-L142 PolarHBondContact O-N 2.84Å; A134-Y143 PolarHBondContact N-O 2.87Å; A134-Y143 PolarHBondContact O-N 2.95Å; A134-L281 CarbonylContact C-O 3.53Å; A134-L281 WeakPolarHBondContact CA-O 3.4Å
135	L	98.3	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	149.8	169.5	-57.1	-179.6	0	0	0	109.6	F133 K140 F141 V164 M176 L180 G280 L281	F133-L135 HydrophobicContact CD2-CD1 4.46Å; F133-L135 HydrophobicContact CD2-CD2 4.02Å; F133-L135 HydrophobicContact CD2-CG 3.82Å; F133-L135 HydrophobicContact CE2-CD1 3.86Å; F133-L135 HydrophobicContact CE2-CD2 4.16Å; F133-L135 HydrophobicContact CE2-CG 3.73Å; L135-K140 WeakPolarHBondContact CA-O 3.48Å; L135-F141 HydrophobicContact CD2-CB 4.45Å; L135-F141 HydrophobicContact CD2-CD1 3.45Å; L135-F141 VanDerWaalsContact CD2-CD1 3.45Å; L135-F141 HydrophobicContact CD2-CE1 3.73Å; L135-F141 HydrophobicContact CD2-CG 3.89Å; L135-F141 HydrophobicContact CD2-CZ 4.38Å; L135-V164 HydrophobicContact CD1-CB 4.05Å; L135-V164 HydrophobicContact CD1-CG1 4.11Å; L135-V164 HydrophobicContact CD1-CG2 4.05Å; L135-V164 HydrophobicContact CD2-CB 4.1Å; L135-V164 HydrophobicContact CD2-CG2 4.39Å; L135-M176 HydrophobicContact CD1-CE 3.48Å; L135-M176 VanDerWaalsContact CD1-CE 3.48Å; L135-L180 HydrophobicContact CB-CD2 4.38Å; L135-L180 HydrophobicContact CD1-CD1 4.29Å; L135-L180 HydrophobicContact CD1-CD2 4.07Å; L135-G280 CarbonylContact O-C 3.58Å; L135-G280 VanDerWaalsContact O-CA 3.28Å; L135-G280 WeakPolarHBondContact O-CA 3.25Å; L135-L281 HydrophobicContact CB-CB 4.37Å; L135-L281 HydrophobicContact CD1-CD2 4.49Å; L135-L281 PolarHBondContact N-O 2.98Å; L135-L281 PolarHBondContact O-N 3.1Å
136	N	95.6	Very high	96.1	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	179.9	163.8	78.3	-16.7	0	0	0	112.3	K72 E138 G139 K140 L142 M279	K72-N136 PolarHBondContact NZ-ND2 3.33Å; N136-E138 PolarHBondContact ND2-OE2 3.06Å; N136-E138 PolarHBondContact O-N 2.94Å; N136-E138 WeakPolarHBondContact OD1-CA 3.46Å; N136-E138 WeakPolarHBondContact OD1-CB 3.4Å; N136-E138 PolarHBondContact OD1-N 2.8Å; N136-G139 PolarHBondContact O-N 2.93Å; N136-G139 PolarHBondContact OD1-N 3.2Å; N136-K140 PolarHBondContact N-O 2.87Å; N136-K140 WeakPolarHBondContact OD1-CB 3.49Å; N136-K140 PolarHBondContact OD1-N 3.28Å; N136-L142 HydrophobicContact CB-CD1 3.87Å; N136-L142 HydrophobicContact CB-CD2 3.98Å; N136-L142 HydrophobicContact CB-CG 3.89Å; N136-M279 CarbonylContact C-O 3.52Å; N136-M279 VanDerWaalsContact CA-O 3.28Å; N136-M279 WeakPolarHBondContact CA-O 3.15Å
137	Q	92.6	Very high	96.4	Very high	83 Å²	83	36.6 Å²	36.6	39%	0.388	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-11.7	176.4	72.2	-78.9	-8.4	0	0	115.2	M182 M279	Q137-M182 VanDerWaalsContact O-CE 3.27Å; Q137-M182 WeakPolarHBondContact O-CE 3.39Å; Q137-M279 PolarHBondContact N-O 3.04Å; Q137-M279 PolarHBondContact OE1-O 2.9Å
138	E	94.7	Very high	96.6	Very high	84 Å²	84	31.6 Å²	31.6	39%	0.393	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	6.7	172.7	-61.4	119.4	-140.4	0	0	112.3	K72 N136 K140	K72-E138 IonicContact NZ-OE2 2.8Å; K72-E138 PolarHBondContact NZ-OE2 2.8Å; N136-E138 PolarHBondContact ND2-OE2 3.06Å; N136-E138 PolarHBondContact O-N 2.94Å; N136-E138 WeakPolarHBondContact OD1-CA 3.46Å; N136-E138 WeakPolarHBondContact OD1-CB 3.4Å; N136-E138 PolarHBondContact OD1-N 2.8Å; E138-K140 HydrophobicContact CB-CG 4.49Å; E138-K140 PolarHBondContact O-N 3.13Å
139	G	96.4	Very high	96.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	67.4	20.5	-176.6	0	0	0	0	0	113.5	N136 V164 M182	N136-G139 PolarHBondContact O-N 2.93Å; N136-G139 PolarHBondContact OD1-N 3.2Å; G139-V164 WeakPolarHBondContact O-CB 3.37Å; G139-V164 WeakPolarHBondContact O-CG1 3.37Å; G139-V164 PolarHBondContact O-N 3.15Å; G139-M182 VanDerWaalsContact N-CE 3.31Å
140	K	98.3	Very high	96.8	Very high	81 Å²	81	31.8 Å²	31.8	35%	0.352	16%	0.157	S	C	.	.	B	Isolated β-bridge	trans	-91	136.6	176.3	-71.5	177.4	163.5	-72.3	0	111.1	L135 N136 E138 L142 G161 S162	L135-K140 WeakPolarHBondContact CA-O 3.48Å; N136-K140 PolarHBondContact N-O 2.87Å; N136-K140 WeakPolarHBondContact OD1-CB 3.49Å; N136-K140 PolarHBondContact OD1-N 3.28Å; E138-K140 HydrophobicContact CB-CG 4.49Å; E138-K140 PolarHBondContact O-N 3.13Å; K140-L142 PolarHBondContact O-N 3.06Å; K140-L142 VanDerWaalsContact O-N 3.1Å; K140-G161 PolarHBondContact NZ-O 3.02Å; K140-S162 WeakPolarHBondContact CA-O 3.44Å
141	F	98.6	Very high	96.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	109.3	173.3	-65	-77.3	0	0	0	110.3	F133 L135 I144 L159 G161 S162 V164 Y167 M237	F133-F141 HydrophobicContact CB-CD1 4.15Å; F133-F141 HydrophobicContact CB-CE1 4.29Å; F133-F141 HydrophobicContact CD1-CE1 4.4Å; F133-F141 HydrophobicContact CD2-CD1 4.28Å; F133-F141 HydrophobicContact CD2-CE1 4.04Å; F133-F141 HydrophobicContact CE2-CE1 4.42Å; F133-F141 HydrophobicContact CG-CD1 4.31Å; F133-F141 HydrophobicContact CG-CE1 4.03Å; L135-F141 HydrophobicContact CD2-CB 4.45Å; L135-F141 HydrophobicContact CD2-CD1 3.45Å; L135-F141 VanDerWaalsContact CD2-CD1 3.45Å; L135-F141 HydrophobicContact CD2-CE1 3.73Å; L135-F141 HydrophobicContact CD2-CG 3.89Å; L135-F141 HydrophobicContact CD2-CZ 4.38Å; F141-I144 HydrophobicContact CD1-CB 4.36Å; F141-I144 HydrophobicContact CD1-CD1 4.07Å; F141-I144 HydrophobicContact CE1-CD1 3.77Å; F141-I144 HydrophobicContact CZ-CD1 4.44Å; F141-L159 HydrophobicContact CD2-CB 4.35Å; F141-L159 HydrophobicContact CD2-CD2 4.37Å; F141-L159 WeakPolarHBondContact CD2-O 3.41Å; F141-L159 HydrophobicContact CE2-CD2 3.78Å; F141-L159 HydrophobicContact CZ-CD2 4.17Å; F141-G161 WeakPolarHBondContact O-CA 3.37Å; F141-G161 PolarHBondContact O-N 3Å; F141-S162 PolarHBondContact N-O 2.82Å; F141-V164 HydrophobicContact CE1-CG2 4.44Å; F141-V164 HydrophobicContact CE2-CB 4.26Å; F141-V164 HydrophobicContact CE2-CG2 4.38Å; F141-V164 HydrophobicContact CZ-CB 4.2Å; F141-V164 HydrophobicContact CZ-CG2 3.86Å; F141-Y167 HydrophobicContact CE2-CD2 4.16Å; F141-M237 HydrophobicContact CZ-CE 4.17Å
142	L	98.2	Very high	96.5	Very high	9 Å²	9	33.6 Å²	33.6	5%	0.047	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-35.8	167.8	-61.2	-171.4	0	0	0	110.9	K72 M73 F76 A134 N136 K140	K72-L142 HydrophobicContact CB-CD2 3.59Å; K72-L142 HydrophobicContact CD-CD2 4.05Å; K72-L142 HydrophobicContact CG-CD2 4.48Å; M73-L142 HydrophobicContact CB-CB 3.99Å; M73-L142 HydrophobicContact CG-CB 4.27Å; M73-L142 HydrophobicContact SD-CB 3.44Å; M73-L142 WeakPolarHBondContact SD-CB 3.07Å; M73-L142 HydrophobicContact SD-CD1 4.32Å; F76-L142 HydrophobicContact CB-CD1 3.56Å; F76-L142 HydrophobicContact CD1-CD1 4.35Å; F76-L142 HydrophobicContact CD2-CD1 3.77Å; F76-L142 HydrophobicContact CG-CD1 3.66Å; A134-L142 PolarHBondContact O-N 2.84Å; N136-L142 HydrophobicContact CB-CD1 3.87Å; N136-L142 HydrophobicContact CB-CD2 3.98Å; N136-L142 HydrophobicContact CB-CG 3.89Å; K140-L142 PolarHBondContact O-N 3.06Å; K140-L142 VanDerWaalsContact O-N 3.1Å
143	Y	98.4	Very high	96.3	Very high	78 Å²	78	33.4 Å²	33.4	31%	0.306	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	147.8	174.4	170.6	-94.5	0	0	0	109.8	M73 V132 F133 A134	M73-Y143 HydrophobicContact CE-CG 4.18Å; V132-Y143 HydrophobicContact CB-CE1 4.48Å; V132-Y143 HydrophobicContact CG1-CE1 4.44Å; F133-Y143 VanDerWaalsContact CA-O 3.31Å; F133-Y143 WeakPolarHBondContact CA-O 3.45Å; F133-Y143 WeakPolarHBondContact CB-O 3.36Å; A134-Y143 PolarHBondContact N-O 2.87Å; A134-Y143 PolarHBondContact O-N 2.95Å
144	I	98.5	Very high	96.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.1	162.5	-173.8	148.9	0	0	0	108.5	F131 V132 F133 F141 V148 Q156 L159	F131-I144 HydrophobicContact CD2-CD1 3.79Å; F131-I144 HydrophobicContact CD2-CG1 4.15Å; F131-I144 HydrophobicContact CE2-CD1 4Å; V132-I144 CarbonylContact O-C 3.52Å; V132-I144 VanDerWaalsContact O-CA 3.3Å; V132-I144 WeakPolarHBondContact O-CA 3.35Å; F133-I144 HydrophobicContact CB-CB 3.93Å; F133-I144 HydrophobicContact CB-CD1 3.9Å; F133-I144 HydrophobicContact CB-CG1 3.87Å; F133-I144 HydrophobicContact CD1-CD1 4.18Å; F133-I144 HydrophobicContact CG-CD1 4.36Å; F141-I144 HydrophobicContact CD1-CB 4.36Å; F141-I144 HydrophobicContact CD1-CD1 4.07Å; F141-I144 HydrophobicContact CE1-CD1 3.77Å; F141-I144 HydrophobicContact CZ-CD1 4.44Å; I144-V148 HydrophobicContact CD1-CB 4.18Å; I144-V148 HydrophobicContact CD1-CG1 4.42Å; I144-V148 HydrophobicContact CD1-CG2 3.96Å; I144-V148 HydrophobicContact CG1-CB 4.11Å; I144-V148 HydrophobicContact CG1-CG1 4.17Å; I144-V148 HydrophobicContact CG1-CG2 4.44Å; I144-Q156 HydrophobicContact CG2-CB 4.45Å; I144-Q156 HydrophobicContact CG2-CG 4.1Å; I144-Q156 WeakPolarHBondContact O-CG 3.29Å; I144-Q156 PolarHBondContact O-NE2 3.5Å; I144-L159 HydrophobicContact CD1-CD1 4.13Å; I144-L159 HydrophobicContact CG2-CB 3.9Å
145	S	98.1	Very high	96.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.			trans	-72.6	149.5	178.4	61.1	0	0	0	0	111.9	F131 V132 T147 V148	F131-S145 WeakPolarHBondContact CA-OG 3.38Å; F131-S145 WeakPolarHBondContact CB-OG 3.39Å; V132-S145 PolarHBondContact N-OG 3.11Å; V132-S145 PolarHBondContact O-N 3.11Å; S145-T147 PolarHBondContact O-N 3Å; S145-T147 PolarHBondContact OG-OG1 3Å; S145-V148 VanDerWaalsContact O-CG1 3.27Å; S145-V148 WeakPolarHBondContact O-CG1 3.46Å; S145-V148 PolarHBondContact O-N 2.99Å
146	E	96.5	Very high	96	Very high	116 Å²	116	38.1 Å²	38.1	54%	0.542	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.5	176.9	62.9	-171	174	0	0	113.2	V148 S149	E146-V148 PolarHBondContact O-N 2.95Å; E146-V148 VanDerWaalsContact O-N 3.1Å; E146-S149 WeakPolarHBondContact O-CB 3.45Å; E146-S149 PolarHBondContact O-N 2.88Å; E146-S149 VanDerWaalsContact O-N 3.11Å; E146-S149 PolarHBondContact O-OG 2.96Å
147	T	96.8	Very high	96.1	Very high	13 Å²	13	39 Å²	39	8%	0.08	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.1	176.1	60.7	0	0	0	0	113.8	L125 G130 F131 S145 S149 I150 Y151	L125-T147 HydrophobicContact CB-CG2 4.15Å; G130-T147 PolarHBondContact O-OG1 3.22Å; F131-T147 WeakPolarHBondContact CA-OG1 3.35Å; F131-T147 WeakPolarHBondContact CB-OG1 3.14Å; S145-T147 PolarHBondContact O-N 3Å; S145-T147 PolarHBondContact OG-OG1 3Å; T147-S149 PolarHBondContact O-N 2.88Å; T147-I150 HydrophobicContact CG2-CD1 4.27Å; T147-I150 VanDerWaalsContact O-CB 3.31Å; T147-I150 WeakPolarHBondContact O-CB 3.37Å; T147-I150 PolarHBondContact O-N 3.03Å; T147-Y151 VanDerWaalsContact O-CD2 3.26Å; T147-Y151 WeakPolarHBondContact O-CD2 3.45Å
148	V	97	Very high	96.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-54.4	-28.1	172.3	71.9	0	0	0	0	112.7	F131 I144 S145 E146 I150 Y151 L152 L159	F131-V148 HydrophobicContact CB-CB 4Å; F131-V148 HydrophobicContact CD1-CB 4.48Å; F131-V148 HydrophobicContact CD1-CG2 4.26Å; F131-V148 HydrophobicContact CD2-CB 4Å; F131-V148 HydrophobicContact CD2-CG2 3.77Å; F131-V148 HydrophobicContact CE1-CG2 4.39Å; F131-V148 HydrophobicContact CE2-CG2 3.9Å; F131-V148 HydrophobicContact CG-CB 3.92Å; F131-V148 HydrophobicContact CG-CG2 3.96Å; F131-V148 HydrophobicContact CZ-CG2 4.22Å; I144-V148 HydrophobicContact CD1-CB 4.18Å; I144-V148 HydrophobicContact CD1-CG1 4.42Å; I144-V148 HydrophobicContact CD1-CG2 3.96Å; I144-V148 HydrophobicContact CG1-CB 4.11Å; I144-V148 HydrophobicContact CG1-CG1 4.17Å; I144-V148 HydrophobicContact CG1-CG2 4.44Å; S145-V148 VanDerWaalsContact O-CG1 3.27Å; S145-V148 WeakPolarHBondContact O-CG1 3.46Å; S145-V148 PolarHBondContact O-N 2.99Å; E146-V148 PolarHBondContact O-N 2.95Å; E146-V148 VanDerWaalsContact O-N 3.1Å; V148-I150 VanDerWaalsContact C-N 3.31Å; V148-I150 PolarHBondContact O-N 3.36Å; V148-Y151 PolarHBondContact O-N 3.44Å; V148-L152 HydrophobicContact CG2-CB 4.33Å; V148-L152 HydrophobicContact CG2-CD1 3.96Å; V148-L152 HydrophobicContact CG2-CG 4.39Å; V148-L152 PolarHBondContact O-N 3.22Å; V148-L159 HydrophobicContact CB-CD1 4.46Å; V148-L159 HydrophobicContact CG1-CD1 3.76Å; V148-L159 HydrophobicContact CG2-CD1 3.88Å
149	S	95.1	Very high	96.5	Very high	58 Å²	58	35 Å²	35	41%	0.406	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-31.5	174.4	62.1	0	0	0	0	113.4	E146 T147 G153 L154	E146-S149 WeakPolarHBondContact O-CB 3.45Å; E146-S149 PolarHBondContact O-N 2.88Å; E146-S149 VanDerWaalsContact O-N 3.11Å; E146-S149 PolarHBondContact O-OG 2.96Å; T147-S149 PolarHBondContact O-N 2.88Å; S149-G153 WeakPolarHBondContact O-CA 3.37Å; S149-G153 PolarHBondContact O-N 2.72Å; S149-L154 VanDerWaalsContact CA-O 3.3Å; S149-L154 WeakPolarHBondContact CA-O 3.49Å; S149-L154 PolarHBondContact N-O 2.71Å
150	I	92.6	Very high	96.6	Very high	110 Å²	110	35.7 Å²	35.7	56%	0.564	19%	0.187	S	C	*	.	H	α-helix	trans	-70.6	-41	176.8	-52.6	172.3	0	0	0	110.1	T147 V148 L241	T147-I150 HydrophobicContact CG2-CD1 4.27Å; T147-I150 VanDerWaalsContact O-CB 3.31Å; T147-I150 WeakPolarHBondContact O-CB 3.37Å; T147-I150 PolarHBondContact O-N 3.03Å; V148-I150 VanDerWaalsContact C-N 3.31Å; V148-I150 PolarHBondContact O-N 3.36Å; I150-L241 VanDerWaalsContact O-CD1 3.32Å; I150-L241 WeakPolarHBondContact O-CD1 3.44Å
151	Y	92.1	Very high	96.6	Very high	37 Å²	37	32.2 Å²	32.2	15%	0.145	18%	0.175	C	C	.	.	H	α-helix	trans	-90.6	-34.4	-171.4	-65.6	-75.4	0	0	0	114.2	D129 G130 F131 T147 V148 L241 K254 A287	D129-Y151 WeakPolarHBondContact CA-OH 3.27Å; D129-Y151 VanDerWaalsContact OD1-CE1 3.25Å; D129-Y151 WeakPolarHBondContact OD1-CE1 3.21Å; D129-Y151 VanDerWaalsContact OD1-CZ 3.31Å; D129-Y151 PolarHBondContact OD1-OH 3.34Å; G130-Y151 VanDerWaalsContact CA-CE2 3.45Å; G130-Y151 VanDerWaalsContact N-CZ 3.26Å; G130-Y151 PolarHBondContact N-OH 2.9Å; G130-Y151 VanDerWaalsContact N-OH 3.15Å; G130-Y151 WeakPolarHBondContact O-CE2 3.44Å; F131-Y151 HydrophobicContact CD1-CD2 4.19Å; F131-Y151 HydrophobicContact CD1-CG 4.33Å; T147-Y151 VanDerWaalsContact O-CD2 3.26Å; T147-Y151 WeakPolarHBondContact O-CD2 3.45Å; V148-Y151 PolarHBondContact O-N 3.44Å; Y151-L241 WeakPolarHBondContact O-CD1 3.45Å; Y151-K254 WeakPolarHBondContact O-CD 3.33Å; Y151-K254 WeakPolarHBondContact O-CE 3.29Å; Y151-K254 PolarHBondContact O-NZ 2.9Å; Y151-A287 HydrophobicContact CD1-CB 3.9Å; Y151-A287 HydrophobicContact CG-CB 4.29Å
152	L	93.5	Very high	96.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-118.3	-19.8	-178	-67.3	-179.4	0	0	0	114	F131 V148 L154 M237 K238 S239 T240 K254 I256	F131-L152 HydrophobicContact CE1-CD1 4.29Å; F131-L152 HydrophobicContact CE1-CG 4.4Å; F131-L152 HydrophobicContact CZ-CD1 3.9Å; F131-L152 HydrophobicContact CZ-CG 4.49Å; V148-L152 HydrophobicContact CG2-CB 4.33Å; V148-L152 HydrophobicContact CG2-CD1 3.96Å; V148-L152 HydrophobicContact CG2-CG 4.39Å; V148-L152 PolarHBondContact O-N 3.22Å; L152-L154 HydrophobicContact CB-CB 4.47Å; L152-L154 HydrophobicContact CB-CD1 4.28Å; L152-L154 HydrophobicContact CB-CG 4.18Å; L152-L154 HydrophobicContact CD1-CD1 4.3Å; L152-M237 HydrophobicContact CD1-CB 3.89Å; L152-M237 HydrophobicContact CD1-CE 4.25Å; L152-M237 HydrophobicContact CD1-SD 4.3Å; L152-M237 HydrophobicContact CD2-CB 4.33Å; L152-K238 WeakPolarHBondContact CD2-O 3.45Å; L152-S239 CarbonylContact O-C 3.59Å; L152-S239 WeakPolarHBondContact O-CA 3.25Å; L152-S239 PolarHBondContact O-OG 3.19Å; L152-S239 VanDerWaalsContact O-OG 3.06Å; L152-T240 PolarHBondContact O-N 3.01Å; L152-T240 PolarHBondContact O-OG1 3.01Å; L152-K254 HydrophobicContact CD2-CB 4.17Å; L152-K254 HydrophobicContact CD2-CD 4.34Å; L152-I256 HydrophobicContact CD2-CD1 4Å; L152-I256 HydrophobicContact CD2-CG1 4.47Å
153	G	94	Very high	96.6	Very high	27 Å²	27	33.7 Å²	33.7	28%	0.278	19%	0.186	S	C	.	.			trans	76.1	10	-173.8	0	0	0	0	0	114.3	S149 T240	S149-G153 WeakPolarHBondContact O-CA 3.37Å; S149-G153 PolarHBondContact O-N 2.72Å; G153-T240 VanDerWaalsContact CA-OG1 3.25Å; G153-T240 WeakPolarHBondContact CA-OG1 3.44Å; G153-T240 PolarHBondContact O-OG1 2.91Å
154	L	95.3	Very high	96.6	Very high	6 Å²	6	30 Å²	30	3%	0.031	17%	0.171	C	C	.	.			trans	-92.5	152.5	176.4	-63.2	176.9	0	0	0	110.9	S149 L152 L159 Y167 K238 T240	S149-L154 VanDerWaalsContact CA-O 3.3Å; S149-L154 WeakPolarHBondContact CA-O 3.49Å; S149-L154 PolarHBondContact N-O 2.71Å; L152-L154 HydrophobicContact CB-CB 4.47Å; L152-L154 HydrophobicContact CB-CD1 4.28Å; L152-L154 HydrophobicContact CB-CG 4.18Å; L152-L154 HydrophobicContact CD1-CD1 4.3Å; L154-L159 HydrophobicContact CB-CD1 3.75Å; L154-L159 HydrophobicContact CB-CG 4.36Å; L154-L159 HydrophobicContact CD1-CD1 4.38Å; L154-L159 HydrophobicContact CD1-CD2 4.24Å; L154-Y167 HydrophobicContact CD1-CD1 3.71Å; L154-Y167 HydrophobicContact CD1-CE1 4.31Å; L154-K238 HydrophobicContact CD1-CB 4.41Å; L154-K238 WeakPolarHBondContact CD1-O 3.27Å; L154-T240 HydrophobicContact CD2-CG2 3.87Å
155	S	96.8	Very high	96.6	Very high	55 Å²	55	32.1 Å²	32.1	39%	0.385	18%	0.181	S	C	.	.			trans	-90.9	139	-178.8	-180	0	0	0	0	112.7	V157 E158 L159	S155-V157 PolarHBondContact O-N 3.2Å; S155-V157 PolarHBondContact OG-N 2.85Å; S155-E158 WeakPolarHBondContact O-CB 3.47Å; S155-E158 PolarHBondContact O-N 3.09Å; S155-L159 PolarHBondContact O-N 3.31Å
156	Q	97.8	Very high	96.6	Very high	39 Å²	39	36.2 Å²	36.2	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-52.3	-38.4	168.5	177	-171.5	61.9	0	0	111.9	I144 E158 L159 T160	I144-Q156 HydrophobicContact CG2-CB 4.45Å; I144-Q156 HydrophobicContact CG2-CG 4.1Å; I144-Q156 WeakPolarHBondContact O-CG 3.29Å; I144-Q156 PolarHBondContact O-NE2 3.5Å; Q156-E158 VanDerWaalsContact C-N 3.32Å; Q156-E158 PolarHBondContact O-N 3.15Å; Q156-L159 PolarHBondContact O-N 3.05Å; Q156-T160 VanDerWaalsContact O-CB 3.29Å; Q156-T160 WeakPolarHBondContact O-CB 3.41Å; Q156-T160 PolarHBondContact O-N 2.77Å; Q156-T160 PolarHBondContact O-OG1 2.86Å
157	V	97.7	Very high	96.7	Very high	23 Å²	23	31.9 Å²	31.9	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-68.6	-29.9	178.8	167.3	0	0	0	0	112	L50 I54 L58 R65 L66 S155	L50-V157 HydrophobicContact CD1-CG2 4.1Å; I54-V157 HydrophobicContact CG2-CG2 3.93Å; L58-V157 HydrophobicContact CD2-CG1 3.55Å; L58-V157 HydrophobicContact CD2-CG2 4.49Å; R65-V157 VanDerWaalsContact CZ-O 3.28Å; R65-V157 PolarHBondContact NH1-O 2.9Å; R65-V157 PolarHBondContact NH2-O 3.33Å; L66-V157 HydrophobicContact CD1-CG1 4.32Å; S155-V157 PolarHBondContact O-N 3.2Å; S155-V157 PolarHBondContact OG-N 2.85Å
158	E	97.1	Very high	96.7	Very high	83 Å²	83	31.3 Å²	31.3	39%	0.388	18%	0.178	S	C	.	.	H	α-helix	trans	-78	-42.6	176.8	-170.3	-165.1	160.5	0	0	111.2	R65 S155 Q156 S162 Y167	R65-E158 PolarHBondContact NH1-O 3.09Å; S155-E158 WeakPolarHBondContact O-CB 3.47Å; S155-E158 PolarHBondContact O-N 3.09Å; Q156-E158 VanDerWaalsContact C-N 3.32Å; Q156-E158 PolarHBondContact O-N 3.15Å; E158-S162 PolarHBondContact O-OG 2.8Å; E158-Y167 PolarHBondContact O-OH 2.9Å
159	L	98.3	Very high	96.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-75.1	-41.8	-176.4	-73.3	159.6	0	0	0	113.4	F141 I144 V148 L154 S155 Q156 G161 S162 Y167	F141-L159 HydrophobicContact CD2-CB 4.35Å; F141-L159 HydrophobicContact CD2-CD2 4.37Å; F141-L159 WeakPolarHBondContact CD2-O 3.41Å; F141-L159 HydrophobicContact CE2-CD2 3.78Å; F141-L159 HydrophobicContact CZ-CD2 4.17Å; I144-L159 HydrophobicContact CD1-CD1 4.13Å; I144-L159 HydrophobicContact CG2-CB 3.9Å; V148-L159 HydrophobicContact CB-CD1 4.46Å; V148-L159 HydrophobicContact CG1-CD1 3.76Å; V148-L159 HydrophobicContact CG2-CD1 3.88Å; L154-L159 HydrophobicContact CB-CD1 3.75Å; L154-L159 HydrophobicContact CB-CG 4.36Å; L154-L159 HydrophobicContact CD1-CD1 4.38Å; L154-L159 HydrophobicContact CD1-CD2 4.24Å; S155-L159 PolarHBondContact O-N 3.31Å; Q156-L159 PolarHBondContact O-N 3.05Å; L159-G161 PolarHBondContact O-N 3.28Å; L159-S162 VanDerWaalsContact O-CB 3.25Å; L159-S162 WeakPolarHBondContact O-CB 3.34Å; L159-S162 PolarHBondContact O-N 3.04Å; L159-Y167 HydrophobicContact CD2-CD1 3.68Å; L159-Y167 HydrophobicContact CD2-CD2 3.65Å; L159-Y167 HydrophobicContact CD2-CE1 3.77Å; L159-Y167 HydrophobicContact CD2-CE2 3.77Å; L159-Y167 HydrophobicContact CD2-CG 3.62Å; L159-Y167 HydrophobicContact CG-CE1 4.49Å
160	T	98.6	Very high	96.7	Very high	14 Å²	14	35.3 Å²	35.3	9%	0.086	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	122.4	-172.7	-58.7	0	0	0	0	112.2	R65 L66 Q156 S162	R65-T160 WeakPolarHBondContact CG-O 3.46Å; R65-T160 PolarHBondContact NH1-O 3.04Å; L66-T160 HydrophobicContact CD2-CG2 3.78Å; Q156-T160 VanDerWaalsContact O-CB 3.29Å; Q156-T160 WeakPolarHBondContact O-CB 3.41Å; Q156-T160 PolarHBondContact O-N 2.77Å; Q156-T160 PolarHBondContact O-OG1 2.86Å; T160-S162 VanDerWaalsContact C-N 3.29Å; T160-S162 PolarHBondContact O-N 3.36Å
161	G	98	Very high	96.9	Very high	9 Å²	9	32.9 Å²	32.9	9%	0.093	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	-12.4	-177	0	0	0	0	0	116.1	S69 K140 F141 L159	S69-G161 WeakPolarHBondContact OG-CA 3.32Å; S69-G161 PolarHBondContact OG-N 3.35Å; K140-G161 PolarHBondContact NZ-O 3.02Å; F141-G161 WeakPolarHBondContact O-CA 3.37Å; F141-G161 PolarHBondContact O-N 3Å; L159-G161 PolarHBondContact O-N 3.28Å
162	S	98.4	Very high	97.1	Very high	18 Å²	18	31.2 Å²	31.2	13%	0.126	19%	0.193	C	C	.	.	S	Bend	trans	-77.4	164.6	172.5	-52	0	0	0	0	110.2	R65 K140 F141 E158 L159 T160	R65-S162 PolarHBondContact NH1-OG 2.77Å; K140-S162 WeakPolarHBondContact CA-O 3.44Å; F141-S162 PolarHBondContact N-O 2.82Å; E158-S162 PolarHBondContact O-OG 2.8Å; L159-S162 VanDerWaalsContact O-CB 3.25Å; L159-S162 WeakPolarHBondContact O-CB 3.34Å; L159-S162 PolarHBondContact O-N 3.04Å; T160-S162 VanDerWaalsContact C-N 3.29Å; T160-S162 PolarHBondContact O-N 3.36Å
163	S	98.3	Very high	97.3	Very high	21 Å²	21	33.8 Å²	33.8	15%	0.147	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-82.9	145.3	177.2	-167.1	0	0	0	0	110.7	F165 D166 Y167	S163-F165 PolarHBondContact O-N 2.9Å; S163-F165 WeakPolarHBondContact OG-CD2 3.46Å; S163-D166 WeakPolarHBondContact CA-OD2 3.2Å; S163-D166 WeakPolarHBondContact CB-OD2 3.28Å; S163-D166 PolarHBondContact N-OD2 3Å; S163-D166 WeakPolarHBondContact O-CB 3.39Å; S163-D166 PolarHBondContact O-N 2.98Å; S163-Y167 WeakPolarHBondContact O-CD2 3.32Å
164	V	98.5	Very high	97.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-58.7	-38.6	172.4	73.4	0	0	0	0	110.8	L135 G139 F141 D166 Y167 V168 M176 L180	L135-V164 HydrophobicContact CD1-CB 4.05Å; L135-V164 HydrophobicContact CD1-CG1 4.11Å; L135-V164 HydrophobicContact CD1-CG2 4.05Å; L135-V164 HydrophobicContact CD2-CB 4.1Å; L135-V164 HydrophobicContact CD2-CG2 4.39Å; G139-V164 WeakPolarHBondContact O-CB 3.37Å; G139-V164 WeakPolarHBondContact O-CG1 3.37Å; G139-V164 PolarHBondContact O-N 3.15Å; F141-V164 HydrophobicContact CE1-CG2 4.44Å; F141-V164 HydrophobicContact CE2-CB 4.26Å; F141-V164 HydrophobicContact CE2-CG2 4.38Å; F141-V164 HydrophobicContact CZ-CB 4.2Å; F141-V164 HydrophobicContact CZ-CG2 3.86Å; V164-D166 PolarHBondContact O-N 3.32Å; V164-Y167 PolarHBondContact O-N 2.94Å; V164-V168 HydrophobicContact CG2-CG2 3.84Å; V164-V168 WeakPolarHBondContact O-CG2 3.47Å; V164-V168 PolarHBondContact O-N 2.91Å; V164-M176 HydrophobicContact CG1-CE 4.2Å; V164-M176 HydrophobicContact CG1-CG 4.17Å; V164-M176 HydrophobicContact CG2-CE 4.12Å; V164-L180 HydrophobicContact CG1-CD1 4.37Å
165	F	98.3	Very high	97.4	Very high	46 Å²	46	38.9 Å²	38.9	20%	0.202	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-63.8	-21.5	179.5	-56.7	-72.4	0	0	0	113.5	S163 Y167 H173 M176 A177 L180 M182	S163-F165 PolarHBondContact O-N 2.9Å; S163-F165 WeakPolarHBondContact OG-CD2 3.46Å; F165-Y167 PolarHBondContact O-N 2.93Å; F165-H173 HydrophobicContact CD1-CB 4.12Å; F165-H173 AromaticContact CD1-CG 3.88Å; F165-H173 HydrophobicContact CE1-CB 4.49Å; F165-H173 WeakPolarHBondContact CE1-O 3.36Å; F165-H173 PolarHBondContact O-CE1 3.05Å; F165-H173 PolarHBondContact O-NE2 3Å; F165-H173 VanDerWaalsContact O-NE2 3.09Å; F165-M176 HydrophobicContact CE1-CB 3.93Å; F165-M176 HydrophobicContact CE1-CG 3.89Å; F165-M176 HydrophobicContact CZ-CG 4.36Å; F165-A177 HydrophobicContact CE1-CB 4.25Å; F165-A177 HydrophobicContact CZ-CB 4.07Å; F165-L180 HydrophobicContact CZ-CD1 4.11Å; F165-M182 HydrophobicContact CE2-CE 4.08Å; F165-M182 HydrophobicContact CE2-SD 3.88Å; F165-M182 HydrophobicContact CZ-CE 4.43Å; F165-M182 HydrophobicContact CZ-SD 3.78Å
166	D	98.1	Very high	97.4	Very high	86 Å²	86	36.3 Å²	36.3	46%	0.46	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-67.1	-21	173	-57.5	-42.5	0	0	0	111.8	S163 V164 K238	S163-D166 WeakPolarHBondContact CA-OD2 3.2Å; S163-D166 WeakPolarHBondContact CB-OD2 3.28Å; S163-D166 PolarHBondContact N-OD2 3Å; S163-D166 WeakPolarHBondContact O-CB 3.39Å; S163-D166 PolarHBondContact O-N 2.98Å; V164-D166 PolarHBondContact O-N 3.32Å; D166-K238 WeakPolarHBondContact O-CE 3.48Å; D166-K238 PolarHBondContact O-NZ 2.81Å
167	Y	98	Very high	97.3	Very high	24 Å²	24	34.6 Å²	34.6	9%	0.094	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-12.7	-175	-57.2	-90.1	0	0	0	114.3	F141 L154 E158 L159 S163 V164 F165 M237 K238	F141-Y167 HydrophobicContact CE2-CD2 4.16Å; L154-Y167 HydrophobicContact CD1-CD1 3.71Å; L154-Y167 HydrophobicContact CD1-CE1 4.31Å; E158-Y167 PolarHBondContact O-OH 2.9Å; L159-Y167 HydrophobicContact CD2-CD1 3.68Å; L159-Y167 HydrophobicContact CD2-CD2 3.65Å; L159-Y167 HydrophobicContact CD2-CE1 3.77Å; L159-Y167 HydrophobicContact CD2-CE2 3.77Å; L159-Y167 HydrophobicContact CD2-CG 3.62Å; L159-Y167 HydrophobicContact CG-CE1 4.49Å; S163-Y167 WeakPolarHBondContact O-CD2 3.32Å; V164-Y167 PolarHBondContact O-N 2.94Å; F165-Y167 PolarHBondContact O-N 2.93Å; Y167-M237 CarbonylContact O-C 3.53Å; Y167-M237 WeakPolarHBondContact O-CA 3.28Å; Y167-K238 WeakPolarHBondContact O-CG 3.33Å; Y167-K238 PolarHBondContact O-N 3.38Å
168	V	98.1	Very high	97	Very high	2 Å²	2	40 Å²	40	1%	0.012	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-85.8	145.6	173.5	-179.9	0	0	0	0	110.3	V164 D172 H173 I235 R236 M237	V164-V168 HydrophobicContact CG2-CG2 3.84Å; V164-V168 WeakPolarHBondContact O-CG2 3.47Å; V164-V168 PolarHBondContact O-N 2.91Å; V168-D172 HydrophobicContact CG1-CB 3.88Å; V168-H173 PolarHBondContact O-NE2 2.83Å; V168-I235 HydrophobicContact CG1-CB 4.28Å; V168-I235 HydrophobicContact CG1-CD1 4.24Å; V168-I235 HydrophobicContact CG2-CD1 3.65Å; V168-R236 CarbonylContact C-O 3.54Å; V168-R236 WeakPolarHBondContact CA-O 3.38Å; V168-M237 HydrophobicContact CG2-CG 4.36Å
169	H	96.5	Very high	96.9	Very high	55 Å²	55	38.3 Å²	38.3	26%	0.255	22%	0.218	S	C	.	.			trans	-60	132.8	174.8	180	-104.3	0	0	0	111.2	G171 D172 H173 R236 Y253	H169-G171 PolarHBondContact ND1-N 2.86Å; H169-G171 PolarHBondContact O-N 2.85Å; H169-G171 VanDerWaalsContact O-N 3.09Å; H169-D172 IonicContact ND1-OD1 2.72Å; H169-D172 PolarHBondContact ND1-OD1 3.47Å; H169-D172 PolarHBondContact O-N 2.8Å; H169-H173 PolarHBondContact O-CD2 3.06Å; H169-R236 HydrophobicContact CB-CB 3.62Å; H169-R236 WeakPolarHBondContact CB-O 3.25Å; H169-R236 PolarHBondContact N-O 2.81Å; H169-Y253 HydrophobicContact CB-CD1 3.85Å; H169-Y253 HydrophobicContact CB-CE1 3.71Å; H169-Y253 HydrophobicContact CB-CG 4.48Å; H169-Y253 AromaticContact CD2-CE2 3.89Å; H169-Y253 AromaticContact CD2-CZ 3.99Å
170	P	96.1	Very high	96.6	Very high	86 Å²	86	38.5 Å²	38.5	56%	0.558	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-55.2	-32.1	-174.9	-30.1	36.8	0	0	0	115.5	D172 H173	P170-D172 PolarHBondContact O-N 2.73Å; P170-H173 WeakPolarHBondContact O-CB 3.48Å; P170-H173 PolarHBondContact O-N 3Å
171	G	94.9	Very high	96.1	Very high	59 Å²	59	39.8 Å²	39.8	61%	0.608	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-65	-15.6	175.9	0	0	0	0	0	114.6	H169	H169-G171 PolarHBondContact ND1-N 2.86Å; H169-G171 PolarHBondContact O-N 2.85Å; H169-G171 VanDerWaalsContact O-N 3.09Å
172	D	96.9	Very high	95.6	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.011	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-109.9	2	-173.1	-46.3	6.8	0	0	0	110.4	V168 H169 P170 M176 I235 R236	V168-D172 HydrophobicContact CG1-CB 3.88Å; H169-D172 IonicContact ND1-OD1 2.72Å; H169-D172 PolarHBondContact ND1-OD1 3.47Å; H169-D172 PolarHBondContact O-N 2.8Å; P170-D172 PolarHBondContact O-N 2.73Å; D172-M176 WeakPolarHBondContact O-CB 3.44Å; D172-M176 PolarHBondContact O-N 2.91Å; D172-I235 HydrophobicContact CB-CB 4.45Å; D172-I235 HydrophobicContact CB-CG2 4.31Å; D172-R236 IonicContact OD1-CZ 2.7Å; D172-R236 VanDerWaalsContact OD1-CZ 3.26Å; D172-R236 IonicContact OD1-NE 2.65Å; D172-R236 PolarHBondContact OD1-NE 3.05Å; D172-R236 VanDerWaalsContact OD1-NE 3.09Å; D172-R236 IonicContact OD1-NH2 3.81Å; D172-R236 PolarHBondContact OD1-NH2 3.08Å; D172-R236 VanDerWaalsContact OD2-CB 3.27Å; D172-R236 WeakPolarHBondContact OD2-CB 3.49Å; D172-R236 WeakPolarHBondContact OD2-CG 3.41Å; D172-R236 IonicContact OD2-CZ 3.9Å; D172-R236 PolarHBondContact OD2-N 3Å; D172-R236 IonicContact OD2-NE 2.76Å; D172-R236 PolarHBondContact OD2-NE 3.18Å; D172-R236 IonicContact OD2-NH2 3.36Å
173	H	97.2	Very high	94.1	Very high	54 Å²	54	50.6 Å²	50.6	25%	0.25	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-36.4	-176.8	-76.8	-165.1	0	0	0	113.1	F165 V168 H169 P170 A177	F165-H173 HydrophobicContact CD1-CB 4.12Å; F165-H173 AromaticContact CD1-CG 3.88Å; F165-H173 HydrophobicContact CE1-CB 4.49Å; F165-H173 WeakPolarHBondContact CE1-O 3.36Å; F165-H173 PolarHBondContact O-CE1 3.05Å; F165-H173 PolarHBondContact O-NE2 3Å; F165-H173 VanDerWaalsContact O-NE2 3.09Å; V168-H173 PolarHBondContact O-NE2 2.83Å; H169-H173 PolarHBondContact O-CD2 3.06Å; P170-H173 WeakPolarHBondContact O-CB 3.48Å; P170-H173 PolarHBondContact O-N 3Å; H173-A177 WeakPolarHBondContact O-CB 3.23Å; H173-A177 PolarHBondContact O-N 2.82Å
174	V	96.4	Very high	92	Very high	93 Å²	93	54 Å²	54	56%	0.564	29%	0.294	S	S	*	.	H	α-helix	trans	-65.9	-49.1	178.5	176.2	0	0	0	0	110.3	A177 E178 L184	V174-A177 PolarHBondContact O-N 2.82Å; V174-E178 PolarHBondContact O-N 2.98Å; V174-L184 HydrophobicContact CG1-CD1 3.93Å
175	E	95.8	Very high	89.3	Confident	48 Å²	48	59.1 Å²	59.1	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-58.8	-49.1	175.8	-176.9	-176.6	153.9	0	0	111.3	A177 E178 Q179 K358	E175-A177 VanDerWaalsContact C-N 3.27Å; E175-A177 PolarHBondContact O-N 2.97Å; E175-E178 PolarHBondContact O-N 2.9Å; E175-Q179 HydrophobicContact CG-CG 4.33Å; E175-Q179 WeakPolarHBondContact O-CB 3.28Å; E175-Q179 WeakPolarHBondContact O-CG 3.34Å; E175-Q179 PolarHBondContact O-N 3.24Å; E175-K358 IonicContact OE1-NZ 2.74Å; E175-K358 PolarHBondContact OE1-NZ 2.83Å; E175-K358 WeakPolarHBondContact OE2-CE 3.34Å; E175-K358 IonicContact OE2-NZ 3.18Å; E175-K358 PolarHBondContact OE2-NZ 2.98Å
176	M	96.2	Very high	86.5	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-59	-37.7	177.8	-174.4	71.8	-150	0	0	112.4	L135 V164 F165 D172 L180 F233 I235 I258 L281	L135-M176 HydrophobicContact CD1-CE 3.48Å; L135-M176 VanDerWaalsContact CD1-CE 3.48Å; V164-M176 HydrophobicContact CG1-CE 4.2Å; V164-M176 HydrophobicContact CG1-CG 4.17Å; V164-M176 HydrophobicContact CG2-CE 4.12Å; F165-M176 HydrophobicContact CE1-CB 3.93Å; F165-M176 HydrophobicContact CE1-CG 3.89Å; F165-M176 HydrophobicContact CZ-CG 4.36Å; D172-M176 WeakPolarHBondContact O-CB 3.44Å; D172-M176 PolarHBondContact O-N 2.91Å; M176-L180 HydrophobicContact CE-CD1 3.73Å; M176-L180 HydrophobicContact CE-CG 4Å; M176-L180 HydrophobicContact CG-CD1 4.26Å; M176-L180 WeakPolarHBondContact O-CB 3.45Å; M176-L180 WeakPolarHBondContact O-CD1 3.34Å; M176-L180 WeakPolarHBondContact O-CG 3.46Å; M176-L180 PolarHBondContact O-N 2.84Å; M176-L180 VanDerWaalsContact O-N 3.14Å; M176-F233 HydrophobicContact CE-CZ 4.22Å; M176-F233 HydrophobicContact SD-CE2 3.68Å; M176-F233 HydrophobicContact SD-CZ 3.76Å; M176-I235 HydrophobicContact SD-CD1 3.81Å; M176-I235 HydrophobicContact SD-CG2 4.48Å; M176-I258 HydrophobicContact SD-CD1 4.3Å; M176-L281 HydrophobicContact CE-CD2 4.18Å
177	A	95.1	Very high	84.1	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.025	37%	0.373	C	S	.	.	H	α-helix	trans	-70	-41.5	176.9	0	0	0	0	0	112.4	F165 H173 V174 E175 L180 G181 M182 L184	F165-A177 HydrophobicContact CE1-CB 4.25Å; F165-A177 HydrophobicContact CZ-CB 4.07Å; H173-A177 WeakPolarHBondContact O-CB 3.23Å; H173-A177 PolarHBondContact O-N 2.82Å; V174-A177 PolarHBondContact O-N 2.82Å; E175-A177 VanDerWaalsContact C-N 3.27Å; E175-A177 PolarHBondContact O-N 2.97Å; A177-L180 PolarHBondContact O-N 3.02Å; A177-G181 PolarHBondContact O-N 2.83Å; A177-M182 HydrophobicContact CB-CB 4.19Å; A177-M182 HydrophobicContact CB-SD 4.22Å; A177-M182 WeakPolarHBondContact O-CB 3.5Å; A177-M182 PolarHBondContact O-N 2.81Å; A177-L184 HydrophobicContact CB-CD1 4.41Å; A177-L184 HydrophobicContact CB-CD2 3.88Å; A177-L184 HydrophobicContact CB-CG 4.21Å
178	E	93.2	Very high	81.3	Confident	138 Å²	138	73 Å²	73	65%	0.645	41%	0.412	S	S	*	.	H	α-helix	trans	-61.9	-47.7	174.8	-175.7	-179.6	170.7	0	0	111.6	V174 E175 L180 G181	V174-E178 PolarHBondContact O-N 2.98Å; E175-E178 PolarHBondContact O-N 2.9Å; E178-L180 PolarHBondContact O-N 3.4Å; E178-G181 WeakPolarHBondContact O-CA 3.11Å; E178-G181 PolarHBondContact O-N 3.3Å
179	Q	94.1	Very high	78.3	Confident	46 Å²	46	76.3 Å²	76.3	22%	0.215	45%	0.447	C	S	.	.	H	α-helix	trans	-61.6	-31.5	177.4	-63.1	-75.7	-8.2	0	0	111.8	E175 G181 R231 F233	E175-Q179 HydrophobicContact CG-CG 4.33Å; E175-Q179 WeakPolarHBondContact O-CB 3.28Å; E175-Q179 WeakPolarHBondContact O-CG 3.34Å; E175-Q179 PolarHBondContact O-N 3.24Å; Q179-G181 VanDerWaalsContact C-N 3.3Å; Q179-G181 PolarHBondContact O-N 3.38Å; Q179-R231 WeakPolarHBondContact O-CD 3.42Å; Q179-R231 PolarHBondContact O-NE 3.49Å; Q179-F233 HydrophobicContact CB-CD1 4.07Å; Q179-F233 HydrophobicContact CB-CE1 3.62Å; Q179-F233 HydrophobicContact CB-CE2 4.12Å; Q179-F233 HydrophobicContact CB-CZ 3.66Å; Q179-F233 HydrophobicContact CG-CB 4.44Å; Q179-F233 HydrophobicContact CG-CD1 3.72Å; Q179-F233 HydrophobicContact CG-CD2 3.86Å; Q179-F233 HydrophobicContact CG-CE1 3.8Å; Q179-F233 HydrophobicContact CG-CE2 3.94Å; Q179-F233 HydrophobicContact CG-CG 3.76Å; Q179-F233 HydrophobicContact CG-CZ 3.92Å
180	L	92.5	Very high	75.5	Confident	5 Å²	5	81.4 Å²	81.4	3%	0.026	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.3	171.9	-82	163.9	0	0	0	114.5	L135 V164 F165 M176 A177 E178 M182 L281	L135-L180 HydrophobicContact CB-CD2 4.38Å; L135-L180 HydrophobicContact CD1-CD1 4.29Å; L135-L180 HydrophobicContact CD1-CD2 4.07Å; V164-L180 HydrophobicContact CG1-CD1 4.37Å; F165-L180 HydrophobicContact CZ-CD1 4.11Å; M176-L180 HydrophobicContact CE-CD1 3.73Å; M176-L180 HydrophobicContact CE-CG 4Å; M176-L180 HydrophobicContact CG-CD1 4.26Å; M176-L180 WeakPolarHBondContact O-CB 3.45Å; M176-L180 WeakPolarHBondContact O-CD1 3.34Å; M176-L180 WeakPolarHBondContact O-CG 3.46Å; M176-L180 PolarHBondContact O-N 2.84Å; M176-L180 VanDerWaalsContact O-N 3.14Å; A177-L180 PolarHBondContact O-N 3.02Å; E178-L180 PolarHBondContact O-N 3.4Å; L180-M182 VanDerWaalsContact C-N 3.3Å; L180-M182 HydrophobicContact CB-CE 4.32Å; L180-M182 HydrophobicContact CB-CG 3.93Å; L180-M182 HydrophobicContact CB-SD 4.25Å; L180-M182 HydrophobicContact CD1-CE 3.83Å; L180-M182 HydrophobicContact CD1-SD 4.15Å; L180-L281 HydrophobicContact CD2-CB 3.77Å; L180-L281 HydrophobicContact CD2-CD2 4.36Å
181	G	88.4	Confident	72.6	Confident	40 Å²	40	84.9 Å²	84.9	41%	0.412	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	20.9	-173.8	0	0	0	0	0	113.8	A177 E178 Q179 K183	A177-G181 PolarHBondContact O-N 2.83Å; E178-G181 WeakPolarHBondContact O-CA 3.11Å; E178-G181 PolarHBondContact O-N 3.3Å; Q179-G181 VanDerWaalsContact C-N 3.3Å; Q179-G181 PolarHBondContact O-N 3.38Å; G181-K183 PolarHBondContact O-N 3.19Å
182	M	86.7	Confident	69.5	Low	48 Å²	48	87.2 Å²	87.2	24%	0.236	50%	0.495	C	S	.	.			trans	-74.9	121.7	178.5	-66.4	177.4	167.2	0	0	110.3	Q137 G139 F165 A177 L180 L184	Q137-M182 VanDerWaalsContact O-CE 3.27Å; Q137-M182 WeakPolarHBondContact O-CE 3.39Å; G139-M182 VanDerWaalsContact N-CE 3.31Å; F165-M182 HydrophobicContact CE2-CE 4.08Å; F165-M182 HydrophobicContact CE2-SD 3.88Å; F165-M182 HydrophobicContact CZ-CE 4.43Å; F165-M182 HydrophobicContact CZ-SD 3.78Å; A177-M182 HydrophobicContact CB-CB 4.19Å; A177-M182 HydrophobicContact CB-SD 4.22Å; A177-M182 WeakPolarHBondContact O-CB 3.5Å; A177-M182 PolarHBondContact O-N 2.81Å; L180-M182 VanDerWaalsContact C-N 3.3Å; L180-M182 HydrophobicContact CB-CE 4.32Å; L180-M182 HydrophobicContact CB-CG 3.93Å; L180-M182 HydrophobicContact CB-SD 4.25Å; L180-M182 HydrophobicContact CD1-CE 3.83Å; L180-M182 HydrophobicContact CD1-SD 4.15Å; M182-L184 VanDerWaalsContact C-N 3.34Å; M182-L184 PolarHBondContact O-N 3.21Å
183	K	66.8	Low	66.5	Low	206 Å²	206	95.9 Å²	95.9	90%	0.896	54%	0.536	S	S	*	.			trans	-69	92.8	167.5	-69.2	-169.8	176.1	-171.3	0	109.6	G181	G181-K183 PolarHBondContact O-N 3.19Å
184	L	54.8	Low	63.1	Low	92 Å²	92	96.5 Å²	96.5	48%	0.482	56%	0.556	S	S	.	*			trans	-55.1	134.3	166.1	-68.4	173	0	0	0	109	V174 A177 M182	V174-L184 HydrophobicContact CG1-CD1 3.93Å; A177-L184 HydrophobicContact CB-CD1 4.41Å; A177-L184 HydrophobicContact CB-CD2 3.88Å; A177-L184 HydrophobicContact CB-CG 4.21Å; M182-L184 VanDerWaalsContact C-N 3.34Å; M182-L184 PolarHBondContact O-N 3.21Å
185	P	42.3	Very low	59.9	Low	108 Å²	108	98.3 Å²	98.3	70%	0.701	57%	0.568	S	S	*	*			trans	-59.7	131.4	174.9	-23.8	34	0	0	0	110.5	G187	P185-G187 VanDerWaalsContact C-N 3.32Å; P185-G187 PolarHBondContact O-N 2.75Å
186	P	39	Very low	56.7	Low	141 Å²	141	101 Å²	101	92%	0.916	60%	0.598	S	S	*	*	S	Bend	trans	-69.3	90.7	175.1	28.7	-33.7	0	0	0	109.3
187	G	46.1	Very low	53.8	Low	69 Å²	69	109 Å²	109	71%	0.711	64%	0.636	S	S	*	*			trans	150	44.2	-177.5	0	0	0	0	0	116.9	P185	P185-G187 VanDerWaalsContact C-N 3.32Å; P185-G187 PolarHBondContact O-N 2.75Å
188	R	39.5	Very low	50.6	Low	237 Å²	237	117.1 Å²	117.1	89%	0.894	68%	0.679	S	S	*	*			trans	-150.7	44.7	155.8	-125	173.7	-160.9	-92.6	-1.7	114.5
189	G	34.8	Very low	47.6	Very low	73 Å²	73	113.7 Å²	113.7	75%	0.753	68%	0.68	S	S	*	*			trans	-57.2	154.1	158.9	0	0	0	0	0	111.3
190	L	39.1	Very low	44.6	Very low	161 Å²	161	116 Å²	116	84%	0.843	71%	0.708	S	S	*	*			trans	-36.1	136.9	-177.9	-174	65.1	0	0	0	115.4	S192	L190-S192 PolarHBondContact O-N 3.47Å
191	L	34.1	Very low	41.9	Very low	160 Å²	160	121.3 Å²	121.3	84%	0.838	75%	0.745	S	S	*	*			trans	-67.8	97.3	160.7	-80	170.1	0	0	0	109.2
192	S	31.2	Very low	39.3	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	76%	0.762	S	S	*	*			trans	-122.7	118.4	156.3	-169.8	0	0	0	0	107.4	L190	L190-S192 PolarHBondContact O-N 3.47Å
193	Q	33.1	Very low	36.7	Very low	184 Å²	184	127.2 Å²	127.2	86%	0.86	79%	0.791	S	S	*	*			trans	-135.1	129.9	-176.5	-175.6	174.1	1	0	0	108.2
194	G	26.2	Very low	35	Very low	67 Å²	67	122.9 Å²	122.9	69%	0.691	79%	0.786	S	S	*	*			cis	-171.6	-174	-3.4	0	0	0	0	0	112
195	T	29.6	Very low	33.9	Very low	131 Å²	131	123.7 Å²	123.7	80%	0.804	80%	0.799	S	S	*	*			trans	-76.5	152.3	173.2	41.3	0	0	0	0	112.1
196	A	27.5	Very low	33.4	Very low	104 Å²	104	124.1 Å²	124.1	86%	0.86	81%	0.805	S	S	*	*			trans	-130.7	151.9	150.5	0	0	0	0	0	106.6
197	E	35.5	Very low	33.3	Very low	168 Å²	168	122.3 Å²	122.3	79%	0.785	80%	0.796	S	S	*	*			trans	-121.6	153.6	-152.7	-54.9	176	137.3	0	0	112.7
198	D	29.1	Very low	32.7	Very low	174 Å²	174	128.1 Å²	128.1	93%	0.93	80%	0.804	S	S	*	*			trans	173.2	143	141.9	-94	-27.3	0	0	0	109.6
199	G	29.5	Very low	32.3	Very low	66 Å²	66	122 Å²	122	68%	0.68	80%	0.798	S	S	*	*			cis	179.5	-179.7	-4	0	0	0	0	0	112.1
200	A	30.4	Very low	32.1	Very low	95 Å²	95	127.6 Å²	127.6	79%	0.785	81%	0.805	S	S	*	*			trans	66.2	123.2	177.7	0	0	0	0	0	117.1
201	S	37.3	Very low	32.1	Very low	116 Å²	116	126.3 Å²	126.3	81%	0.811	80%	0.804	S	S	*	*				74	131.5	60.7	-56.1	0	0	0	0	113
202	S	33.5	Very low	32.2	Very low	110 Å²	110	124.5 Å²	124.5	77%	0.769	80%	0.802	S	S	*	*			cis	-152	139.9	9.1	-40.6	0	0	0	0	109.2
203	A	32	Very low	32.2	Very low	102 Å²	102	127.3 Å²	127.3	84%	0.843	80%	0.803	S	S	*	*				61.8	90.2	80.1	0	0	0	0	0	117.8
204	S	31.3	Very low	32.3	Very low	114 Å²	114	124.3 Å²	124.3	80%	0.797	80%	0.799	S	S	*	*			trans	-178.7	159.2	150.7	53.4	0	0	0	0	111.1
205	S	31.1	Very low	32.6	Very low	109 Å²	109	127 Å²	127	76%	0.762	80%	0.802	S	S	*	*				180	107.9	-54.1	47.7	0	0	0	0	110.5
206	S	32	Very low	32.9	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	80%	0.803	S	S	*	*			trans	163.3	160.1	157.8	52.5	0	0	0	0	111.7
207	S	35.7	Very low	33.1	Very low	104 Å²	104	129.1 Å²	129.1	73%	0.727	80%	0.797	S	S	*	*				174	99	-58.4	50.1	0	0	0	0	110.1
208	Q	33.6	Very low	33.3	Very low	190 Å²	190	127 Å²	127	89%	0.888	80%	0.795	S	S	*	*			trans	-171	109.2	157.1	-106	160.9	48.4	0	0	106.1
209	S	32.1	Very low	33.3	Very low	109 Å²	109	123.5 Å²	123.5	76%	0.762	78%	0.784	S	S	*	*			cis	95.9	69.3	39.3	79.7	0	0	0	0	114.1
210	E	30.2	Very low	33.8	Very low	191 Å²	191	125.1 Å²	125.1	89%	0.893	78%	0.783	S	S	*	*			trans	-142	151.4	147.8	-115.1	172.8	-173.3	0	0	109.2
211	T	39.3	Very low	34	Very low	134 Å²	134	125.4 Å²	125.4	82%	0.822	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-97.9	126.1	-159.4	48.1	0	0	0	0	114.1
212	P	36.5	Very low	34.3	Very low	122 Å²	122	127.7 Å²	127.7	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.2	125.8	161.7	32.6	-29.6	0	0	0	110.8
213	E	31.6	Very low	34.8	Very low	166 Å²	166	127.8 Å²	127.8	78%	0.776	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-69.7	150.4	164.8	-69.9	-163.8	136.4	0	0	111	V215	E213-V215 PolarHBondContact O-N 3.41Å
214	P	35.2	Very low	35.1	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	77%	0.765	S	S	*	*			trans	-73.4	89.6	174	31.2	-34.2	0	0	0	110.2	E216	P214-E216 PolarHBondContact O-N 3.33Å
215	V	32.7	Very low	36.1	Very low	122 Å²	122	127.6 Å²	127.6	74%	0.739	76%	0.757	S	S	*	*			trans	-65.5	102.5	177.1	-161.7	0	0	0	0	109.5	E213 S217	E213-V215 PolarHBondContact O-N 3.41Å; V215-S217 VanDerWaalsContact C-N 3.27Å; V215-S217 PolarHBondContact O-N 3.04Å; V215-S217 PolarHBondContact O-OG 2.9Å
216	E	35.9	Very low	36.9	Very low	177 Å²	177	128.6 Å²	128.6	83%	0.827	75%	0.753	S	S	*	*			trans	-65.4	85.6	173	-73.9	-164.6	145.6	0	0	110.1	P214 T218	P214-E216 PolarHBondContact O-N 3.33Å; E216-T218 PolarHBondContact O-N 2.98Å
217	S	30.5	Very low	37.9	Very low	104 Å²	104	129 Å²	129	73%	0.727	75%	0.746	S	S	*	*			trans	-72.9	46.5	179.3	-66	0	0	0	0	113.1	V215 S219	V215-S217 VanDerWaalsContact C-N 3.27Å; V215-S217 PolarHBondContact O-N 3.04Å; V215-S217 PolarHBondContact O-OG 2.9Å; S217-S219 PolarHBondContact O-N 2.74Å; S217-S219 VanDerWaalsContact O-N 3.11Å
218	T	39.3	Very low	39.5	Very low	124 Å²	124	126.3 Å²	126.3	76%	0.761	73%	0.725	S	S	*	*			trans	-85.8	59.9	172.6	-49.6	0	0	0	0	110	E216	E216-T218 PolarHBondContact O-N 2.98Å
219	S	29.1	Very low	42	Very low	100 Å²	100	118.6 Å²	118.6	70%	0.699	69%	0.69	S	S	*	*			trans	-114.9	114.7	169.6	-75.1	0	0	0	0	108.8	S217 S221	S217-S219 PolarHBondContact O-N 2.74Å; S217-S219 VanDerWaalsContact O-N 3.11Å; S219-S221 PolarHBondContact O-N 2.65Å; S219-S221 VanDerWaalsContact O-N 3.12Å
220	P	40.1	Very low	44.9	Very low	99 Å²	99	117.8 Å²	117.8	64%	0.643	68%	0.675	S	S	*	*			trans	-68.5	111.4	169.4	28.5	-30.8	0	0	0	107.8	L222	P220-L222 PolarHBondContact O-N 3.04Å; P220-L222 VanDerWaalsContact O-N 3.15Å
221	S	35.7	Very low	48	Very low	102 Å²	102	111 Å²	111	71%	0.713	64%	0.64	S	S	*	*			trans	-51.3	124.6	174.4	-65.1	0	0	0	0	109.8	S219 L223	S219-S221 PolarHBondContact O-N 2.65Å; S219-S221 VanDerWaalsContact O-N 3.12Å; S221-L223 VanDerWaalsContact C-N 3.33Å; S221-L223 PolarHBondContact O-N 2.72Å
222	L	42.7	Very low	50.6	Low	163 Å²	163	108.4 Å²	108.4	85%	0.853	63%	0.628	S	S	*	*			trans	-64.2	97.7	171.2	-69.1	170	0	0	0	107.4	P220 T224	P220-L222 PolarHBondContact O-N 3.04Å; P220-L222 VanDerWaalsContact O-N 3.15Å; L222-T224 PolarHBondContact O-N 3.26Å
223	L	44.4	Very low	53.5	Low	112 Å²	112	102.9 Å²	102.9	59%	0.586	59%	0.592	S	S	*	*			trans	-58.2	121.2	-179.3	-65.6	177.3	0	0	0	109	S221 T225	S221-L223 VanDerWaalsContact C-N 3.33Å; S221-L223 PolarHBondContact O-N 2.72Å; L223-T225 PolarHBondContact O-N 3.16Å
224	T	37.5	Very low	56.6	Low	113 Å²	113	95.5 Å²	95.5	69%	0.693	56%	0.557	S	S	*	*			trans	-63	125.8	173.3	38.4	0	0	0	0	109	L222 D226 T228	L222-T224 PolarHBondContact O-N 3.26Å; T224-D226 PolarHBondContact O-N 2.91Å; T224-T228 WeakPolarHBondContact O-CG2 3.23Å; T224-T228 PolarHBondContact O-OG1 3.17Å
225	T	52.4	Low	59.5	Low	100 Å²	100	89.7 Å²	89.7	61%	0.613	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-38.3	-138.8	-43.9	0	0	0	0	115.4	L223 L229	L223-T225 PolarHBondContact O-N 3.16Å; T225-L229 WeakPolarHBondContact O-CD1 3.46Å
226	D	49.5	Very low	62.6	Low	129 Å²	129	86.6 Å²	86.6	69%	0.69	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-59	-160.6	-58.4	-31.7	0	0	0	112.7	T224 T228	T224-D226 PolarHBondContact O-N 2.91Å; D226-T228 VanDerWaalsContact C-N 3.35Å; D226-T228 PolarHBondContact O-N 2.88Å
227	N	53	Low	65.4	Low	125 Å²	125	78.2 Å²	78.2	67%	0.668	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.6	-172.3	-66.1	7.2	0	0	0	114.1	L229	N227-L229 VanDerWaalsContact C-N 3.3Å; N227-L229 PolarHBondContact O-N 3.18Å
228	T	67.8	Low	68.5	Low	48 Å²	48	77.3 Å²	77.3	29%	0.294	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.5	-174.1	58.7	0	0	0	0	113.9	T224 D226 R231	T224-T228 WeakPolarHBondContact O-CG2 3.23Å; T224-T228 PolarHBondContact O-OG1 3.17Å; D226-T228 VanDerWaalsContact C-N 3.35Å; D226-T228 PolarHBondContact O-N 2.88Å; T228-R231 PolarHBondContact O-NH1 2.91Å; T228-R231 PolarHBondContact O-NH2 2.92Å
229	L	87.3	Confident	71.1	Confident	28 Å²	28	72.1 Å²	72.1	15%	0.147	41%	0.407	C	S	.	.	S	Bend	trans	-101.8	-14.6	-176.5	-57.4	178.4	0	0	0	113.6	T225 N227 R261 L262 L264	T225-L229 WeakPolarHBondContact O-CD1 3.46Å; N227-L229 VanDerWaalsContact C-N 3.3Å; N227-L229 PolarHBondContact O-N 3.18Å; L229-R261 CarbonylContact O-C 3.57Å; L229-R261 VanDerWaalsContact O-CA 3.32Å; L229-R261 WeakPolarHBondContact O-CA 3.23Å; L229-L262 PolarHBondContact O-N 3.31Å; L229-L264 HydrophobicContact CD1-CD1 3.56Å; L229-L264 HydrophobicContact CD1-CG 4.09Å; L229-L264 HydrophobicContact CD2-CD1 3.89Å; L229-L264 HydrophobicContact CD2-CD2 4.29Å; L229-L264 HydrophobicContact CD2-CG 4.13Å; L229-L264 HydrophobicContact CG-CD1 4.38Å
230	E	92.4	Very high	74	Confident	93 Å²	93	71.6 Å²	71.6	44%	0.435	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	145.9	177	-52.3	-148.8	138.4	0	0	111.7	R261	E230-R261 HydrophobicContact CG-CG 4.31Å; E230-R261 IonicContact OE1-CZ 2.8Å; E230-R261 IonicContact OE1-NE 3.83Å; E230-R261 PolarHBondContact OE1-NE 3.32Å; E230-R261 IonicContact OE1-NH2 2.74Å; E230-R261 PolarHBondContact OE1-NH2 3.01Å
231	R	94.4	Very high	76.2	Confident	47 Å²	47	70.1 Å²	70.1	18%	0.177	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	121.6	-175.3	-64.8	-69.4	177.9	-90.2	10.9	109.1	Q179 T228 F233 T259 G260 L262 L281	Q179-R231 WeakPolarHBondContact O-CD 3.42Å; Q179-R231 PolarHBondContact O-NE 3.49Å; T228-R231 PolarHBondContact O-NH1 2.91Å; T228-R231 PolarHBondContact O-NH2 2.92Å; R231-F233 HydrophobicContact CB-CD1 4.31Å; R231-F233 HydrophobicContact CB-CE1 4.13Å; R231-T259 CarbonylContact O-C 3.52Å; R231-T259 WeakPolarHBondContact O-CA 3.22Å; R231-G260 PolarHBondContact N-O 2.93Å; R231-G260 PolarHBondContact O-N 2.81Å; R231-L262 HydrophobicContact CG-CG 4.26Å; R231-L262 VanDerWaalsContact NH2-CD1 3.31Å; R231-L281 HydrophobicContact CB-CD1 4.01Å; R231-L281 HydrophobicContact CG-CD1 3.71Å
232	S	95.6	Very high	77.7	Confident	81 Å²	81	70.7 Å²	70.7	57%	0.566	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	111.2	175.6	-173.3	0	0	0	0	108.1	H257 I258	S232-H257 PolarHBondContact OG-NE2 3.15Å; S232-I258 VanDerWaalsContact CA-O 3.27Å; S232-I258 WeakPolarHBondContact CA-O 3.3Å
233	F	96.4	Very high	78.6	Confident	6 Å²	6	66.1 Å²	66.1	3%	0.026	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	164.8	-173.9	64.3	-80.8	0	0	0	111.8	M176 Q179 R231 I235 I258	M176-F233 HydrophobicContact CE-CZ 4.22Å; M176-F233 HydrophobicContact SD-CE2 3.68Å; M176-F233 HydrophobicContact SD-CZ 3.76Å; Q179-F233 HydrophobicContact CB-CD1 4.07Å; Q179-F233 HydrophobicContact CB-CE1 3.62Å; Q179-F233 HydrophobicContact CB-CE2 4.12Å; Q179-F233 HydrophobicContact CB-CZ 3.66Å; Q179-F233 HydrophobicContact CG-CB 4.44Å; Q179-F233 HydrophobicContact CG-CD1 3.72Å; Q179-F233 HydrophobicContact CG-CD2 3.86Å; Q179-F233 HydrophobicContact CG-CE1 3.8Å; Q179-F233 HydrophobicContact CG-CE2 3.94Å; Q179-F233 HydrophobicContact CG-CG 3.76Å; Q179-F233 HydrophobicContact CG-CZ 3.92Å; R231-F233 HydrophobicContact CB-CD1 4.31Å; R231-F233 HydrophobicContact CB-CE1 4.13Å; F233-I235 HydrophobicContact CD2-CG2 3.72Å; F233-I235 HydrophobicContact CE2-CG2 3.61Å; F233-I258 HydrophobicContact CD1-CB 4.29Å; F233-I258 HydrophobicContact CD1-CG2 3.96Å; F233-I258 HydrophobicContact CE1-CB 4.05Å; F233-I258 HydrophobicContact CE1-CG2 3.4Å; F233-I258 HydrophobicContact CE2-CB 4.47Å; F233-I258 HydrophobicContact CE2-CD1 3.94Å; F233-I258 HydrophobicContact CZ-CB 4.14Å; F233-I258 HydrophobicContact CZ-CD1 3.79Å; F233-I258 HydrophobicContact CZ-CG2 3.74Å; F233-I258 PolarHBondContact N-O 2.87Å; F233-I258 VanDerWaalsContact N-O 3.1Å; F233-I258 PolarHBondContact O-N 2.83Å
234	F	97.3	Very high	78.8	Confident	10 Å²	10	71.9 Å²	71.9	4%	0.044	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.4	-176.7	-59.3	-84.4	0	0	0	111.1	V255 I256 H257 L288 D354 K358 C361 V362	F234-V255 HydrophobicContact CB-CG1 4.21Å; F234-V255 HydrophobicContact CD1-CG1 4.26Å; F234-I256 WeakPolarHBondContact CA-O 3.34Å; F234-H257 HydrophobicContact CD1-CB 3.8Å; F234-H257 AromaticContact CD1-CD2 3.91Å; F234-H257 HydrophobicContact CE1-CB 3.55Å; F234-H257 AromaticContact CE1-CD2 3.44Å; F234-H257 VanDerWaalsContact CE1-CD2 3.44Å; F234-H257 WeakPolarHBondContact CE1-CD2 3.32Å; F234-H257 AromaticContact CE1-CG 3.45Å; F234-H257 VanDerWaalsContact CE1-CG 3.45Å; F234-H257 AromaticContact CZ-CD2 3.63Å; F234-H257 AromaticContact CZ-CG 3.99Å; F234-H257 AromaticContact CZ-NE2 3.96Å; F234-L288 HydrophobicContact CD1-CD1 4.12Å; F234-L288 HydrophobicContact CE1-CD1 4.08Å; F234-D354 HydrophobicContact CD2-CB 4.3Å; F234-D354 WeakPolarHBondContact CD2-OD2 3.48Å; F234-K358 HydrophobicContact CB-CD 3.81Å; F234-K358 WeakPolarHBondContact O-CD 3.36Å; F234-K358 WeakPolarHBondContact O-CE 3.42Å; F234-K358 PolarHBondContact O-NZ 3.29Å; F234-C361 HydrophobicContact CE2-CB 4.37Å; F234-C361 HydrophobicContact CZ-CB 4.42Å; F234-V362 HydrophobicContact CE1-CB 4.23Å; F234-V362 HydrophobicContact CE1-CG2 4.43Å; F234-V362 HydrophobicContact CZ-CB 4.04Å; F234-V362 VanDerWaalsContact CZ-O 3.3Å; F234-V362 WeakPolarHBondContact CZ-O 3.48Å
235	I	96.9	Very high	79.2	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155.6	173.1	60.2	170.5	0	0	0	111.5	V168 D172 M176 F233 M237 I256 I258	V168-I235 HydrophobicContact CG1-CB 4.28Å; V168-I235 HydrophobicContact CG1-CD1 4.24Å; V168-I235 HydrophobicContact CG2-CD1 3.65Å; D172-I235 HydrophobicContact CB-CB 4.45Å; D172-I235 HydrophobicContact CB-CG2 4.31Å; M176-I235 HydrophobicContact SD-CD1 3.81Å; M176-I235 HydrophobicContact SD-CG2 4.48Å; F233-I235 HydrophobicContact CD2-CG2 3.72Å; F233-I235 HydrophobicContact CE2-CG2 3.61Å; I235-M237 HydrophobicContact CD1-CG 3.89Å; I235-M237 HydrophobicContact CD1-SD 4.21Å; I235-M237 HydrophobicContact CG1-CG 4.09Å; I235-I256 PolarHBondContact N-O 2.8Å; I235-I256 PolarHBondContact O-N 3.17Å; I235-I258 HydrophobicContact CD1-CD1 3.41Å; I235-I258 VanDerWaalsContact CD1-CD1 3.41Å; I235-I258 HydrophobicContact CD1-CG1 4.46Å; I235-I258 HydrophobicContact CG1-CD1 3.79Å; I235-I258 HydrophobicContact CG1-CG1 4.42Å
236	R	95.9	Very high	78.6	Confident	58 Å²	58	68.4 Å²	68.4	22%	0.219	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.7	173.7	-65.7	169.7	-76.8	-153	-4.2	109.5	V168 H169 D172 Y253 K254 V255 N357	V168-R236 CarbonylContact C-O 3.54Å; V168-R236 WeakPolarHBondContact CA-O 3.38Å; H169-R236 HydrophobicContact CB-CB 3.62Å; H169-R236 WeakPolarHBondContact CB-O 3.25Å; H169-R236 PolarHBondContact N-O 2.81Å; D172-R236 IonicContact OD1-CZ 2.7Å; D172-R236 VanDerWaalsContact OD1-CZ 3.26Å; D172-R236 IonicContact OD1-NE 2.65Å; D172-R236 PolarHBondContact OD1-NE 3.05Å; D172-R236 VanDerWaalsContact OD1-NE 3.09Å; D172-R236 IonicContact OD1-NH2 3.81Å; D172-R236 PolarHBondContact OD1-NH2 3.08Å; D172-R236 VanDerWaalsContact OD2-CB 3.27Å; D172-R236 WeakPolarHBondContact OD2-CB 3.49Å; D172-R236 WeakPolarHBondContact OD2-CG 3.41Å; D172-R236 IonicContact OD2-CZ 3.9Å; D172-R236 PolarHBondContact OD2-N 3Å; D172-R236 IonicContact OD2-NE 2.76Å; D172-R236 PolarHBondContact OD2-NE 3.18Å; D172-R236 IonicContact OD2-NH2 3.36Å; R236-Y253 HydrophobicContact CB-CD1 4.29Å; R236-Y253 HydrophobicContact CB-CG 4.48Å; R236-K254 CarbonylContact C-O 3.58Å; R236-K254 VanDerWaalsContact CA-O 3.29Å; R236-K254 WeakPolarHBondContact CA-O 3.33Å; R236-V255 HydrophobicContact CG-CG2 4.29Å; R236-N357 PolarHBondContact NH1-O 2.99Å
237	M	96.6	Very high	78	Confident	1 Å²	1	72 Å²	72	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	146	176.8	-65.2	-168.1	71.6	0	0	111.7	F131 F141 L152 Y167 V168 I235 S239 Y253 K254 I256	F131-M237 HydrophobicContact CE2-SD 4.43Å; F131-M237 HydrophobicContact CZ-SD 4.1Å; F141-M237 HydrophobicContact CZ-CE 4.17Å; L152-M237 HydrophobicContact CD1-CB 3.89Å; L152-M237 HydrophobicContact CD1-CE 4.25Å; L152-M237 HydrophobicContact CD1-SD 4.3Å; L152-M237 HydrophobicContact CD2-CB 4.33Å; Y167-M237 CarbonylContact O-C 3.53Å; Y167-M237 WeakPolarHBondContact O-CA 3.28Å; V168-M237 HydrophobicContact CG2-CG 4.36Å; I235-M237 HydrophobicContact CD1-CG 3.89Å; I235-M237 HydrophobicContact CD1-SD 4.21Å; I235-M237 HydrophobicContact CG1-CG 4.09Å; M237-S239 PolarHBondContact O-N 2.77Å; M237-Y253 VanDerWaalsContact C-CD1 3.47Å; M237-Y253 CarbonylContact O-C 3.6Å; M237-Y253 VanDerWaalsContact O-CA 3.23Å; M237-Y253 WeakPolarHBondContact O-CA 3.31Å; M237-K254 PolarHBondContact N-O 3.12Å; M237-K254 PolarHBondContact O-N 3.1Å; M237-I256 HydrophobicContact CB-CG1 3.79Å; M237-I256 HydrophobicContact CG-CB 4.27Å; M237-I256 HydrophobicContact CG-CG1 3.77Å; M237-I256 HydrophobicContact SD-CB 4.34Å; M237-I256 HydrophobicContact SD-CG1 3.96Å; M237-I256 HydrophobicContact SD-CG2 4.33Å
238	K	95.1	Very high	77.6	Confident	85 Å²	85	71.1 Å²	71.1	37%	0.37	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	135.9	179.2	-76.2	-179.3	-173.7	167.2	0	111.2	L152 L154 D166 Y167 G252 Y253	L152-K238 WeakPolarHBondContact CD2-O 3.45Å; L154-K238 HydrophobicContact CD1-CB 4.41Å; L154-K238 WeakPolarHBondContact CD1-O 3.27Å; D166-K238 WeakPolarHBondContact O-CE 3.48Å; D166-K238 PolarHBondContact O-NZ 2.81Å; Y167-K238 WeakPolarHBondContact O-CG 3.33Å; Y167-K238 PolarHBondContact O-N 3.38Å; K238-G252 CarbonylContact C-O 3.06Å; K238-G252 VanDerWaalsContact CA-O 3.23Å; K238-G252 WeakPolarHBondContact CA-O 3.15Å; K238-Y253 HydrophobicContact CB-CE1 4.4Å; K238-Y253 WeakPolarHBondContact CE-OH 3.34Å; K238-Y253 HydrophobicContact CG-CD1 4.1Å; K238-Y253 HydrophobicContact CG-CE1 3.46Å; K238-Y253 VanDerWaalsContact CG-CE1 3.46Å
239	S	92.3	Very high	76.4	Confident	14 Å²	14	78.6 Å²	78.6	10%	0.098	40%	0.402	C	S	.	.			trans	-134.3	127	176.6	-173.1	0	0	0	0	111	L152 M237 L241 G252	L152-S239 CarbonylContact O-C 3.59Å; L152-S239 WeakPolarHBondContact O-CA 3.25Å; L152-S239 PolarHBondContact O-OG 3.19Å; L152-S239 VanDerWaalsContact O-OG 3.06Å; M237-S239 PolarHBondContact O-N 2.77Å; S239-L241 PolarHBondContact OG-N 3.39Å; S239-G252 PolarHBondContact N-O 3.32Å
240	T	90.8	Very high	74.8	Confident	90 Å²	90	80.3 Å²	80.3	55%	0.552	42%	0.417	S	S	*	.			trans	-88.2	-9.2	174.2	55.7	0	0	0	0	112.4	L152 G153 L154 T242	L152-T240 PolarHBondContact O-N 3.01Å; L152-T240 PolarHBondContact O-OG1 3.01Å; G153-T240 VanDerWaalsContact CA-OG1 3.25Å; G153-T240 WeakPolarHBondContact CA-OG1 3.44Å; G153-T240 PolarHBondContact O-OG1 2.91Å; L154-T240 HydrophobicContact CD2-CG2 3.87Å; T240-T242 PolarHBondContact O-N 3.33Å
241	L	85.4	Confident	73.5	Confident	68 Å²	68	80.5 Å²	80.5	36%	0.356	43%	0.428	S	S	.	.			trans	-69.1	110.6	179.1	-60.5	173.6	0	0	0	110.6	I150 Y151 S239	I150-L241 VanDerWaalsContact O-CD1 3.32Å; I150-L241 WeakPolarHBondContact O-CD1 3.44Å; Y151-L241 WeakPolarHBondContact O-CD1 3.45Å; S239-L241 PolarHBondContact OG-N 3.39Å
242	T	67.5	Low	73.1	Confident	113 Å²	113	79.6 Å²	79.6	69%	0.693	43%	0.433	S	S	*	.			trans	-74.2	132.7	171.5	53.5	0	0	0	0	110.2	T240 R244	T240-T242 PolarHBondContact O-N 3.33Å; T242-R244 PolarHBondContact O-N 2.83Å
243	K	61.3	Low	72.8	Confident	68 Å²	68	78.4 Å²	78.4	30%	0.296	42%	0.417	S	S	.	.			trans	-73.8	93	173.7	-170	170.8	-174.1	177	0	109.4	G245 V246 T292	K243-G245 PolarHBondContact O-N 3.43Å; K243-V246 HydrophobicContact CD-CB 4.17Å; K243-V246 HydrophobicContact CD-CG2 3.88Å; K243-V246 HydrophobicContact CG-CB 4.29Å; K243-V246 HydrophobicContact CG-CG2 4.17Å; K243-V246 PolarHBondContact O-N 3.47Å; K243-T292 PolarHBondContact NZ-OG1 2.85Å
244	R	49.9	Very low	72.6	Confident	233 Å²	233	81.2 Å²	81.2	88%	0.879	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	136.7	171.6	-62.4	-174.2	-171.3	171.6	4.1	109.3	T242	T242-R244 PolarHBondContact O-N 2.83Å
245	G	45.5	Very low	72.5	Confident	84 Å²	84	81.1 Å²	81.1	87%	0.866	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	1.4	175	0	0	0	0	0	116.7	K243	K243-G245 PolarHBondContact O-N 3.43Å
246	V	40.8	Very low	72.4	Confident	55 Å²	55	81.1 Å²	81.1	33%	0.333	43%	0.429	S	S	.	.			trans	-129.7	118	173.6	-175.1	0	0	0	0	110.4	K243 I248	K243-V246 HydrophobicContact CD-CB 4.17Å; K243-V246 HydrophobicContact CD-CG2 3.88Å; K243-V246 HydrophobicContact CG-CB 4.29Å; K243-V246 HydrophobicContact CG-CG2 4.17Å; K243-V246 PolarHBondContact O-N 3.47Å; V246-I248 HydrophobicContact CG1-CB 4.04Å; V246-I248 HydrophobicContact CG1-CD1 3.82Å; V246-I248 HydrophobicContact CG1-CG1 3.81Å; V246-I248 PolarHBondContact O-N 2.94Å
247	H	35.1	Very low	72.5	Confident	204 Å²	204	79.5 Å²	79.5	94%	0.944	42%	0.424	S	S	*	.			trans	-74.7	34	-180	-75.6	-90.7	0	0	0	114.2
248	I	44.7	Very low	72.5	Confident	107 Å²	107	79.5 Å²	79.5	55%	0.549	42%	0.424	S	S	.	.	S	Bend	trans	-99.9	125.2	171.7	-64.7	172.6	0	0	0	107.5	V246 S250	V246-I248 HydrophobicContact CG1-CB 4.04Å; V246-I248 HydrophobicContact CG1-CD1 3.82Å; V246-I248 HydrophobicContact CG1-CG1 3.81Å; V246-I248 PolarHBondContact O-N 2.94Å; I248-S250 VanDerWaalsContact C-N 3.33Å; I248-S250 PolarHBondContact O-N 2.74Å
249	K	42.8	Very low	72.6	Confident	205 Å²	205	77.5 Å²	77.5	89%	0.891	42%	0.419	S	S	*	.			trans	-64.5	95.3	167.5	-64.8	176.7	-176.9	175.4	0	107.6	S251	K249-S251 PolarHBondContact O-N 3.38Å
250	S	54.1	Low	72.8	Confident	64 Å²	64	77.7 Å²	77.7	45%	0.448	42%	0.423	S	S	.	.			trans	-54.8	140.7	169.8	52.8	0	0	0	0	108.6	I248 G252	I248-S250 VanDerWaalsContact C-N 3.33Å; I248-S250 PolarHBondContact O-N 2.74Å; S250-G252 PolarHBondContact O-N 3.28Å
251	S	64.5	Low	72.9	Confident	98 Å²	98	80.4 Å²	80.4	69%	0.685	42%	0.423	S	S	*	.			trans	-65.9	4.4	-173.1	54.1	0	0	0	0	114.6	K249 Y253	K249-S251 PolarHBondContact O-N 3.38Å; S251-Y253 VanDerWaalsContact C-N 3.29Å; S251-Y253 VanDerWaalsContact O-CD2 3.23Å; S251-Y253 WeakPolarHBondContact O-CD2 3.48Å
252	G	86.4	Confident	73.3	Confident	27 Å²	27	77.4 Å²	77.4	28%	0.278	41%	0.408	S	S	.	.	S	Bend	trans	77.2	12.3	-169	0	0	0	0	0	113.5	K238 S239 S250	K238-G252 CarbonylContact C-O 3.06Å; K238-G252 VanDerWaalsContact CA-O 3.23Å; K238-G252 WeakPolarHBondContact CA-O 3.15Å; S239-G252 PolarHBondContact N-O 3.32Å; S250-G252 PolarHBondContact O-N 3.28Å
253	Y	90.6	Very high	74.3	Confident	57 Å²	57	73 Å²	73	22%	0.224	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.7	-179.6	-64.7	-91.3	0	0	0	112.7	H169 R236 M237 K238 S251	H169-Y253 HydrophobicContact CB-CD1 3.85Å; H169-Y253 HydrophobicContact CB-CE1 3.71Å; H169-Y253 HydrophobicContact CB-CG 4.48Å; H169-Y253 AromaticContact CD2-CE2 3.89Å; H169-Y253 AromaticContact CD2-CZ 3.99Å; R236-Y253 HydrophobicContact CB-CD1 4.29Å; R236-Y253 HydrophobicContact CB-CG 4.48Å; M237-Y253 VanDerWaalsContact C-CD1 3.47Å; M237-Y253 CarbonylContact O-C 3.6Å; M237-Y253 VanDerWaalsContact O-CA 3.23Å; M237-Y253 WeakPolarHBondContact O-CA 3.31Å; K238-Y253 HydrophobicContact CB-CE1 4.4Å; K238-Y253 WeakPolarHBondContact CE-OH 3.34Å; K238-Y253 HydrophobicContact CG-CD1 4.1Å; K238-Y253 HydrophobicContact CG-CE1 3.46Å; K238-Y253 VanDerWaalsContact CG-CE1 3.46Å; S251-Y253 VanDerWaalsContact C-N 3.29Å; S251-Y253 VanDerWaalsContact O-CD2 3.23Å; S251-Y253 WeakPolarHBondContact O-CD2 3.48Å
254	K	91.9	Very high	75.4	Confident	65 Å²	65	71.5 Å²	71.5	28%	0.283	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	151.5	164.4	-76	-171.6	-179.7	-177.8	0	110.3	Y151 L152 R236 M237 I256	Y151-K254 WeakPolarHBondContact O-CD 3.33Å; Y151-K254 WeakPolarHBondContact O-CE 3.29Å; Y151-K254 PolarHBondContact O-NZ 2.9Å; L152-K254 HydrophobicContact CD2-CB 4.17Å; L152-K254 HydrophobicContact CD2-CD 4.34Å; R236-K254 CarbonylContact C-O 3.58Å; R236-K254 VanDerWaalsContact CA-O 3.29Å; R236-K254 WeakPolarHBondContact CA-O 3.33Å; M237-K254 PolarHBondContact N-O 3.12Å; M237-K254 PolarHBondContact O-N 3.1Å; K254-I256 HydrophobicContact CB-CD1 4.5Å
255	V	93.8	Very high	76.7	Confident	8 Å²	8	65.8 Å²	65.8	5%	0.048	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.7	168.3	-173.3	0	0	0	0	109.2	F234 R236 L288 K358 Q360	F234-V255 HydrophobicContact CB-CG1 4.21Å; F234-V255 HydrophobicContact CD1-CG1 4.26Å; R236-V255 HydrophobicContact CG-CG2 4.29Å; V255-L288 HydrophobicContact CB-CD1 4.37Å; V255-L288 HydrophobicContact CG1-CD1 3.92Å; V255-L288 PolarHBondContact O-N 2.83Å; V255-K358 HydrophobicContact CG2-CB 4.5Å; V255-K358 WeakPolarHBondContact CG2-O 3.45Å; V255-Q360 HydrophobicContact CB-CB 4.05Å; V255-Q360 HydrophobicContact CB-CG 4.37Å; V255-Q360 HydrophobicContact CG1-CB 4.26Å; V255-Q360 HydrophobicContact CG2-CB 3.97Å; V255-Q360 HydrophobicContact CG2-CG 4.02Å
256	I	96.5	Very high	77.7	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.7	176	-59.1	-53.8	0	0	0	108.1	F131 L152 F234 I235 M237 K254 I258 A285 H286 A287	F131-I256 HydrophobicContact CE1-CD1 4.07Å; F131-I256 HydrophobicContact CE1-CG2 4.5Å; F131-I256 HydrophobicContact CZ-CD1 4.29Å; F131-I256 HydrophobicContact CZ-CG1 4.39Å; F131-I256 HydrophobicContact CZ-CG2 4.13Å; L152-I256 HydrophobicContact CD2-CD1 4Å; L152-I256 HydrophobicContact CD2-CG1 4.47Å; F234-I256 WeakPolarHBondContact CA-O 3.34Å; I235-I256 PolarHBondContact N-O 2.8Å; I235-I256 PolarHBondContact O-N 3.17Å; M237-I256 HydrophobicContact CB-CG1 3.79Å; M237-I256 HydrophobicContact CG-CB 4.27Å; M237-I256 HydrophobicContact CG-CG1 3.77Å; M237-I256 HydrophobicContact SD-CB 4.34Å; M237-I256 HydrophobicContact SD-CG1 3.96Å; M237-I256 HydrophobicContact SD-CG2 4.33Å; K254-I256 HydrophobicContact CB-CD1 4.5Å; I256-I258 HydrophobicContact CG2-CG1 4.23Å; I256-A285 HydrophobicContact CG2-CB 3.73Å; I256-H286 CarbonylContact C-O 3.49Å; I256-H286 WeakPolarHBondContact CA-O 3.38Å; I256-A287 HydrophobicContact CD1-CB 3.49Å; I256-A287 VanDerWaalsContact CD1-CB 3.49Å
257	H	97.2	Very high	78.6	Confident	24 Å²	24	65.5 Å²	65.5	11%	0.111	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.5	165.6	-175.4	-153.3	0	0	0	108.6	S232 F234 T259 A285 H286 L288	S232-H257 PolarHBondContact OG-NE2 3.15Å; F234-H257 HydrophobicContact CD1-CB 3.8Å; F234-H257 AromaticContact CD1-CD2 3.91Å; F234-H257 HydrophobicContact CE1-CB 3.55Å; F234-H257 AromaticContact CE1-CD2 3.44Å; F234-H257 VanDerWaalsContact CE1-CD2 3.44Å; F234-H257 WeakPolarHBondContact CE1-CD2 3.32Å; F234-H257 AromaticContact CE1-CG 3.45Å; F234-H257 VanDerWaalsContact CE1-CG 3.45Å; F234-H257 AromaticContact CZ-CD2 3.63Å; F234-H257 AromaticContact CZ-CG 3.99Å; F234-H257 AromaticContact CZ-NE2 3.96Å; H257-T259 WeakPolarHBondContact CE1-CG2 3.49Å; H257-A285 WeakPolarHBondContact O-CA 3.25Å; H257-H286 HydrophobicContact CB-CB 4.49Å; H257-H286 PolarHBondContact N-O 2.94Å; H257-H286 PolarHBondContact O-N 2.8Å; H257-L288 HydrophobicContact CB-CD2 4.18Å
258	I	96.9	Very high	79.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.9	173.2	-76.1	178.6	0	0	0	108.1	F133 M176 S232 F233 I235 I256 V283	F133-I258 HydrophobicContact CZ-CD1 3.85Å; F133-I258 HydrophobicContact CZ-CG1 4.27Å; M176-I258 HydrophobicContact SD-CD1 4.3Å; S232-I258 VanDerWaalsContact CA-O 3.27Å; S232-I258 WeakPolarHBondContact CA-O 3.3Å; F233-I258 HydrophobicContact CD1-CB 4.29Å; F233-I258 HydrophobicContact CD1-CG2 3.96Å; F233-I258 HydrophobicContact CE1-CB 4.05Å; F233-I258 HydrophobicContact CE1-CG2 3.4Å; F233-I258 HydrophobicContact CE2-CB 4.47Å; F233-I258 HydrophobicContact CE2-CD1 3.94Å; F233-I258 HydrophobicContact CZ-CB 4.14Å; F233-I258 HydrophobicContact CZ-CD1 3.79Å; F233-I258 HydrophobicContact CZ-CG2 3.74Å; F233-I258 PolarHBondContact N-O 2.87Å; F233-I258 VanDerWaalsContact N-O 3.1Å; F233-I258 PolarHBondContact O-N 2.83Å; I235-I258 HydrophobicContact CD1-CD1 3.41Å; I235-I258 VanDerWaalsContact CD1-CD1 3.41Å; I235-I258 HydrophobicContact CD1-CG1 4.46Å; I235-I258 HydrophobicContact CG1-CD1 3.79Å; I235-I258 HydrophobicContact CG1-CG1 4.42Å; I256-I258 HydrophobicContact CG2-CG1 4.23Å; I258-V283 HydrophobicContact CB-CG1 4.21Å; I258-V283 HydrophobicContact CG1-CG1 4.08Å; I258-V283 HydrophobicContact CG2-CB 4.46Å; I258-V283 HydrophobicContact CG2-CG1 3.71Å; I258-V283 HydrophobicContact CG2-CG2 3.87Å
259	T	96.9	Very high	80	Confident	44 Å²	44	60.8 Å²	60.8	27%	0.27	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.4	164.9	65	0	0	0	0	109.5	R231 H257 V283 V284	R231-T259 CarbonylContact O-C 3.52Å; R231-T259 WeakPolarHBondContact O-CA 3.22Å; H257-T259 WeakPolarHBondContact CE1-CG2 3.49Å; T259-V283 CarbonylContact O-C 3.56Å; T259-V283 WeakPolarHBondContact O-CA 3.48Å; T259-V284 PolarHBondContact N-O 2.85Å; T259-V284 PolarHBondContact O-N 3.23Å; T259-V284 VanDerWaalsContact O-O 3.06Å; T259-V284 PolarHBondContact OG1-O 3.47Å
260	G	95.7	Very high	80.4	Confident	18 Å²	18	60.5 Å²	60.5	19%	0.186	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.8	-171.5	-171.4	0	0	0	0	0	114.7	R231 V282	R231-G260 PolarHBondContact N-O 2.93Å; R231-G260 PolarHBondContact O-N 2.81Å; G260-V282 CarbonylContact C-O 3.12Å; G260-V282 WeakPolarHBondContact CA-O 3.5Å
261	R	94.2	Very high	80.5	Confident	146 Å²	146	61.6 Å²	61.6	55%	0.551	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	143.4	177	-59.7	-171.4	178.9	89.7	4.1	111.4	L229 E230 R263 V282	L229-R261 CarbonylContact O-C 3.57Å; L229-R261 VanDerWaalsContact O-CA 3.32Å; L229-R261 WeakPolarHBondContact O-CA 3.23Å; E230-R261 HydrophobicContact CG-CG 4.31Å; E230-R261 IonicContact OE1-CZ 2.8Å; E230-R261 IonicContact OE1-NE 3.83Å; E230-R261 PolarHBondContact OE1-NE 3.32Å; E230-R261 IonicContact OE1-NH2 2.74Å; E230-R261 PolarHBondContact OE1-NH2 3.01Å; R261-R263 PolarHBondContact O-N 3.48Å; R261-V282 PolarHBondContact N-O 2.98Å; R261-V282 PolarHBondContact O-N 2.98Å
262	L	92.4	Very high	80	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	123.7	166	-73.7	178.8	0	0	0	109.2	L229 R231 I278 G280 L281	L229-L262 PolarHBondContact O-N 3.31Å; R231-L262 HydrophobicContact CG-CG 4.26Å; R231-L262 VanDerWaalsContact NH2-CD1 3.31Å; L262-I278 HydrophobicContact CD1-CD1 4.13Å; L262-I278 HydrophobicContact CD2-CG2 4.06Å; L262-G280 CarbonylContact C-O 3.47Å; L262-G280 WeakPolarHBondContact CA-O 3.39Å; L262-L281 HydrophobicContact CD2-CB 4.02Å; L262-L281 HydrophobicContact CD2-CD1 3.63Å; L262-L281 HydrophobicContact CD2-CG 4.43Å; L262-L281 HydrophobicContact CG-CD1 4.04Å
263	R	88.9	Confident	78.5	Confident	21 Å²	21	72.3 Å²	72.3	8%	0.079	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.4	179	-160.5	167.2	-179.3	-137.1	-2.1	109.4	F76 A77 G80 P82 W84 R261 M279 G280 V282	F76-R263 HydrophobicContact CE2-CB 4.48Å; F76-R263 HydrophobicContact CZ-CB 4.03Å; F76-R263 PolarHBondContact O-NH1 3.3Å; A77-R263 PolarHBondContact O-NH2 3.07Å; G80-R263 VanDerWaalsContact C-NH2 3.26Å; G80-R263 PolarHBondContact O-NH2 3.39Å; P82-R263 PolarHBondContact O-NH2 3.05Å; W84-R263 VanDerWaalsContact CD1-NH2 3.32Å; W84-R263 VanDerWaalsContact NE1-CZ 3.26Å; R261-R263 PolarHBondContact O-N 3.48Å; R263-M279 WeakPolarHBondContact O-CB 3.22Å; R263-M279 PolarHBondContact O-N 3.43Å; R263-G280 PolarHBondContact N-O 2.87Å; R263-V282 HydrophobicContact CB-CG2 4.34Å
264	L	84.6	Confident	76.7	Confident	36 Å²	36	72.6 Å²	72.6	19%	0.188	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	147	179.6	-65.7	178.5	0	0	0	111.5	L229 Q277 I278	L229-L264 HydrophobicContact CD1-CD1 3.56Å; L229-L264 HydrophobicContact CD1-CG 4.09Å; L229-L264 HydrophobicContact CD2-CD1 3.89Å; L229-L264 HydrophobicContact CD2-CD2 4.29Å; L229-L264 HydrophobicContact CD2-CG 4.13Å; L229-L264 HydrophobicContact CG-CD1 4.38Å; L264-Q277 WeakPolarHBondContact CA-O 3.34Å; L264-I278 HydrophobicContact CD2-CG1 3.88Å
265	R	77.5	Confident	75.1	Confident	114 Å²	114	74 Å²	74	43%	0.43	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	111.6	164.1	-171.9	179	-174.1	170.6	6.1	109	Q277 M279	R265-Q277 PolarHBondContact N-O 3.31Å; R265-Q277 PolarHBondContact O-N 2.93Å; R265-M279 HydrophobicContact CB-CG 3.67Å; R265-M279 HydrophobicContact CB-SD 3.77Å; R265-M279 HydrophobicContact CG-SD 4.46Å
266	V	65.4	Low	73.8	Confident	77 Å²	77	76.7 Å²	76.7	47%	0.467	42%	0.42	S	S	.	.			trans	-80.3	130.3	169.7	-172.4	0	0	0	0	108.6	L268	V266-L268 HydrophobicContact CG1-CD2 3.99Å; V266-L268 HydrophobicContact CG1-CG 4.04Å
267	S	60	Low	72.9	Confident	56 Å²	56	82.5 Å²	82.5	39%	0.392	45%	0.447	S	S	.	.			trans	-120.2	95	175.3	-168.9	0	0	0	0	110.2	S269	S267-S269 PolarHBondContact O-N 3.22Å; S267-S269 VanDerWaalsContact O-N 3.09Å
268	L	56.8	Low	72.4	Confident	161 Å²	161	83.9 Å²	83.9	84%	0.843	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	83.4	177.9	-63.2	178	0	0	0	110.3	V266	V266-L268 HydrophobicContact CG1-CD2 3.99Å; V266-L268 HydrophobicContact CG1-CG 4.04Å
269	S	53.6	Low	72.1	Confident	50 Å²	50	84.6 Å²	84.6	35%	0.35	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	133.7	167.4	70.6	0	0	0	0	110.8	S267 G271 R272 V274	S267-S269 PolarHBondContact O-N 3.22Å; S267-S269 VanDerWaalsContact O-N 3.09Å; S269-G271 PolarHBondContact O-N 2.91Å; S269-R272 PolarHBondContact O-N 2.76Å; S269-R272 VanDerWaalsContact O-N 3.11Å; S269-R272 VanDerWaalsContact O-O 3.1Å; S269-R272 PolarHBondContact OG-O 3.07Å; S269-V274 WeakPolarHBondContact OG-CG2 3.23Å
270	H	50.4	Low	71.9	Confident	199 Å²	199	82.5 Å²	82.5	92%	0.921	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	112.4	-177.4	-68	85.7	0	0	0	112.2	R272	H270-R272 PolarHBondContact O-N 3.11Å
271	G	55.6	Low	71.9	Confident	87 Å²	87	81.7 Å²	81.7	90%	0.897	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	3.9	174.6	0	0	0	0	0	117	S269	S269-G271 PolarHBondContact O-N 2.91Å
272	R	55.2	Low	72	Confident	210 Å²	210	76.5 Å²	76.5	79%	0.792	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	127.3	173.5	-67.9	-169.8	179	-161.3	-1.4	112.6	S269 H270 V274	S269-R272 PolarHBondContact O-N 2.76Å; S269-R272 VanDerWaalsContact O-N 3.11Å; S269-R272 VanDerWaalsContact O-O 3.1Å; S269-R272 PolarHBondContact OG-O 3.07Å; H270-R272 PolarHBondContact O-N 3.11Å; R272-V274 PolarHBondContact O-N 2.93Å
273	T	53.6	Low	72.2	Confident	141 Å²	141	76.4 Å²	76.4	87%	0.865	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	98.1	170.1	36.2	0	0	0	0	110.1
274	V	54.6	Low	72.7	Confident	62 Å²	62	77.4 Å²	77.4	38%	0.376	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-71.8	134.1	170.4	176.4	0	0	0	0	108.4	S269 R272 S276	S269-V274 WeakPolarHBondContact OG-CG2 3.23Å; R272-V274 PolarHBondContact O-N 2.93Å; V274-S276 PolarHBondContact O-N 2.92Å
275	P	56.3	Low	73.3	Confident	95 Å²	95	75.7 Å²	75.7	62%	0.617	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-61	131.7	-179.8	24	-34.1	0	0	0	111.6	Q277	P275-Q277 PolarHBondContact O-N 2.84Å
276	S	67.1	Low	74	Confident	65 Å²	65	73 Å²	73	46%	0.455	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-60.8	121.1	-178.5	-58.1	0	0	0	0	111.9	V274	V274-S276 PolarHBondContact O-N 2.92Å
277	Q	78.7	Confident	75.1	Confident	122 Å²	122	70 Å²	70	57%	0.57	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.6	178.5	-171.1	178.9	8.6	0	0	110.7	L264 R265 P275 M279	L264-Q277 WeakPolarHBondContact CA-O 3.34Å; R265-Q277 PolarHBondContact N-O 3.31Å; R265-Q277 PolarHBondContact O-N 2.93Å; P275-Q277 PolarHBondContact O-N 2.84Å; Q277-M279 PolarHBondContact O-N 3.25Å
278	I	86.4	Confident	76.1	Confident	53 Å²	53	68 Å²	68	27%	0.272	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	121.7	170.8	-62.9	165.4	0	0	0	109.1	L262 L264	L262-I278 HydrophobicContact CD1-CD1 4.13Å; L262-I278 HydrophobicContact CD2-CG2 4.06Å; L264-I278 HydrophobicContact CD2-CG1 3.88Å
279	M	89.3	Confident	76.7	Confident	15 Å²	15	63.8 Å²	63.8	7%	0.074	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-20.2	173.6	-61.8	172.6	57.8	0	0	112.4	F76 Q79 N136 Q137 R263 R265 Q277	F76-M279 HydrophobicContact CB-CE 4.4Å; F76-M279 HydrophobicContact CD2-CB 3.95Å; F76-M279 HydrophobicContact CD2-CE 3.75Å; F76-M279 HydrophobicContact CE2-CB 3.71Å; F76-M279 HydrophobicContact CE2-CE 4.29Å; F76-M279 HydrophobicContact CG-CE 4.11Å; F76-M279 WeakPolarHBondContact O-CE 3.5Å; Q79-M279 HydrophobicContact CB-CE 3.64Å; Q79-M279 HydrophobicContact CB-SD 4.36Å; N136-M279 CarbonylContact C-O 3.52Å; N136-M279 VanDerWaalsContact CA-O 3.28Å; N136-M279 WeakPolarHBondContact CA-O 3.15Å; Q137-M279 PolarHBondContact N-O 3.04Å; Q137-M279 PolarHBondContact OE1-O 2.9Å; R263-M279 WeakPolarHBondContact O-CB 3.22Å; R263-M279 PolarHBondContact O-N 3.43Å; R265-M279 HydrophobicContact CB-CG 3.67Å; R265-M279 HydrophobicContact CB-SD 3.77Å; R265-M279 HydrophobicContact CG-SD 4.46Å; Q277-M279 PolarHBondContact O-N 3.25Å
280	G	93	Very high	77.1	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138	-162.4	-174.6	0	0	0	0	0	112.5	L135 L262 R263	L135-G280 CarbonylContact O-C 3.58Å; L135-G280 VanDerWaalsContact O-CA 3.28Å; L135-G280 WeakPolarHBondContact O-CA 3.25Å; L262-G280 CarbonylContact C-O 3.47Å; L262-G280 WeakPolarHBondContact CA-O 3.39Å; R263-G280 PolarHBondContact N-O 2.87Å
281	L	96.2	Very high	77.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.9	-168.8	-173.8	74.6	0	0	0	110.4	A134 L135 M176 L180 R231 L262 V283	A134-L281 CarbonylContact C-O 3.53Å; A134-L281 WeakPolarHBondContact CA-O 3.4Å; L135-L281 HydrophobicContact CB-CB 4.37Å; L135-L281 HydrophobicContact CD1-CD2 4.49Å; L135-L281 PolarHBondContact N-O 2.98Å; L135-L281 PolarHBondContact O-N 3.1Å; M176-L281 HydrophobicContact CE-CD2 4.18Å; L180-L281 HydrophobicContact CD2-CB 3.77Å; L180-L281 HydrophobicContact CD2-CD2 4.36Å; R231-L281 HydrophobicContact CB-CD1 4.01Å; R231-L281 HydrophobicContact CG-CD1 3.71Å; L262-L281 HydrophobicContact CD2-CB 4.02Å; L262-L281 HydrophobicContact CD2-CD1 3.63Å; L262-L281 HydrophobicContact CD2-CG 4.43Å; L262-L281 HydrophobicContact CG-CD1 4.04Å; L281-V283 HydrophobicContact CD2-CG2 3.5Å; L281-V283 VanDerWaalsContact CD2-CG2 3.5Å; L281-V283 HydrophobicContact CG-CG2 3.57Å
282	V	96.9	Very high	77.4	Confident	37 Å²	37	56 Å²	56	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.3	175.1	-173.6	0	0	0	0	108.7	F76 W84 G260 R261 R263	F76-V282 HydrophobicContact CE1-CG2 3.75Å; F76-V282 HydrophobicContact CZ-CG2 3.63Å; W84-V282 HydrophobicContact CH2-CG1 3.99Å; W84-V282 HydrophobicContact CH2-CG2 4.15Å; W84-V282 HydrophobicContact CZ2-CG1 4.07Å; W84-V282 HydrophobicContact CZ2-CG2 3.97Å; G260-V282 CarbonylContact C-O 3.12Å; G260-V282 WeakPolarHBondContact CA-O 3.5Å; R261-V282 PolarHBondContact N-O 2.98Å; R261-V282 PolarHBondContact O-N 2.98Å; R263-V282 HydrophobicContact CB-CG2 4.34Å
283	V	97.1	Very high	77.4	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.1	-161.7	174.4	0	0	0	0	112.4	V132 F133 I258 T259 L281 A285	V132-V283 WeakPolarHBondContact CA-O 3.3Å; V132-V283 WeakPolarHBondContact CG1-O 3.45Å; F133-V283 HydrophobicContact CD1-CB 4.24Å; F133-V283 HydrophobicContact CD1-CG1 4.13Å; F133-V283 HydrophobicContact CD2-CB 3.93Å; F133-V283 HydrophobicContact CD2-CG2 4.12Å; F133-V283 HydrophobicContact CE1-CB 4.06Å; F133-V283 HydrophobicContact CE1-CG1 3.63Å; F133-V283 HydrophobicContact CE2-CB 3.7Å; F133-V283 HydrophobicContact CE2-CG1 4.09Å; F133-V283 HydrophobicContact CE2-CG2 3.55Å; F133-V283 HydrophobicContact CG-CB 4.2Å; F133-V283 HydrophobicContact CZ-CB 3.79Å; F133-V283 HydrophobicContact CZ-CG1 3.61Å; F133-V283 HydrophobicContact CZ-CG2 3.85Å; F133-V283 PolarHBondContact N-O 2.73Å; F133-V283 PolarHBondContact O-N 2.7Å; I258-V283 HydrophobicContact CB-CG1 4.21Å; I258-V283 HydrophobicContact CG1-CG1 4.08Å; I258-V283 HydrophobicContact CG2-CB 4.46Å; I258-V283 HydrophobicContact CG2-CG1 3.71Å; I258-V283 HydrophobicContact CG2-CG2 3.87Å; T259-V283 CarbonylContact O-C 3.56Å; T259-V283 WeakPolarHBondContact O-CA 3.48Å; L281-V283 HydrophobicContact CD2-CG2 3.5Å; L281-V283 VanDerWaalsContact CD2-CG2 3.5Å; L281-V283 HydrophobicContact CG-CG2 3.57Å; V283-A285 HydrophobicContact CG1-CB 3.9Å
284	V	97.6	Very high	77.3	Confident	43 Å²	43	50.3 Å²	50.3	26%	0.261	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.8	150.9	-171.8	0	0	0	0	107.8	L128 V132 T259	L128-V284 HydrophobicContact CD2-CG1 4.22Å; V132-V284 HydrophobicContact CG2-CG2 4.43Å; T259-V284 PolarHBondContact N-O 2.85Å; T259-V284 PolarHBondContact O-N 3.23Å; T259-V284 VanDerWaalsContact O-O 3.06Å; T259-V284 PolarHBondContact OG1-O 3.47Å
285	A	97.5	Very high	77.3	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121	-173	0	0	0	0	0	110.8	G130 F131 F133 I256 H257 V283	G130-A285 CarbonylContact C-O 3.59Å; G130-A285 VanDerWaalsContact CA-O 3.25Å; G130-A285 WeakPolarHBondContact CA-O 3.32Å; F131-A285 HydrophobicContact CD1-CB 4.35Å; F131-A285 HydrophobicContact CD2-CB 4.01Å; F131-A285 HydrophobicContact CE1-CB 4.05Å; F131-A285 HydrophobicContact CE2-CB 3.69Å; F131-A285 HydrophobicContact CG-CB 4.33Å; F131-A285 HydrophobicContact CZ-CB 3.71Å; F131-A285 PolarHBondContact N-O 3.13Å; F131-A285 WeakPolarHBondContact O-CB 3.38Å; F131-A285 PolarHBondContact O-N 3.5Å; F133-A285 HydrophobicContact CD1-CB 4.16Å; F133-A285 HydrophobicContact CE1-CB 3.7Å; I256-A285 HydrophobicContact CG2-CB 3.73Å; H257-A285 WeakPolarHBondContact O-CA 3.25Å; V283-A285 HydrophobicContact CG1-CB 3.9Å
286	H	92.8	Very high	77.4	Confident	58 Å²	58	50.7 Å²	50.7	27%	0.269	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.3	-178.6	-57.6	-75.5	0	0	0	109.5	D129 I256 H257	D129-H286 PolarHBondContact O-ND1 3.16Å; I256-H286 CarbonylContact C-O 3.49Å; I256-H286 WeakPolarHBondContact CA-O 3.38Å; H257-H286 HydrophobicContact CB-CB 4.49Å; H257-H286 PolarHBondContact N-O 2.94Å; H257-H286 PolarHBondContact O-N 2.8Å
287	A	87.9	Confident	77.1	Confident	14 Å²	14	57.4 Å²	57.4	12%	0.116	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	121.5	171	0	0	0	0	0	108.8	Y151 I256	Y151-A287 HydrophobicContact CD1-CB 3.9Å; Y151-A287 HydrophobicContact CG-CB 4.29Å; I256-A287 HydrophobicContact CD1-CB 3.49Å; I256-A287 VanDerWaalsContact CD1-CB 3.49Å
288	L	81.8	Confident	76.4	Confident	14 Å²	14	54 Å²	54	7%	0.073	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-66.4	143.1	-175.6	-60.5	-177.1	0	0	0	110.7	F234 V255 H257 Q360 V362	F234-L288 HydrophobicContact CD1-CD1 4.12Å; F234-L288 HydrophobicContact CE1-CD1 4.08Å; V255-L288 HydrophobicContact CB-CD1 4.37Å; V255-L288 HydrophobicContact CG1-CD1 3.92Å; V255-L288 PolarHBondContact O-N 2.83Å; H257-L288 HydrophobicContact CB-CD2 4.18Å; L288-Q360 HydrophobicContact CB-CB 4.38Å; L288-Q360 HydrophobicContact CD1-CB 3.63Å; L288-V362 HydrophobicContact CD1-CG2 4.34Å; L288-V362 HydrophobicContact CD2-CG2 3.54Å
289	P	68.9	Low	75.5	Confident	71 Å²	71	56 Å²	56	46%	0.461	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-56	155.2	-175.8	-28.6	36	0	0	0	113.5	Q360	P289-Q360 PolarHBondContact O-NE2 3.18Å
290	P	61.8	Low	74.2	Confident	68 Å²	68	58.3 Å²	58.3	44%	0.442	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-59.5	153.6	176.7	-21.3	33	0	0	0	112.5	T292 E295	P290-T292 PolarHBondContact O-N 3.32Å; P290-E295 WeakPolarHBondContact CB-OE2 3.45Å
291	P	54.6	Low	73.9	Confident	63 Å²	63	60.7 Å²	60.7	41%	0.409	32%	0.323	S	S	.	.	S	Bend	trans	-72.9	31.5	-175.3	31.9	-40	0	0	0	114.8	T383	P291-T383 HydrophobicContact CB-CG2 3.47Å; P291-T383 VanDerWaalsContact CB-CG2 3.47Å
292	T	57.9	Low	73.6	Confident	43 Å²	43	61.6 Å²	61.6	26%	0.264	33%	0.328	S	S	.	.			trans	-117.2	101.7	-170.1	4	0	0	0	0	110.4	K243 P290 N294 E295	K243-T292 PolarHBondContact NZ-OG1 2.85Å; P290-T292 PolarHBondContact O-N 3.32Å; T292-N294 PolarHBondContact O-N 2.71Å; T292-N294 VanDerWaalsContact O-N 3.08Å; T292-E295 VanDerWaalsContact CB-OE2 3.3Å; T292-E295 WeakPolarHBondContact CB-OE2 3.32Å; T292-E295 PolarHBondContact O-N 2.8Å; T292-E295 PolarHBondContact OG1-OE2 2.9Å
293	I	55.3	Low	73.4	Confident	75 Å²	75	59.9 Å²	59.9	39%	0.385	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-51.3	-34.4	-179.6	-169.6	169.9	0	0	0	113.1	E295 V296 V304	I293-E295 PolarHBondContact O-N 3.48Å; I293-E295 VanDerWaalsContact O-N 3.12Å; I293-V296 WeakPolarHBondContact O-CB 2.99Å; I293-V296 PolarHBondContact O-N 2.88Å; I293-V296 VanDerWaalsContact O-N 3.08Å; I293-V304 HydrophobicContact CD1-CG1 4.17Å
294	N	52.4	Low	73.2	Confident	155 Å²	155	59.9 Å²	59.9	83%	0.829	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-62.8	-14.7	176.9	-58.8	20.8	0	0	0	114.7	T292	T292-N294 PolarHBondContact O-N 2.71Å; T292-N294 VanDerWaalsContact O-N 3.08Å
295	E	54	Low	73.1	Confident	119 Å²	119	57.8 Å²	57.8	56%	0.556	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-97.8	-9.5	178.1	-64.5	172.8	143.5	0	0	112.2	P290 T292 I293 R297	P290-E295 WeakPolarHBondContact CB-OE2 3.45Å; T292-E295 VanDerWaalsContact CB-OE2 3.3Å; T292-E295 WeakPolarHBondContact CB-OE2 3.32Å; T292-E295 PolarHBondContact O-N 2.8Å; T292-E295 PolarHBondContact OG1-OE2 2.9Å; I293-E295 PolarHBondContact O-N 3.48Å; I293-E295 VanDerWaalsContact O-N 3.12Å; E295-R297 PolarHBondContact O-N 3.38Å
296	V	57.9	Low	72.9	Confident	47 Å²	47	61.1 Å²	61.1	29%	0.285	32%	0.317	S	S	.	.			trans	-78.1	111.6	176.8	-174.9	0	0	0	0	109.3	I293 I298	I293-V296 WeakPolarHBondContact O-CB 2.99Å; I293-V296 PolarHBondContact O-N 2.88Å; I293-V296 VanDerWaalsContact O-N 3.08Å; V296-I298 HydrophobicContact CG1-CG1 4.24Å; V296-I298 PolarHBondContact O-N 2.91Å
297	R	60.2	Low	73.1	Confident	205 Å²	205	58.3 Å²	58.3	77%	0.774	31%	0.305	S	S	*	.			trans	-77	115.4	167.9	-65.5	-177.5	178.9	-170.4	-1.4	108.3	E295 D299	E295-R297 PolarHBondContact O-N 3.38Å; R297-D299 PolarHBondContact O-N 3.34Å
298	I	65.6	Low	73.5	Confident	51 Å²	51	60.9 Å²	60.9	26%	0.262	32%	0.316	S	S	.	.			trans	-94.5	83.7	-172.7	-44.4	-178.1	0	0	0	110.2	V296 M302 V304 E317 R319	V296-I298 HydrophobicContact CG1-CG1 4.24Å; V296-I298 PolarHBondContact O-N 2.91Å; I298-M302 HydrophobicContact CG2-CG 3.75Å; I298-M302 HydrophobicContact CG2-SD 4.13Å; I298-V304 HydrophobicContact CD1-CG2 4Å; I298-E317 WeakPolarHBondContact CD1-OE1 3.34Å; I298-R319 PolarHBondContact O-NH1 3.06Å
299	D	67.8	Low	74.1	Confident	95 Å²	95	63.3 Å²	63.3	51%	0.508	33%	0.328	S	S	.	.			trans	-65.9	179	178.6	-55.2	-47.3	0	0	0	112.5	R297 M302 R319	R297-D299 PolarHBondContact O-N 3.34Å; D299-M302 HydrophobicContact CB-CE 4.01Å; D299-M302 WeakPolarHBondContact O-CG 3.29Å; D299-R319 PolarHBondContact O-NH1 3.46Å
300	C	61.8	Low	75.4	Confident	63 Å²	63	62.2 Å²	62.2	43%	0.426	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	149.4	167.3	50.4	0	0	0	0	111	Y801	C300-Y801 PolarHBondContact O-OH 2.73Å; C300-Y801 VanDerWaalsContact SG-CE1 3.53Å
301	H	86.3	Confident	77.1	Confident	50 Å²	50	59 Å²	59	23%	0.231	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	29.8	-176.4	-50.9	-83	0	0	0	115.1	Y323 L402 Y801	H301-Y323 PolarHBondContact N-OH 2.53Å; H301-L402 HydrophobicContact CB-CB 4.04Å; H301-L402 WeakPolarHBondContact O-CB 3.31Å; H301-L402 PolarHBondContact O-N 2.8Å; H301-Y801 PolarHBondContact CD2-OH 3.22Å
302	M	90.3	Very high	79.2	Confident	20 Å²	20	58 Å²	58	10%	0.099	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	155	161.9	64.6	167.6	88.3	0	0	112.7	I298 D299 V399 N400 Y401	I298-M302 HydrophobicContact CG2-CG 3.75Å; I298-M302 HydrophobicContact CG2-SD 4.13Å; D299-M302 HydrophobicContact CB-CE 4.01Å; D299-M302 WeakPolarHBondContact O-CG 3.29Å; M302-V399 HydrophobicContact SD-CG1 4.43Å; M302-N400 CarbonylContact C-O 3.52Å; M302-N400 WeakPolarHBondContact CA-O 3.36Å; M302-N400 VanDerWaalsContact CB-O 3.25Å; M302-N400 WeakPolarHBondContact CB-O 3.31Å; M302-Y401 HydrophobicContact CB-CD1 4.03Å; M302-Y401 HydrophobicContact CE-CD1 3.99Å; M302-Y401 HydrophobicContact CE-CE1 3.72Å; M302-Y401 HydrophobicContact SD-CD1 4.4Å; M302-Y401 HydrophobicContact SD-CE1 4.05Å
303	F	92.4	Very high	81.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	148.8	174.8	71.2	-84.2	0	0	0	111.8	T305 E317 I320 Y323 M324 I378 N400 L402	F303-T305 HydrophobicContact CD2-CG2 4.39Å; F303-T305 HydrophobicContact CE2-CG2 4.03Å; F303-E317 WeakPolarHBondContact CA-OE2 3.41Å; F303-I320 HydrophobicContact CD2-CB 4.15Å; F303-I320 HydrophobicContact CD2-CD1 4.49Å; F303-I320 HydrophobicContact CD2-CG1 4.34Å; F303-I320 HydrophobicContact CE2-CB 4.27Å; F303-I320 HydrophobicContact CE2-CD1 3.8Å; F303-I320 HydrophobicContact CE2-CG1 3.97Å; F303-I320 HydrophobicContact CZ-CD1 4.08Å; F303-I320 HydrophobicContact CZ-CG1 4.07Å; F303-Y323 HydrophobicContact CD1-CD2 4.15Å; F303-M324 HydrophobicContact CE1-CE 4.07Å; F303-M324 HydrophobicContact CZ-CE 3.75Å; F303-I378 HydrophobicContact CE1-CD1 4.23Å; F303-I378 HydrophobicContact CZ-CD1 4.34Å; F303-N400 HydrophobicContact CD1-CB 3.95Å; F303-N400 HydrophobicContact CD2-CB 4.47Å; F303-N400 HydrophobicContact CE1-CB 3.6Å; F303-N400 HydrophobicContact CE2-CB 4.16Å; F303-N400 VanDerWaalsContact CE2-ND2 3.34Å; F303-N400 WeakPolarHBondContact CE2-ND2 3.44Å; F303-N400 HydrophobicContact CG-CB 4.38Å; F303-N400 HydrophobicContact CZ-CB 3.71Å; F303-N400 PolarHBondContact N-O 3.36Å; F303-N400 WeakPolarHBondContact O-CB 3.42Å; F303-N400 PolarHBondContact O-N 3.09Å; F303-N400 PolarHBondContact O-ND2 2.86Å; F303-N400 VanDerWaalsContact O-ND2 3.11Å; F303-L402 HydrophobicContact CD1-CD1 4.28Å; F303-L402 HydrophobicContact CE1-CD1 3.98Å
304	V	92.9	Very high	83.1	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.9	-177	-173	0	0	0	0	112	I293 I298 E317 I397 V399	I293-V304 HydrophobicContact CD1-CG1 4.17Å; I298-V304 HydrophobicContact CD1-CG2 4Å; V304-E317 HydrophobicContact CB-CG 4.18Å; V304-E317 PolarHBondContact N-OE2 3.06Å; V304-E317 PolarHBondContact O-N 3.47Å; V304-E317 VanDerWaalsContact O-N 3.11Å; V304-I397 HydrophobicContact CG1-CG2 3.92Å; V304-V399 HydrophobicContact CG2-CG2 4.37Å
305	T	95	Very high	85.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	144.5	164.4	41.5	0	0	0	0	110.7	F303 I313 Y315 C316 W398 N400	F303-T305 HydrophobicContact CD2-CG2 4.39Å; F303-T305 HydrophobicContact CE2-CG2 4.03Å; T305-I313 HydrophobicContact CG2-CG2 4.49Å; T305-Y315 WeakPolarHBondContact CA-O 3.32Å; T305-C316 HydrophobicContact CG2-CB 3.81Å; T305-C316 VanDerWaalsContact CG2-SG 3.58Å; T305-W398 PolarHBondContact N-O 3.02Å; T305-W398 PolarHBondContact O-N 2.82Å; T305-W398 PolarHBondContact OG1-O 3.23Å; T305-W398 VanDerWaalsContact OG1-O 3.08Å; T305-N400 PolarHBondContact OG1-ND2 3.11Å; T305-N400 VanDerWaalsContact OG1-ND2 3.13Å
306	R	94.4	Very high	87.1	Confident	69 Å²	69	48 Å²	48	26%	0.26	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.4	169.3	-178.2	-169.6	-173.2	-131.3	-0.1	107.8	I314 Y315 E393 N395 I396 I397	R306-I314 HydrophobicContact CG-CD1 4.39Å; R306-I314 WeakPolarHBondContact O-CB 3.25Å; R306-I314 PolarHBondContact O-N 2.77Å; R306-Y315 HydrophobicContact CB-CD1 4.3Å; R306-Y315 PolarHBondContact N-O 2.91Å; R306-Y315 PolarHBondContact O-N 3.44Å; R306-Y315 VanDerWaalsContact O-N 3.13Å; R306-E393 IonicContact CZ-OE1 3.2Å; R306-E393 IonicContact NH2-OE1 2.66Å; R306-E393 PolarHBondContact NH2-OE1 2.98Å; R306-N395 HydrophobicContact CG-CB 4.3Å; R306-N395 PolarHBondContact NE-OD1 3.12Å; R306-N395 PolarHBondContact NH2-ND2 3.5Å; R306-I396 WeakPolarHBondContact CA-O 3.42Å; R306-I397 HydrophobicContact CB-CD1 4.46Å; R306-I397 HydrophobicContact CG-CD1 4.16Å
307	V	95.9	Very high	88.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.4	-173.3	-47.2	0	0	0	0	111.4	L311 N312 I313 I396	V307-L311 HydrophobicContact CG2-CD2 3.72Å; V307-N312 CarbonylContact C-O 3.54Å; V307-N312 WeakPolarHBondContact CA-O 3.49Å; V307-N312 WeakPolarHBondContact CB-O 3.36Å; V307-I313 HydrophobicContact CG1-CB 4.44Å; V307-I313 HydrophobicContact CG1-CG1 3.99Å; V307-I396 HydrophobicContact CG2-CB 3.62Å; V307-I396 HydrophobicContact CG2-CD1 4.47Å; V307-I396 HydrophobicContact CG2-CG2 3.72Å; V307-I396 PolarHBondContact N-O 3.29Å; V307-I396 PolarHBondContact O-N 3.5Å
308	N	95.9	Very high	90.4	Very high	68 Å²	68	43.5 Å²	43.5	36%	0.364	22%	0.218	S	C	.	.			trans	-72.4	171.4	172.3	-88.7	-31.3	0	0	0	111.3	D310 L311 N312 I314	N308-D310 WeakPolarHBondContact CB-OD1 3.31Å; N308-D310 PolarHBondContact O-N 3.05Å; N308-L311 WeakPolarHBondContact O-CA 3.27Å; N308-L311 PolarHBondContact O-N 3.5Å; N308-N312 HydrophobicContact CB-CB 4.21Å; N308-N312 PolarHBondContact N-O 2.9Å; N308-I314 HydrophobicContact CB-CD1 4.43Å; N308-I314 HydrophobicContact CB-CG1 4.5Å; N308-I314 VanDerWaalsContact OD1-CD1 3.24Å; N308-I314 WeakPolarHBondContact OD1-CD1 3.3Å
309	M	95.2	Very high	91.7	Very high	64 Å²	64	45 Å²	45	32%	0.315	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-4.3	176.9	-60	-55.8	-62.7	0	0	114.7	H352 L356 I384 K394 I396	M309-H352 PolarHBondContact O-NE2 3.49Å; M309-L356 HydrophobicContact CE-CD2 3.42Å; M309-L356 VanDerWaalsContact CE-CD2 3.42Å; M309-I384 HydrophobicContact CE-CD1 3.76Å; M309-I384 HydrophobicContact CE-CG1 4.27Å; M309-I384 HydrophobicContact SD-CG2 4.41Å; M309-K394 HydrophobicContact CG-CB 4.32Å; M309-K394 HydrophobicContact SD-CB 3.82Å; M309-I396 HydrophobicContact SD-CD1 4.22Å; M309-I396 HydrophobicContact SD-CG1 4.15Å
310	D	96.6	Very high	92.9	Very high	48 Å²	48	40.4 Å²	40.4	26%	0.257	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	10.8	174	71.2	-25.8	0	0	0	112.8	N308 N312 R335	N308-D310 WeakPolarHBondContact CB-OD1 3.31Å; N308-D310 PolarHBondContact O-N 3.05Å; D310-N312 VanDerWaalsContact C-N 3.29Å; D310-N312 PolarHBondContact O-N 3.25Å; D310-N312 WeakPolarHBondContact OD1-CB 3.26Å; D310-N312 PolarHBondContact OD1-N 2.99Å; D310-R335 IonicContact OD2-CZ 3.22Å; D310-R335 IonicContact OD2-NE 2.8Å; D310-R335 PolarHBondContact OD2-NE 3.4Å; D310-R335 IonicContact OD2-NH2 2.71Å; D310-R335 PolarHBondContact OD2-NH2 2.93Å
311	L	97.6	Very high	94.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.195	C	C	.	.			trans	59.9	24.3	-169.5	-51.2	-179.8	0	0	0	115.2	V307 N308 R335 C336 Y337 I348 H352 I396 W398	V307-L311 HydrophobicContact CG2-CD2 3.72Å; N308-L311 WeakPolarHBondContact O-CA 3.27Å; N308-L311 PolarHBondContact O-N 3.5Å; L311-R335 CarbonylContact O-C 3.59Å; L311-R335 VanDerWaalsContact O-CA 3.29Å; L311-R335 WeakPolarHBondContact O-CA 3.18Å; L311-C336 HydrophobicContact CB-CB 4.11Å; L311-C336 PolarHBondContact O-N 3.29Å; L311-C336 PolarHBondContact O-SG 2.91Å; L311-Y337 HydrophobicContact CD1-CE2 4.23Å; L311-I348 HydrophobicContact CD1-CG2 4.45Å; L311-H352 HydrophobicContact CD1-CB 4.21Å; L311-I396 HydrophobicContact CD2-CD1 4.08Å; L311-W398 HydrophobicContact CD1-CH2 4.49Å; L311-W398 HydrophobicContact CD1-CZ3 4.4Å; L311-W398 HydrophobicContact CD2-CE3 4.01Å; L311-W398 HydrophobicContact CD2-CZ3 3.82Å
312	N	98	Very high	94.8	Very high	42 Å²	42	43.5 Å²	43.5	23%	0.225	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-70.4	125.3	166.5	-168.5	-7.1	0	0	0	111	V307 N308 D310 I314 G333 K334 R335	V307-N312 CarbonylContact C-O 3.54Å; V307-N312 WeakPolarHBondContact CA-O 3.49Å; V307-N312 WeakPolarHBondContact CB-O 3.36Å; N308-N312 HydrophobicContact CB-CB 4.21Å; N308-N312 PolarHBondContact N-O 2.9Å; D310-N312 VanDerWaalsContact C-N 3.29Å; D310-N312 PolarHBondContact O-N 3.25Å; D310-N312 WeakPolarHBondContact OD1-CB 3.26Å; D310-N312 PolarHBondContact OD1-N 2.99Å; N312-I314 PolarHBondContact O-N 2.85Å; N312-G333 WeakPolarHBondContact OD1-CA 3.2Å; N312-G333 PolarHBondContact OD1-O 2.81Å; N312-G333 VanDerWaalsContact OD1-O 3.09Å; N312-K334 PolarHBondContact OD1-N 3.44Å; N312-K334 PolarHBondContact OD1-O 3.33Å; N312-R335 HydrophobicContact CB-CG 3.96Å
313	I	98	Very high	94.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	111.2	-174.2	-58.4	168.9	0	0	0	109.9	T305 V307 I331 V332 G333 K334 F339 W368	T305-I313 HydrophobicContact CG2-CG2 4.49Å; V307-I313 HydrophobicContact CG1-CB 4.44Å; V307-I313 HydrophobicContact CG1-CG1 3.99Å; I313-I331 HydrophobicContact CD1-CB 4.19Å; I313-I331 HydrophobicContact CD1-CD1 4.26Å; I313-I331 HydrophobicContact CD1-CG1 4.5Å; I313-I331 HydrophobicContact CG2-CD1 4.48Å; I313-V332 HydrophobicContact CG2-CG2 4.1Å; I313-V332 WeakPolarHBondContact O-CA 3.09Å; I313-G333 PolarHBondContact O-N 2.83Å; I313-K334 WeakPolarHBondContact CB-O 3.45Å; I313-K334 WeakPolarHBondContact CG1-O 3.32Å; I313-K334 PolarHBondContact N-O 3.12Å; I313-F339 HydrophobicContact CD1-CD2 4.29Å; I313-F339 HydrophobicContact CD1-CE2 4.1Å; I313-W368 HydrophobicContact CD1-CH2 4.36Å; I313-W368 HydrophobicContact CD1-CZ2 4.38Å
314	I	96.3	Very high	95.1	Very high	62 Å²	62	45 Å²	45	32%	0.318	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-34.8	179	-40.2	171.7	0	0	0	110.5	R306 N308 N312	R306-I314 HydrophobicContact CG-CD1 4.39Å; R306-I314 WeakPolarHBondContact O-CB 3.25Å; R306-I314 PolarHBondContact O-N 2.77Å; N308-I314 HydrophobicContact CB-CD1 4.43Å; N308-I314 HydrophobicContact CB-CG1 4.5Å; N308-I314 VanDerWaalsContact OD1-CD1 3.24Å; N308-I314 WeakPolarHBondContact OD1-CD1 3.3Å; N312-I314 PolarHBondContact O-N 2.85Å
315	Y	96	Very high	95.1	Very high	118 Å²	118	47.5 Å²	47.5	46%	0.463	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	146.5	-176.6	164.5	-89.7	0	0	0	110.8	T305 R306 E317	T305-Y315 WeakPolarHBondContact CA-O 3.32Å; R306-Y315 HydrophobicContact CB-CD1 4.3Å; R306-Y315 PolarHBondContact N-O 2.91Å; R306-Y315 PolarHBondContact O-N 3.44Å; R306-Y315 VanDerWaalsContact O-N 3.13Å; Y315-E317 HydrophobicContact CE1-CG 4.06Å
316	C	96.3	Very high	95	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.02	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.4	169.1	-174.9	0	0	0	0	109.5	T305 P328 I331	T305-C316 HydrophobicContact CG2-CB 3.81Å; T305-C316 VanDerWaalsContact CG2-SG 3.58Å; C316-P328 HydrophobicContact CB-CB 4.12Å; C316-P328 HydrophobicContact CB-CG 4.39Å; C316-I331 HydrophobicContact CB-CD1 3.79Å; C316-I331 HydrophobicContact CB-CG1 4.4Å
317	E	93.3	Very high	95.1	Very high	32 Å²	32	47.2 Å²	47.2	15%	0.15	24%	0.239	C	C	.	.			trans	-66	143.2	168.7	-67.9	-179.2	145.2	0	0	111.9	I298 F303 V304 Y315 R319 I320	I298-E317 WeakPolarHBondContact CD1-OE1 3.34Å; F303-E317 WeakPolarHBondContact CA-OE2 3.41Å; V304-E317 HydrophobicContact CB-CG 4.18Å; V304-E317 PolarHBondContact N-OE2 3.06Å; V304-E317 PolarHBondContact O-N 3.47Å; V304-E317 VanDerWaalsContact O-N 3.11Å; Y315-E317 HydrophobicContact CE1-CG 4.06Å; E317-R319 PolarHBondContact O-N 3.08Å; E317-I320 WeakPolarHBondContact O-CG2 3.26Å; E317-I320 PolarHBondContact O-N 3.27Å
318	N	94.2	Very high	95.2	Very high	126 Å²	126	48.1 Å²	48.1	67%	0.674	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-59.1	-22	178.7	-66.1	-4.2	0	0	0	113.9	I320 S321	N318-I320 PolarHBondContact O-N 2.88Å; N318-I320 VanDerWaalsContact O-N 3.13Å; N318-S321 WeakPolarHBondContact O-CB 3.49Å; N318-S321 PolarHBondContact O-N 2.64Å; N318-S321 VanDerWaalsContact O-N 3.15Å; N318-S321 PolarHBondContact O-OG 2.71Å
319	R	91.2	Very high	95.2	Very high	81 Å²	81	51.2 Å²	51.2	31%	0.306	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-61.2	-16.6	-179.8	-156.2	-172.3	-68.3	-171.5	0.9	113.4	I298 D299 E317 S321 D322 Y323	I298-R319 PolarHBondContact O-NH1 3.06Å; D299-R319 PolarHBondContact O-NH1 3.46Å; E317-R319 PolarHBondContact O-N 3.08Å; R319-S321 PolarHBondContact O-N 3.34Å; R319-D322 HydrophobicContact CG-CB 4.48Å; R319-D322 VanDerWaalsContact CG-OD2 3.23Å; R319-D322 WeakPolarHBondContact CG-OD2 3.37Å; R319-D322 WeakPolarHBondContact O-CB 3.4Å; R319-D322 PolarHBondContact O-N 3.45Å; R319-Y323 HydrophobicContact CG-CE2 3.91Å
320	I	94.4	Very high	95.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-54	-35	171.3	-167.6	173.9	0	0	0	112.1	F303 E317 N318 D322 Y323 M324 P328 I331	F303-I320 HydrophobicContact CD2-CB 4.15Å; F303-I320 HydrophobicContact CD2-CD1 4.49Å; F303-I320 HydrophobicContact CD2-CG1 4.34Å; F303-I320 HydrophobicContact CE2-CB 4.27Å; F303-I320 HydrophobicContact CE2-CD1 3.8Å; F303-I320 HydrophobicContact CE2-CG1 3.97Å; F303-I320 HydrophobicContact CZ-CD1 4.08Å; F303-I320 HydrophobicContact CZ-CG1 4.07Å; E317-I320 WeakPolarHBondContact O-CG2 3.26Å; E317-I320 PolarHBondContact O-N 3.27Å; N318-I320 PolarHBondContact O-N 2.88Å; N318-I320 VanDerWaalsContact O-N 3.13Å; I320-D322 PolarHBondContact O-N 3.48Å; I320-Y323 PolarHBondContact O-N 2.98Å; I320-M324 HydrophobicContact CD1-CE 4.36Å; I320-M324 HydrophobicContact CD1-SD 3.71Å; I320-M324 HydrophobicContact CG1-CB 4.25Å; I320-M324 HydrophobicContact CG1-CE 4.37Å; I320-M324 HydrophobicContact CG1-CG 4.05Å; I320-M324 HydrophobicContact CG1-SD 3.7Å; I320-M324 PolarHBondContact O-N 3.18Å; I320-P328 HydrophobicContact CG2-CG 3.84Å; I320-I331 HydrophobicContact CD1-CD1 3.46Å; I320-I331 VanDerWaalsContact CD1-CD1 3.46Å
321	S	94.7	Very high	95.2	Very high	56 Å²	56	47.5 Å²	47.5	39%	0.392	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-67.8	-14.6	178.2	-38.1	0	0	0	0	114.1	N318 R319 Y323	N318-S321 WeakPolarHBondContact O-CB 3.49Å; N318-S321 PolarHBondContact O-N 2.64Å; N318-S321 VanDerWaalsContact O-N 3.15Å; N318-S321 PolarHBondContact O-OG 2.71Å; R319-S321 PolarHBondContact O-N 3.34Å; S321-Y323 VanDerWaalsContact C-N 3.28Å
322	D	93.3	Very high	95.2	Very high	121 Å²	121	50.5 Å²	50.5	65%	0.647	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-80.9	-14.3	174.1	-58.5	-18.3	0	0	0	111.4	R319 I320	R319-D322 HydrophobicContact CG-CB 4.48Å; R319-D322 VanDerWaalsContact CG-OD2 3.23Å; R319-D322 WeakPolarHBondContact CG-OD2 3.37Å; R319-D322 WeakPolarHBondContact O-CB 3.4Å; R319-D322 PolarHBondContact O-N 3.45Å; I320-D322 PolarHBondContact O-N 3.48Å
323	Y	92.4	Very high	95.2	Very high	38 Å²	38	51 Å²	51	15%	0.149	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-23.9	-167	-57.9	-34.4	0	0	0	113.9	H301 F303 R319 I320 S321 L402	H301-Y323 PolarHBondContact N-OH 2.53Å; F303-Y323 HydrophobicContact CD1-CD2 4.15Å; R319-Y323 HydrophobicContact CG-CE2 3.91Å; I320-Y323 PolarHBondContact O-N 2.98Å; S321-Y323 VanDerWaalsContact C-N 3.28Å; Y323-L402 HydrophobicContact CD1-CD2 4.02Å; Y323-L402 HydrophobicContact CD2-CD1 4.12Å; Y323-L402 HydrophobicContact CD2-CD2 4.47Å; Y323-L402 HydrophobicContact CG-CD1 4.14Å; Y323-L402 HydrophobicContact CG-CD2 3.81Å
324	M	95	Very high	95.1	Very high	14 Å²	14	55.7 Å²	55.7	7%	0.069	30%	0.301	C	S	.	.	S	Bend	trans	-129.8	162.9	179.7	-60.4	-172.2	-175.2	0	0	111.6	F303 I320 L326 W368 Q370 I376 I378	F303-M324 HydrophobicContact CE1-CE 4.07Å; F303-M324 HydrophobicContact CZ-CE 3.75Å; I320-M324 HydrophobicContact CD1-CE 4.36Å; I320-M324 HydrophobicContact CD1-SD 3.71Å; I320-M324 HydrophobicContact CG1-CB 4.25Å; I320-M324 HydrophobicContact CG1-CE 4.37Å; I320-M324 HydrophobicContact CG1-CG 4.05Å; I320-M324 HydrophobicContact CG1-SD 3.7Å; I320-M324 PolarHBondContact O-N 3.18Å; M324-L326 HydrophobicContact CB-CB 4.19Å; M324-L326 PolarHBondContact O-N 3.2Å; M324-L326 HydrophobicContact SD-CB 4.39Å; M324-L326 HydrophobicContact SD-CD1 4.12Å; M324-W368 HydrophobicContact CE-CB 4.11Å; M324-W368 VanDerWaalsContact CE-CD1 3.49Å; M324-W368 HydrophobicContact CE-CD2 3.75Å; M324-W368 HydrophobicContact CE-CE3 4.44Å; M324-W368 HydrophobicContact CE-CG 3.53Å; M324-W368 HydrophobicContact SD-CG 4.41Å; M324-Q370 VanDerWaalsContact CA-OE1 3.26Å; M324-I376 HydrophobicContact CE-CD1 3.64Å; M324-I376 HydrophobicContact CE-CG1 4.12Å; M324-I376 HydrophobicContact CG-CD1 3.81Å; M324-I378 HydrophobicContact CE-CD1 3.65Å
325	D	93.1	Very high	95.2	Very high	56 Å²	56	58.5 Å²	58.5	30%	0.299	31%	0.308	S	S	.	.	S	Bend	trans	-82.8	10.9	165.1	62.1	-4.9	0	0	0	113.5	Q370 K371 N372	D325-Q370 WeakPolarHBondContact OD1-CA 3.29Å; D325-Q370 VanDerWaalsContact OD1-CB 3.3Å; D325-Q370 WeakPolarHBondContact OD1-CB 3.46Å; D325-Q370 PolarHBondContact OD1-OE1 2.99Å; D325-K371 HydrophobicContact CB-CB 4.31Å; D325-K371 VanDerWaalsContact CG-CB 3.48Å; D325-K371 WeakPolarHBondContact O-CD 3.22Å; D325-K371 WeakPolarHBondContact OD1-CB 3.2Å; D325-K371 PolarHBondContact OD1-N 3.05Å; D325-K371 WeakPolarHBondContact OD2-CB 3.34Å; D325-K371 PolarHBondContact OD2-N 2.66Å; D325-K371 VanDerWaalsContact OD2-N 3.1Å; D325-N372 PolarHBondContact OD2-N 2.76Å; D325-N372 PolarHBondContact OD2-ND2 3.28Å
326	L	94.3	Very high	95.3	Very high	8 Å²	8	53 Å²	53	4%	0.042	29%	0.286	C	S	.	.			trans	-106.8	133	174.4	-69.4	167.2	0	0	0	110.3	M324 D330 I331 F339 K371	M324-L326 HydrophobicContact CB-CB 4.19Å; M324-L326 PolarHBondContact O-N 3.2Å; M324-L326 HydrophobicContact SD-CB 4.39Å; M324-L326 HydrophobicContact SD-CD1 4.12Å; L326-D330 HydrophobicContact CB-CB 4.5Å; L326-D330 HydrophobicContact CD2-CB 3.71Å; L326-I331 HydrophobicContact CB-CG2 4.12Å; L326-I331 HydrophobicContact CD1-CG2 4.09Å; L326-I331 HydrophobicContact CD2-CG2 4.23Å; L326-I331 HydrophobicContact CG-CG2 4.39Å; L326-F339 HydrophobicContact CD1-CD1 4.12Å; L326-F339 HydrophobicContact CD1-CE1 4.21Å; L326-K371 HydrophobicContact CD2-CB 3.75Å; L326-K371 HydrophobicContact CD2-CD 4.26Å; L326-K371 HydrophobicContact CD2-CG 4.17Å; L326-K371 HydrophobicContact CG-CB 4.11Å
327	T	96.3	Very high	95.4	Very high	55 Å²	55	56.1 Å²	56.1	34%	0.337	30%	0.298	S	S	.	.			trans	-95.4	168	170	74.9	0	0	0	0	110.8	V329 D330	T327-V329 PolarHBondContact O-N 3.1Å; T327-V329 VanDerWaalsContact O-N 3.14Å; T327-V329 PolarHBondContact OG1-N 2.88Å; T327-D330 WeakPolarHBondContact CB-OD2 3.42Å; T327-D330 PolarHBondContact N-OD2 3.48Å; T327-D330 WeakPolarHBondContact O-CB 3.49Å; T327-D330 PolarHBondContact O-N 2.61Å; T327-D330 PolarHBondContact OG1-OD2 3.01Å
328	P	97.1	Very high	95.5	Very high	19 Å²	19	59.9 Å²	59.9	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-54.9	-31.2	172.2	-27.9	37.2	0	0	0	113.7	C316 I320 D330 I331 V332	C316-P328 HydrophobicContact CB-CB 4.12Å; C316-P328 HydrophobicContact CB-CG 4.39Å; I320-P328 HydrophobicContact CG2-CG 3.84Å; P328-D330 VanDerWaalsContact C-N 3.33Å; P328-I331 PolarHBondContact O-N 3.5Å; P328-V332 WeakPolarHBondContact O-CB 3.42Å; P328-V332 VanDerWaalsContact O-CG2 3.25Å; P328-V332 WeakPolarHBondContact O-CG2 3.21Å; P328-V332 PolarHBondContact O-N 3.45Å
329	V	96.1	Very high	95.7	Very high	132 Å²	132	54.7 Å²	54.7	80%	0.8	29%	0.287	S	S	*	.	H	α-helix	trans	-70.2	-29.9	179.5	-174.8	0	0	0	0	111.6	T327 I331	T327-V329 PolarHBondContact O-N 3.1Å; T327-V329 VanDerWaalsContact O-N 3.14Å; T327-V329 PolarHBondContact OG1-N 2.88Å; V329-I331 VanDerWaalsContact C-N 3.28Å; V329-I331 PolarHBondContact O-N 3.06Å
330	D	95.3	Very high	96	Very high	34 Å²	34	51 Å²	51	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-72.4	-21.2	177.4	-62.9	-83.6	0	0	0	113.1	L326 T327 P328 K334 K371	L326-D330 HydrophobicContact CB-CB 4.5Å; L326-D330 HydrophobicContact CD2-CB 3.71Å; T327-D330 WeakPolarHBondContact CB-OD2 3.42Å; T327-D330 PolarHBondContact N-OD2 3.48Å; T327-D330 WeakPolarHBondContact O-CB 3.49Å; T327-D330 PolarHBondContact O-N 2.61Å; T327-D330 PolarHBondContact OG1-OD2 3.01Å; P328-D330 VanDerWaalsContact C-N 3.33Å; D330-K334 WeakPolarHBondContact O-CD 3.5Å; D330-K334 WeakPolarHBondContact O-CE 3.25Å; D330-K334 PolarHBondContact O-NZ 3.37Å; D330-K371 IonicContact OD1-NZ 2.81Å; D330-K371 PolarHBondContact OD1-NZ 3.35Å; D330-K371 IonicContact OD2-NZ 2.71Å
331	I	96.5	Very high	96.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-119.9	-26.3	-167.6	68.9	165.1	0	0	0	115.5	I313 C316 I320 L326 P328 V329 K334 F339	I313-I331 HydrophobicContact CD1-CB 4.19Å; I313-I331 HydrophobicContact CD1-CD1 4.26Å; I313-I331 HydrophobicContact CD1-CG1 4.5Å; I313-I331 HydrophobicContact CG2-CD1 4.48Å; C316-I331 HydrophobicContact CB-CD1 3.79Å; C316-I331 HydrophobicContact CB-CG1 4.4Å; I320-I331 HydrophobicContact CD1-CD1 3.46Å; I320-I331 VanDerWaalsContact CD1-CD1 3.46Å; L326-I331 HydrophobicContact CB-CG2 4.12Å; L326-I331 HydrophobicContact CD1-CG2 4.09Å; L326-I331 HydrophobicContact CD2-CG2 4.23Å; L326-I331 HydrophobicContact CG-CG2 4.39Å; P328-I331 PolarHBondContact O-N 3.5Å; V329-I331 VanDerWaalsContact C-N 3.28Å; V329-I331 PolarHBondContact O-N 3.06Å; I331-K334 PolarHBondContact O-N 2.79Å; I331-F339 HydrophobicContact CB-CE2 3.92Å; I331-F339 HydrophobicContact CB-CZ 3.82Å; I331-F339 HydrophobicContact CG2-CE1 3.88Å; I331-F339 HydrophobicContact CG2-CE2 3.98Å; I331-F339 HydrophobicContact CG2-CZ 3.52Å
332	V	97.9	Very high	96.4	Very high	63 Å²	63	53.8 Å²	53.8	38%	0.382	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	139.8	177.3	167.3	0	0	0	0	110.2	I313 P328 K334	I313-V332 HydrophobicContact CG2-CG2 4.1Å; I313-V332 WeakPolarHBondContact O-CA 3.09Å; P328-V332 WeakPolarHBondContact O-CB 3.42Å; P328-V332 VanDerWaalsContact O-CG2 3.25Å; P328-V332 WeakPolarHBondContact O-CG2 3.21Å; P328-V332 PolarHBondContact O-N 3.45Å; V332-K334 VanDerWaalsContact C-N 3.28Å; V332-K334 PolarHBondContact O-N 2.9Å
333	G	96.8	Very high	96.6	Very high	52 Å²	52	54.8 Å²	54.8	54%	0.536	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-9.4	-173.7	0	0	0	0	0	114.9	N312 I313	N312-G333 WeakPolarHBondContact OD1-CA 3.2Å; N312-G333 PolarHBondContact OD1-O 2.81Å; N312-G333 VanDerWaalsContact OD1-O 3.09Å; I313-G333 PolarHBondContact O-N 2.83Å
334	K	97.4	Very high	96.9	Very high	99 Å²	99	54.1 Å²	54.1	43%	0.43	29%	0.294	S	S	.	.	S	Bend	trans	-100.7	148.6	174.3	-65.3	167.3	-178	169.6	0	110.9	N312 I313 D330 I331 V332 F339	N312-K334 PolarHBondContact OD1-N 3.44Å; N312-K334 PolarHBondContact OD1-O 3.33Å; I313-K334 WeakPolarHBondContact CB-O 3.45Å; I313-K334 WeakPolarHBondContact CG1-O 3.32Å; I313-K334 PolarHBondContact N-O 3.12Å; D330-K334 WeakPolarHBondContact O-CD 3.5Å; D330-K334 WeakPolarHBondContact O-CE 3.25Å; D330-K334 PolarHBondContact O-NZ 3.37Å; I331-K334 PolarHBondContact O-N 2.79Å; V332-K334 VanDerWaalsContact C-N 3.28Å; V332-K334 PolarHBondContact O-N 2.9Å; K334-F339 HydrophobicContact CB-CE2 3.9Å; K334-F339 HydrophobicContact CB-CZ 4.18Å; K334-F339 HydrophobicContact CD-CE2 4.27Å; K334-F339 HydrophobicContact CD-CZ 3.67Å
335	R	97.5	Very high	97	Very high	122 Å²	122	55.6 Å²	55.6	46%	0.46	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-74.2	142.3	170.5	-67	177.7	174.8	152.1	-1.4	111.8	D310 L311 N312 Y337 H338	D310-R335 IonicContact OD2-CZ 3.22Å; D310-R335 IonicContact OD2-NE 2.8Å; D310-R335 PolarHBondContact OD2-NE 3.4Å; D310-R335 IonicContact OD2-NH2 2.71Å; D310-R335 PolarHBondContact OD2-NH2 2.93Å; L311-R335 CarbonylContact O-C 3.59Å; L311-R335 VanDerWaalsContact O-CA 3.29Å; L311-R335 WeakPolarHBondContact O-CA 3.18Å; N312-R335 HydrophobicContact CB-CG 3.96Å; R335-Y337 PolarHBondContact O-N 3.21Å; R335-H338 PolarHBondContact N-ND1 3.28Å; R335-H338 PolarHBondContact O-N 3.39Å; R335-H338 PolarHBondContact O-ND1 3.46Å
336	C	97.9	Very high	97.3	Very high	1 Å²	1	58 Å²	58	1%	0.007	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-51.2	-31.8	176.8	-63.8	0	0	0	0	113.5	L311 H338 F339 I340	L311-C336 HydrophobicContact CB-CB 4.11Å; L311-C336 PolarHBondContact O-N 3.29Å; L311-C336 PolarHBondContact O-SG 2.91Å; C336-H338 PolarHBondContact O-N 3.17Å; C336-H338 VanDerWaalsContact O-N 3.16Å; C336-F339 PolarHBondContact O-N 2.91Å; C336-I340 HydrophobicContact CB-CD1 4.21Å; C336-I340 WeakPolarHBondContact O-CG1 3.33Å; C336-I340 PolarHBondContact O-N 3.42Å
337	Y	98.2	Very high	97.4	Very high	70 Å²	70	58.4 Å²	58.4	28%	0.275	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-58.9	-22.9	178.4	-65	-61.2	0	0	0	115	L311 R335 F339 I340 V345 I348 H352	L311-Y337 HydrophobicContact CD1-CE2 4.23Å; R335-Y337 PolarHBondContact O-N 3.21Å; Y337-F339 PolarHBondContact O-N 3.36Å; Y337-I340 HydrophobicContact CD1-CD1 4.05Å; Y337-V345 HydrophobicContact CD1-CG1 4.13Å; Y337-V345 HydrophobicContact CE1-CG1 4.45Å; Y337-I348 HydrophobicContact CE1-CG2 4.26Å; Y337-H352 PolarHBondContact OH-ND1 3.48Å; Y337-H352 VanDerWaalsContact OH-ND1 3.14Å
338	H	96.8	Very high	97.5	Very high	111 Å²	111	55.9 Å²	55.9	51%	0.514	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-72.5	-14.9	173.5	-54.7	95.3	0	0	0	113.2	R335 C336 M369	R335-H338 PolarHBondContact N-ND1 3.28Å; R335-H338 PolarHBondContact O-N 3.39Å; R335-H338 PolarHBondContact O-ND1 3.46Å; C336-H338 PolarHBondContact O-N 3.17Å; C336-H338 VanDerWaalsContact O-N 3.16Å; H338-M369 WeakPolarHBondContact O-CE 3.29Å
339	F	97.5	Very high	97.6	Very high	17 Å²	17	60.8 Å²	60.8	8%	0.075	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-6.8	-177.7	-55.8	-70.7	0	0	0	113.1	I313 L326 I331 K334 C336 Y337 W368 M369	I313-F339 HydrophobicContact CD1-CD2 4.29Å; I313-F339 HydrophobicContact CD1-CE2 4.1Å; L326-F339 HydrophobicContact CD1-CD1 4.12Å; L326-F339 HydrophobicContact CD1-CE1 4.21Å; I331-F339 HydrophobicContact CB-CE2 3.92Å; I331-F339 HydrophobicContact CB-CZ 3.82Å; I331-F339 HydrophobicContact CG2-CE1 3.88Å; I331-F339 HydrophobicContact CG2-CE2 3.98Å; I331-F339 HydrophobicContact CG2-CZ 3.52Å; K334-F339 HydrophobicContact CB-CE2 3.9Å; K334-F339 HydrophobicContact CB-CZ 4.18Å; K334-F339 HydrophobicContact CD-CE2 4.27Å; K334-F339 HydrophobicContact CD-CZ 3.67Å; C336-F339 PolarHBondContact O-N 2.91Å; Y337-F339 PolarHBondContact O-N 3.36Å; F339-W368 HydrophobicContact CB-CD2 4.27Å; F339-W368 HydrophobicContact CB-CG 4.34Å; F339-W368 HydrophobicContact CB-CZ2 4.16Å; F339-W368 HydrophobicContact CD2-CZ2 4.13Å; F339-W368 HydrophobicContact CG-CZ2 4.26Å; F339-W368 AromaticContact CG-NE1 3.78Å; F339-W368 CarbonylContact O-C 3.53Å; F339-W368 WeakPolarHBondContact O-CA 3.31Å; F339-M369 PolarHBondContact O-N 3.14Å
340	I	98.3	Very high	97.6	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.015	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-88	126.1	179.8	-66.8	156.9	0	0	0	108.3	C336 Y337 A342 D344 V345 I348 Y366	C336-I340 HydrophobicContact CB-CD1 4.21Å; C336-I340 WeakPolarHBondContact O-CG1 3.33Å; C336-I340 PolarHBondContact O-N 3.42Å; Y337-I340 HydrophobicContact CD1-CD1 4.05Å; I340-A342 PolarHBondContact O-N 3.23Å; I340-D344 HydrophobicContact CG2-CB 3.91Å; I340-V345 HydrophobicContact CB-CG2 4.24Å; I340-V345 HydrophobicContact CG2-CG2 3.82Å; I340-I348 HydrophobicContact CD1-CB 3.97Å; I340-I348 HydrophobicContact CD1-CG1 3.94Å; I340-I348 HydrophobicContact CD1-CG2 3.64Å; I340-I348 HydrophobicContact CG1-CG1 4.42Å; I340-I348 HydrophobicContact CG2-CG1 4.04Å; I340-Y366 HydrophobicContact CG1-CD2 4.07Å; I340-Y366 HydrophobicContact CG1-CE2 3.95Å; I340-Y366 HydrophobicContact CG2-CD2 4.44Å
341	H	98.4	Very high	97.8	Very high	32 Å²	32	58.2 Å²	58.2	15%	0.148	30%	0.299	C	S	.	.			trans	-54.7	133.9	175.8	-179.7	-93.1	0	0	0	111	E343 D344 V345 R367 M369	H341-E343 VanDerWaalsContact C-N 3.26Å; H341-E343 IonicContact CE1-OE2 3.09Å; H341-E343 PolarHBondContact O-N 3.37Å; H341-D344 PolarHBondContact O-N 2.81Å; H341-V345 PolarHBondContact O-N 2.96Å; H341-R367 HydrophobicContact CB-CB 3.64Å; H341-R367 PolarHBondContact CE1-NH1 2.98Å; H341-R367 VanDerWaalsContact CE1-NH1 3.26Å; H341-R367 PolarHBondContact N-O 3.44Å; H341-R367 VanDerWaalsContact ND1-CZ 3.26Å; H341-R367 PolarHBondContact ND1-NH1 3.43Å; H341-M369 HydrophobicContact CB-CG 4.3Å
342	A	97.8	Very high	97.8	Very high	83 Å²	83	58.9 Å²	58.9	69%	0.686	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-50.3	-39.9	-166.3	0	0	0	0	0	115	I340 D344 V345	I340-A342 PolarHBondContact O-N 3.23Å; A342-D344 VanDerWaalsContact C-N 3.29Å; A342-D344 PolarHBondContact O-N 3.21Å; A342-V345 WeakPolarHBondContact O-CB 3.36Å; A342-V345 PolarHBondContact O-N 2.96Å
343	E	98.1	Very high	97.8	Very high	141 Å²	141	60 Å²	60	66%	0.659	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-64	-28.4	178	-174	-178	-161.7	0	0	113.6	H341 R367	H341-E343 VanDerWaalsContact C-N 3.26Å; H341-E343 IonicContact CE1-OE2 3.09Å; H341-E343 PolarHBondContact O-N 3.37Å; E343-R367 IonicContact OE2-CZ 3.58Å; E343-R367 IonicContact OE2-NH1 3.61Å; E343-R367 PolarHBondContact OE2-NH1 3.17Å; E343-R367 IonicContact OE2-NH2 2.72Å; E343-R367 PolarHBondContact OE2-NH2 2.93Å
344	D	98.5	Very high	97.8	Very high	24 Å²	24	58.3 Å²	58.3	13%	0.128	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-89.5	-13.1	-178.5	-61	-30.7	0	0	0	113.1	I340 H341 A342 E346 G347 I348 R367	I340-D344 HydrophobicContact CG2-CB 3.91Å; H341-D344 PolarHBondContact O-N 2.81Å; A342-D344 VanDerWaalsContact C-N 3.29Å; A342-D344 PolarHBondContact O-N 3.21Å; D344-E346 VanDerWaalsContact C-N 3.31Å; D344-E346 PolarHBondContact O-N 3.22Å; D344-G347 WeakPolarHBondContact O-CA 3.3Å; D344-G347 PolarHBondContact O-N 2.91Å; D344-I348 PolarHBondContact O-N 2.71Å; D344-R367 VanDerWaalsContact CG-NH2 3.31Å; D344-R367 IonicContact OD1-CZ 2.66Å; D344-R367 IonicContact OD1-NE 3.95Å; D344-R367 IonicContact OD1-NH2 2.65Å; D344-R367 PolarHBondContact OD1-NH2 3.43Å; D344-R367 WeakPolarHBondContact OD2-CB 3.07Å; D344-R367 IonicContact OD2-CZ 3.81Å; D344-R367 PolarHBondContact OD2-N 3.42Å; D344-R367 IonicContact OD2-NE 3.05Å; D344-R367 PolarHBondContact OD2-NE 2.83Å; D344-R367 IonicContact OD2-NH2 2.71Å; D344-R367 PolarHBondContact OD2-NH2 3.19Å
345	V	98	Very high	97.7	Very high	46 Å²	46	53.6 Å²	53.6	28%	0.279	26%	0.264	S	S	.	.	H	α-helix	trans	-57.5	-41.2	-171.9	174.5	0	0	0	0	112.1	Y337 I340 H341 A342 G347 I348 R349	Y337-V345 HydrophobicContact CD1-CG1 4.13Å; Y337-V345 HydrophobicContact CE1-CG1 4.45Å; I340-V345 HydrophobicContact CB-CG2 4.24Å; I340-V345 HydrophobicContact CG2-CG2 3.82Å; H341-V345 PolarHBondContact O-N 2.96Å; A342-V345 WeakPolarHBondContact O-CB 3.36Å; A342-V345 PolarHBondContact O-N 2.96Å; V345-G347 VanDerWaalsContact C-N 3.34Å; V345-G347 PolarHBondContact O-N 3.42Å; V345-I348 PolarHBondContact O-N 2.86Å; V345-R349 WeakPolarHBondContact O-CB 3.17Å; V345-R349 PolarHBondContact O-N 3.49Å
346	E	97.7	Very high	97.5	Very high	105 Å²	105	51.3 Å²	51.3	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-66	-35.9	177	178.8	56.3	-159.5	0	0	112.1	D344 R349 H350	D344-E346 VanDerWaalsContact C-N 3.31Å; D344-E346 PolarHBondContact O-N 3.22Å; E346-R349 PolarHBondContact O-N 3Å; E346-R349 IonicContact OE1-CZ 3.58Å; E346-R349 IonicContact OE1-NE 3.65Å; E346-R349 IonicContact OE1-NH2 2.7Å; E346-R349 PolarHBondContact OE1-NH2 3.49Å; E346-R349 IonicContact OE2-CZ 3.39Å; E346-R349 IonicContact OE2-NE 2.72Å; E346-R349 PolarHBondContact OE2-NE 3.22Å; E346-R349 IonicContact OE2-NH2 3.22Å; E346-R349 PolarHBondContact OE2-NH2 3.02Å; E346-H350 WeakPolarHBondContact O-CB 3.32Å; E346-H350 PolarHBondContact O-N 3.31Å
347	G	97.2	Very high	97.3	Very high	18 Å²	18	55.8 Å²	55.8	19%	0.186	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-38.7	174.8	0	0	0	0	0	112.8	D344 V345 S351	D344-G347 WeakPolarHBondContact O-CA 3.3Å; D344-G347 PolarHBondContact O-N 2.91Å; V345-G347 VanDerWaalsContact C-N 3.34Å; V345-G347 PolarHBondContact O-N 3.42Å; G347-S351 PolarHBondContact O-N 2.83Å; G347-S351 VanDerWaalsContact O-N 3.12Å; G347-S351 PolarHBondContact O-OG 2.81Å
348	I	98.4	Very high	97.1	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-74.9	-37.7	174.1	-58	-59.2	0	0	0	111.6	L311 Y337 I340 D344 V345 H350 S351 H352 T363 Y366 W398	L311-I348 HydrophobicContact CD1-CG2 4.45Å; Y337-I348 HydrophobicContact CE1-CG2 4.26Å; I340-I348 HydrophobicContact CD1-CB 3.97Å; I340-I348 HydrophobicContact CD1-CG1 3.94Å; I340-I348 HydrophobicContact CD1-CG2 3.64Å; I340-I348 HydrophobicContact CG1-CG1 4.42Å; I340-I348 HydrophobicContact CG2-CG1 4.04Å; D344-I348 PolarHBondContact O-N 2.71Å; V345-I348 PolarHBondContact O-N 2.86Å; I348-H350 VanDerWaalsContact C-N 3.29Å; I348-H350 PolarHBondContact O-N 2.93Å; I348-S351 PolarHBondContact O-N 2.55Å; I348-H352 VanDerWaalsContact O-CB 3.31Å; I348-H352 WeakPolarHBondContact O-CB 3.33Å; I348-H352 PolarHBondContact O-N 2.85Å; I348-T363 HydrophobicContact CD1-CG2 3.71Å; I348-Y366 HydrophobicContact CD1-CD1 3.65Å; I348-Y366 HydrophobicContact CD1-CD2 4.27Å; I348-Y366 HydrophobicContact CD1-CE1 4.07Å; I348-Y366 HydrophobicContact CD1-CG 3.73Å; I348-Y366 HydrophobicContact CG1-CD2 4.39Å; I348-Y366 HydrophobicContact CG1-CG 4.21Å; I348-W398 HydrophobicContact CG2-CH2 4.27Å
349	R	98.4	Very high	96.8	Very high	121 Å²	121	49.1 Å²	49.1	46%	0.457	26%	0.261	S	S	.	.	H	α-helix	trans	-59	-40.9	174.3	-166.1	-170.8	70.1	82.2	3.9	111.6	V345 E346 L353	V345-R349 WeakPolarHBondContact O-CB 3.17Å; V345-R349 PolarHBondContact O-N 3.49Å; E346-R349 PolarHBondContact O-N 3Å; E346-R349 IonicContact OE1-CZ 3.58Å; E346-R349 IonicContact OE1-NE 3.65Å; E346-R349 IonicContact OE1-NH2 2.7Å; E346-R349 PolarHBondContact OE1-NH2 3.49Å; E346-R349 IonicContact OE2-CZ 3.39Å; E346-R349 IonicContact OE2-NE 2.72Å; E346-R349 PolarHBondContact OE2-NE 3.22Å; E346-R349 IonicContact OE2-NH2 3.22Å; E346-R349 PolarHBondContact OE2-NH2 3.02Å; R349-L353 PolarHBondContact O-N 3.24Å
350	H	97.7	Very high	96.6	Very high	105 Å²	105	49.4 Å²	49.4	49%	0.486	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-46.8	173.5	-169.6	88	0	0	0	112.1	E346 I348 H352 L353 D354	E346-H350 WeakPolarHBondContact O-CB 3.32Å; E346-H350 PolarHBondContact O-N 3.31Å; I348-H350 VanDerWaalsContact C-N 3.29Å; I348-H350 PolarHBondContact O-N 2.93Å; H350-H352 VanDerWaalsContact C-N 3.27Å; H350-H352 PolarHBondContact O-N 3.44Å; H350-L353 WeakPolarHBondContact O-CB 3.42Å; H350-L353 PolarHBondContact O-N 3Å; H350-L353 VanDerWaalsContact O-N 3.13Å; H350-D354 PolarHBondContact O-N 3.34Å
351	S	98.1	Very high	96.5	Very high	7 Å²	7	49.3 Å²	49.3	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-37.9	176.9	-53.9	0	0	0	0	112	G347 I348 D354 L355 C361	G347-S351 PolarHBondContact O-N 2.83Å; G347-S351 VanDerWaalsContact O-N 3.12Å; G347-S351 PolarHBondContact O-OG 2.81Å; I348-S351 PolarHBondContact O-N 2.55Å; S351-D354 WeakPolarHBondContact O-CB 3.3Å; S351-D354 PolarHBondContact O-N 3.5Å; S351-L355 WeakPolarHBondContact O-CB 3.22Å; S351-L355 PolarHBondContact O-N 3.46Å; S351-C361 PolarHBondContact O-SG 3.38Å; S351-C361 VanDerWaalsContact O-SG 3.36Å
352	H	98.2	Very high	96.4	Very high	15 Å²	15	48.8 Å²	48.8	7%	0.069	26%	0.261	C	S	.	.	H	α-helix	trans	-68.7	-38.8	175.8	-175.9	-163.1	0	0	0	112	M309 L311 Y337 I348 H350 L355 L356	M309-H352 PolarHBondContact O-NE2 3.49Å; L311-H352 HydrophobicContact CD1-CB 4.21Å; Y337-H352 PolarHBondContact OH-ND1 3.48Å; Y337-H352 VanDerWaalsContact OH-ND1 3.14Å; I348-H352 VanDerWaalsContact O-CB 3.31Å; I348-H352 WeakPolarHBondContact O-CB 3.33Å; I348-H352 PolarHBondContact O-N 2.85Å; H350-H352 VanDerWaalsContact C-N 3.27Å; H350-H352 PolarHBondContact O-N 3.44Å; H352-L355 WeakPolarHBondContact O-CB 3.41Å; H352-L355 PolarHBondContact O-N 3.31Å; H352-L356 VanDerWaalsContact O-CG 3.31Å; H352-L356 WeakPolarHBondContact O-CG 3.47Å; H352-L356 PolarHBondContact O-N 3.43Å
353	L	97.4	Very high	96.3	Very high	85 Å²	85	45 Å²	45	45%	0.445	23%	0.229	S	C	.	.	H	α-helix	trans	-62.8	-41.5	172.9	-178.1	60	0	0	0	111.8	R349 H350 L356 N357	R349-L353 PolarHBondContact O-N 3.24Å; H350-L353 WeakPolarHBondContact O-CB 3.42Å; H350-L353 PolarHBondContact O-N 3Å; H350-L353 VanDerWaalsContact O-N 3.13Å; L353-L356 PolarHBondContact O-N 2.69Å; L353-N357 WeakPolarHBondContact CD1-ND2 3.4Å; L353-N357 WeakPolarHBondContact O-CB 3.22Å; L353-N357 VanDerWaalsContact O-CG 3.29Å; L353-N357 PolarHBondContact O-N 3.11Å; L353-N357 PolarHBondContact O-ND2 3.33Å; L353-N357 VanDerWaalsContact O-ND2 3.14Å
354	D	95.7	Very high	96.2	Very high	18 Å²	18	45.2 Å²	45.2	10%	0.096	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-47	171.9	-97.2	-32.2	0	0	0	112	F234 H350 S351 L356 N357 K358 C361	F234-D354 HydrophobicContact CD2-CB 4.3Å; F234-D354 WeakPolarHBondContact CD2-OD2 3.48Å; H350-D354 PolarHBondContact O-N 3.34Å; S351-D354 WeakPolarHBondContact O-CB 3.3Å; S351-D354 PolarHBondContact O-N 3.5Å; D354-L356 VanDerWaalsContact C-N 3.34Å; D354-L356 PolarHBondContact O-N 3.28Å; D354-N357 PolarHBondContact O-N 3.15Å; D354-K358 WeakPolarHBondContact O-CB 3.5Å; D354-K358 PolarHBondContact O-N 3.49Å; D354-K358 WeakPolarHBondContact OD1-CD 3.49Å; D354-K358 VanDerWaalsContact OD1-CE 3.23Å; D354-K358 WeakPolarHBondContact OD1-CE 3.39Å; D354-K358 IonicContact OD1-NZ 3.93Å; D354-K358 PolarHBondContact OD1-NZ 3.01Å; D354-C361 HydrophobicContact CB-CB 4.36Å
355	L	95.3	Very high	96.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-56.5	-45.5	177.4	-179.8	60.1	0	0	0	112.2	S351 H352 G359 C361 A382 I384 I396 W398	S351-L355 WeakPolarHBondContact O-CB 3.22Å; S351-L355 PolarHBondContact O-N 3.46Å; H352-L355 WeakPolarHBondContact O-CB 3.41Å; H352-L355 PolarHBondContact O-N 3.31Å; L355-G359 CarbonylContact O-C 3.57Å; L355-G359 WeakPolarHBondContact O-CA 3.09Å; L355-G359 PolarHBondContact O-N 3.02Å; L355-C361 HydrophobicContact CB-CB 4.15Å; L355-A382 HydrophobicContact CD1-CB 4.08Å; L355-A382 HydrophobicContact CD2-CB 3.72Å; L355-I384 HydrophobicContact CD1-CG1 4.16Å; L355-I384 HydrophobicContact CG-CG1 4.34Å; L355-I384 WeakPolarHBondContact O-CD1 3.33Å; L355-I396 HydrophobicContact CD2-CD1 3.67Å; L355-I396 HydrophobicContact CD2-CG1 4.01Å; L355-I396 HydrophobicContact CD2-CG2 3.79Å; L355-I396 HydrophobicContact CG-CD1 4.37Å; L355-W398 HydrophobicContact CD2-CE3 4.38Å; L355-W398 HydrophobicContact CD2-CZ3 4.07Å
356	L	94.2	Very high	96.2	Very high	74 Å²	74	49 Å²	49	39%	0.387	24%	0.237	S	C	.	.	H	α-helix	trans	-66.1	-40.1	177.9	-67.4	174.1	0	0	0	112.3	M309 H352 L353 D354	M309-L356 HydrophobicContact CE-CD2 3.42Å; M309-L356 VanDerWaalsContact CE-CD2 3.42Å; H352-L356 VanDerWaalsContact O-CG 3.31Å; H352-L356 WeakPolarHBondContact O-CG 3.47Å; H352-L356 PolarHBondContact O-N 3.43Å; L353-L356 PolarHBondContact O-N 2.69Å; D354-L356 VanDerWaalsContact C-N 3.34Å; D354-L356 PolarHBondContact O-N 3.28Å
357	N	94.1	Very high	96.3	Very high	94 Å²	94	45.4 Å²	45.4	50%	0.503	22%	0.219	S	C	.	.	H	α-helix	trans	-80.1	-33.5	-176	-73.9	-30.5	0	0	0	114.1	R236 L353 D354	R236-N357 PolarHBondContact NH1-O 2.99Å; L353-N357 WeakPolarHBondContact CD1-ND2 3.4Å; L353-N357 WeakPolarHBondContact O-CB 3.22Å; L353-N357 VanDerWaalsContact O-CG 3.29Å; L353-N357 PolarHBondContact O-N 3.11Å; L353-N357 PolarHBondContact O-ND2 3.33Å; L353-N357 VanDerWaalsContact O-ND2 3.14Å; D354-N357 PolarHBondContact O-N 3.15Å
358	K	93.4	Very high	96.3	Very high	19 Å²	19	44.6 Å²	44.6	8%	0.083	21%	0.21	C	C	.	.	H	α-helix	trans	-114.9	-21.1	-168.9	-62.1	167.5	-176.3	169.9	0	112.9	E175 F234 V255 D354	E175-K358 IonicContact OE1-NZ 2.74Å; E175-K358 PolarHBondContact OE1-NZ 2.83Å; E175-K358 WeakPolarHBondContact OE2-CE 3.34Å; E175-K358 IonicContact OE2-NZ 3.18Å; E175-K358 PolarHBondContact OE2-NZ 2.98Å; F234-K358 HydrophobicContact CB-CD 3.81Å; F234-K358 WeakPolarHBondContact O-CD 3.36Å; F234-K358 WeakPolarHBondContact O-CE 3.42Å; F234-K358 PolarHBondContact O-NZ 3.29Å; V255-K358 HydrophobicContact CG2-CB 4.5Å; V255-K358 WeakPolarHBondContact CG2-O 3.45Å; D354-K358 WeakPolarHBondContact O-CB 3.5Å; D354-K358 PolarHBondContact O-N 3.49Å; D354-K358 WeakPolarHBondContact OD1-CD 3.49Å; D354-K358 VanDerWaalsContact OD1-CE 3.23Å; D354-K358 WeakPolarHBondContact OD1-CE 3.39Å; D354-K358 IonicContact OD1-NZ 3.93Å; D354-K358 PolarHBondContact OD1-NZ 3.01Å
359	G	91.4	Very high	96.3	Very high	22 Å²	22	45.1 Å²	45.1	23%	0.227	21%	0.213	C	C	.	.	S	Bend	trans	99.9	-17.5	173.8	0	0	0	0	0	115.1	L355 I384	L355-G359 CarbonylContact O-C 3.57Å; L355-G359 WeakPolarHBondContact O-CA 3.09Å; L355-G359 PolarHBondContact O-N 3.02Å; G359-I384 PolarHBondContact O-N 2.94Å
360	Q	93.1	Very high	96.2	Very high	24 Å²	24	39.8 Å²	39.8	11%	0.112	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	148.3	178.7	-51.5	-171.3	-99.4	0	0	109.3	V255 L288 P289 A382 T383	V255-Q360 HydrophobicContact CB-CB 4.05Å; V255-Q360 HydrophobicContact CB-CG 4.37Å; V255-Q360 HydrophobicContact CG1-CB 4.26Å; V255-Q360 HydrophobicContact CG2-CB 3.97Å; V255-Q360 HydrophobicContact CG2-CG 4.02Å; L288-Q360 HydrophobicContact CB-CB 4.38Å; L288-Q360 HydrophobicContact CD1-CB 3.63Å; P289-Q360 PolarHBondContact O-NE2 3.18Å; Q360-A382 VanDerWaalsContact CA-O 3.32Å; Q360-A382 WeakPolarHBondContact CA-O 3.37Å; Q360-T383 HydrophobicContact CG-CG2 3.93Å; Q360-T383 WeakPolarHBondContact CG-OG1 3.2Å; Q360-T383 PolarHBondContact NE2-OG1 3.3Å
361	C	94.9	Very high	96	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	167.8	170.4	78	0	0	0	0	111.3	F234 S351 D354 L355 A382	F234-C361 HydrophobicContact CE2-CB 4.37Å; F234-C361 HydrophobicContact CZ-CB 4.42Å; S351-C361 PolarHBondContact O-SG 3.38Å; S351-C361 VanDerWaalsContact O-SG 3.36Å; D354-C361 HydrophobicContact CB-CB 4.36Å; L355-C361 HydrophobicContact CB-CB 4.15Å; C361-A382 PolarHBondContact N-O 3Å; C361-A382 PolarHBondContact O-N 3.01Å
362	V	95.9	Very high	95.6	Very high	21 Å²	21	44.1 Å²	44.1	13%	0.127	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.9	163.9	179.4	0	0	0	0	107.4	F234 L288 Q379 S380	F234-V362 HydrophobicContact CE1-CB 4.23Å; F234-V362 HydrophobicContact CE1-CG2 4.43Å; F234-V362 HydrophobicContact CZ-CB 4.04Å; F234-V362 VanDerWaalsContact CZ-O 3.3Å; F234-V362 WeakPolarHBondContact CZ-O 3.48Å; L288-V362 HydrophobicContact CD1-CG2 4.34Å; L288-V362 HydrophobicContact CD2-CG2 3.54Å; V362-Q379 HydrophobicContact CG1-CG 4.04Å; V362-S380 WeakPolarHBondContact CA-O 3.44Å
363	T	97.6	Very high	95.4	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.025	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-72.3	163.5	-179.4	68.4	0	0	0	0	111.5	I348 Y366 Q379 S380 W398	I348-T363 HydrophobicContact CD1-CG2 3.71Å; T363-Y366 HydrophobicContact CG2-CE1 4.29Å; T363-Q379 WeakPolarHBondContact O-CG 3.47Å; T363-Q379 PolarHBondContact O-NE2 3.47Å; T363-S380 PolarHBondContact N-O 3.36Å; T363-S380 PolarHBondContact OG1-N 2.9Å; T363-W398 HydrophobicContact CG2-CH2 3.84Å; T363-W398 HydrophobicContact CG2-CZ2 3.71Å
364	K	95.8	Very high	95.4	Very high	146 Å²	146	39.4 Å²	39.4	64%	0.635	19%	0.191	S	C	*	.	P	Polyproline II helix	trans	-64.2	168.2	153	-64.1	175.4	-176.2	172.8	0	109.3	Y366	K364-Y366 PolarHBondContact O-N 3.4Å
365	Y	98.1	Very high	95.5	Very high	148 Å²	148	39.3 Å²	39.3	58%	0.58	19%	0.189	S	C	*	.	P	Polyproline II helix	trans	-62.4	132.7	165.7	-50.5	-32.4	0	0	0	108.8	I378 Q379 L403	Y365-I378 WeakPolarHBondContact CA-O 3.41Å; Y365-Q379 HydrophobicContact CD1-CB 3.97Å; Y365-Q379 HydrophobicContact CD1-CG 4.15Å; Y365-Q379 HydrophobicContact CE1-CB 4.31Å; Y365-Q379 HydrophobicContact CE1-CG 4.38Å; Y365-L403 HydrophobicContact CD1-CD1 3.48Å; Y365-L403 VanDerWaalsContact CD1-CD1 3.48Å; Y365-L403 HydrophobicContact CE1-CD1 4.05Å; Y365-L403 HydrophobicContact CG-CD1 3.82Å
366	Y	98.7	Very high	95.6	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.5	-179.2	73.9	-84.4	0	0	0	111.2	I340 I348 T363 K364 W368 W377 I378 S380 W398	I340-Y366 HydrophobicContact CG1-CD2 4.07Å; I340-Y366 HydrophobicContact CG1-CE2 3.95Å; I340-Y366 HydrophobicContact CG2-CD2 4.44Å; I348-Y366 HydrophobicContact CD1-CD1 3.65Å; I348-Y366 HydrophobicContact CD1-CD2 4.27Å; I348-Y366 HydrophobicContact CD1-CE1 4.07Å; I348-Y366 HydrophobicContact CD1-CG 3.73Å; I348-Y366 HydrophobicContact CG1-CD2 4.39Å; I348-Y366 HydrophobicContact CG1-CG 4.21Å; T363-Y366 HydrophobicContact CG2-CE1 4.29Å; K364-Y366 PolarHBondContact O-N 3.4Å; Y366-W368 HydrophobicContact CE2-CB 4.47Å; Y366-W368 AromaticContact CE2-CE3 3.84Å; Y366-W368 HydrophobicContact CE2-CE3 3.84Å; Y366-W368 WeakPolarHBondContact OH-CZ3 3.44Å; Y366-W377 WeakPolarHBondContact O-CA 3.19Å; Y366-I378 HydrophobicContact CD1-CB 4.46Å; Y366-I378 HydrophobicContact CD1-CG2 4.48Å; Y366-I378 WeakPolarHBondContact CD1-O 3.4Å; Y366-I378 HydrophobicContact CE1-CB 4.08Å; Y366-I378 HydrophobicContact CE1-CG2 3.71Å; Y366-I378 PolarHBondContact N-O 3.25Å; Y366-I378 PolarHBondContact O-N 2.92Å; Y366-S380 PolarHBondContact OH-OG 3.41Å; Y366-W398 PolarHBondContact OH-NE1 2.83Å
367	R	98.6	Very high	95.8	Very high	28 Å²	28	39.3 Å²	39.3	11%	0.106	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.5	-177.9	-66.6	162.4	-77.8	-170.8	-11.2	110.4	H341 E343 D344 Y375 I376 W377	H341-R367 HydrophobicContact CB-CB 3.64Å; H341-R367 PolarHBondContact CE1-NH1 2.98Å; H341-R367 VanDerWaalsContact CE1-NH1 3.26Å; H341-R367 PolarHBondContact N-O 3.44Å; H341-R367 VanDerWaalsContact ND1-CZ 3.26Å; H341-R367 PolarHBondContact ND1-NH1 3.43Å; E343-R367 IonicContact OE2-CZ 3.58Å; E343-R367 IonicContact OE2-NH1 3.61Å; E343-R367 PolarHBondContact OE2-NH1 3.17Å; E343-R367 IonicContact OE2-NH2 2.72Å; E343-R367 PolarHBondContact OE2-NH2 2.93Å; D344-R367 VanDerWaalsContact CG-NH2 3.31Å; D344-R367 IonicContact OD1-CZ 2.66Å; D344-R367 IonicContact OD1-NE 3.95Å; D344-R367 IonicContact OD1-NH2 2.65Å; D344-R367 PolarHBondContact OD1-NH2 3.43Å; D344-R367 WeakPolarHBondContact OD2-CB 3.07Å; D344-R367 IonicContact OD2-CZ 3.81Å; D344-R367 PolarHBondContact OD2-N 3.42Å; D344-R367 IonicContact OD2-NE 3.05Å; D344-R367 PolarHBondContact OD2-NE 2.83Å; D344-R367 IonicContact OD2-NH2 2.71Å; D344-R367 PolarHBondContact OD2-NH2 3.19Å; R367-Y375 HydrophobicContact CB-CD1 4.23Å; R367-Y375 HydrophobicContact CB-CD2 3.7Å; R367-Y375 HydrophobicContact CB-CE2 4.35Å; R367-Y375 HydrophobicContact CB-CG 3.67Å; R367-Y375 HydrophobicContact CG-CD1 4.26Å; R367-Y375 HydrophobicContact CG-CD2 3.46Å; R367-Y375 VanDerWaalsContact CG-CD2 3.46Å; R367-Y375 HydrophobicContact CG-CE1 4.36Å; R367-Y375 HydrophobicContact CG-CE2 3.61Å; R367-Y375 HydrophobicContact CG-CG 3.84Å; R367-I376 CarbonylContact C-O 3.41Å; R367-I376 WeakPolarHBondContact CA-O 3.49Å; R367-W377 HydrophobicContact CG-CD2 3.83Å; R367-W377 HydrophobicContact CG-CE3 3.74Å; R367-W377 HydrophobicContact CG-CH2 3.71Å; R367-W377 HydrophobicContact CG-CZ2 3.78Å; R367-W377 HydrophobicContact CG-CZ3 3.69Å
368	W	98.2	Very high	96	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	110.3	173.3	-166.7	-58.2	0	0	0	109.3	I313 M324 F339 Y366 Q370 Y375 I376 I378	I313-W368 HydrophobicContact CD1-CH2 4.36Å; I313-W368 HydrophobicContact CD1-CZ2 4.38Å; M324-W368 HydrophobicContact CE-CB 4.11Å; M324-W368 VanDerWaalsContact CE-CD1 3.49Å; M324-W368 HydrophobicContact CE-CD2 3.75Å; M324-W368 HydrophobicContact CE-CE3 4.44Å; M324-W368 HydrophobicContact CE-CG 3.53Å; M324-W368 HydrophobicContact SD-CG 4.41Å; F339-W368 HydrophobicContact CB-CD2 4.27Å; F339-W368 HydrophobicContact CB-CG 4.34Å; F339-W368 HydrophobicContact CB-CZ2 4.16Å; F339-W368 HydrophobicContact CD2-CZ2 4.13Å; F339-W368 HydrophobicContact CG-CZ2 4.26Å; F339-W368 AromaticContact CG-NE1 3.78Å; F339-W368 CarbonylContact O-C 3.53Å; F339-W368 WeakPolarHBondContact O-CA 3.31Å; Y366-W368 HydrophobicContact CE2-CB 4.47Å; Y366-W368 AromaticContact CE2-CE3 3.84Å; Y366-W368 HydrophobicContact CE2-CE3 3.84Å; Y366-W368 WeakPolarHBondContact OH-CZ3 3.44Å; W368-Q370 PolarHBondContact O-NE2 2.82Å; W368-Q370 VanDerWaalsContact O-NE2 3.16Å; W368-Y375 CarbonylContact O-C 3.59Å; W368-Y375 VanDerWaalsContact O-CA 3.26Å; W368-Y375 WeakPolarHBondContact O-CA 3.44Å; W368-Y375 WeakPolarHBondContact O-CB 3.49Å; W368-I376 HydrophobicContact CB-CG1 4.27Å; W368-I376 PolarHBondContact N-O 3.18Å; W368-I376 PolarHBondContact O-N 3.41Å; W368-I378 HydrophobicContact CB-CD1 3.74Å; W368-I378 HydrophobicContact CB-CG1 4.38Å; W368-I378 HydrophobicContact CD2-CD1 4.14Å; W368-I378 HydrophobicContact CE3-CD1 3.83Å; W368-I378 HydrophobicContact CG-CD1 4.12Å
369	M	97.7	Very high	96.2	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.069	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	135	-177.1	-61.3	-170.3	-63.4	0	0	111.2	H338 F339 H341 G374 M413 D414	H338-M369 WeakPolarHBondContact O-CE 3.29Å; F339-M369 PolarHBondContact O-N 3.14Å; H341-M369 HydrophobicContact CB-CG 4.3Å; M369-G374 WeakPolarHBondContact CA-O 3.27Å; M369-M413 HydrophobicContact SD-CB 4.25Å; M369-D414 HydrophobicContact CE-CB 3.74Å; M369-D414 HydrophobicContact SD-CB 3.88Å
370	Q	96.3	Very high	96.4	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.042	16%	0.156	C	C	.	.			trans	-82.4	176	179.3	-64	-54.1	-87.9	0	0	111.2	M324 D325 W368 G373 G374 I376 Q417	M324-Q370 VanDerWaalsContact CA-OE1 3.26Å; D325-Q370 WeakPolarHBondContact OD1-CA 3.29Å; D325-Q370 VanDerWaalsContact OD1-CB 3.3Å; D325-Q370 WeakPolarHBondContact OD1-CB 3.46Å; D325-Q370 PolarHBondContact OD1-OE1 2.99Å; W368-Q370 PolarHBondContact O-NE2 2.82Å; W368-Q370 VanDerWaalsContact O-NE2 3.16Å; Q370-G373 WeakPolarHBondContact CB-O 3.29Å; Q370-G374 PolarHBondContact N-O 2.95Å; Q370-I376 HydrophobicContact CG-CG2 4.48Å; Q370-Q417 WeakPolarHBondContact O-CG 3.21Å; Q370-Q417 PolarHBondContact O-NE2 3.03Å
371	K	94.1	Very high	96.5	Very high	90 Å²	90	34.7 Å²	34.7	39%	0.391	16%	0.155	S	C	.	.	S	Bend	trans	-74.3	-37.8	178.9	-170.2	170.9	179.1	165.8	0	112.9	D325 L326 D330 Q417	D325-K371 HydrophobicContact CB-CB 4.31Å; D325-K371 VanDerWaalsContact CG-CB 3.48Å; D325-K371 WeakPolarHBondContact O-CD 3.22Å; D325-K371 WeakPolarHBondContact OD1-CB 3.2Å; D325-K371 PolarHBondContact OD1-N 3.05Å; D325-K371 WeakPolarHBondContact OD2-CB 3.34Å; D325-K371 PolarHBondContact OD2-N 2.66Å; D325-K371 VanDerWaalsContact OD2-N 3.1Å; L326-K371 HydrophobicContact CD2-CB 3.75Å; L326-K371 HydrophobicContact CD2-CD 4.26Å; L326-K371 HydrophobicContact CD2-CG 4.17Å; L326-K371 HydrophobicContact CG-CB 4.11Å; D330-K371 IonicContact OD1-NZ 2.81Å; D330-K371 PolarHBondContact OD1-NZ 3.35Å; D330-K371 IonicContact OD2-NZ 2.71Å; K371-Q417 WeakPolarHBondContact O-CA 3.41Å
372	N	89.6	Confident	96.4	Very high	112 Å²	112	34.7 Å²	34.7	60%	0.599	16%	0.155	S	C	*	.	S	Bend	trans	-102.8	-8.2	-170.3	-60	-77.9	0	0	0	114.9	D325	D325-N372 PolarHBondContact OD2-N 2.76Å; D325-N372 PolarHBondContact OD2-ND2 3.28Å
373	G	94.2	Very high	96.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.01	15%	0.153	C	C	.	.	S	Bend	trans	142.2	156.2	-175.4	0	0	0	0	0	111.9	Q370 K409	Q370-G373 WeakPolarHBondContact CB-O 3.29Å; G373-K409 CarbonylContact C-O 3.6Å; G373-K409 WeakPolarHBondContact CA-O 3.39Å; G373-K409 WeakPolarHBondContact O-CA 3.32Å
374	G	97.2	Very high	95.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.16	C	C	.	.			trans	65.7	-158.2	-179.7	0	0	0	0	0	114.6	M369 Q370 E407 Y408 T411 Q417	M369-G374 WeakPolarHBondContact CA-O 3.27Å; Q370-G374 PolarHBondContact N-O 2.95Å; G374-E407 VanDerWaalsContact CA-O 3.26Å; G374-E407 WeakPolarHBondContact CA-O 3.35Å; G374-Y408 WeakPolarHBondContact CA-O 3.44Å; G374-Y408 PolarHBondContact N-O 3.32Å; G374-T411 PolarHBondContact N-O 3.21Å; G374-Q417 PolarHBondContact O-NE2 2.88Å
375	Y	97.8	Very high	95.4	Very high	17 Å²	17	29.4 Å²	29.4	7%	0.067	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	171	-171.7	60.8	-104.4	0	0	0	112.8	R367 W368 W377 P406 E407 Y408	R367-Y375 HydrophobicContact CB-CD1 4.23Å; R367-Y375 HydrophobicContact CB-CD2 3.7Å; R367-Y375 HydrophobicContact CB-CE2 4.35Å; R367-Y375 HydrophobicContact CB-CG 3.67Å; R367-Y375 HydrophobicContact CG-CD1 4.26Å; R367-Y375 HydrophobicContact CG-CD2 3.46Å; R367-Y375 VanDerWaalsContact CG-CD2 3.46Å; R367-Y375 HydrophobicContact CG-CE1 4.36Å; R367-Y375 HydrophobicContact CG-CE2 3.61Å; R367-Y375 HydrophobicContact CG-CG 3.84Å; W368-Y375 CarbonylContact O-C 3.59Å; W368-Y375 VanDerWaalsContact O-CA 3.26Å; W368-Y375 WeakPolarHBondContact O-CA 3.44Å; W368-Y375 WeakPolarHBondContact O-CB 3.49Å; Y375-W377 AromaticContact CE2-CD1 3.93Å; Y375-W377 AromaticContact CE2-CE2 3.98Å; Y375-W377 HydrophobicContact CE2-CZ2 4.48Å; Y375-W377 AromaticContact CE2-NE1 3.53Å; Y375-P406 WeakPolarHBondContact O-CA 3.49Å; Y375-E407 HydrophobicContact CD2-CB 4.27Å; Y375-E407 HydrophobicContact CE2-CB 3.67Å; Y375-E407 HydrophobicContact CE2-CG 4.18Å; Y375-E407 WeakPolarHBondContact CE2-OE2 3.42Å; Y375-E407 VanDerWaalsContact CZ-OE2 3.3Å; Y375-E407 PolarHBondContact N-O 2.97Å; Y375-E407 VanDerWaalsContact N-O 3.08Å; Y375-E407 PolarHBondContact O-N 2.91Å; Y375-E407 PolarHBondContact OH-OE2 3.22Å; Y375-Y408 AromaticContact CE1-CD2 3.92Å; Y375-Y408 HydrophobicContact CE1-CD2 3.92Å; Y375-Y408 AromaticContact CZ-CD2 3.88Å; Y375-Y408 WeakPolarHBondContact OH-CD2 3.42Å; Y375-Y408 WeakPolarHBondContact OH-CE2 3.43Å
376	I	97.6	Very high	94.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.1	159.9	63.4	173	0	0	0	111.6	M324 R367 W368 Q370 I378 L402 P406	M324-I376 HydrophobicContact CE-CD1 3.64Å; M324-I376 HydrophobicContact CE-CG1 4.12Å; M324-I376 HydrophobicContact CG-CD1 3.81Å; R367-I376 CarbonylContact C-O 3.41Å; R367-I376 WeakPolarHBondContact CA-O 3.49Å; W368-I376 HydrophobicContact CB-CG1 4.27Å; W368-I376 PolarHBondContact N-O 3.18Å; W368-I376 PolarHBondContact O-N 3.41Å; Q370-I376 HydrophobicContact CG-CG2 4.48Å; I376-I378 HydrophobicContact CD1-CD1 4.08Å; I376-I378 HydrophobicContact CD1-CG1 4.23Å; I376-I378 HydrophobicContact CG1-CD1 4.17Å; I376-I378 HydrophobicContact CG1-CG1 4.14Å; I376-L402 HydrophobicContact CD1-CD1 3.62Å; I376-L402 HydrophobicContact CD1-CD2 4.26Å; I376-L402 HydrophobicContact CD1-CG 3.94Å; I376-P406 HydrophobicContact CG2-CB 4.22Å; I376-P406 HydrophobicContact CG2-CG 3.78Å
377	W	98.3	Very high	93.4	Very high	73 Å²	73	29 Å²	29	28%	0.277	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133.1	172.5	-71.4	100.2	0	0	0	111.6	Y366 R367 Y375 L403 S404 E407	Y366-W377 WeakPolarHBondContact O-CA 3.19Å; R367-W377 HydrophobicContact CG-CD2 3.83Å; R367-W377 HydrophobicContact CG-CE3 3.74Å; R367-W377 HydrophobicContact CG-CH2 3.71Å; R367-W377 HydrophobicContact CG-CZ2 3.78Å; R367-W377 HydrophobicContact CG-CZ3 3.69Å; Y375-W377 AromaticContact CE2-CD1 3.93Å; Y375-W377 AromaticContact CE2-CE2 3.98Å; Y375-W377 HydrophobicContact CE2-CZ2 4.48Å; Y375-W377 AromaticContact CE2-NE1 3.53Å; W377-L403 HydrophobicContact CB-CB 3.79Å; W377-L403 HydrophobicContact CB-CD1 4.35Å; W377-L403 WeakPolarHBondContact O-CB 3.46Å; W377-L403 PolarHBondContact O-N 3.23Å; W377-S404 PolarHBondContact N-OG 3.32Å; W377-E407 VanDerWaalsContact CD1-OE1 3.25Å; W377-E407 PolarHBondContact NE1-OE1 3.49Å; W377-E407 PolarHBondContact NE1-OE2 2.92Å
378	I	98.1	Very high	92.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	148.1	179	-66.9	-175.7	0	0	0	110.1	F303 M324 Y365 Y366 W368 I376 S380 N400 Y401 L402	F303-I378 HydrophobicContact CE1-CD1 4.23Å; F303-I378 HydrophobicContact CZ-CD1 4.34Å; M324-I378 HydrophobicContact CE-CD1 3.65Å; Y365-I378 WeakPolarHBondContact CA-O 3.41Å; Y366-I378 HydrophobicContact CD1-CB 4.46Å; Y366-I378 HydrophobicContact CD1-CG2 4.48Å; Y366-I378 WeakPolarHBondContact CD1-O 3.4Å; Y366-I378 HydrophobicContact CE1-CB 4.08Å; Y366-I378 HydrophobicContact CE1-CG2 3.71Å; Y366-I378 PolarHBondContact N-O 3.25Å; Y366-I378 PolarHBondContact O-N 2.92Å; W368-I378 HydrophobicContact CB-CD1 3.74Å; W368-I378 HydrophobicContact CB-CG1 4.38Å; W368-I378 HydrophobicContact CD2-CD1 4.14Å; W368-I378 HydrophobicContact CE3-CD1 3.83Å; W368-I378 HydrophobicContact CG-CD1 4.12Å; I376-I378 HydrophobicContact CD1-CD1 4.08Å; I376-I378 HydrophobicContact CD1-CG1 4.23Å; I376-I378 HydrophobicContact CG1-CD1 4.17Å; I376-I378 HydrophobicContact CG1-CG1 4.14Å; I378-S380 WeakPolarHBondContact CG2-OG 3.44Å; I378-N400 HydrophobicContact CG2-CB 3.99Å; I378-Y401 WeakPolarHBondContact CA-O 3.49Å; I378-L402 HydrophobicContact CG1-CD1 4.49Å
379	Q	97.3	Very high	91.2	Very high	50 Å²	50	42 Å²	42	23%	0.234	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143	153.3	-165.6	173.3	30	0	0	108.7	V362 T363 Y365 Y401 L403	V362-Q379 HydrophobicContact CG1-CG 4.04Å; T363-Q379 WeakPolarHBondContact O-CG 3.47Å; T363-Q379 PolarHBondContact O-NE2 3.47Å; Y365-Q379 HydrophobicContact CD1-CB 3.97Å; Y365-Q379 HydrophobicContact CD1-CG 4.15Å; Y365-Q379 HydrophobicContact CE1-CB 4.31Å; Y365-Q379 HydrophobicContact CE1-CG 4.38Å; Q379-Y401 PolarHBondContact N-O 3.3Å; Q379-Y401 VanDerWaalsContact N-O 3.07Å; Q379-Y401 WeakPolarHBondContact O-CB 3.43Å; Q379-Y401 WeakPolarHBondContact O-CD2 3.44Å; Q379-Y401 PolarHBondContact O-N 3.29Å; Q379-L403 HydrophobicContact CB-CD1 4.24Å
380	S	96	Very high	90.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	137.8	177.6	-52.8	0	0	0	0	112.9	V362 T363 Y366 I378 W398 V399 N400	V362-S380 WeakPolarHBondContact CA-O 3.44Å; T363-S380 PolarHBondContact N-O 3.36Å; T363-S380 PolarHBondContact OG1-N 2.9Å; Y366-S380 PolarHBondContact OH-OG 3.41Å; I378-S380 WeakPolarHBondContact CG2-OG 3.44Å; S380-W398 PolarHBondContact OG-NE1 2.93Å; S380-W398 VanDerWaalsContact OG-NE1 3.11Å; S380-V399 CarbonylContact C-O 3.58Å; S380-V399 WeakPolarHBondContact CA-O 3.3Å; S380-V399 WeakPolarHBondContact CB-O 3.28Å; S380-N400 PolarHBondContact OG-OD1 3.41Å
381	S	94	Very high	89.2	Confident	13 Å²	13	47.8 Å²	47.8	9%	0.091	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.6	168.2	-178	0	0	0	0	108.4	V399	S381-V399 PolarHBondContact N-O 2.82Å; S381-V399 PolarHBondContact O-N 3.49Å
382	A	93.8	Very high	88.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.5	-172.4	0	0	0	0	0	111.3	L355 Q360 C361 I396 I397 W398	L355-A382 HydrophobicContact CD1-CB 4.08Å; L355-A382 HydrophobicContact CD2-CB 3.72Å; Q360-A382 VanDerWaalsContact CA-O 3.32Å; Q360-A382 WeakPolarHBondContact CA-O 3.37Å; C361-A382 PolarHBondContact N-O 3Å; C361-A382 PolarHBondContact O-N 3.01Å; A382-I396 HydrophobicContact CB-CG2 4.27Å; A382-I397 CarbonylContact C-O 3.47Å; A382-I397 WeakPolarHBondContact CA-O 3.14Å; A382-W398 HydrophobicContact CB-CD2 3.97Å; A382-W398 HydrophobicContact CB-CE3 3.32Å; A382-W398 HydrophobicContact CB-CH2 4.49Å; A382-W398 HydrophobicContact CB-CZ3 3.62Å
383	T	92.2	Very high	88.1	Confident	14 Å²	14	48.5 Å²	48.5	9%	0.086	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	133	-175.9	-73.8	0	0	0	0	111.4	P291 Q360 A385 I396 I397	P291-T383 HydrophobicContact CB-CG2 3.47Å; P291-T383 VanDerWaalsContact CB-CG2 3.47Å; Q360-T383 HydrophobicContact CG-CG2 3.93Å; Q360-T383 WeakPolarHBondContact CG-OG1 3.2Å; Q360-T383 PolarHBondContact NE2-OG1 3.3Å; T383-A385 PolarHBondContact O-N 2.84Å; T383-I396 WeakPolarHBondContact O-CA 3.49Å; T383-I397 PolarHBondContact N-O 3.34Å; T383-I397 PolarHBondContact O-N 3.39Å
384	I	90.4	Very high	87.7	Confident	31 Å²	31	53.5 Å²	53.5	16%	0.159	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	113.4	174	-58.4	176.1	0	0	0	109.1	M309 L355 G359 K394 N395 I396	M309-I384 HydrophobicContact CE-CD1 3.76Å; M309-I384 HydrophobicContact CE-CG1 4.27Å; M309-I384 HydrophobicContact SD-CG2 4.41Å; L355-I384 HydrophobicContact CD1-CG1 4.16Å; L355-I384 HydrophobicContact CG-CG1 4.34Å; L355-I384 WeakPolarHBondContact O-CD1 3.33Å; G359-I384 PolarHBondContact O-N 2.94Å; I384-K394 HydrophobicContact CG2-CB 4.26Å; I384-N395 CarbonylContact C-O 3.57Å; I384-I396 HydrophobicContact CG1-CG1 4.03Å
385	A	85	Confident	87.4	Confident	15 Å²	15	54 Å²	54	12%	0.124	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	130.1	168.3	0	0	0	0	0	110.4	T383 N395 I397	T383-A385 PolarHBondContact O-N 2.84Å; A385-N395 PolarHBondContact N-O 3.5Å; A385-N395 PolarHBondContact O-N 3.03Å; A385-N395 PolarHBondContact O-ND2 3.32Å; A385-N395 VanDerWaalsContact O-O 3.09Å; A385-I397 HydrophobicContact CB-CD1 4.44Å; A385-I397 HydrophobicContact CB-CG1 3.86Å
386	I	80.8	Confident	87.1	Confident	90 Å²	90	53.2 Å²	53.2	46%	0.462	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.3	173.5	-57.3	175.2	0	0	0	107.5	A388 A391 K394	I386-A388 PolarHBondContact O-N 3.19Å; I386-A391 HydrophobicContact CG2-CB 4.29Å; I386-K394 HydrophobicContact CG1-CG 4.45Å
387	N	74.3	Confident	86.9	Confident	50 Å²	50	54.2 Å²	54.2	27%	0.267	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	121.4	177	-176.7	-12.6	0	0	0	110.3	K389 N390 E393	N387-K389 PolarHBondContact O-N 2.89Å; N387-K389 VanDerWaalsContact O-N 3.16Å; N387-K389 PolarHBondContact OD1-N 2.87Å; N387-N390 CarbonylContact O-C 3.6Å; N387-N390 PolarHBondContact O-N 2.73Å; N387-N390 VanDerWaalsContact O-O 3.11Å; N387-E393 HydrophobicContact CB-CB 4Å; N387-E393 HydrophobicContact CB-CG 4.49Å; N387-E393 PolarHBondContact N-O 3.39Å; N387-E393 PolarHBondContact ND2-OE2 3.07Å
388	A	72.4	Confident	86.7	Confident	102 Å²	102	50.8 Å²	50.8	84%	0.843	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21	179.9	0	0	0	0	0	114	I386	I386-A388 PolarHBondContact O-N 3.19Å
389	K	77.2	Confident	86.5	Confident	200 Å²	200	51.2 Å²	51.2	87%	0.87	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-22.7	174	-61.7	-174.9	179.9	-178.1	0	113.5	N387	N387-K389 PolarHBondContact O-N 2.89Å; N387-K389 VanDerWaalsContact O-N 3.16Å; N387-K389 PolarHBondContact OD1-N 2.87Å
390	N	75.9	Confident	86.4	Confident	76 Å²	76	48.8 Å²	48.8	41%	0.406	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	97	-176.9	-179.8	3.9	0	0	0	110	N387 N392 E393	N387-N390 CarbonylContact O-C 3.6Å; N387-N390 PolarHBondContact O-N 2.73Å; N387-N390 VanDerWaalsContact O-O 3.11Å; N390-N392 PolarHBondContact O-N 3.34Å; N390-N392 WeakPolarHBondContact OD1-CB 3.27Å; N390-N392 PolarHBondContact OD1-N 2.91Å; N390-E393 HydrophobicContact CB-CB 4.39Å; N390-E393 PolarHBondContact O-N 2.99Å
391	A	76.6	Confident	86.3	Confident	69 Å²	69	52.5 Å²	52.5	57%	0.57	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	-14	-176.1	0	0	0	0	0	114.6	I386	I386-A391 HydrophobicContact CG2-CB 4.29Å
392	N	77.4	Confident	86.3	Confident	144 Å²	144	52.9 Å²	52.9	77%	0.77	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	-25.1	175.3	-61.3	-17.6	0	0	0	112.2	N390 K394	N390-N392 PolarHBondContact O-N 3.34Å; N390-N392 WeakPolarHBondContact OD1-CB 3.27Å; N390-N392 PolarHBondContact OD1-N 2.91Å; N392-K394 PolarHBondContact O-N 3.33Å
393	E	82.7	Confident	86.4	Confident	73 Å²	73	57 Å²	57	34%	0.341	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	104.1	175.1	-169.5	-160.4	154.9	0	0	109.9	R306 N387 N390	R306-E393 IonicContact CZ-OE1 3.2Å; R306-E393 IonicContact NH2-OE1 2.66Å; R306-E393 PolarHBondContact NH2-OE1 2.98Å; N387-E393 HydrophobicContact CB-CB 4Å; N387-E393 HydrophobicContact CB-CG 4.49Å; N387-E393 PolarHBondContact N-O 3.39Å; N387-E393 PolarHBondContact ND2-OE2 3.07Å; N390-E393 HydrophobicContact CB-CB 4.39Å; N390-E393 PolarHBondContact O-N 2.99Å
394	K	86.4	Confident	86.6	Confident	107 Å²	107	57.3 Å²	57.3	47%	0.465	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	136.3	174.1	-61.8	177.5	-174.5	170.9	0	109.6	M309 I384 I386 N392	M309-K394 HydrophobicContact CG-CB 4.32Å; M309-K394 HydrophobicContact SD-CB 3.82Å; I384-K394 HydrophobicContact CG2-CB 4.26Å; I386-K394 HydrophobicContact CG1-CG 4.45Å; N392-K394 PolarHBondContact O-N 3.33Å
395	N	90.8	Very high	86.8	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.053	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	157.8	174.1	59.1	106.6	0	0	0	108.7	R306 I384 A385	R306-N395 HydrophobicContact CG-CB 4.3Å; R306-N395 PolarHBondContact NE-OD1 3.12Å; R306-N395 PolarHBondContact NH2-ND2 3.5Å; I384-N395 CarbonylContact C-O 3.57Å; A385-N395 PolarHBondContact N-O 3.5Å; A385-N395 PolarHBondContact O-N 3.03Å; A385-N395 PolarHBondContact O-ND2 3.32Å; A385-N395 VanDerWaalsContact O-O 3.09Å
396	I	93.1	Very high	87.4	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.6	177.7	-70.5	159.5	0	0	0	107.9	R306 V307 M309 L311 L355 A382 T383 I384 W398	R306-I396 WeakPolarHBondContact CA-O 3.42Å; V307-I396 HydrophobicContact CG2-CB 3.62Å; V307-I396 HydrophobicContact CG2-CD1 4.47Å; V307-I396 HydrophobicContact CG2-CG2 3.72Å; V307-I396 PolarHBondContact N-O 3.29Å; V307-I396 PolarHBondContact O-N 3.5Å; M309-I396 HydrophobicContact SD-CD1 4.22Å; M309-I396 HydrophobicContact SD-CG1 4.15Å; L311-I396 HydrophobicContact CD2-CD1 4.08Å; L355-I396 HydrophobicContact CD2-CD1 3.67Å; L355-I396 HydrophobicContact CD2-CG1 4.01Å; L355-I396 HydrophobicContact CD2-CG2 3.79Å; L355-I396 HydrophobicContact CG-CD1 4.37Å; A382-I396 HydrophobicContact CB-CG2 4.27Å; T383-I396 WeakPolarHBondContact O-CA 3.49Å; I384-I396 HydrophobicContact CG1-CG1 4.03Å; I396-W398 HydrophobicContact CG2-CB 4.33Å; I396-W398 HydrophobicContact CG2-CE3 3.98Å
397	I	92.7	Very high	88.1	Confident	22 Å²	22	62.8 Å²	62.8	11%	0.113	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.8	163.5	-52.7	-58.2	0	0	0	106.6	V304 R306 A382 T383 A385 V399	V304-I397 HydrophobicContact CG1-CG2 3.92Å; R306-I397 HydrophobicContact CB-CD1 4.46Å; R306-I397 HydrophobicContact CG-CD1 4.16Å; A382-I397 CarbonylContact C-O 3.47Å; A382-I397 WeakPolarHBondContact CA-O 3.14Å; T383-I397 PolarHBondContact N-O 3.34Å; T383-I397 PolarHBondContact O-N 3.39Å; A385-I397 HydrophobicContact CB-CD1 4.44Å; A385-I397 HydrophobicContact CB-CG1 3.86Å; I397-V399 HydrophobicContact CG2-CG2 4.26Å
398	W	94.1	Very high	89.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	100.4	-173	-170.6	-77.8	0	0	0	107.8	T305 L311 I348 L355 T363 Y366 S380 A382 I396 N400	T305-W398 PolarHBondContact N-O 3.02Å; T305-W398 PolarHBondContact O-N 2.82Å; T305-W398 PolarHBondContact OG1-O 3.23Å; T305-W398 VanDerWaalsContact OG1-O 3.08Å; L311-W398 HydrophobicContact CD1-CH2 4.49Å; L311-W398 HydrophobicContact CD1-CZ3 4.4Å; L311-W398 HydrophobicContact CD2-CE3 4.01Å; L311-W398 HydrophobicContact CD2-CZ3 3.82Å; I348-W398 HydrophobicContact CG2-CH2 4.27Å; L355-W398 HydrophobicContact CD2-CE3 4.38Å; L355-W398 HydrophobicContact CD2-CZ3 4.07Å; T363-W398 HydrophobicContact CG2-CH2 3.84Å; T363-W398 HydrophobicContact CG2-CZ2 3.71Å; Y366-W398 PolarHBondContact OH-NE1 2.83Å; S380-W398 PolarHBondContact OG-NE1 2.93Å; S380-W398 VanDerWaalsContact OG-NE1 3.11Å; A382-W398 HydrophobicContact CB-CD2 3.97Å; A382-W398 HydrophobicContact CB-CE3 3.32Å; A382-W398 HydrophobicContact CB-CH2 4.49Å; A382-W398 HydrophobicContact CB-CZ3 3.62Å; I396-W398 HydrophobicContact CG2-CB 4.33Å; I396-W398 HydrophobicContact CG2-CE3 3.98Å; W398-N400 PolarHBondContact NE1-OD1 3.18Å; W398-N400 PolarHBondContact O-ND2 3.16Å
399	V	93.3	Very high	90.3	Very high	9 Å²	9	68.5 Å²	68.5	6%	0.055	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119.4	-176.8	-176.8	0	0	0	0	108.2	M302 V304 S380 S381 I397 Y401	M302-V399 HydrophobicContact SD-CG1 4.43Å; V304-V399 HydrophobicContact CG2-CG2 4.37Å; S380-V399 CarbonylContact C-O 3.58Å; S380-V399 WeakPolarHBondContact CA-O 3.3Å; S380-V399 WeakPolarHBondContact CB-O 3.28Å; S381-V399 PolarHBondContact N-O 2.82Å; S381-V399 PolarHBondContact O-N 3.49Å; I397-V399 HydrophobicContact CG2-CG2 4.26Å; V399-Y401 HydrophobicContact CG1-CE1 4.04Å; V399-Y401 HydrophobicContact CG1-CE2 4.5Å
400	N	95.3	Very high	91.1	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122.8	-176	-52.4	-78.3	0	0	0	110.2	M302 F303 T305 I378 S380 W398	M302-N400 CarbonylContact C-O 3.52Å; M302-N400 WeakPolarHBondContact CA-O 3.36Å; M302-N400 VanDerWaalsContact CB-O 3.25Å; M302-N400 WeakPolarHBondContact CB-O 3.31Å; F303-N400 HydrophobicContact CD1-CB 3.95Å; F303-N400 HydrophobicContact CD2-CB 4.47Å; F303-N400 HydrophobicContact CE1-CB 3.6Å; F303-N400 HydrophobicContact CE2-CB 4.16Å; F303-N400 VanDerWaalsContact CE2-ND2 3.34Å; F303-N400 WeakPolarHBondContact CE2-ND2 3.44Å; F303-N400 HydrophobicContact CG-CB 4.38Å; F303-N400 HydrophobicContact CZ-CB 3.71Å; F303-N400 PolarHBondContact N-O 3.36Å; F303-N400 WeakPolarHBondContact O-CB 3.42Å; F303-N400 PolarHBondContact O-N 3.09Å; F303-N400 PolarHBondContact O-ND2 2.86Å; F303-N400 VanDerWaalsContact O-ND2 3.11Å; T305-N400 PolarHBondContact OG1-ND2 3.11Å; T305-N400 VanDerWaalsContact OG1-ND2 3.13Å; I378-N400 HydrophobicContact CG2-CB 3.99Å; S380-N400 PolarHBondContact OG-OD1 3.41Å; W398-N400 PolarHBondContact NE1-OD1 3.18Å; W398-N400 PolarHBondContact O-ND2 3.16Å
401	Y	94.2	Very high	91.9	Very high	77 Å²	77	64.6 Å²	64.6	30%	0.302	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.7	172.1	-51.8	-73.7	0	0	0	109.1	M302 I378 Q379 V399	M302-Y401 HydrophobicContact CB-CD1 4.03Å; M302-Y401 HydrophobicContact CE-CD1 3.99Å; M302-Y401 HydrophobicContact CE-CE1 3.72Å; M302-Y401 HydrophobicContact SD-CD1 4.4Å; M302-Y401 HydrophobicContact SD-CE1 4.05Å; I378-Y401 WeakPolarHBondContact CA-O 3.49Å; Q379-Y401 PolarHBondContact N-O 3.3Å; Q379-Y401 VanDerWaalsContact N-O 3.07Å; Q379-Y401 WeakPolarHBondContact O-CB 3.43Å; Q379-Y401 WeakPolarHBondContact O-CD2 3.44Å; Q379-Y401 PolarHBondContact O-N 3.29Å; V399-Y401 HydrophobicContact CG1-CE1 4.04Å; V399-Y401 HydrophobicContact CG1-CE2 4.5Å
402	L	94.9	Very high	92.8	Very high	22 Å²	22	64.4 Å²	64.4	12%	0.115	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.3	178	-124	81.7	0	0	0	110.7	H301 F303 Y323 I376 I378	H301-L402 HydrophobicContact CB-CB 4.04Å; H301-L402 WeakPolarHBondContact O-CB 3.31Å; H301-L402 PolarHBondContact O-N 2.8Å; F303-L402 HydrophobicContact CD1-CD1 4.28Å; F303-L402 HydrophobicContact CE1-CD1 3.98Å; Y323-L402 HydrophobicContact CD1-CD2 4.02Å; Y323-L402 HydrophobicContact CD2-CD1 4.12Å; Y323-L402 HydrophobicContact CD2-CD2 4.47Å; Y323-L402 HydrophobicContact CG-CD1 4.14Å; Y323-L402 HydrophobicContact CG-CD2 3.81Å; I376-L402 HydrophobicContact CD1-CD1 3.62Å; I376-L402 HydrophobicContact CD1-CD2 4.26Å; I376-L402 HydrophobicContact CD1-CG 3.94Å; I378-L402 HydrophobicContact CG1-CD1 4.49Å
403	L	95.8	Very high	93.6	Very high	85 Å²	85	61.3 Å²	61.3	45%	0.445	31%	0.306	S	S	.	.			trans	-114.7	-24.2	179.2	-51.5	176.5	0	0	0	113	Y365 W377 Q379	Y365-L403 HydrophobicContact CD1-CD1 3.48Å; Y365-L403 VanDerWaalsContact CD1-CD1 3.48Å; Y365-L403 HydrophobicContact CE1-CD1 4.05Å; Y365-L403 HydrophobicContact CG-CD1 3.82Å; W377-L403 HydrophobicContact CB-CB 3.79Å; W377-L403 HydrophobicContact CB-CD1 4.35Å; W377-L403 WeakPolarHBondContact O-CB 3.46Å; W377-L403 PolarHBondContact O-N 3.23Å; Q379-L403 HydrophobicContact CB-CD1 4.24Å
404	S	96	Very high	94.2	Very high	21 Å²	21	60.8 Å²	60.8	15%	0.147	31%	0.306	C	S	.	.			trans	-141.4	165	179.2	81.3	0	0	0	0	113.2	W377	W377-S404 PolarHBondContact N-OG 3.32Å
405	N	95.1	Very high	94.5	Very high	120 Å²	120	60.8 Å²	60.8	64%	0.642	31%	0.31	S	S	*	.	S	Bend	trans	-78.3	171.5	157.8	-65.2	-26.1	0	0	0	109.9	E407	N405-E407 PolarHBondContact O-N 2.84Å
406	P	96	Very high	94.5	Very high	66 Å²	66	63.9 Å²	63.9	43%	0.429	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-55.1	120	176.5	-30.7	37.9	0	0	0	114.6	Y375 I376	Y375-P406 WeakPolarHBondContact O-CA 3.49Å; I376-P406 HydrophobicContact CG2-CB 4.22Å; I376-P406 HydrophobicContact CG2-CG 3.78Å
407	E	97	Very high	94.5	Very high	66 Å²	66	64.4 Å²	64.4	31%	0.308	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-100.5	145.8	173.3	-65.7	-178.1	-172.9	0	0	110.1	G374 Y375 W377 N405 K409	G374-E407 VanDerWaalsContact CA-O 3.26Å; G374-E407 WeakPolarHBondContact CA-O 3.35Å; Y375-E407 HydrophobicContact CD2-CB 4.27Å; Y375-E407 HydrophobicContact CE2-CB 3.67Å; Y375-E407 HydrophobicContact CE2-CG 4.18Å; Y375-E407 WeakPolarHBondContact CE2-OE2 3.42Å; Y375-E407 VanDerWaalsContact CZ-OE2 3.3Å; Y375-E407 PolarHBondContact N-O 2.97Å; Y375-E407 VanDerWaalsContact N-O 3.08Å; Y375-E407 PolarHBondContact O-N 2.91Å; Y375-E407 PolarHBondContact OH-OE2 3.22Å; W377-E407 VanDerWaalsContact CD1-OE1 3.25Å; W377-E407 PolarHBondContact NE1-OE1 3.49Å; W377-E407 PolarHBondContact NE1-OE2 2.92Å; N405-E407 PolarHBondContact O-N 2.84Å; E407-K409 PolarHBondContact O-N 3.5Å; E407-K409 VanDerWaalsContact O-N 3.08Å
408	Y	96.7	Very high	94.4	Very high	152 Å²	152	67.5 Å²	67.5	60%	0.596	36%	0.356	S	S	*	.	S	Bend	trans	52.9	28.3	176.5	-56.9	-80.9	0	0	0	115.9	G374 Y375 D410 T411	G374-Y408 WeakPolarHBondContact CA-O 3.44Å; G374-Y408 PolarHBondContact N-O 3.32Å; Y375-Y408 AromaticContact CE1-CD2 3.92Å; Y375-Y408 HydrophobicContact CE1-CD2 3.92Å; Y375-Y408 AromaticContact CZ-CD2 3.88Å; Y375-Y408 WeakPolarHBondContact OH-CD2 3.42Å; Y375-Y408 WeakPolarHBondContact OH-CE2 3.43Å; Y408-D410 PolarHBondContact O-N 3.06Å; Y408-T411 PolarHBondContact O-N 2.97Å
409	K	94.6	Very high	93.6	Very high	120 Å²	120	72.4 Å²	72.4	52%	0.522	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-26.1	-176.6	62.1	167.1	-174.1	84.9	0	116.7	G373 E407	G373-K409 CarbonylContact C-O 3.6Å; G373-K409 WeakPolarHBondContact CA-O 3.39Å; G373-K409 WeakPolarHBondContact O-CA 3.32Å; E407-K409 PolarHBondContact O-N 3.5Å; E407-K409 VanDerWaalsContact O-N 3.08Å
410	D	94.1	Very high	92	Very high	126 Å²	126	81 Å²	81	67%	0.674	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	6.2	-176.3	-52.5	-63	0	0	0	112.4	Y408	Y408-D410 PolarHBondContact O-N 3.06Å
411	T	94.1	Very high	90.3	Very high	68 Å²	68	85.2 Å²	85.2	42%	0.417	45%	0.449	S	S	.	.	S	Bend	trans	-123.7	112.3	-178.7	-56.5	0	0	0	0	110.5	G374 Y408 M413	G374-T411 PolarHBondContact N-O 3.21Å; Y408-T411 PolarHBondContact O-N 2.97Å; T411-M413 HydrophobicContact CG2-CE 3.71Å; T411-M413 HydrophobicContact CG2-SD 4.12Å
412	P	94.8	Very high	88.2	Confident	65 Å²	65	86.6 Å²	86.6	42%	0.422	47%	0.467	S	S	.	.			trans	-71.9	136.8	172.8	29.8	-33.3	0	0	0	110.9	Q417 L418	P412-Q417 HydrophobicContact CB-CB 3.97Å; P412-L418 HydrophobicContact CB-CD2 3.84Å; P412-L418 HydrophobicContact CG-CD2 3.76Å
413	M	94.9	Very high	85.8	Confident	79 Å²	79	94.8 Å²	94.8	39%	0.389	51%	0.505	S	S	.	.			trans	-113.4	-26.8	-177.8	-54.3	-62.8	178.6	0	0	112.2	M369 T411	M369-M413 HydrophobicContact SD-CB 4.25Å; T411-M413 HydrophobicContact CG2-CE 3.71Å; T411-M413 HydrophobicContact CG2-SD 4.12Å
414	D	94.9	Very high	83.3	Confident	61 Å²	61	99.3 Å²	99.3	33%	0.326	52%	0.521	S	S	.	.	S	Bend	trans	-130	157.7	178.1	-179.7	-106	0	0	0	111.6	M369 A416 Q417	M369-D414 HydrophobicContact CE-CB 3.74Å; M369-D414 HydrophobicContact SD-CB 3.88Å; D414-A416 PolarHBondContact O-N 3.17Å; D414-A416 WeakPolarHBondContact OD1-CB 3.5Å; D414-A416 PolarHBondContact OD1-N 3.2Å; D414-Q417 WeakPolarHBondContact O-CB 3.48Å; D414-Q417 PolarHBondContact O-N 3.13Å
415	I	92.9	Very high	80.5	Confident	107 Å²	107	104.7 Å²	104.7	55%	0.549	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-56.6	-34.2	177.3	-168	164.9	0	0	0	112.5	Q417 L418 L421	I415-Q417 PolarHBondContact O-N 2.81Å; I415-Q417 VanDerWaalsContact O-N 3.09Å; I415-L418 PolarHBondContact O-N 3.42Å; I415-L418 VanDerWaalsContact O-N 3.12Å; I415-L421 HydrophobicContact CD1-CD1 4.43Å; I415-L421 HydrophobicContact CD1-CD2 4.08Å; I415-L421 HydrophobicContact CG1-CD1 3.56Å; I415-L421 HydrophobicContact CG1-CD2 4.04Å; I415-L421 HydrophobicContact CG1-CG 4.45Å; I415-L421 WeakPolarHBondContact O-CD1 3.32Å
416	A	89.4	Confident	77.9	Confident	76 Å²	76	104.8 Å²	104.8	63%	0.628	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-65.3	-11.1	177.8	0	0	0	0	0	114.4	D414	D414-A416 PolarHBondContact O-N 3.17Å; D414-A416 WeakPolarHBondContact OD1-CB 3.5Å; D414-A416 PolarHBondContact OD1-N 3.2Å
417	Q	93.3	Very high	75.3	Confident	11 Å²	11	110.4 Å²	110.4	5%	0.051	58%	0.584	C	S	.	*	G	3₁₀ helix	trans	-95.1	-3.1	177.1	-58.7	-176	-41.9	0	0	113.5	Q370 K371 G374 P412 D414 I415	Q370-Q417 WeakPolarHBondContact O-CG 3.21Å; Q370-Q417 PolarHBondContact O-NE2 3.03Å; K371-Q417 WeakPolarHBondContact O-CA 3.41Å; G374-Q417 PolarHBondContact O-NE2 2.88Å; P412-Q417 HydrophobicContact CB-CB 3.97Å; D414-Q417 WeakPolarHBondContact O-CB 3.48Å; D414-Q417 PolarHBondContact O-N 3.13Å; I415-Q417 PolarHBondContact O-N 2.81Å; I415-Q417 VanDerWaalsContact O-N 3.09Å
418	L	90.6	Very high	72.5	Confident	87 Å²	87	113.1 Å²	113.1	46%	0.455	61%	0.61	S	S	.	*	S	Bend	trans	-89.2	127.3	-179.4	-64.5	177.6	0	0	0	111.6	P412 I415 L421	P412-L418 HydrophobicContact CB-CD2 3.84Å; P412-L418 HydrophobicContact CG-CD2 3.76Å; I415-L418 PolarHBondContact O-N 3.42Å; I415-L418 VanDerWaalsContact O-N 3.12Å; L418-L421 HydrophobicContact CB-CD1 4.14Å
419	P	78	Confident	69.8	Low	103 Å²	103	111.5 Å²	111.5	67%	0.669	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	147.2	175	30.1	-34.9	0	0	0	111.4	L421	P419-L421 PolarHBondContact O-N 3.35Å
420	H	59.2	Low	67.2	Low	189 Å²	189	115 Å²	115	88%	0.875	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.5	33.5	173.5	-49.1	-65.1	0	0	0	116.8
421	L	59.7	Low	64.8	Low	88 Å²	88	114.9 Å²	114.9	46%	0.461	64%	0.643	S	S	.	*			trans	-62	133.8	154.1	-77.8	151.3	0	0	0	109.6	I415 L418 P419 E423	I415-L421 HydrophobicContact CD1-CD1 4.43Å; I415-L421 HydrophobicContact CD1-CD2 4.08Å; I415-L421 HydrophobicContact CG1-CD1 3.56Å; I415-L421 HydrophobicContact CG1-CD2 4.04Å; I415-L421 HydrophobicContact CG1-CG 4.45Å; I415-L421 WeakPolarHBondContact O-CD1 3.32Å; L418-L421 HydrophobicContact CB-CD1 4.14Å; P419-L421 PolarHBondContact O-N 3.35Å; L421-E423 PolarHBondContact O-N 2.88Å
422	P	51.1	Low	62	Low	107 Å²	107	117 Å²	117	70%	0.695	66%	0.661	S	S	*	*			trans	-67.1	134.4	174.5	27.8	-33.3	0	0	0	109.7	K424	P422-K424 PolarHBondContact O-N 3.48Å
423	E	43.3	Very low	59.5	Low	193 Å²	193	121.8 Å²	121.8	90%	0.902	68%	0.683	S	S	*	*			trans	-62.4	100.2	172.6	-70.1	-174.4	126.6	0	0	109.7	L421 T425	L421-E423 PolarHBondContact O-N 2.88Å; E423-T425 PolarHBondContact O-N 3.06Å
424	K	43.9	Very low	56.7	Low	180 Å²	180	122.6 Å²	122.6	78%	0.783	70%	0.696	S	S	*	*			trans	-69.1	103.9	164	-76.8	-168.5	174.3	-174.1	0	107.8	P422 S426	P422-K424 PolarHBondContact O-N 3.48Å; K424-S426 PolarHBondContact O-N 2.98Å; K424-S426 PolarHBondContact O-OG 2.83Å
425	T	37.5	Very low	53.9	Low	135 Å²	135	129.3 Å²	129.3	83%	0.828	73%	0.726	S	S	*	*			trans	-43.1	104.2	170.7	46.8	0	0	0	0	110.1	E423 E427	E423-T425 PolarHBondContact O-N 3.06Å; T425-E427 PolarHBondContact O-N 3.39Å
426	S	39	Very low	51.1	Low	121 Å²	121	129.3 Å²	129.3	85%	0.846	74%	0.735	S	S	*	*			trans	-89.3	58.3	-167.9	-66.4	0	0	0	0	111.7	K424	K424-S426 PolarHBondContact O-N 2.98Å; K424-S426 PolarHBondContact O-OG 2.83Å
427	E	43.3	Very low	48.5	Very low	185 Å²	185	133.7 Å²	133.7	86%	0.864	75%	0.748	S	S	*	*			trans	-115.1	91.6	170.1	-71.1	-166.1	158.2	0	0	110.2	T425	T425-E427 PolarHBondContact O-N 3.39Å
428	S	38	Very low	45.7	Very low	123 Å²	123	138.9 Å²	138.9	86%	0.86	79%	0.786	S	S	*	*			trans	175	89	149.6	35.5	0	0	0	0	110
429	S	39.2	Very low	43	Very low	118 Å²	118	144 Å²	144	83%	0.825	80%	0.804	S	S	*	*			trans	-92.1	102.8	153	57.1	0	0	0	0	108.2
430	E	41	Very low	40.9	Very low	193 Å²	193	146.6 Å²	146.6	90%	0.902	81%	0.812	S	S	*	*			trans	-157.4	165.6	153.7	-122.8	164.5	-137	0	0	112.4
431	T	43	Very low	39.5	Very low	124 Å²	124	144.4 Å²	144.4	76%	0.761	81%	0.812	S	S	*	*			trans	-90	144.3	-159.4	50.4	0	0	0	0	113.5
432	S	35.4	Very low	38.4	Very low	112 Å²	112	145.5 Å²	145.5	78%	0.783	83%	0.827	S	S	*	*			trans	-155.1	98.6	152.6	-77.7	0	0	0	0	110.1
433	D	42.3	Very low	37.4	Very low	165 Å²	165	144.2 Å²	144.2	88%	0.882	83%	0.834	S	S	*	*			trans	-65	132.7	153.5	-66.8	-58.8	0	0	0	108.1
434	S	35.2	Very low	37	Very low	96 Å²	96	142.3 Å²	142.3	67%	0.671	83%	0.828	S	S	*	*			trans	-153	87.3	174.1	-70.5	0	0	0	0	109.3	S436	S434-S436 PolarHBondContact O-N 3.49Å
435	E	36.9	Very low	36.5	Very low	203 Å²	203	139.6 Å²	139.6	95%	0.949	83%	0.827	S	S	*	*			trans	-60.4	136.6	165.3	-63	-165.9	125.8	0	0	109.1
436	S	34.8	Very low	36.4	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	83%	0.826	S	S	*	*			trans	-139.1	102.4	173.7	31.1	0	0	0	0	110.1	S434 S438	S434-S436 PolarHBondContact O-N 3.49Å; S436-S438 PolarHBondContact O-N 2.85Å
437	D	33.5	Very low	36	Very low	169 Å²	169	142.8 Å²	142.8	90%	0.904	82%	0.824	S	S	*	*			trans	-50.1	128.1	166	-90.7	-51.5	0	0	0	110.1
438	S	35.3	Very low	35.4	Very low	120 Å²	120	140.3 Å²	140.3	84%	0.839	82%	0.816	S	S	*	*			trans	-127.4	118.9	153.3	52.6	0	0	0	0	107.9	S436	S436-S438 PolarHBondContact O-N 2.85Å
439	K	34	Very low	35.2	Very low	195 Å²	195	141.8 Å²	141.8	85%	0.848	81%	0.81	S	S	*	*			trans	-110	128.1	-167.8	-168.9	171.4	-171.2	166.3	0	108.9
440	D	32.4	Very low	34.7	Very low	157 Å²	157	142.9 Å²	142.9	84%	0.84	81%	0.806	S	S	*	*			trans	-54.1	145.8	-178.6	-66.4	-72	0	0	0	113
441	T	31.7	Very low	34.4	Very low	142 Å²	142	139 Å²	139	87%	0.871	80%	0.801	S	S	*	*			trans	-143.9	132.9	154.8	-63.5	0	0	0	0	108.9
442	S	35.7	Very low	33.8	Very low	111 Å²	111	142 Å²	142	78%	0.776	80%	0.803	S	S	*	*			trans	-82.7	146.3	-163.1	54	0	0	0	0	115
443	G	29.1	Very low	33.8	Very low	81 Å²	81	141.7 Å²	141.7	84%	0.835	80%	0.801	S	S	*	*			trans	-146	106.5	167.9	0	0	0	0	0	111.7
444	I	35.6	Very low	33.3	Very low	152 Å²	152	140.1 Å²	140.1	78%	0.779	79%	0.792	S	S	*	*			trans	-93.3	134.6	-175.1	-50.6	164.6	0	0	0	109.2
445	T	34.2	Very low	33.1	Very low	123 Å²	123	142.7 Å²	142.7	76%	0.755	79%	0.794	S	S	*	*				162.4	129.5	125.1	46.1	0	0	0	0	113.8
446	E	34.3	Very low	32.9	Very low	175 Å²	175	141.6 Å²	141.6	82%	0.818	79%	0.786	S	S	*	*			trans	-7.2	168.8	150.4	-63.2	168	139.1	0	0	123.4
447	D	30.9	Very low	32.6	Very low	148 Å²	148	140.1 Å²	140.1	79%	0.791	79%	0.787	S	S	*	*			trans	84.5	95.5	157	-67.5	-18.1	0	0	0	124
448	N	31	Very low	32.5	Very low	133 Å²	133	138 Å²	138	71%	0.711	78%	0.776	S	S	*	*				68.5	150.8	105.4	-156.9	27.9	0	0	0	122.9
449	E	33	Very low	32.3	Very low	155 Å²	155	140.5 Å²	140.5	72%	0.724	78%	0.775	S	S	*	*			trans	65.2	122.7	171.3	-47.9	-149.7	172.7	0	0	117.4
450	N	29.4	Very low	32.3	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	77%	0.765	S	S	*	*			cis	88.5	137.9	48.1	-176.1	44.2	0	0	0	114.7
451	S	35	Very low	32.3	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	76%	0.76	S	S	*	*			trans	105.1	119.1	-169.7	-53.3	0	0	0	0	113
452	K	31	Very low	32.2	Very low	188 Å²	188	135.3 Å²	135.3	82%	0.817	75%	0.753	S	S	*	*			cis	92.8	83.2	10.2	-155.8	-163.3	175.6	-172.9	0	118.1
453	S	34.9	Very low	32	Very low	105 Å²	105	134.4 Å²	134.4	73%	0.734	75%	0.747	S	S	*	*			trans	-159.8	141	144.6	56.6	0	0	0	0	106.7
454	D	32	Very low	32	Very low	131 Å²	131	139.1 Å²	139.1	70%	0.701	75%	0.747	S	S	*	*				61.7	134.5	55.4	-61.3	-58.6	0	0	0	111.7
455	E	30.8	Very low	32	Very low	151 Å²	151	138.1 Å²	138.1	71%	0.706	74%	0.743	S	S	*	*			cis	-148.4	-163.5	18.7	-140.6	-172.8	129	0	0	115.1
456	K	31.9	Very low	32.7	Very low	180 Å²	180	137.7 Å²	137.7	78%	0.783	74%	0.742	S	S	*	*			trans	-86.9	166.6	-161.6	-41.1	121.6	-172.6	161.6	0	115.6
457	G	29.4	Very low	32.7	Very low	75 Å²	75	137.1 Å²	137.1	77%	0.773	74%	0.74	S	S	*	*			trans	143.3	136.1	144.9	0	0	0	0	0	115.8
458	N	31.4	Very low	33.6	Very low	124 Å²	124	135.9 Å²	135.9	66%	0.663	74%	0.74	S	S	*	*			cis	158.8	113.7	-38	169.2	78.3	0	0	0	108.2
459	Q	31.8	Very low	33.7	Very low	173 Å²	173	134 Å²	134	81%	0.808	73%	0.73	S	S	*	*			trans	64.6	155.5	170.1	-65.4	159.2	-14.1	0	0	115.6
460	S	32.6	Very low	33.6	Very low	94 Å²	94	136.1 Å²	136.1	66%	0.657	73%	0.731	S	S	*	*			cis	-157.6	-170.8	-21	52.5	0	0	0	0	107.2
461	E	32	Very low	33.8	Very low	155 Å²	155	138.3 Å²	138.3	72%	0.724	73%	0.734	S	S	*	*			cis	-162.7	-144.4	12.2	-146.8	154.7	-70.1	0	0	112.1
462	N	29.5	Very low	33.5	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	74%	0.736	S	S	*	*			trans	-36.8	160.1	165.8	-61.5	-35.9	0	0	0	116.6
463	S	31.7	Very low	33.5	Very low	92 Å²	92	138 Å²	138	64%	0.643	73%	0.732	S	S	*	*			cis	-163.2	-160	-3.7	42.8	0	0	0	0	107.9
464	E	30.8	Very low	33.1	Very low	180 Å²	180	136.6 Å²	136.6	84%	0.841	73%	0.734	S	S	*	*			cis	-160.6	-169.2	10.2	-149.6	143.3	108.7	0	0	110.7
465	D	33.8	Very low	33.1	Very low	131 Å²	131	138.2 Å²	138.2	70%	0.701	74%	0.743	S	S	*	*			trans	-121.8	152.3	177.1	-178.6	44.7	0	0	0	110.7
466	P	49	Very low	33.1	Very low	114 Å²	114	135.3 Å²	135.3	74%	0.74	75%	0.745	S	S	*	*				-154.9	150.2	107.1	38.8	-20.3	0	0	0	118.3
467	E	34.9	Very low	32.8	Very low	163 Å²	163	131.7 Å²	131.7	76%	0.762	74%	0.741	S	S	*	*			trans	-67.6	170.5	153.9	-72.2	-156.5	142.2	0	0	113.1
468	P	49.4	Very low	32.8	Very low	122 Å²	122	135 Å²	135	79%	0.792	74%	0.74	S	S	*	*				-152.6	127.8	101	35.1	-15.3	0	0	0	119.3
469	D	33.1	Very low	32.7	Very low	95 Å²	95	135.3 Å²	135.3	51%	0.508	74%	0.743	S	S	.	*				76.5	145.4	123.3	-151.7	9.1	0	0	0	123.5
470	R	31.6	Very low	32.5	Very low	199 Å²	199	134 Å²	134	75%	0.751	74%	0.741	S	S	*	*			trans	85.2	104.2	159.7	-75.4	153.2	-143.6	-152.8	6.7	124.5
471	K	32.6	Very low	32.7	Very low	186 Å²	186	136.4 Å²	136.4	81%	0.809	74%	0.744	S	S	*	*				38.7	139.3	106.9	-60.2	165.6	-177.4	159.9	0	117.9
472	K	30.2	Very low	32.7	Very low	187 Å²	187	135.5 Å²	135.5	81%	0.813	74%	0.744	S	S	*	*			cis	-176.3	148.8	42.1	-155.4	-167.5	178.3	-172.6	0	113.3
473	S	30	Very low	32.9	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	74%	0.739	S	S	*	*			trans	46.4	139.1	146.1	60.5	0	0	0	0	124.1
474	G	27.5	Very low	32.9	Very low	75 Å²	75	135 Å²	135	77%	0.773	74%	0.74	S	S	*	*			trans	167.1	135.9	150.6	0	0	0	0	0	115.4
475	N	30.9	Very low	33.1	Very low	165 Å²	165	133.1 Å²	133.1	88%	0.882	74%	0.736	S	S	*	*			trans	-116.1	142.3	174.9	-83.9	12.4	0	0	0	111.7
476	A	30	Very low	33.3	Very low	90 Å²	90	133 Å²	133	74%	0.744	74%	0.735	S	S	*	*			trans	60.8	141.7	140.4	0	0	0	0	0	124
477	C	26.8	Very low	32.5	Very low	104 Å²	104	130.8 Å²	130.8	70%	0.703	73%	0.733	S	S	*	*			trans	65.9	109.6	144.9	69.9	0	0	0	0	123.4
478	D	28.8	Very low	32.4	Very low	143 Å²	143	130.1 Å²	130.1	77%	0.765	73%	0.729	S	S	*	*				90.3	146.5	120.4	-57.2	-10.6	0	0	0	124.2
479	N	29.1	Very low	31.7	Very low	132 Å²	132	129.6 Å²	129.6	71%	0.706	73%	0.729	S	S	*	*			trans	70.6	146.2	169.8	-56	-35	0	0	0	116.9
480	D	28.8	Very low	31.9	Very low	146 Å²	146	129.6 Å²	129.6	78%	0.781	74%	0.736	S	S	*	*			cis	-123.5	157	19.9	-80.9	-52.4	0	0	0	112.4
481	M	35.2	Very low	32.1	Very low	144 Å²	144	125.6 Å²	125.6	71%	0.709	74%	0.738	S	S	*	*			cis	69	141.3	48.5	-66.3	-74.5	-175.4	0	0	113.8
482	N	33.8	Very low	32.3	Very low	136 Å²	136	124.1 Å²	124.1	73%	0.727	74%	0.74	S	S	*	*			cis	-162.2	-175.4	-22.1	-148.2	5.3	0	0	0	106.5
483	C	33.8	Very low	33.5	Very low	91 Å²	91	120.6 Å²	120.6	62%	0.615	74%	0.736	S	S	*	*			cis	-159.4	-147.8	4.3	-161.1	0	0	0	0	108.6
484	N	31.6	Very low	33.6	Very low	126 Å²	126	122.5 Å²	122.5	67%	0.674	74%	0.738	S	S	*	*			trans	75.3	129.5	164.3	-65.3	67.1	0	0	0	117.5
485	D	34.3	Very low	34.1	Very low	139 Å²	139	124.2 Å²	124.2	74%	0.743	74%	0.737	S	S	*	*			cis	-162	164.9	-7.6	-80.6	-40	0	0	0	106.7
486	D	37.7	Very low	34.4	Very low	129 Å²	129	126.8 Å²	126.8	69%	0.69	74%	0.735	S	S	*	*			cis	-165	172.5	-32.8	-178.9	22.4	0	0	0	105.9	H488	D486-H488 IonicContact OD2-CE1 3.26Å; D486-H488 PolarHBondContact OD2-CE1 2.87Å; D486-H488 IonicContact OD2-NE2 3.21Å
487	G	32.4	Very low	34.9	Very low	67 Å²	67	128.8 Å²	128.8	69%	0.691	73%	0.733	S	S	*	*			trans	162.8	33	174.6	0	0	0	0	0	121
488	H	33.3	Very low	35.4	Very low	150 Å²	150	129.8 Å²	129.8	69%	0.694	74%	0.741	S	S	*	*			trans	37.1	118.9	156.2	-55.5	-32.3	0	0	0	123.3	D486	D486-H488 IonicContact OD2-CE1 3.26Å; D486-H488 PolarHBondContact OD2-CE1 2.87Å; D486-H488 IonicContact OD2-NE2 3.21Å
489	S	34.5	Very low	35.7	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	75%	0.746	S	S	*	*				60.8	149.5	118.8	-55.4	0	0	0	0	123.4
490	S	37.2	Very low	36	Very low	95 Å²	95	131.3 Å²	131.3	66%	0.664	75%	0.749	S	S	*	*			cis	-176.4	144.4	-15.7	52.3	0	0	0	0	114
491	S	35.8	Very low	36.4	Very low	114 Å²	114	128 Å²	128	80%	0.797	74%	0.738	S	S	*	*			trans	65.6	150.9	144.9	58	0	0	0	0	124.5
492	N	37	Very low	36.3	Very low	156 Å²	156	130.3 Å²	130.3	83%	0.834	74%	0.744	S	S	*	*			trans	-77	-178.4	175.3	-57	-19.4	0	0	0	113.8
493	P	54.4	Low	36.3	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	75%	0.751	S	S	*	*				-153.4	157.8	101.3	39.8	-22	0	0	0	119.7
494	D	33.5	Very low	36.5	Very low	147 Å²	147	137.1 Å²	137.1	79%	0.786	76%	0.762	S	S	*	*			trans	59.9	117.8	136.6	-62.6	-21.5	0	0	0	128
495	S	37.6	Very low	36.6	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	77%	0.766	S	S	*	*				107.4	122.3	114.7	71.8	0	0	0	0	125.3
496	R	37.1	Very low	36.6	Very low	219 Å²	219	136.4 Å²	136.4	83%	0.826	77%	0.767	S	S	*	*			trans	65.7	117.6	134.9	-71.6	-167.4	155.2	133.7	-1.3	125.8
497	D	40.2	Very low	36.3	Very low	132 Å²	132	138.2 Å²	138.2	71%	0.706	77%	0.769	S	S	*	*				48.4	117.4	120	-39.9	-25	0	0	0	122.6
498	S	36.8	Very low	36.1	Very low	125 Å²	125	143.5 Å²	143.5	87%	0.874	78%	0.776	S	S	*	*				-179	162.8	129	26.5	0	0	0	0	113.3
499	D	36.1	Very low	36	Very low	161 Å²	161	143.3 Å²	143.3	86%	0.861	78%	0.78	S	S	*	*			trans	-100.7	168.5	-171.3	-66.7	-74.5	0	0	0	115.7
500	D	35.3	Very low	36.5	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	78%	0.776	S	S	*	*				109.8	132.1	128.2	-134.5	-9.4	0	0	0	122.5
501	S	37.1	Very low	36	Very low	78 Å²	78	147.4 Å²	147.4	55%	0.545	78%	0.783	S	S	.	*			trans	67.7	119.2	141.6	-80.9	0	0	0	0	126.2
502	F	33.6	Very low	35.7	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.842	79%	0.787	S	S	*	*			trans	52	131.2	138.7	-68.1	-75.1	0	0	0	123.6
503	E	32.9	Very low	35.3	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.864	79%	0.786	S	S	*	*				-153.9	160.5	124.6	-131.7	177	-141.6	0	0	112.4
504	H	38.7	Very low	34.1	Very low	184 Å²	184	147.3 Å²	147.3	85%	0.852	79%	0.794	S	S	*	*			trans	-149.4	132.7	178.1	-127.1	-66.6	0	0	0	108.3
505	S	32.1	Very low	33.9	Very low	109 Å²	109	148.7 Å²	148.7	76%	0.762	80%	0.802	S	S	*	*			trans	-154.4	173.8	170.7	58.1	0	0	0	0	112
506	D	36.3	Very low	33.5	Very low	141 Å²	141	146.5 Å²	146.5	75%	0.754	80%	0.797	S	S	*	*			trans	-124.4	157.7	-144.8	-96.6	-50.7	0	0	0	116.4
507	F	29.9	Very low	33.1	Very low	167 Å²	167	146.7 Å²	146.7	73%	0.732	80%	0.804	S	S	*	*			trans	72	126.5	146	-93.9	-116	0	0	0	123.9
508	E	28.5	Very low	32.6	Very low	179 Å²	179	144.5 Å²	144.5	84%	0.836	81%	0.812	S	S	*	*			trans	74.3	149.4	138.8	-81.7	-174.1	151.1	0	0	124.7
509	N	31.9	Very low	32.4	Very low	146 Å²	146	143.2 Å²	143.2	78%	0.781	81%	0.81	S	S	*	*			trans	-92.9	152.9	-170.7	-162.4	3.6	0	0	0	109.3
510	P	43.9	Very low	32	Very low	106 Å²	106	144.4 Å²	144.4	69%	0.688	82%	0.815	S	S	*	*				-156.9	161	89	39.5	-20	0	0	0	118.5
511	K	27.1	Very low	31.8	Very low	186 Å²	186	140.7 Å²	140.7	81%	0.809	81%	0.811	S	S	*	*			trans	70.1	104	144.6	-77.3	171.4	178.4	177.3	0	121.1
512	A	28.7	Very low	31.7	Very low	107 Å²	107	142 Å²	142	88%	0.884	83%	0.826	S	S	*	*				57.2	118.8	114.1	0	0	0	0	0	121.1
513	G	30.2	Very low	31.3	Very low	80 Å²	80	142 Å²	142	83%	0.825	83%	0.831	S	S	*	*			trans	-172.9	115.6	160	0	0	0	0	0	109.6
514	E	28.4	Very low	31	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	83%	0.83	S	S	*	*			trans	-94.8	134.2	-178.3	-66.1	171.4	103.4	0	0	111.2
515	D	29.2	Very low	30.4	Very low	176 Å²	176	140.7 Å²	140.7	94%	0.941	83%	0.829	S	S	*	*			trans	-176.6	144.9	131.8	-110	-33.4	0	0	0	110.4
516	G	28.4	Very low	30	Very low	65 Å²	65	141.9 Å²	141.9	67%	0.67	82%	0.821	S	S	*	*	S	Bend	trans	141	46.8	171.9	0	0	0	0	0	119.7
517	F	28.7	Very low	29.7	Very low	223 Å²	223	142.5 Å²	142.5	98%	0.978	83%	0.829	S	S	*	*	S	Bend	trans	47.1	95.7	159.9	-81.7	-93.7	0	0	0	118.9
518	G	30.2	Very low	29.5	Very low	85 Å²	85	140.4 Å²	140.4	88%	0.876	82%	0.822	S	S	*	*			trans	157	46.8	159.6	0	0	0	0	0	117.9
519	A	33.8	Very low	29.4	Very low	99 Å²	99	142.9 Å²	142.9	82%	0.818	82%	0.823	S	S	*	*			trans	-141.1	129	-176.4	0	0	0	0	0	114.8
520	L	26.9	Very low	29	Very low	186 Å²	186	146.6 Å²	146.6	97%	0.974	83%	0.828	S	S	*	*				-161.1	134.5	125.8	-100.2	-175.9	0	0	0	108.4
521	G	32	Very low	28.1	Very low	68 Å²	68	146.3 Å²	146.3	70%	0.701	82%	0.824	S	S	*	*			trans	-125.2	146.5	-176.4	0	0	0	0	0	113
522	A	34.8	Very low	27.9	Very low	104 Å²	104	146.7 Å²	146.7	86%	0.86	83%	0.829	S	S	*	*			trans	55.9	108.9	165.5	0	0	0	0	0	118.8
523	M	24.1	Very low	27.7	Very low	192 Å²	192	146.3 Å²	146.3	95%	0.946	82%	0.82	S	S	*	*			trans	-153.1	171.2	133.1	-117.7	-173.4	-169.3	0	0	112.8
524	Q	27.2	Very low	27.5	Very low	182 Å²	182	150.9 Å²	150.9	85%	0.85	82%	0.82	S	S	*	*			trans	-82.3	144.6	-169.6	-61.8	166.1	-37	0	0	112.9
525	I	26.8	Very low	27.5	Very low	161 Å²	161	146.7 Å²	146.7	83%	0.826	81%	0.812	S	S	*	*			trans	-126.3	115.9	160.6	-60.3	176.6	0	0	0	105
526	K	23	Very low	27.3	Very low	134 Å²	134	144.8 Å²	144.8	58%	0.583	80%	0.801	S	S	*	*			cis	70.4	67.3	30.1	-150.5	-163.3	-172.9	-158.5	0	113.5	E528	K526-E528 VanDerWaalsContact CE-CD 3.41Å; K526-E528 WeakPolarHBondContact CE-OE1 3.34Å; K526-E528 WeakPolarHBondContact CE-OE2 3.32Å; K526-E528 HydrophobicContact CG-CB 4.46Å; K526-E528 IonicContact NZ-OE1 3.62Å; K526-E528 PolarHBondContact NZ-OE1 3.02Å; K526-E528 IonicContact NZ-OE2 2.62Å; K526-E528 PolarHBondContact NZ-OE2 2.69Å; K526-E528 PolarHBondContact O-N 3.25Å
527	V	30.7	Very low	27.3	Very low	153 Å²	153	147 Å²	147	93%	0.927	80%	0.797	S	S	*	*			trans	-69.4	83.7	163.8	-177.2	0	0	0	0	108.6
528	E	24	Very low	27.2	Very low	124 Å²	124	146.4 Å²	146.4	58%	0.579	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.4	138.3	172	-160.1	156.3	-123.7	0	0	109	K526	K526-E528 VanDerWaalsContact CE-CD 3.41Å; K526-E528 WeakPolarHBondContact CE-OE1 3.34Å; K526-E528 WeakPolarHBondContact CE-OE2 3.32Å; K526-E528 HydrophobicContact CG-CB 4.46Å; K526-E528 IonicContact NZ-OE1 3.62Å; K526-E528 PolarHBondContact NZ-OE1 3.02Å; K526-E528 IonicContact NZ-OE2 2.62Å; K526-E528 PolarHBondContact NZ-OE2 2.69Å; K526-E528 PolarHBondContact O-N 3.25Å
529	R	27.3	Very low	27.1	Very low	231 Å²	231	148.9 Å²	148.9	87%	0.872	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73	137.6	175.1	-50.3	177.4	-156.1	177.9	5.9	107.8
530	Y	23.2	Very low	26.9	Very low	223 Å²	223	151.3 Å²	151.3	88%	0.875	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-97.6	151.3	156.2	-116.4	-94.2	0	0	0	111.2
531	V	24.5	Very low	26.9	Very low	100 Å²	100	149.6 Å²	149.6	61%	0.606	77%	0.767	S	S	*	*			trans	-120.8	136.8	-177.2	171	0	0	0	0	106.8
532	E	24	Very low	26.7	Very low	195 Å²	195	150.6 Å²	150.6	91%	0.911	76%	0.762	S	S	*	*			trans	-105.3	138.3	152.2	-72.9	-167.4	133.7	0	0	109.1
533	S	24.9	Very low	26.3	Very low	99 Å²	99	154 Å²	154	69%	0.692	76%	0.76	S	S	*	*			trans	-119.4	173.7	175.4	-55	0	0	0	0	106.7
534	E	26.4	Very low	26.7	Very low	176 Å²	176	150 Å²	150	82%	0.822	75%	0.752	S	S	*	*			cis	-149.4	-175.7	26.7	-62.3	-171.1	103.9	0	0	112.3
535	S	27.1	Very low	26.8	Very low	105 Å²	105	148.9 Å²	148.9	73%	0.734	75%	0.751	S	S	*	*			trans	66.8	138.5	153.3	53.1	0	0	0	0	118.9
536	D	26.2	Very low	26.8	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	75%	0.75	S	S	*	*			cis	-160.8	160	2.4	-102.4	7.3	0	0	0	108
537	L	26.9	Very low	27.2	Very low	112 Å²	112	145.6 Å²	145.6	59%	0.586	75%	0.753	S	S	*	*			cis	-165.1	142.1	-14.3	-105.7	170.2	0	0	0	109.4
538	R	28.1	Very low	27	Very low	209 Å²	209	145.6 Å²	145.6	79%	0.789	75%	0.748	S	S	*	*			trans	68.7	152.9	146.9	-65	-179.1	172.5	164.8	3.2	118.7
539	L	27.4	Very low	27.4	Very low	138 Å²	138	144.8 Å²	144.8	72%	0.723	76%	0.756	S	S	*	*			cis	-162.7	-178.1	-7.1	-110.1	168	0	0	0	108.9
540	Q	29	Very low	27.7	Very low	149 Å²	149	138 Å²	138	70%	0.696	75%	0.75	S	S	*	*				-164.5	145	-93.4	-172.6	-179.5	35	0	0	110.6
541	N	27.4	Very low	28.3	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	74%	0.742	S	S	*	*			trans	-179.4	122.3	146.9	-103.3	-5.5	0	0	0	107.1
542	C	28.4	Very low	28.6	Very low	88 Å²	88	136.5 Å²	136.5	60%	0.595	75%	0.745	S	S	*	*				72	137.6	55.7	-56.7	0	0	0	0	112
543	E	25.9	Very low	29	Very low	176 Å²	176	133.1 Å²	133.1	82%	0.822	74%	0.743	S	S	*	*			cis	-154.7	158	27.2	-160.7	165.8	-114.7	0	0	113.1
544	S	33.2	Very low	29.2	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	75%	0.753	S	S	*	*			trans	-155.7	118.4	173.8	59.6	0	0	0	0	111.5
545	L	27.6	Very low	29.5	Very low	158 Å²	158	133 Å²	133	83%	0.827	75%	0.748	S	S	*	*			trans	-146.4	140.8	179.8	-76.7	178.5	0	0	0	115.3
546	T	28.6	Very low	29.7	Very low	131 Å²	131	132.9 Å²	132.9	80%	0.804	75%	0.754	S	S	*	*			trans	-118.6	156.1	141.5	54.4	0	0	0	0	105.6
547	S	30	Very low	29.8	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	76%	0.76	S	S	*	*			cis	-156.1	-178.4	14.3	53.8	0	0	0	0	111.8
548	D	27.3	Very low	29.9	Very low	154 Å²	154	134.1 Å²	134.1	82%	0.824	78%	0.775	S	S	*	*			trans	70	135.7	151.1	-59.4	-46.5	0	0	0	124.8
549	S	31.4	Very low	30	Very low	107 Å²	107	129.3 Å²	129.3	75%	0.748	78%	0.779	S	S	*	*			trans	-159.8	121.1	150.6	59	0	0	0	0	106.5
550	A	34	Very low	30.1	Very low	89 Å²	89	126.6 Å²	126.6	74%	0.736	79%	0.785	S	S	*	*				64	135.1	66.5	0	0	0	0	0	112.5
551	K	36.2	Very low	30.2	Very low	166 Å²	166	123.8 Å²	123.8	72%	0.722	79%	0.787	S	S	*	*			cis	-167.5	169	2.6	-130.7	176	148.6	-102.7	0	112
552	D	31.7	Very low	30.3	Very low	125 Å²	125	125.6 Å²	125.6	67%	0.668	79%	0.791	S	S	*	*			trans	60.2	147	153.1	-52.2	-30	0	0	0	120.9
553	S	31.6	Very low	30.3	Very low	123 Å²	123	125.2 Å²	125.2	86%	0.86	79%	0.794	S	S	*	*			trans	-141.8	144.4	175.6	-66.6	0	0	0	0	109.7
554	D	29.6	Very low	30.5	Very low	168 Å²	168	121.9 Å²	121.9	90%	0.898	79%	0.79	S	S	*	*			trans	-159.8	161.9	160.7	-141.7	-23.3	0	0	0	113.7
555	S	32.5	Very low	30.4	Very low	104 Å²	104	121.3 Å²	121.3	73%	0.727	79%	0.786	S	S	*	*			trans	70.3	106.4	169.1	-158	0	0	0	0	120.7
556	A	31.5	Very low	30.6	Very low	104 Å²	104	122.6 Å²	122.6	86%	0.86	79%	0.785	S	S	*	*			trans	35.8	139.7	135.5	0	0	0	0	0	123.6
557	G	28.3	Very low	30.7	Very low	82 Å²	82	123.5 Å²	123.5	85%	0.845	78%	0.78	S	S	*	*			trans	165.8	132.5	159.3	0	0	0	0	0	115.1
558	E	29.2	Very low	30.8	Very low	192 Å²	192	124.7 Å²	124.7	90%	0.897	78%	0.775	S	S	*	*			trans	-80	159.2	-177.9	-60.1	178	102.1	0	0	114.9
559	A	30	Very low	31	Very low	107 Å²	107	125.3 Å²	125.3	88%	0.884	77%	0.77	S	S	*	*			trans	47.6	140.6	142.9	0	0	0	0	0	122
560	G	28.8	Very low	31.1	Very low	81 Å²	81	130.4 Å²	130.4	84%	0.835	77%	0.773	S	S	*	*			trans	168.2	107.3	164.3	0	0	0	0	0	117.6
561	A	30.9	Very low	31	Very low	91 Å²	91	135.7 Å²	135.7	75%	0.752	78%	0.779	S	S	*	*			trans	-61.1	160.2	179.6	0	0	0	0	0	118.2
562	Q	29.3	Very low	30.8	Very low	188 Å²	188	137.3 Å²	137.3	88%	0.879	79%	0.787	S	S	*	*			trans	69.9	122.1	138.8	-80.3	-178.1	11.2	0	0	123.7
563	A	29.7	Very low	30.7	Very low	81 Å²	81	143 Å²	143	67%	0.669	80%	0.799	S	S	*	*				73.5	119.4	119.6	0	0	0	0	0	123.7
564	S	28.7	Very low	30.8	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	80%	0.797	S	S	*	*				93.4	112.9	125.1	80.1	0	0	0	0	122.9
565	S	31.3	Very low	31	Very low	96 Å²	96	147.3 Å²	147.3	67%	0.671	79%	0.788	S	S	*	*				86.8	141.3	126.2	90.6	0	0	0	0	122.8
566	K	32.4	Very low	30.9	Very low	185 Å²	185	152.5 Å²	152.5	80%	0.804	79%	0.792	S	S	*	*			trans	66.7	120	139.6	-74	168.8	-179.7	171.2	0	121.5
567	H	30.1	Very low	30.9	Very low	150 Å²	150	156.5 Å²	156.5	69%	0.694	79%	0.792	S	S	*	*				103.9	117.3	119.3	-100.8	28.8	0	0	0	122.7
568	Q	33	Very low	30.9	Very low	120 Å²	120	162.5 Å²	162.5	56%	0.561	80%	0.795	S	S	*	*				85.2	137.8	124.8	-85.7	-172.8	19.6	0	0	123.4
569	K	32	Very low	30.8	Very low	167 Å²	167	157 Å²	157	73%	0.726	79%	0.79	S	S	*	*			trans	75.4	161.8	142.2	-75.7	165.6	178.4	153.1	0	118.1
570	R	32	Very low	30.8	Very low	213 Å²	213	155.7 Å²	155.7	80%	0.804	79%	0.787	S	S	*	*			cis	165.9	114.6	-34.8	162.1	-177.2	155.5	-175	-6.5	109.3
571	K	31.7	Very low	30.8	Very low	200 Å²	200	157.6 Å²	157.6	87%	0.87	79%	0.787	S	S	*	*			trans	164.8	137.1	153.5	-89	146.5	-173.4	178.8	0	106.7
572	K	32.4	Very low	30.7	Very low	200 Å²	200	157.8 Å²	157.8	87%	0.87	79%	0.789	S	S	*	*			cis	84.4	89.9	12.8	-162.6	-178.9	-177.1	173.4	0	116.9
573	R	29.2	Very low	30.8	Very low	244 Å²	244	153.4 Å²	153.4	92%	0.921	78%	0.779	S	S	*	*			trans	-168.7	172.8	143.4	-105.6	163.1	78.9	160.2	2.3	111.5
574	R	34.6	Very low	30.8	Very low	219 Å²	219	159.7 Å²	159.7	83%	0.826	79%	0.786	S	S	*	*				-172.9	137.6	-71.1	-151.9	-169.5	178.2	-179.9	-1	111
575	K	33.1	Very low	30.7	Very low	163 Å²	163	165.4 Å²	165.4	71%	0.709	79%	0.791	S	S	*	*			trans	85.9	146.8	140.9	-145.4	-169.7	176.8	-175.2	0	121.3
576	R	29.9	Very low	30.4	Very low	214 Å²	214	171.1 Å²	171.1	81%	0.808	80%	0.798	S	S	*	*			trans	82.4	126.5	165.2	-51.3	-167.7	109.5	162.1	2.9	114.9
577	Q	32	Very low	30	Very low	187 Å²	187	168.7 Å²	168.7	87%	0.874	79%	0.793	S	S	*	*			cis	80.2	103.1	7.8	-156.7	-166.4	22.9	0	0	118
578	K	29.3	Very low	29.7	Very low	209 Å²	209	166.3 Å²	166.3	91%	0.909	79%	0.793	S	S	*	*			trans	-168.6	144.4	156.6	-163.2	-176.4	-177.9	-167.9	0	107.4
579	G	26.5	Very low	29.4	Very low	75 Å²	75	165.7 Å²	165.7	77%	0.773	80%	0.802	S	S	*	*			cis	150.3	100.7	-17.9	0	0	0	0	0	114.7
580	G	29.3	Very low	29.2	Very low	80 Å²	80	162.2 Å²	162.2	83%	0.825	80%	0.804	S	S	*	*			trans	104.3	156	169.7	0	0	0	0	0	115.6
581	S	29.2	Very low	29.1	Very low	121 Å²	121	157.5 Å²	157.5	85%	0.846	80%	0.804	S	S	*	*			cis	-167.1	160.5	-7.1	-161.8	0	0	0	0	112.8
582	A	29.7	Very low	29	Very low	96 Å²	96	153.3 Å²	153.3	79%	0.793	80%	0.8	S	S	*	*			trans	65.7	155.9	158.9	0	0	0	0	0	119.8
583	S	29.8	Very low	29.8	Very low	96 Å²	96	150.1 Å²	150.1	67%	0.671	80%	0.8	S	S	*	*			cis	-169.9	144.9	-24.9	-176	0	0	0	0	112.7
584	R	29.8	Very low	29.8	Very low	213 Å²	213	142 Å²	142	80%	0.804	79%	0.793	S	S	*	*			trans	53.3	116.6	154.3	-72.8	173.7	-168.3	-168.8	4.7	123.2
585	R	26.8	Very low	29.5	Very low	226 Å²	226	135.2 Å²	135.2	85%	0.853	79%	0.79	S	S	*	*				61.3	133.7	120.2	-64.6	-177.4	177.7	-179.6	-1.3	122.7
586	R	24.8	Very low	29.7	Very low	216 Å²	216	136 Å²	136	82%	0.815	80%	0.801	S	S	*	*			trans	92.7	121.2	138.2	-94.7	-164.9	167.4	-159	-2	120.8
587	L	24.6	Very low	29.8	Very low	133 Å²	133	133.5 Å²	133.5	70%	0.696	80%	0.804	S	S	*	*			trans	80.9	141	138.8	-65.7	171.4	0	0	0	121.6
588	S	23.9	Very low	29.9	Very low	101 Å²	101	129 Å²	129	71%	0.706	80%	0.799	S	S	*	*			trans	63.6	113.3	145.4	53.7	0	0	0	0	121.9
589	S	26.1	Very low	29.9	Very low	106 Å²	106	122.2 Å²	122.2	74%	0.741	79%	0.788	S	S	*	*				64.1	105.5	129.4	64.3	0	0	0	0	122.3
590	A	28.9	Very low	30.3	Very low	94 Å²	94	127.1 Å²	127.1	78%	0.777	80%	0.795	S	S	*	*				84	160.1	111.5	0	0	0	0	0	122.3
591	S	29.1	Very low	30.4	Very low	114 Å²	114	129.9 Å²	129.9	80%	0.797	80%	0.796	S	S	*	*			trans	70.9	132.8	161	71.7	0	0	0	0	122.1
592	S	30.8	Very low	30.5	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	80%	0.797	S	S	*	*			trans	142	151.3	142.2	-66.2	0	0	0	0	111.9
593	P	47.4	Very low	31	Very low	132 Å²	132	133.5 Å²	133.5	86%	0.857	79%	0.793	S	S	*	*			cis	-116.5	-173.7	-21.6	37.4	-21.4	0	0	0	111.2
594	G	30.1	Very low	31.5	Very low	75 Å²	75	134.8 Å²	134.8	77%	0.773	80%	0.798	S	S	*	*			cis	150.9	133.7	-10.8	0	0	0	0	0	113.1
595	G	29.2	Very low	31.5	Very low	75 Å²	75	135.3 Å²	135.3	77%	0.773	80%	0.801	S	S	*	*			trans	83.3	146.2	177.8	0	0	0	0	0	114.9
596	L	35.7	Very low	31.7	Very low	180 Å²	180	131.6 Å²	131.6	94%	0.942	80%	0.797	S	S	*	*			cis	-141.5	169.5	7.7	-70.6	170	0	0	0	112.1
597	D	32.1	Very low	31.8	Very low	161 Å²	161	129.2 Å²	129.2	86%	0.861	80%	0.799	S	S	*	*			trans	-68.7	167	174.9	-105.7	-41.7	0	0	0	113.9
598	A	34.6	Very low	31.9	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	80%	0.803	S	S	*	*			cis	-157.3	163.8	-3	0	0	0	0	0	108.6
599	G	30.3	Very low	32.5	Very low	65 Å²	65	129 Å²	129	67%	0.67	81%	0.809	S	S	*	*			cis	169.7	156.5	-7.5	0	0	0	0	0	112.2
600	L	33.9	Very low	33.4	Very low	178 Å²	178	129.8 Å²	129.8	93%	0.932	81%	0.811	S	S	*	*			trans	60.1	131.7	168.4	-65.1	160	0	0	0	117.4
601	V	31	Very low	33.3	Very low	138 Å²	138	132.1 Å²	132.1	84%	0.836	81%	0.811	S	S	*	*			cis	-134.1	159.6	20.8	176.6	0	0	0	0	111.1
602	E	32.5	Very low	33.3	Very low	185 Å²	185	132.2 Å²	132.2	86%	0.864	81%	0.811	S	S	*	*			trans	-79.6	157.4	-165.6	-81	-172	108.7	0	0	118.7
603	P	39	Very low	33.2	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	81%	0.81	S	S	*	*			trans	-107	-173.9	170.1	43.3	-35.7	0	0	0	113.2
604	P	41	Very low	32.2	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	81%	0.807	S	S	*	*			trans	-132.2	136.3	147.2	36.1	-24.4	0	0	0	113.7
605	R	30.2	Very low	31.9	Very low	225 Å²	225	133.4 Å²	133.4	85%	0.849	81%	0.811	S	S	*	*			trans	-148.6	125.8	166.3	-87.4	-155.7	172.7	-146.5	-1.7	116.1
606	L	29.8	Very low	31.9	Very low	148 Å²	148	137.6 Å²	137.6	78%	0.775	81%	0.814	S	S	*	*			trans	70	159.4	136.6	-60.2	179.3	0	0	0	121.9
607	L	27.8	Very low	31.5	Very low	165 Å²	165	139 Å²	139	86%	0.864	81%	0.813	S	S	*	*			trans	-88.2	164	-173	-63.7	149.4	0	0	0	112.9
608	S	27.2	Very low	31.5	Very low	112 Å²	112	138.8 Å²	138.8	78%	0.783	81%	0.81	S	S	*	*				-172	126	124.7	39.8	0	0	0	0	115.7
609	S	35.8	Very low	31	Very low	118 Å²	118	142.7 Å²	142.7	83%	0.825	81%	0.81	S	S	*	*			trans	64	171.7	152	-92.8	0	0	0	0	119
610	P	44.2	Very low	30.9	Very low	122 Å²	122	144.1 Å²	144.1	79%	0.792	81%	0.806	S	S	*	*			cis	-131.6	-176	9.8	42.6	-25.5	0	0	0	117.5
611	N	28	Very low	30.6	Very low	143 Å²	143	143 Å²	143	77%	0.765	80%	0.795	S	S	*	*			trans	-54.8	153.8	179.1	-50.4	-43.5	0	0	0	116.8
612	S	29.7	Very low	30.4	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	79%	0.789	S	S	*	*				171.4	131.7	102	-73.4	0	0	0	0	117.6
613	A	26.8	Very low	30.1	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	78%	0.783	S	S	*	*			trans	73.4	143	138.9	0	0	0	0	0	124.4
614	S	26.4	Very low	29.9	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	79%	0.788	S	S	*	*			trans	73.8	152.2	156.4	79.2	0	0	0	0	118.8
615	V	24.9	Very low	29.7	Very low	139 Å²	139	141.8 Å²	141.8	84%	0.842	79%	0.785	S	S	*	*			cis	-155	158.8	-20.8	125.5	0	0	0	0	109.2
616	L	29.2	Very low	29.7	Very low	162 Å²	162	138.4 Å²	138.4	85%	0.848	78%	0.782	S	S	*	*			trans	-48.9	138.6	-177.7	-64	162.4	0	0	0	117.1
617	K	26.3	Very low	29.6	Very low	210 Å²	210	137.3 Å²	137.3	91%	0.913	78%	0.777	S	S	*	*			trans	-157.7	168.1	137.6	-125.5	174.6	-176.7	177.7	0	113.5
618	I	32.8	Very low	29.8	Very low	157 Å²	157	136.8 Å²	136.8	81%	0.805	77%	0.768	S	S	*	*			trans	-126.4	140.8	-164.3	-61.2	158.9	0	0	0	110.6
619	K	25.3	Very low	29.9	Very low	176 Å²	176	138.3 Å²	138.3	77%	0.765	77%	0.768	S	S	*	*			trans	178.3	134.1	139.2	-95.6	-174	75.4	172.3	0	108.1
620	T	27.4	Very low	29.9	Very low	95 Å²	95	137.8 Å²	137.8	58%	0.583	76%	0.755	S	S	*	*				48.3	133.3	86.6	87.6	0	0	0	0	113.5
621	E	27.7	Very low	29.4	Very low	153 Å²	153	138.2 Å²	138.2	72%	0.715	75%	0.751	S	S	*	*			cis	-170.8	172	19.4	-134.3	166.5	144.6	0	0	112.3
622	I	26.1	Very low	29.7	Very low	137 Å²	137	135.5 Å²	135.5	70%	0.703	74%	0.743	S	S	*	*			trans	74.5	125.1	143.6	-81.8	160.2	0	0	0	123
623	S	27.4	Very low	29.9	Very low	106 Å²	106	134.2 Å²	134.2	74%	0.741	73%	0.734	S	S	*	*			trans	64	127.8	145.8	72	0	0	0	0	125
624	E	34	Very low	30.2	Very low	176 Å²	176	135.6 Å²	135.6	82%	0.822	73%	0.728	S	S	*	*			trans	-67.7	-178.7	147	-48.4	175.5	141.7	0	0	111.6
625	P	37.6	Very low	30.3	Very low	110 Å²	110	141.7 Å²	141.7	71%	0.714	73%	0.733	S	S	*	*				-157.8	179.3	86.7	41.2	-20.5	0	0	0	117.5
626	I	30.1	Very low	30.6	Very low	154 Å²	154	142.2 Å²	142.2	79%	0.79	73%	0.731	S	S	*	*			trans	71	116.9	163.8	-46.5	176.7	0	0	0	116.1
627	N	28	Very low	30.8	Very low	125 Å²	125	145.3 Å²	145.3	67%	0.668	73%	0.733	S	S	*	*			cis	93.2	143.1	2.7	-148.4	6.6	0	0	0	119.4
628	F	30.8	Very low	31.5	Very low	154 Å²	154	140.9 Å²	140.9	68%	0.675	73%	0.726	S	S	*	*			trans	69.5	153.7	-179.3	-65.6	-78	0	0	0	117	N630	F628-N630 HydrophobicContact CD1-CB 4.24Å
629	D	30.3	Very low	32.6	Very low	145 Å²	145	138.5 Å²	138.5	78%	0.775	72%	0.721	S	S	*	*			cis	-102	152.4	9.4	-78.4	-57.7	0	0	0	114.4
630	N	35.3	Very low	33	Very low	107 Å²	107	137.1 Å²	137.1	57%	0.572	72%	0.722	S	S	*	*			cis	80.9	142.5	46.3	-140.4	39.4	0	0	0	112.9	F628	F628-N630 HydrophobicContact CD1-CB 4.24Å
631	D	33.5	Very low	33.1	Very low	130 Å²	130	143.8 Å²	143.8	70%	0.695	74%	0.736	S	S	*	*			cis	-140.9	177.9	1.9	-141.2	-37.3	0	0	0	106
632	S	33.3	Very low	33.3	Very low	86 Å²	86	144.3 Å²	144.3	60%	0.601	74%	0.739	S	S	*	*			cis	-157.3	146.4	7.5	96.3	0	0	0	0	109.4
633	S	34.3	Very low	33.6	Very low	90 Å²	90	145 Å²	145	63%	0.629	74%	0.742	S	S	*	*				83.2	143	79.1	101.3	0	0	0	0	113.4
634	I	33.8	Very low	33.7	Very low	119 Å²	119	144.4 Å²	144.4	61%	0.61	74%	0.738	S	S	*	*			cis	-141.8	142.1	17.9	-94.5	151.6	0	0	0	108.2
635	W	28.7	Very low	33.6	Very low	244 Å²	244	147 Å²	147	92%	0.924	74%	0.741	S	S	*	*				-156.4	152.4	90.9	-85.3	99.3	0	0	0	112.6
636	N	30.4	Very low	33.2	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	74%	0.737	S	S	*	*			trans	-128.9	160.5	-166.3	-92.8	-46.9	0	0	0	115.2
637	Y	33.9	Very low	33.1	Very low	226 Å²	226	148.4 Å²	148.4	89%	0.886	74%	0.738	S	S	*	*			trans	-87.1	164.1	169.4	-93.4	-92	0	0	0	113.3
638	P	40.8	Very low	33.4	Very low	117 Å²	117	147.7 Å²	147.7	76%	0.76	74%	0.743	S	S	*	*			trans	-138.6	174	131.7	24.3	-3.2	0	0	0	115.2
639	P	56.8	Low	34.4	Very low	107 Å²	107	144.9 Å²	144.9	70%	0.695	74%	0.74	S	S	*	*			trans	-136.8	-163.2	-152.1	42.5	-23.7	0	0	0	118.2
640	N	32.5	Very low	34.3	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	74%	0.744	S	S	*	*			trans	88.5	122.5	156.5	-63.5	-18	0	0	0	122.5
641	R	30.9	Very low	34	Very low	235 Å²	235	148.3 Å²	148.3	89%	0.887	75%	0.751	S	S	*	*				178.4	113	105.9	-103.2	-176.3	164	162.6	-1.6	116.9
642	E	31.8	Very low	33.9	Very low	164 Å²	164	149.9 Å²	149.9	77%	0.766	76%	0.756	S	S	*	*				40.1	149.5	124.1	-99.5	171.6	-169.6	0	0	126.8
643	I	30.7	Very low	33.7	Very low	151 Å²	151	152.7 Å²	152.7	77%	0.774	77%	0.77	S	S	*	*			trans	76.7	128.5	156.5	-65.1	159.1	0	0	0	116.1
644	S	29.7	Very low	33.4	Very low	94 Å²	94	157.8 Å²	157.8	66%	0.657	78%	0.781	S	S	*	*			cis	-165.4	161.6	-1	54.6	0	0	0	0	113.6
645	R	32.7	Very low	34.2	Very low	231 Å²	231	157.5 Å²	157.5	87%	0.872	79%	0.787	S	S	*	*			trans	46.2	140.5	146	-71.2	178.3	-178	160.3	0.5	119.6
646	N	28.3	Very low	34.7	Very low	119 Å²	119	151.9 Å²	151.9	64%	0.636	78%	0.782	S	S	*	*			cis	-159.8	146.8	33.9	-141.6	40.2	0	0	0	113.9
647	E	29.4	Very low	34.6	Very low	174 Å²	174	149.9 Å²	149.9	81%	0.813	78%	0.78	S	S	*	*			trans	37.4	157.5	146.9	-64.5	173.6	146.6	0	0	125.6
648	S	33.4	Very low	34.5	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	77%	0.771	S	S	*	*			trans	-144.3	-161.6	176.9	60.4	0	0	0	0	107.9
649	P	52.1	Low	33.9	Very low	94 Å²	94	147.2 Å²	147.2	61%	0.61	78%	0.776	S	S	*	*			cis	-142.7	-174.6	-6.7	44	-25.7	0	0	0	116.9
650	Y	28.7	Very low	32.5	Very low	223 Å²	223	151.1 Å²	151.1	88%	0.875	79%	0.785	S	S	*	*			trans	59.5	170.1	159.1	-69.3	-65.5	0	0	0	118.2
651	S	28.7	Very low	32.4	Very low	102 Å²	102	152.6 Å²	152.6	71%	0.713	78%	0.784	S	S	*	*			cis	-150.1	-170.3	4	-154.6	0	0	0	0	113.4
652	M	30.4	Very low	32.7	Very low	162 Å²	162	147.1 Å²	147.1	80%	0.798	78%	0.779	S	S	*	*			trans	-71	157.9	-177.1	-55.9	174.1	-77.1	0	0	116.7
653	T	29.3	Very low	32.5	Very low	146 Å²	146	144.2 Å²	144.2	90%	0.896	78%	0.777	S	S	*	*				-176.6	168.1	121.5	22.3	0	0	0	0	115.6
654	K	29	Very low	32.8	Very low	196 Å²	196	143 Å²	143	85%	0.852	78%	0.779	S	S	*	*			trans	-135.9	172	168.4	-75	-175	177.4	-178.1	0	107.8
655	P	50.8	Low	32.9	Very low	114 Å²	114	148 Å²	148	74%	0.74	79%	0.792	S	S	*	*			cis	-117.4	-156.4	-31.1	33	-12.2	0	0	0	109.9
656	P	38.7	Very low	32.7	Very low	126 Å²	126	140.6 Å²	140.6	82%	0.818	79%	0.788	S	S	*	*				-145	-158.6	93.8	40.9	-24.1	0	0	0	114.2
657	S	29	Very low	32.9	Very low	109 Å²	109	139 Å²	139	76%	0.762	80%	0.8	S	S	*	*			trans	-126.4	-174.4	-165.5	56.2	0	0	0	0	114
658	S	30.9	Very low	33	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	80%	0.804	S	S	*	*			trans	92.7	115.2	156	75.5	0	0	0	0	121.5
659	E	28.4	Very low	32.9	Very low	187 Å²	187	133.7 Å²	133.7	87%	0.874	81%	0.809	S	S	*	*				69.2	109	127.5	-63.7	-174.2	170.6	0	0	123.3
660	H	28.1	Very low	32	Very low	189 Å²	189	133.1 Å²	133.1	88%	0.875	82%	0.82	S	S	*	*				75.8	149.3	124.7	-131.1	59.6	0	0	0	122.4
661	F	28.9	Very low	32.1	Very low	178 Å²	178	126.8 Å²	126.8	78%	0.781	82%	0.822	S	S	*	*			trans	-70.5	157.4	179.1	-92.4	-89.5	0	0	0	112
662	P	37.1	Very low	32.3	Very low	120 Å²	120	125.8 Å²	125.8	78%	0.779	83%	0.828	S	S	*	*				-150.4	177.3	64.8	41.5	-20.6	0	0	0	120.1
663	S	27.5	Very low	32.4	Very low	103 Å²	103	122.2 Å²	122.2	72%	0.72	83%	0.833	S	S	*	*			trans	-29.5	152.9	173.7	-43.2	0	0	0	0	120.8
664	P	38.7	Very low	32.5	Very low	126 Å²	126	119.3 Å²	119.3	82%	0.818	83%	0.832	S	S	*	*			trans	-87.1	136.2	166.6	34.7	-32.4	0	0	0	113.9
665	Q	31	Very low	32.6	Very low	198 Å²	198	114.1 Å²	114.1	93%	0.925	83%	0.834	S	S	*	*			trans	-88.8	164.7	144.4	-72.4	177.9	-15.5	0	0	108.3
666	G	29.3	Very low	31.6	Very low	76 Å²	76	112 Å²	112	78%	0.784	83%	0.833	S	S	*	*			cis	146.7	121	-2.4	0	0	0	0	0	111.2
667	G	31.8	Very low	31.2	Very low	87 Å²	87	114.1 Å²	114.1	90%	0.897	84%	0.837	S	S	*	*			trans	97.9	147.3	-174.5	0	0	0	0	0	113
668	G	31.3	Very low	31.1	Very low	87 Å²	87	116.2 Å²	116.2	90%	0.897	83%	0.834	S	S	*	*			cis	155.5	147.5	-3.3	0	0	0	0	0	109.9
669	G	31.7	Very low	30.9	Very low	84 Å²	84	117.2 Å²	117.2	87%	0.866	84%	0.835	S	S	*	*			cis	-177.1	173	-5.3	0	0	0	0	0	110.2
670	G	31.8	Very low	30.8	Very low	82 Å²	82	111.9 Å²	111.9	85%	0.845	82%	0.824	S	S	*	*			trans	172.7	121.9	177.5	0	0	0	0	0	111.5
671	G	32.1	Very low	31	Very low	90 Å²	90	110.5 Å²	110.5	93%	0.928	82%	0.821	S	S	*	*			trans	-67.9	166.8	-165.9	0	0	0	0	0	115.9
672	G	33	Very low	31.2	Very low	81 Å²	81	107.8 Å²	107.8	84%	0.835	82%	0.821	S	S	*	*			cis	-160.6	167.8	-1.6	0	0	0	0	0	108.9
673	G	32.3	Very low	31	Very low	88 Å²	88	109.1 Å²	109.1	91%	0.907	82%	0.822	S	S	*	*			cis	111	126.4	26.4	0	0	0	0	0	108.6
674	G	32	Very low	31.3	Very low	85 Å²	85	109.8 Å²	109.8	88%	0.876	83%	0.827	S	S	*	*			cis	-178	175.9	-4.2	0	0	0	0	0	108.3
675	G	30.8	Very low	30.9	Very low	86 Å²	86	109.8 Å²	109.8	89%	0.887	82%	0.824	S	S	*	*			cis	174.3	163.2	-4.3	0	0	0	0	0	110.9
676	G	29.8	Very low	30.7	Very low	69 Å²	69	107 Å²	107	71%	0.711	82%	0.815	S	S	*	*			trans	117.3	128.8	179.7	0	0	0	0	0	112.6
677	L	30.2	Very low	30.8	Very low	172 Å²	172	109.5 Å²	109.5	90%	0.901	82%	0.815	S	S	*	*			cis	75.6	142.9	28.3	-53.1	172.9	0	0	0	115.3
678	H	26.6	Very low	32.1	Very low	153 Å²	153	110.8 Å²	110.8	71%	0.708	81%	0.807	S	S	*	*			cis	-174.1	112.5	-22.6	169.4	-94.5	0	0	0	111.3
679	V	26.6	Very low	32.7	Very low	120 Å²	120	113.1 Å²	113.1	73%	0.727	81%	0.807	S	S	*	*			trans	62	147	146.6	173.5	0	0	0	0	122
680	A	25.4	Very low	32.6	Very low	76 Å²	76	112.5 Å²	112.5	63%	0.628	80%	0.8	S	S	*	*			trans	94.2	122.4	154.2	0	0	0	0	0	122.3
681	I	32.3	Very low	32.6	Very low	160 Å²	160	113 Å²	113	82%	0.821	80%	0.796	S	S	*	*			trans	67.7	125.9	131.5	-64.1	172.6	0	0	0	116.4
682	P	34.3	Very low	32.4	Very low	121 Å²	121	116.7 Å²	116.7	79%	0.786	79%	0.794	S	S	*	*				-147.9	172.8	61.7	42.2	-23.3	0	0	0	119.3
683	D	32.5	Very low	32.2	Very low	147 Å²	147	116.1 Å²	116.1	79%	0.786	79%	0.789	S	S	*	*			trans	-71.8	176.7	160	-69.3	-72.8	0	0	0	113.2
684	S	33.6	Very low	32	Very low	118 Å²	118	117 Å²	117	83%	0.825	79%	0.787	S	S	*	*			trans	104	143.7	165.2	-51.9	0	0	0	0	116.4
685	V	30.5	Very low	31.8	Very low	125 Å²	125	117.9 Å²	117.9	76%	0.758	79%	0.786	S	S	*	*			cis	-167.3	153.7	-25.2	96	0	0	0	0	110.8
686	L	26.7	Very low	31.7	Very low	141 Å²	141	117.8 Å²	117.8	74%	0.738	78%	0.777	S	S	*	*			trans	52.7	108.8	157.4	-68	175	0	0	0	124.1
687	T	32.2	Very low	31.7	Very low	128 Å²	128	125.4 Å²	125.4	79%	0.785	78%	0.784	S	S	*	*				60.4	159.7	126.3	43.9	0	0	0	0	124.2
688	P	58.8	Low	31.5	Very low	114 Å²	114	125.2 Å²	125.2	74%	0.74	78%	0.776	S	S	*	*			trans	-108.2	171.9	-155.4	43.5	-37.8	0	0	0	116.7
689	P	44.4	Very low	31.5	Very low	136 Å²	136	122.5 Å²	122.5	88%	0.883	77%	0.771	S	S	*	*				-143.2	-178.3	100.3	39.6	-25.4	0	0	0	113.6
690	G	29.5	Very low	31.6	Very low	70 Å²	70	123.9 Å²	123.9	72%	0.722	77%	0.769	S	S	*	*			cis	154.1	145.5	-11.6	0	0	0	0	0	114.8
691	A	31.3	Very low	31.8	Very low	92 Å²	92	129.4 Å²	129.4	76%	0.76	78%	0.78	S	S	*	*			trans	70.8	152.9	168.8	0	0	0	0	0	121.5
692	D	28.3	Very low	31.5	Very low	168 Å²	168	124.7 Å²	124.7	90%	0.898	77%	0.77	S	S	*	*			trans	56.4	155.4	162.2	-57.3	-25.6	0	0	0	121.4
693	G	28	Very low	31.2	Very low	69 Å²	69	123.5 Å²	123.5	71%	0.711	77%	0.771	S	S	*	*			cis	171.9	121.9	-10.9	0	0	0	0	0	116.3
694	A	27.7	Very low	31	Very low	107 Å²	107	122.2 Å²	122.2	88%	0.884	77%	0.773	S	S	*	*			trans	67.2	163	151.8	0	0	0	0	0	123.4
695	A	28.3	Very low	30.7	Very low	103 Å²	103	120 Å²	120	85%	0.851	76%	0.762	S	S	*	*			trans	76.2	142.9	161.4	0	0	0	0	0	120.3
696	A	29.3	Very low	30.5	Very low	84 Å²	84	120.7 Å²	120.7	69%	0.694	77%	0.767	S	S	*	*			cis	-171.1	176.5	-17.6	0	0	0	0	0	111.4
697	R	28.3	Very low	30.6	Very low	229 Å²	229	118.1 Å²	118.1	86%	0.864	77%	0.766	S	S	*	*			trans	89.6	140.2	163.4	-57.7	178.6	174	178	-0.5	115.6
698	K	27.6	Very low	30.3	Very low	168 Å²	168	116.4 Å²	116.4	73%	0.73	76%	0.764	S	S	*	*			cis	-160.2	146.7	5.4	-133.6	-176.8	177.5	-170.7	0	114.3
699	T	26.5	Very low	28.9	Very low	97 Å²	97	119.2 Å²	119.2	60%	0.595	77%	0.772	S	S	*	*			trans	59.5	124.5	149	41.4	0	0	0	0	119.6
700	Q	28.6	Very low	28.1	Very low	149 Å²	149	117.2 Å²	117.2	70%	0.696	77%	0.767	S	S	*	*				64	140.8	73.5	-76.7	179.3	-25.3	0	0	113.7
701	F	28.4	Very low	28.7	Very low	192 Å²	192	119.3 Å²	119.3	84%	0.842	77%	0.768	S	S	*	*			cis	-142.4	175.5	1	-96.5	-71.5	0	0	0	107.1
702	G	27.6	Very low	28.5	Very low	60 Å²	60	121.6 Å²	121.6	62%	0.619	77%	0.772	S	S	*	*			cis	147.4	162.9	1.7	0	0	0	0	0	111.6
703	A	27.7	Very low	28.5	Very low	97 Å²	97	118.1 Å²	118.1	80%	0.802	77%	0.766	S	S	*	*			trans	68	136	179.2	0	0	0	0	0	116.2
704	S	27.1	Very low	28.7	Very low	119 Å²	119	120.5 Å²	120.5	83%	0.832	77%	0.772	S	S	*	*			cis	83.1	140.9	42.4	-74.1	0	0	0	0	114
705	A	28.5	Very low	28.8	Very low	71 Å²	71	122.5 Å²	122.5	59%	0.587	77%	0.768	S	S	*	*			cis	-169	-178.5	-9.5	0	0	0	0	0	110.3
706	T	26.7	Very low	29.8	Very low	141 Å²	141	122.4 Å²	122.4	87%	0.865	76%	0.759	S	S	*	*			trans	66.5	152.9	154.1	46.1	0	0	0	0	118.6
707	A	28	Very low	29.9	Very low	87 Å²	87	125.7 Å²	125.7	72%	0.719	76%	0.764	S	S	*	*			cis	-164	150.9	-14.4	0	0	0	0	0	113.4
708	A	26.8	Very low	30.3	Very low	91 Å²	91	120 Å²	120	75%	0.752	76%	0.759	S	S	*	*			trans	70.2	168	136.9	0	0	0	0	0	122.9
709	L	28	Very low	31.7	Very low	174 Å²	174	117.9 Å²	117.9	91%	0.911	76%	0.763	S	S	*	*			trans	87.2	128.2	167.8	-54.1	179.3	0	0	0	118.6
710	A	27	Very low	33.2	Very low	93 Å²	93	118.1 Å²	118.1	77%	0.769	77%	0.766	S	S	*	*			trans	-98.7	-168.8	166.2	0	0	0	0	0	108.4
711	P	42.6	Very low	33.7	Very low	114 Å²	114	118.8 Å²	118.8	74%	0.74	77%	0.773	S	S	*	*			cis	-146.3	163.4	33.1	42	-20.7	0	0	0	119.8
712	V	26.9	Very low	34.2	Very low	141 Å²	141	115.1 Å²	115.1	86%	0.855	77%	0.772	S	S	*	*			trans	43.1	112	137.5	-177.1	0	0	0	0	121.7
713	A	29.1	Very low	34.6	Very low	94 Å²	94	117.1 Å²	117.1	78%	0.777	78%	0.783	S	S	*	*			trans	-167.2	152.7	138.2	0	0	0	0	0	108.8
714	S	31.4	Very low	34.9	Very low	119 Å²	119	117.9 Å²	117.9	83%	0.832	78%	0.782	S	S	*	*			cis	-162.8	161.4	-19.1	51.1	0	0	0	0	110.2
715	D	29.5	Very low	36.1	Very low	149 Å²	149	118.6 Å²	118.6	80%	0.797	78%	0.784	S	S	*	*			trans	-99.9	177.7	-177.8	-114.4	-34.2	0	0	0	112.7
716	P	50.5	Low	36.5	Very low	101 Å²	101	125.3 Å²	125.3	66%	0.656	79%	0.794	S	S	*	*			cis	-139.9	166.8	-13.6	34.8	-13.8	0	0	0	117.9
717	L	31.5	Very low	37.2	Very low	153 Å²	153	123.7 Å²	123.7	80%	0.801	78%	0.78	S	S	*	*			trans	39.1	114	141.3	-57.8	169.6	0	0	0	125
718	S	37.4	Very low	37.2	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	79%	0.79	S	S	*	*				61.6	171.9	129.8	-58.4	0	0	0	0	123.2
719	P	56.9	Low	37.5	Very low	123 Å²	123	134.2 Å²	134.2	80%	0.799	80%	0.795	S	S	*	*			cis	-119	-76	-32.2	23.5	-8.4	0	0	0	124.4
720	P	57.5	Low	38.9	Very low	103 Å²	103	131.5 Å²	131.5	67%	0.669	79%	0.787	S	S	*	*				-137.6	160.2	-127.1	40.9	-22.2	0	0	0	123.7
721	L	38.7	Very low	39.3	Very low	162 Å²	162	130.4 Å²	130.4	85%	0.848	79%	0.786	S	S	*	*			trans	66.5	132.8	141	-71.4	173.9	0	0	0	127.2
722	S	39.4	Very low	38.9	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	80%	0.795	S	S	*	*			trans	101.4	151.3	133.3	77.3	0	0	0	0	125.5
723	A	35.2	Very low	39.1	Very low	102 Å²	102	130.1 Å²	130.1	84%	0.843	79%	0.79	S	S	*	*			trans	97.6	156.2	151.4	0	0	0	0	0	124
724	S	33.9	Very low	39.2	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	79%	0.794	S	S	*	*			trans	-107.3	-176	-170.1	-44.4	0	0	0	0	114.8
725	P	52.2	Low	39.2	Very low	134 Å²	134	128 Å²	128	87%	0.87	80%	0.797	S	S	*	*				-156.3	-141.2	94.9	42.3	-19.8	0	0	0	117.8
726	R	36.9	Very low	39.3	Very low	212 Å²	212	125.2 Å²	125.2	80%	0.8	80%	0.803	S	S	*	*			trans	-139.7	165.1	-145.4	-96.3	176.4	74.3	157.5	3.3	119.3
727	D	40.9	Very low	38.4	Very low	106 Å²	106	124.1 Å²	124.1	57%	0.567	81%	0.811	S	S	*	*			trans	45.2	136.5	147.9	-53.2	-6.2	0	0	0	125.1
728	K	29.6	Very low	38.5	Very low	216 Å²	216	121.2 Å²	121.2	94%	0.939	82%	0.817	S	S	*	*				176.2	168.6	110	-97.2	176.7	178.5	178.9	0	117.7
729	H	32.7	Very low	38.1	Very low	184 Å²	184	120 Å²	120	85%	0.852	82%	0.822	S	S	*	*			trans	-112.2	-169	-175.8	-124	-26.1	0	0	0	110.4
730	P	57.8	Low	37	Very low	116 Å²	116	118.1 Å²	118.1	75%	0.753	83%	0.825	S	S	*	*			cis	-136.3	-169.1	-30.8	40.9	-23.4	0	0	0	113.8
731	G	33.9	Very low	35.6	Very low	71 Å²	71	117.2 Å²	117.2	73%	0.732	84%	0.835	S	S	*	*			trans	144	98.6	141.9	0	0	0	0	0	124
732	N	34.5	Very low	35.3	Very low	174 Å²	174	113.3 Å²	113.3	93%	0.93	83%	0.834	S	S	*	*				66.5	134	126.6	-159.7	55.3	0	0	0	126.5
733	G	31.7	Very low	35	Very low	74 Å²	74	113 Å²	113	76%	0.763	84%	0.838	S	S	*	*			trans	88.4	151.3	151.4	0	0	0	0	0	119
734	G	31.3	Very low	34.8	Very low	82 Å²	82	112.2 Å²	112.2	85%	0.845	84%	0.84	S	S	*	*			cis	160.4	131.9	-11.2	0	0	0	0	0	114.4
735	G	32.1	Very low	34.6	Very low	88 Å²	88	110.7 Å²	110.7	91%	0.907	84%	0.842	S	S	*	*			trans	82.6	156.4	-179.8	0	0	0	0	0	114.6
736	G	31.3	Very low	33.5	Very low	89 Å²	89	108.6 Å²	108.6	92%	0.918	84%	0.844	S	S	*	*			cis	112.2	130	9.4	0	0	0	0	0	111.4
737	G	30.9	Very low	33.2	Very low	79 Å²	79	102.1 Å²	102.1	81%	0.814	84%	0.844	S	S	*	*			cis	178.4	166.2	-5.6	0	0	0	0	0	111.1
738	G	32.9	Very low	33.1	Very low	91 Å²	91	103.4 Å²	103.4	94%	0.938	86%	0.858	S	S	*	*			trans	79.9	167.2	179.4	0	0	0	0	0	115.5
739	G	29.7	Very low	33	Very low	85 Å²	85	99 Å²	99	88%	0.876	85%	0.854	S	S	*	*			cis	156.5	75.9	-6.2	0	0	0	0	0	115
740	G	33	Very low	33	Very low	84 Å²	84	94 Å²	94	87%	0.866	84%	0.844	S	S	*	*			trans	128.8	159.5	173.6	0	0	0	0	0	114.2
741	G	29.6	Very low	31.6	Very low	84 Å²	84	93.6 Å²	93.6	87%	0.866	85%	0.845	S	S	*	*			cis	168.8	80.7	-5.2	0	0	0	0	0	115.4
742	G	31.6	Very low	31.3	Very low	80 Å²	80	98 Å²	98	83%	0.825	85%	0.851	S	S	*	*			trans	86.4	164.8	168.5	0	0	0	0	0	116.5
743	A	34.3	Very low	30.9	Very low	110 Å²	110	95.2 Å²	95.2	91%	0.909	85%	0.846	S	S	*	*			cis	-162	153.9	-11.3	0	0	0	0	0	112.2
744	G	29.9	Very low	31.1	Very low	85 Å²	85	99.2 Å²	99.2	88%	0.876	85%	0.849	S	S	*	*			trans	97.1	128.2	165	0	0	0	0	0	115.9
745	G	29.4	Very low	31.1	Very low	81 Å²	81	102.6 Å²	102.6	84%	0.835	85%	0.847	S	S	*	*			cis	170.7	172.6	-8	0	0	0	0	0	113.7
746	G	28.9	Very low	31	Very low	89 Å²	89	107.1 Å²	107.1	92%	0.918	84%	0.838	S	S	*	*			trans	96.2	117.6	167.7	0	0	0	0	0	116.2
747	G	31	Very low	31	Very low	76 Å²	76	109.6 Å²	109.6	78%	0.784	84%	0.835	S	S	*	*			trans	146.7	113.2	173	0	0	0	0	0	113.1
748	P	39.3	Very low	31.4	Very low	133 Å²	133	108 Å²	108	86%	0.864	82%	0.818	S	S	*	*			trans	-89.5	150.4	-174.5	34.2	-34.9	0	0	0	114.8
749	S	28.2	Very low	31.5	Very low	123 Å²	123	108.8 Å²	108.8	86%	0.86	80%	0.801	S	S	*	*			trans	-74.3	166.2	158.7	-145.2	0	0	0	0	109.8
750	A	32	Very low	31.8	Very low	79 Å²	79	111.9 Å²	111.9	65%	0.653	80%	0.797	S	S	*	*			cis	-148.3	-174.9	9.2	0	0	0	0	0	107.7
751	S	28.7	Very low	31.9	Very low	109 Å²	109	113.2 Å²	113.2	76%	0.762	78%	0.781	S	S	*	*			cis	-161.3	158.9	25.5	-46.1	0	0	0	0	112.8
752	N	28.2	Very low	32.2	Very low	162 Å²	162	111.9 Å²	111.9	87%	0.866	76%	0.761	S	S	*	*			trans	2.1	132.5	153.9	-54.5	-14.4	0	0	0	120.8
753	S	25.8	Very low	32.3	Very low	117 Å²	117	111.5 Å²	111.5	82%	0.818	74%	0.74	S	S	*	*				-151.3	138.7	108	-166	0	0	0	0	111.8
754	L	35.3	Very low	32.4	Very low	157 Å²	157	113.4 Å²	113.4	82%	0.822	73%	0.73	S	S	*	*			trans	-76	156.2	159.7	-73.9	151.3	0	0	0	109.7
755	L	30.8	Very low	32.6	Very low	154 Å²	154	116.7 Å²	116.7	81%	0.806	72%	0.716	S	S	*	*				163.1	155.5	126.4	-87.2	167	0	0	0	112.3
756	Y	30.7	Very low	32.9	Very low	183 Å²	183	119 Å²	119	72%	0.718	71%	0.709	S	S	*	*			trans	57.8	80.5	169.4	-77.8	-77.3	0	0	0	119.4	D759	Y756-D759 WeakPolarHBondContact CE1-OD2 3.48Å
757	T	31.9	Very low	33.1	Very low	140 Å²	140	123.5 Å²	123.5	86%	0.859	71%	0.706	S	S	*	*			trans	-131.6	22.9	157.2	57	0	0	0	0	113.5
758	G	38.1	Very low	33.3	Very low	45 Å²	45	123 Å²	123	46%	0.464	70%	0.695	S	S	.	*	S	Bend	trans	-92.4	-49.5	-180	0	0	0	0	0	114.8	L760 E761	G758-L760 VanDerWaalsContact C-N 3.28Å; G758-L760 PolarHBondContact O-N 2.62Å; G758-L760 VanDerWaalsContact O-N 3.16Å; G758-E761 PolarHBondContact O-N 3.46Å
759	D	35.8	Very low	33.1	Very low	108 Å²	108	120 Å²	120	58%	0.578	69%	0.688	S	S	*	*	H	α-helix	trans	-69	-21.6	-161.9	-57.7	0.4	0	0	0	114.8	Y756 A762 L763	Y756-D759 WeakPolarHBondContact CE1-OD2 3.48Å; D759-A762 PolarHBondContact O-N 3.18Å; D759-L763 PolarHBondContact O-N 3.47Å
760	L	35	Very low	33.5	Very low	150 Å²	150	121 Å²	121	79%	0.785	68%	0.683	S	S	*	*	H	α-helix	trans	-72.5	-38	-179.2	-143.1	76.4	0	0	0	112	G758 A762 L763 Q764	G758-L760 VanDerWaalsContact C-N 3.28Å; G758-L760 PolarHBondContact O-N 2.62Å; G758-L760 VanDerWaalsContact O-N 3.16Å; L760-A762 VanDerWaalsContact C-N 3.32Å; L760-L763 PolarHBondContact O-N 3.43Å; L760-Q764 PolarHBondContact O-N 3.35Å
761	E	34.6	Very low	33.4	Very low	113 Å²	113	123.3 Å²	123.3	53%	0.528	69%	0.689	S	S	.	*	H	α-helix	trans	-73.7	-23.5	176.6	-107.3	-156.3	96.4	0	0	112.8	G758 R765	G758-E761 PolarHBondContact O-N 3.46Å; E761-R765 PolarHBondContact O-NH1 3.14Å; E761-R765 IonicContact OE1-CZ 3.4Å; E761-R765 IonicContact OE1-NH1 3.52Å; E761-R765 PolarHBondContact OE1-NH1 3.08Å; E761-R765 IonicContact OE1-NH2 2.67Å; E761-R765 PolarHBondContact OE1-NH2 3.49Å
762	A	36.1	Very low	33.3	Very low	55 Å²	55	124.4 Å²	124.4	46%	0.455	69%	0.691	S	S	.	*	H	α-helix	trans	-72.9	-43	172.8	0	0	0	0	0	111.5	D759 L760 Q764 R765 L766	D759-A762 PolarHBondContact O-N 3.18Å; L760-A762 VanDerWaalsContact C-N 3.32Å; A762-Q764 VanDerWaalsContact C-N 3.34Å; A762-Q764 PolarHBondContact O-N 3.21Å; A762-R765 PolarHBondContact O-N 3.24Å; A762-L766 PolarHBondContact O-N 2.96Å
763	L	34.4	Very low	33.2	Very low	73 Å²	73	123.8 Å²	123.8	38%	0.382	69%	0.687	S	S	.	*	H	α-helix	trans	-64.6	-38	-179.3	-136.1	76.7	0	0	0	112.4	D759 L760 R765 L766	D759-L763 PolarHBondContact O-N 3.47Å; L760-L763 PolarHBondContact O-N 3.43Å; L763-R765 VanDerWaalsContact C-N 3.3Å; L763-R765 PolarHBondContact O-N 3.35Å; L763-L766 PolarHBondContact O-N 2.91Å
764	Q	35.8	Very low	33.3	Very low	150 Å²	150	123.2 Å²	123.2	70%	0.701	68%	0.68	S	S	*	*	H	α-helix	trans	-72.4	-22.3	179.4	-160.4	166.6	10.8	0	0	113.1	L760 A762	L760-Q764 PolarHBondContact O-N 3.35Å; A762-Q764 VanDerWaalsContact C-N 3.34Å; A762-Q764 PolarHBondContact O-N 3.21Å
765	R	35.7	Very low	32.9	Very low	153 Å²	153	123.5 Å²	123.5	58%	0.577	68%	0.682	S	S	*	*	H	α-helix	trans	-78.2	-23.7	170.7	-74.3	178.4	178.2	77	-5.2	113.2	E761 A762 L763 Q767 A768	E761-R765 PolarHBondContact O-NH1 3.14Å; E761-R765 IonicContact OE1-CZ 3.4Å; E761-R765 IonicContact OE1-NH1 3.52Å; E761-R765 PolarHBondContact OE1-NH1 3.08Å; E761-R765 IonicContact OE1-NH2 2.67Å; E761-R765 PolarHBondContact OE1-NH2 3.49Å; A762-R765 PolarHBondContact O-N 3.24Å; L763-R765 VanDerWaalsContact C-N 3.3Å; L763-R765 PolarHBondContact O-N 3.35Å; R765-Q767 VanDerWaalsContact C-N 3.33Å; R765-Q767 PolarHBondContact O-N 3.39Å; R765-A768 CarbonylContact O-C 3.54Å; R765-A768 PolarHBondContact O-N 3.4Å
766	L	35.2	Very low	32.7	Very low	131 Å²	131	122.2 Å²	122.2	69%	0.686	68%	0.68	S	S	*	*	H	α-helix	trans	-74.1	-18.2	178.3	-92.8	162.1	0	0	0	114.5	A762 L763	A762-L766 PolarHBondContact O-N 2.96Å; L763-L766 PolarHBondContact O-N 2.91Å
767	Q	33.4	Very low	32.5	Very low	182 Å²	182	120.7 Å²	120.7	85%	0.85	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-12.2	171.4	-67.6	-170.2	-75.8	0	0	113.5	R765	R765-Q767 VanDerWaalsContact C-N 3.33Å; R765-Q767 PolarHBondContact O-N 3.39Å
768	A	34.2	Very low	32.2	Very low	67 Å²	67	124.1 Å²	124.1	55%	0.554	68%	0.676	S	S	*	*	S	Bend	trans	-111.3	77.3	174.5	0	0	0	0	0	109	R765 N770	R765-A768 CarbonylContact O-C 3.54Å; R765-A768 PolarHBondContact O-N 3.4Å; A768-N770 PolarHBondContact O-N 2.99Å
769	G	36.1	Very low	31.7	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	69%	0.691	S	S	*	*			trans	-54.1	101.3	-169	0	0	0	0	0	114.2
770	N	35.3	Very low	31.3	Very low	143 Å²	143	128.2 Å²	128.2	77%	0.765	70%	0.696	S	S	*	*			trans	-159.2	96	172.7	-98.1	-40.6	0	0	0	109.4	A768	A768-N770 PolarHBondContact O-N 2.99Å
771	V	29.6	Very low	31	Very low	128 Å²	128	124.4 Å²	124.4	78%	0.776	69%	0.693	S	S	*	*			trans	-137.5	111.4	169	-178.8	0	0	0	0	108.9
772	V	28	Very low	30.8	Very low	131 Å²	131	125.8 Å²	125.8	79%	0.794	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-95.4	131.1	165.9	176.9	0	0	0	0	107.7	P774	V772-P774 WeakPolarHBondContact O-CD 3.27Å
773	L	25.7	Very low	30.5	Very low	150 Å²	150	131.8 Å²	131.8	79%	0.785	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-86.1	118.1	171.3	-76.1	170.1	0	0	0	109.7	L775	L773-L775 PolarHBondContact O-N 3.23Å
774	P	27.5	Very low	30.1	Very low	104 Å²	104	132.9 Å²	132.9	68%	0.675	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-75.2	118	176.2	29.5	-32.8	0	0	0	110.6	V772 V776	V772-P774 WeakPolarHBondContact O-CD 3.27Å; P774-V776 PolarHBondContact O-N 3.38Å; P774-V776 VanDerWaalsContact O-N 3.15Å
775	L	26.3	Very low	29.7	Very low	164 Å²	164	129.8 Å²	129.8	86%	0.859	75%	0.753	S	S	*	*			trans	-77.4	96.4	170.5	-135.6	81.7	0	0	0	109.2	L773 H777	L773-L775 PolarHBondContact O-N 3.23Å; L775-H777 PolarHBondContact O-N 3.16Å
776	V	26.9	Very low	29.3	Very low	126 Å²	126	129.6 Å²	129.6	76%	0.764	77%	0.768	S	S	*	*			trans	-77.4	94.6	-178	-177.3	0	0	0	0	110.4	P774 R778	P774-V776 PolarHBondContact O-N 3.38Å; P774-V776 VanDerWaalsContact O-N 3.15Å; V776-R778 PolarHBondContact O-N 3.01Å
777	H	27.4	Very low	29	Very low	151 Å²	151	128.5 Å²	128.5	70%	0.699	77%	0.772	S	S	*	*			trans	-76.4	110.5	174.5	-151.8	-90.9	0	0	0	110.5	L775 V779	L775-H777 PolarHBondContact O-N 3.16Å; H777-V779 PolarHBondContact O-N 3.11Å; H777-V779 VanDerWaalsContact O-N 3.16Å
778	R	24.8	Very low	28.7	Very low	213 Å²	213	126.7 Å²	126.7	80%	0.804	77%	0.774	S	S	*	*			trans	-86.7	86.6	-171.7	-166.7	-174.6	-172.1	-177.6	2.8	112.1	V776 T780	V776-R778 PolarHBondContact O-N 3.01Å; R778-T780 HydrophobicContact CG-CG2 4.23Å; R778-T780 PolarHBondContact O-N 3.44Å
779	V	28.8	Very low	28.7	Very low	128 Å²	128	128.6 Å²	128.6	78%	0.776	79%	0.789	S	S	*	*			trans	-70.5	106.2	171.5	-177.3	0	0	0	0	110.1	H777	H777-V779 PolarHBondContact O-N 3.11Å; H777-V779 VanDerWaalsContact O-N 3.16Å
780	T	27.4	Very low	28.2	Very low	110 Å²	110	129.8 Å²	129.8	68%	0.675	79%	0.792	S	S	*	*			trans	-94.8	89.5	174.4	49.4	0	0	0	0	111.2	R778	R778-T780 HydrophobicContact CG-CG2 4.23Å; R778-T780 PolarHBondContact O-N 3.44Å
781	G	28.1	Very low	27.8	Very low	71 Å²	71	132.5 Å²	132.5	73%	0.732	80%	0.8	S	S	*	*			trans	-74	137.1	166.3	0	0	0	0	0	111.6	L783	G781-L783 PolarHBondContact O-N 2.99Å
782	T	30.5	Very low	27.6	Very low	142 Å²	142	137.3 Å²	137.3	87%	0.871	80%	0.804	S	S	*	*			trans	-88	101.9	179.2	48.7	0	0	0	0	111.5
783	L	28.6	Very low	27.5	Very low	181 Å²	181	137.6 Å²	137.6	95%	0.948	81%	0.806	S	S	*	*			trans	-132.7	151.2	163	-80.7	175	0	0	0	110.2	G781	G781-L783 PolarHBondContact O-N 2.99Å
784	A	26.3	Very low	27.4	Very low	96 Å²	96	140.5 Å²	140.5	79%	0.793	81%	0.808	S	S	*	*			trans	-109.6	164.5	-171	0	0	0	0	0	113.2
785	A	28.6	Very low	27.3	Very low	85 Å²	85	142 Å²	142	70%	0.702	82%	0.816	S	S	*	*			trans	80.7	136.3	159.1	0	0	0	0	0	120.6
786	T	26.3	Very low	27.3	Very low	148 Å²	148	140.5 Å²	140.5	91%	0.908	81%	0.813	S	S	*	*			trans	72.7	152.8	152.3	48.1	0	0	0	0	120.5
787	S	28.8	Very low	27.3	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	82%	0.815	S	S	*	*			trans	-105.4	136.6	-172	173	0	0	0	0	111.1
788	T	27.8	Very low	27.2	Very low	144 Å²	144	136.8 Å²	136.8	88%	0.883	82%	0.817	S	S	*	*			trans	-167.2	150.5	138.3	8.6	0	0	0	0	109.6
789	A	33.1	Very low	27.3	Very low	106 Å²	106	131.8 Å²	131.8	88%	0.876	81%	0.806	S	S	*	*			trans	-96.3	134.7	-177.5	0	0	0	0	0	111.8
790	A	25.7	Very low	27.2	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	81%	0.809	S	S	*	*			trans	-142.4	124.3	166.9	0	0	0	0	0	109.7
791	Q	28.6	Very low	27.1	Very low	200 Å²	200	138.2 Å²	138.2	94%	0.935	81%	0.805	S	S	*	*			trans	-76.1	138.5	173.5	-67.6	171.4	-44.2	0	0	109.7
792	R	25.4	Very low	27	Very low	229 Å²	229	139.1 Å²	139.1	86%	0.864	81%	0.805	S	S	*	*			trans	-128.2	137.1	163.8	-74.6	-170.6	174.8	-174.7	-1.2	109.7
793	V	24.8	Very low	26.9	Very low	138 Å²	138	138.5 Å²	138.5	84%	0.836	80%	0.803	S	S	*	*			trans	-90.1	134.1	-178	178	0	0	0	0	109
794	Y	24.4	Very low	26.9	Very low	211 Å²	211	134.2 Å²	134.2	83%	0.827	79%	0.794	S	S	*	*			trans	-99.1	126.8	172.1	-69.6	-84	0	0	0	110.3
795	T	24.8	Very low	27	Very low	136 Å²	136	137.9 Å²	137.9	83%	0.834	80%	0.795	S	S	*	*			trans	-95.2	109.6	173.3	50.5	0	0	0	0	110	G797	T795-G797 PolarHBondContact O-N 3.27Å
796	T	26.2	Very low	27.1	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	80%	0.803	S	S	*	*			trans	-82	111.1	178.8	51.5	0	0	0	0	111.4
797	G	26.1	Very low	27.1	Very low	78 Å²	78	139.2 Å²	139.2	80%	0.804	79%	0.794	S	S	*	*			trans	-87.4	132.1	166.3	0	0	0	0	0	111.1	T795	T795-G797 PolarHBondContact O-N 3.27Å
798	T	26.9	Very low	27.2	Very low	121 Å²	121	141.7 Å²	141.7	74%	0.742	80%	0.798	S	S	*	*			trans	-114.1	110.7	-175.4	-50.6	0	0	0	0	111.3
799	I	26.3	Very low	27.1	Very low	109 Å²	109	139.3 Å²	139.3	56%	0.559	79%	0.793	S	S	*	*			trans	-85.8	142.1	167.6	-62	176.3	0	0	0	108.6
800	R	26.2	Very low	26.8	Very low	227 Å²	227	143 Å²	143	86%	0.857	79%	0.794	S	S	*	*			trans	-109.1	130.9	-179.1	-58.4	-178.2	-174.2	-174.1	2	110.2
801	Y	25.5	Very low	26.8	Very low	146 Å²	146	147.7 Å²	147.7	57%	0.573	80%	0.8	S	S	*	*			trans	-99.9	147.3	159.1	-78	-91.2	0	0	0	109.7	C300 H301	C300-Y801 PolarHBondContact O-OH 2.73Å; C300-Y801 VanDerWaalsContact SG-CE1 3.53Å; H301-Y801 PolarHBondContact CD2-OH 3.22Å
802	A	27.2	Very low	26.5	Very low	89 Å²	89	143 Å²	143	74%	0.736	79%	0.789	S	S	*	*			trans	-132.8	141.8	172.4	0	0	0	0	0	108.7
803	P	27.8	Very low	26.6	Very low	129 Å²	129	139.4 Å²	139.4	84%	0.838	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-70.7	146.1	178.7	30.2	-34.6	0	0	0	111.1	E805	P803-E805 PolarHBondContact O-N 3.24Å
804	A	29.3	Very low	26.7	Very low	92 Å²	92	141 Å²	141	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.4	128.2	-178.9	0	0	0	0	0	112.4
805	E	27	Very low	26.8	Very low	173 Å²	173	139 Å²	139	81%	0.808	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.1	151.3	169.6	-64.6	-169	144.3	0	0	111.7	P803 T807	P803-E805 PolarHBondContact O-N 3.24Å; E805-T807 PolarHBondContact O-N 3.25Å
806	V	30.2	Very low	26.9	Very low	142 Å²	142	138.3 Å²	138.3	86%	0.861	79%	0.791	S	S	*	*			trans	-91.6	86.7	175	-179	0	0	0	0	109.5	L808	V806-L808 PolarHBondContact O-N 3.07Å
807	T	28.1	Very low	26.9	Very low	118 Å²	118	139.5 Å²	139.5	72%	0.724	79%	0.792	S	S	*	*			trans	-91.3	97.8	-179.2	-44.7	0	0	0	0	111.6	E805 A809	E805-T807 PolarHBondContact O-N 3.25Å; T807-A809 PolarHBondContact O-N 2.76Å
808	L	29.1	Very low	26.9	Very low	161 Å²	161	140.7 Å²	140.7	84%	0.843	79%	0.794	S	S	*	*			trans	-76.9	115.5	169.3	-111.6	160.5	0	0	0	109.9	V806	V806-L808 PolarHBondContact O-N 3.07Å
809	A	25.9	Very low	26.8	Very low	94 Å²	94	143.2 Å²	143.2	78%	0.777	80%	0.797	S	S	*	*			trans	-88	113.1	179.5	0	0	0	0	0	111.9	T807	T807-A809 PolarHBondContact O-N 2.76Å
810	M	26.9	Very low	26.8	Very low	183 Å²	183	142.7 Å²	142.7	90%	0.901	81%	0.809	S	S	*	*			trans	-136.5	157.1	158.2	-78.8	-161.2	73.5	0	0	110.3
811	Q	26	Very low	26.8	Very low	195 Å²	195	137.4 Å²	137.4	91%	0.911	80%	0.802	S	S	*	*			trans	-78.2	153.5	-164.1	-67.6	165.4	-48.7	0	0	113.7
812	S	22.8	Very low	26.8	Very low	102 Å²	102	137.5 Å²	137.5	71%	0.713	81%	0.812	S	S	*	*			trans	-76.1	140.1	-177.5	54	0	0	0	0	114
813	N	26.3	Very low	26.8	Very low	153 Å²	153	142.8 Å²	142.8	82%	0.818	82%	0.819	S	S	*	*				-175.2	163.2	120.4	-96.4	-31.8	0	0	0	113.7
814	L	27.8	Very low	26.9	Very low	171 Å²	171	142.2 Å²	142.2	90%	0.895	81%	0.813	S	S	*	*			trans	72.6	102.4	172.9	-58.6	174.4	0	0	0	118.1
815	L	27.1	Very low	26.9	Very low	169 Å²	169	144.6 Å²	144.6	89%	0.885	81%	0.813	S	S	*	*			trans	-86	156.3	159.2	-74.8	163.7	0	0	0	111
816	P	26.8	Very low	27.1	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	81%	0.813	S	S	*	*				-133.2	161.5	125.5	36.8	-27.8	0	0	0	114.3
817	N	25	Very low	27	Very low	155 Å²	155	143.2 Å²	143.2	83%	0.829	81%	0.811	S	S	*	*			trans	-36.3	136.5	-171.4	-69.9	-12.2	0	0	0	118.2
818	A	26.5	Very low	27	Very low	103 Å²	103	142.5 Å²	142.5	85%	0.851	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-86.6	136.7	158.2	0	0	0	0	0	111.2
819	H	25.8	Very low	27.4	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.806	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.3	129.9	163.9	-79.1	-82	0	0	0	109.7
820	A	25	Very low	27.8	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-75	137.6	174.6	0	0	0	0	0	111.1
821	V	27.2	Very low	27.8	Very low	115 Å²	115	141.3 Å²	141.3	70%	0.697	81%	0.809	S	S	*	*			trans	-126	105.2	173	-173	0	0	0	0	108.3	F823	V821-F823 HydrophobicContact CG1-CE2 4.44Å
822	N	24.6	Very low	28.5	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	80%	0.801	S	S	*	*			trans	-72.3	137.2	172.2	-75.3	-27	0	0	0	110
823	F	28	Very low	29.1	Very low	200 Å²	200	138.5 Å²	138.5	88%	0.877	81%	0.809	S	S	*	*			trans	-99.2	133.9	161.6	-93.3	-91.8	0	0	0	110	V821	V821-F823 HydrophobicContact CG1-CE2 4.44Å
824	V	30.6	Very low	29.7	Very low	118 Å²	118	135.4 Å²	135.4	72%	0.715	79%	0.792	S	S	*	*			trans	-106	162.5	-173.6	172.9	0	0	0	0	109.9
825	D	29.1	Very low	30.3	Very low	142 Å²	142	132.6 Å²	132.6	76%	0.759	78%	0.784	S	S	*	*			trans	-31.9	135.2	177	-74	-76.4	0	0	0	116.5
826	V	30.4	Very low	30.9	Very low	132 Å²	132	130.5 Å²	130.5	80%	0.8	77%	0.768	S	S	*	*			trans	-127.6	78	162.7	-172.3	0	0	0	0	110
827	N	28.6	Very low	31.7	Very low	153 Å²	153	128.9 Å²	128.9	82%	0.818	76%	0.756	S	S	*	*			trans	-102	79.8	164	-103.6	-41.7	0	0	0	109.4
828	S	26.8	Very low	32.6	Very low	103 Å²	103	125.8 Å²	125.8	72%	0.72	75%	0.745	S	S	*	*			trans	-159.3	146.5	165.5	-85.3	0	0	0	0	111.9
829	P	38.6	Very low	33.3	Very low	132 Å²	132	127.9 Å²	127.9	86%	0.857	74%	0.738	S	S	*	*			trans	-90.2	140.7	-172	34.6	-34.3	0	0	0	113.4
830	G	33.7	Very low	34	Very low	69 Å²	69	125.8 Å²	125.8	71%	0.711	73%	0.729	S	S	*	*			trans	111.8	81	155.8	0	0	0	0	0	116.8
831	F	27.9	Very low	34.7	Very low	212 Å²	212	127.7 Å²	127.7	93%	0.93	72%	0.723	S	S	*	*			trans	-152	134.4	139	-107.6	-76.7	0	0	0	108.5
832	G	40	Very low	35.3	Very low	72 Å²	72	128.1 Å²	128.1	74%	0.742	72%	0.72	S	S	*	*			trans	-93.9	134.9	-179.2	0	0	0	0	0	112
833	L	35.2	Very low	35.9	Very low	166 Å²	166	129.3 Å²	129.3	87%	0.869	72%	0.715	S	S	*	*			trans	-123.4	135.6	172.6	-65	174.9	0	0	0	109.5
834	D	38.8	Very low	36.4	Very low	89 Å²	89	125.6 Å²	125.6	48%	0.476	70%	0.7	S	S	.	*			trans	-71.1	124.8	-179.1	-173.2	-0.7	0	0	0	109.9	K836	D834-K836 PolarHBondContact O-N 2.95Å; D834-K836 IonicContact OD1-NZ 3.11Å; D834-K836 IonicContact OD2-NZ 2.74Å; D834-K836 PolarHBondContact OD2-NZ 3.36Å
835	P	41.6	Very low	36.7	Very low	112 Å²	112	126.1 Å²	126.1	73%	0.727	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	2.1	-174.3	23.4	-35.9	0	0	0	116.8
836	K	39.3	Very low	37.2	Very low	125 Å²	125	123.5 Å²	123.5	54%	0.543	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	-38.9	-178.1	-65.6	172.1	-164.5	136.6	0	114.2	D834 M839 E840	D834-K836 PolarHBondContact O-N 2.95Å; D834-K836 IonicContact OD1-NZ 3.11Å; D834-K836 IonicContact OD2-NZ 2.74Å; D834-K836 PolarHBondContact OD2-NZ 3.36Å; K836-M839 WeakPolarHBondContact O-CB 3.35Å; K836-M839 PolarHBondContact O-N 3.07Å; K836-E840 PolarHBondContact O-N 3.31Å; K836-E840 VanDerWaalsContact O-N 3.11Å
837	T	43.3	Very low	37.6	Very low	87 Å²	87	122.4 Å²	122.4	53%	0.534	67%	0.67	S	S	.	*	H	α-helix	trans	-57.9	-41	-168.9	-29.8	0	0	0	0	114.4	M839 M841	T837-M839 VanDerWaalsContact C-N 3.31Å; T837-M839 PolarHBondContact O-N 2.81Å; T837-M841 PolarHBondContact O-N 3.13Å
838	P	44.4	Very low	38	Very low	91 Å²	91	124.5 Å²	124.5	59%	0.591	67%	0.666	S	S	*	*	H	α-helix	trans	-65.9	-33.5	175.7	-20.5	33.7	0	0	0	113	L842	P838-L842 PolarHBondContact O-N 3.1Å; P838-L842 VanDerWaalsContact O-N 3.16Å
839	M	40.7	Very low	38.5	Very low	147 Å²	147	125.5 Å²	125.5	72%	0.724	66%	0.663	S	S	*	*	H	α-helix	trans	-74.3	-40	-176	-158.4	173.1	-168.5	0	0	111.3	K836 T837 L842 Y843	K836-M839 WeakPolarHBondContact O-CB 3.35Å; K836-M839 PolarHBondContact O-N 3.07Å; T837-M839 VanDerWaalsContact C-N 3.31Å; T837-M839 PolarHBondContact O-N 2.81Å; M839-L842 PolarHBondContact O-N 3.03Å; M839-Y843 WeakPolarHBondContact O-CB 3.5Å; M839-Y843 PolarHBondContact O-N 2.93Å
840	E	41.1	Very low	38.6	Very low	130 Å²	130	125.6 Å²	125.6	61%	0.607	66%	0.656	S	S	*	*	H	α-helix	trans	-64.4	-39.1	173.3	-69.2	-173.3	153	0	0	112.3	K836 Y843 H844	K836-E840 PolarHBondContact O-N 3.31Å; K836-E840 VanDerWaalsContact O-N 3.11Å; E840-Y843 PolarHBondContact O-N 3.49Å; E840-H844 WeakPolarHBondContact O-CB 3.4Å; E840-H844 PolarHBondContact O-N 3.33Å
841	M	37.8	Very low	38.6	Very low	139 Å²	139	129.1 Å²	129.1	69%	0.685	66%	0.656	S	S	*	*	H	α-helix	trans	-61.5	-44.8	174.4	-78.1	-175.5	62.5	0	0	112.3	T837 H844 H845	T837-M841 PolarHBondContact O-N 3.13Å; M841-H844 PolarHBondContact O-N 2.79Å; M841-H845 PolarHBondContact O-N 3.35Å
842	L	41.7	Very low	38.8	Very low	124 Å²	124	124.2 Å²	124.2	65%	0.649	65%	0.647	S	S	*	*	H	α-helix	trans	-64.6	-42.8	178.2	-165.6	69.9	0	0	0	111.2	P838 M839 H844 H845 V846	P838-L842 PolarHBondContact O-N 3.1Å; P838-L842 VanDerWaalsContact O-N 3.16Å; M839-L842 PolarHBondContact O-N 3.03Å; L842-H844 PolarHBondContact O-N 3.5Å; L842-H845 PolarHBondContact O-N 2.94Å; L842-V846 WeakPolarHBondContact O-CG2 3.43Å; L842-V846 PolarHBondContact O-N 3.43Å; L842-V846 VanDerWaalsContact O-N 3.08Å
843	Y	36.5	Very low	38.5	Very low	172 Å²	172	123.7 Å²	123.7	68%	0.675	64%	0.642	S	S	*	*	H	α-helix	trans	-60.8	-44.6	176	-157	-92.3	0	0	0	111.6	M839 E840 H845 H847	M839-Y843 WeakPolarHBondContact O-CB 3.5Å; M839-Y843 PolarHBondContact O-N 2.93Å; E840-Y843 PolarHBondContact O-N 3.49Å; Y843-H845 VanDerWaalsContact C-N 3.33Å; Y843-H845 PolarHBondContact O-N 2.84Å; Y843-H847 VanDerWaalsContact O-CB 3.31Å; Y843-H847 WeakPolarHBondContact O-CB 3.32Å; Y843-H847 PolarHBondContact O-N 2.97Å
844	H	37.8	Very low	38.4	Very low	123 Å²	123	122 Å²	122	57%	0.569	64%	0.641	S	S	*	*	H	α-helix	trans	-64.5	-34	176.1	-117.2	92	0	0	0	113.3	E840 M841 L842 R848	E840-H844 WeakPolarHBondContact O-CB 3.4Å; E840-H844 PolarHBondContact O-N 3.33Å; M841-H844 PolarHBondContact O-N 2.79Å; L842-H844 PolarHBondContact O-N 3.5Å; H844-R848 WeakPolarHBondContact O-CG 3.28Å; H844-R848 PolarHBondContact O-N 3.3Å; H844-R848 VanDerWaalsContact O-N 3.14Å
845	H	36.8	Very low	37.9	Very low	128 Å²	128	128 Å²	128	59%	0.593	66%	0.663	S	S	*	*	H	α-helix	trans	-69.9	-47.6	179.1	-154.3	88.1	0	0	0	111.2	M841 L842 Y843 H847 R848 L849	M841-H845 PolarHBondContact O-N 3.35Å; L842-H845 PolarHBondContact O-N 2.94Å; Y843-H845 VanDerWaalsContact C-N 3.33Å; Y843-H845 PolarHBondContact O-N 2.84Å; H845-H847 PolarHBondContact O-N 2.79Å; H845-R848 PolarHBondContact O-N 3.29Å; H845-L849 PolarHBondContact O-N 2.92Å
846	V	39.4	Very low	37.3	Very low	88 Å²	88	126 Å²	126	53%	0.533	66%	0.664	S	S	.	*	H	α-helix	trans	-62	-42.6	175.1	175.4	0	0	0	0	111.2	L842 R848 L849 N850	L842-V846 WeakPolarHBondContact O-CG2 3.43Å; L842-V846 PolarHBondContact O-N 3.43Å; L842-V846 VanDerWaalsContact O-N 3.08Å; V846-R848 VanDerWaalsContact C-N 3.29Å; V846-R848 PolarHBondContact O-N 2.89Å; V846-L849 PolarHBondContact O-N 3.17Å; V846-N850 PolarHBondContact O-N 2.66Å
847	H	38.8	Very low	36.8	Very low	109 Å²	109	123.8 Å²	123.8	51%	0.505	68%	0.676	S	S	.	*	H	α-helix	trans	-72	-20.4	-177.7	-146.8	-48.8	0	0	0	114	Y843 H845	Y843-H847 VanDerWaalsContact O-CB 3.31Å; Y843-H847 WeakPolarHBondContact O-CB 3.32Å; Y843-H847 PolarHBondContact O-N 2.97Å; H845-H847 PolarHBondContact O-N 2.79Å
848	R	36.9	Very low	36.1	Very low	196 Å²	196	124.4 Å²	124.4	74%	0.74	69%	0.689	S	S	*	*	H	α-helix	trans	-77.3	-36.7	169.2	-80.2	-176.9	176.5	-165.5	0.8	112.8	H844 H845 V846 N850	H844-R848 WeakPolarHBondContact O-CG 3.28Å; H844-R848 PolarHBondContact O-N 3.3Å; H844-R848 VanDerWaalsContact O-N 3.14Å; H845-R848 PolarHBondContact O-N 3.29Å; V846-R848 VanDerWaalsContact C-N 3.29Å; V846-R848 PolarHBondContact O-N 2.89Å; R848-N850 VanDerWaalsContact C-N 3.28Å; R848-N850 PolarHBondContact O-N 2.9Å
849	L	38.8	Very low	35.3	Very low	125 Å²	125	126.8 Å²	126.8	65%	0.654	70%	0.702	S	S	*	*	H	α-helix	trans	-68.3	-28.7	176.9	-70.4	168.3	0	0	0	112.5	H845 V846	H845-L849 PolarHBondContact O-N 2.92Å; V846-L849 PolarHBondContact O-N 3.17Å
850	N	40.2	Very low	34.6	Very low	133 Å²	133	125.5 Å²	125.5	71%	0.711	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	9.7	-175.7	-143.4	12.1	0	0	0	114.7	V846 R848	V846-N850 PolarHBondContact O-N 2.66Å; R848-N850 VanDerWaalsContact C-N 3.28Å; R848-N850 PolarHBondContact O-N 2.9Å
851	M	33.2	Very low	33.9	Very low	144 Å²	144	124.2 Å²	124.2	71%	0.709	72%	0.72	S	S	*	*			trans	-137.1	54.2	-174.4	-73.8	-66.6	-70.7	0	0	112.9
852	S	31.8	Very low	33.4	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	72%	0.724	S	S	*	*			trans	-110.2	68.6	177.9	46.7	0	0	0	0	112.8
853	G	33.7	Very low	32.7	Very low	61 Å²	61	121 Å²	121	63%	0.629	73%	0.727	S	S	*	*			trans	-73.3	153.6	165.2	0	0	0	0	0	112.2	F855	G853-F855 PolarHBondContact O-N 2.74Å
854	P	34.3	Very low	32.2	Very low	130 Å²	130	120.3 Å²	120.3	84%	0.844	73%	0.734	S	S	*	*			trans	-79.9	111.9	-169	30.8	-35.1	0	0	0	113.8
855	F	28.2	Very low	31.7	Very low	215 Å²	215	119.7 Å²	119.7	94%	0.943	74%	0.739	S	S	*	*			trans	-123.2	149.6	146.7	-80.3	-95	0	0	0	106.5	G853	G853-F855 PolarHBondContact O-N 2.74Å
856	G	30	Very low	31.3	Very low	72 Å²	72	122.7 Å²	122.7	74%	0.742	75%	0.753	S	S	*	*			cis	134.4	55	18.6	0	0	0	0	0	108
857	G	28.3	Very low	30.6	Very low	77 Å²	77	126.9 Å²	126.9	79%	0.794	77%	0.769	S	S	*	*			trans	-80.5	117.9	-169.5	0	0	0	0	0	112.5
858	A	27.1	Very low	30.8	Very low	100 Å²	100	127.4 Å²	127.4	83%	0.826	78%	0.782	S	S	*	*			trans	-73.6	143.7	171.6	0	0	0	0	0	111.2
859	V	27.5	Very low	30.5	Very low	141 Å²	141	122.7 Å²	122.7	86%	0.855	79%	0.785	S	S	*	*			trans	-112.1	113.2	173.4	-176.9	0	0	0	0	108.8
860	S	27.3	Very low	30	Very low	120 Å²	120	119.7 Å²	119.7	84%	0.839	79%	0.785	S	S	*	*			trans	-81.4	136.5	170.1	-63.4	0	0	0	0	110.2
861	A	25.5	Very low	29.5	Very low	104 Å²	104	121 Å²	121	86%	0.86	79%	0.791	S	S	*	*			trans	-89	146.3	-172.3	0	0	0	0	0	114
862	A	27.9	Very low	29.3	Very low	95 Å²	95	119.3 Å²	119.3	79%	0.785	79%	0.789	S	S	*	*			trans	-150.5	85.2	170.4	0	0	0	0	0	112.9
863	S	26.1	Very low	29.2	Very low	100 Å²	100	122.8 Å²	122.8	70%	0.699	79%	0.791	S	S	*	*			trans	40.2	121.8	142.5	58.5	0	0	0	0	123.4
864	L	27	Very low	29.1	Very low	157 Å²	157	125.3 Å²	125.3	82%	0.822	79%	0.794	S	S	*	*			trans	71.1	149.9	141.7	-86.5	67.7	0	0	0	118.3
865	T	27.5	Very low	28.8	Very low	110 Å²	110	125 Å²	125	68%	0.675	79%	0.79	S	S	*	*			cis	-150.8	152.3	10.6	-20.1	0	0	0	0	113.9
866	Q	27.1	Very low	28.9	Very low	191 Å²	191	118.2 Å²	118.2	89%	0.893	77%	0.774	S	S	*	*			trans	75.5	143.4	149	-98.5	169.1	-17	0	0	123.6
867	M	25.4	Very low	28.9	Very low	176 Å²	176	123.1 Å²	123.1	87%	0.867	78%	0.778	S	S	*	*			trans	-105.8	-175.7	-178.3	-85.1	-82.7	-177.8	0	0	109.5
868	P	43.3	Very low	28.9	Very low	120 Å²	120	122.7 Å²	122.7	78%	0.779	77%	0.773	S	S	*	*			cis	-130.8	-165.6	9.2	47.2	-30.4	0	0	0	112.7
869	A	30.2	Very low	29	Very low	97 Å²	97	124.5 Å²	124.5	80%	0.802	77%	0.768	S	S	*	*			cis	-147.3	164.3	0.1	0	0	0	0	0	108.6
870	G	29.3	Very low	29	Very low	63 Å²	63	126.1 Å²	126.1	65%	0.649	76%	0.764	S	S	*	*			cis	-178.6	171.1	-2.7	0	0	0	0	0	112.1
871	N	27.8	Very low	29	Very low	159 Å²	159	125 Å²	125	85%	0.85	76%	0.756	S	S	*	*			trans	35.9	133.8	164.2	-59.9	10	0	0	0	121.3
872	V	30	Very low	29.1	Very low	110 Å²	110	126.3 Å²	126.3	67%	0.667	75%	0.754	S	S	*	*			cis	134	107.1	1.1	-52	0	0	0	0	114.5
873	F	29	Very low	29.3	Very low	181 Å²	181	129.2 Å²	129.2	79%	0.794	76%	0.755	S	S	*	*			trans	85.6	155.8	142.6	-58	-41.9	0	0	0	119.1
874	T	31.2	Very low	29.8	Very low	114 Å²	114	130 Å²	130	70%	0.699	76%	0.758	S	S	*	*			cis	-156.9	177.3	-13.3	17	0	0	0	0	107.4
875	T	29	Very low	29.9	Very low	122 Å²	122	131.8 Å²	131.8	75%	0.748	76%	0.759	S	S	*	*			cis	-140.4	153.7	24.3	37.4	0	0	0	0	109.8
876	A	30.7	Very low	30.4	Very low	74 Å²	74	131.7 Å²	131.7	61%	0.612	76%	0.76	S	S	*	*			cis	71.1	136	49.1	0	0	0	0	0	113.3
877	E	29.2	Very low	30.4	Very low	175 Å²	175	129.2 Å²	129.2	82%	0.818	76%	0.758	S	S	*	*			cis	-156.2	150.8	1.8	-128.3	166.2	-133.3	0	0	110
878	G	28.3	Very low	30.5	Very low	68 Å²	68	131 Å²	131	70%	0.701	76%	0.757	S	S	*	*				113.2	158.3	95.2	0	0	0	0	0	111.6
879	L	29.3	Very low	29.8	Very low	138 Å²	138	129.6 Å²	129.6	72%	0.723	75%	0.75	S	S	*	*			cis	-157.3	173.5	-7.4	-85.9	173.5	0	0	0	110
880	F	27.3	Very low	29.6	Very low	175 Å²	175	132.8 Å²	132.8	77%	0.768	75%	0.754	S	S	*	*			trans	78.7	96.2	160.3	-63.3	-67.3	0	0	0	123
881	S	27.3	Very low	29.6	Very low	95 Å²	95	133 Å²	133	66%	0.664	76%	0.755	S	S	*	*				57.3	108.9	109.1	-53.1	0	0	0	0	123.7
882	T	27.8	Very low	29.7	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	75%	0.752	S	S	*	*				59.3	116.5	128.2	60.3	0	0	0	0	123
883	L	32.9	Very low	29.7	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	76%	0.76	S	S	*	*			trans	-15	157.7	137.8	-61.5	174	0	0	0	117.7
884	P	37	Very low	29.6	Very low	116 Å²	116	132.3 Å²	132.3	75%	0.753	76%	0.763	S	S	*	*			cis	-146.4	-173	33	43.1	-22.7	0	0	0	118.2
885	F	29.1	Very low	29.6	Very low	195 Å²	195	131.6 Å²	131.6	86%	0.855	77%	0.768	S	S	*	*			trans	-62.6	158.8	166.6	-70.3	-90.2	0	0	0	113.6
886	P	37.2	Very low	29.5	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	78%	0.777	S	S	*	*			trans	-128.5	149.2	134.1	37	-29	0	0	0	113.9	Y888	P886-Y888 HydrophobicContact CB-CD2 4.49Å
887	V	28.3	Very low	29.5	Very low	139 Å²	139	137.9 Å²	137.9	84%	0.842	79%	0.785	S	S	*	*			trans	-89	138.2	163.1	172.1	0	0	0	0	108.5
888	Y	27.4	Very low	29.5	Very low	213 Å²	213	136.8 Å²	136.8	84%	0.835	78%	0.784	S	S	*	*			trans	-139.8	134.9	164.4	-99.8	-76.2	0	0	0	113.5	P886	P886-Y888 HydrophobicContact CB-CD2 4.49Å
889	S	26.6	Very low	29.6	Very low	91 Å²	91	142.2 Å²	142.2	64%	0.636	79%	0.791	S	S	*	*			trans	-91.5	146.3	164.3	54.2	0	0	0	0	110.6
890	N	27.8	Very low	29.7	Very low	165 Å²	165	146.6 Å²	146.6	88%	0.882	80%	0.798	S	S	*	*				-174.4	167.4	128.4	-93	-18.9	0	0	0	111.3
891	G	27.8	Very low	29.9	Very low	66 Å²	66	148.1 Å²	148.1	68%	0.68	80%	0.804	S	S	*	*			trans	-103.3	158.8	-171.5	0	0	0	0	0	115.4
892	I	29.8	Very low	30.2	Very low	155 Å²	155	151 Å²	151	80%	0.795	81%	0.808	S	S	*	*			trans	52.1	95.2	153.9	-38.3	177.5	0	0	0	116.6
893	H	29.9	Very low	30.4	Very low	180 Å²	180	156.5 Å²	156.5	83%	0.833	83%	0.832	S	S	*	*				-169.6	152.5	108.2	-114.8	-82.9	0	0	0	114
894	A	28.1	Very low	30.2	Very low	102 Å²	102	156.5 Å²	156.5	84%	0.843	83%	0.832	S	S	*	*			trans	62.7	164.9	165.8	0	0	0	0	0	117.4
895	A	30.2	Very low	29.9	Very low	98 Å²	98	158.6 Å²	158.6	81%	0.81	84%	0.836	S	S	*	*			trans	-132.7	145.4	-176.4	0	0	0	0	0	110.4
896	Q	28.2	Very low	29.9	Very low	202 Å²	202	156.6 Å²	156.6	94%	0.944	84%	0.835	S	S	*	*			trans	-152	149.5	159.5	-114.9	167.5	5.1	0	0	110.3
897	T	31.1	Very low	29.5	Very low	127 Å²	127	159.5 Å²	159.5	78%	0.779	84%	0.843	S	S	*	*			trans	-114	131.3	-177.2	44.2	0	0	0	0	110.2
898	L	29.3	Very low	29.6	Very low	152 Å²	152	160.8 Å²	160.8	80%	0.796	84%	0.844	S	S	*	*			trans	-169.6	115.2	141.8	-119.5	72.9	0	0	0	105
899	E	29.7	Very low	29.7	Very low	181 Å²	181	157.3 Å²	157.3	85%	0.846	84%	0.844	S	S	*	*				87	153.7	83.5	-75	-161.1	140.5	0	0	114.5
900	R	31.8	Very low	30	Very low	231 Å²	231	162 Å²	162	87%	0.872	86%	0.859	S	S	*	*			trans	-90	159.5	-175.4	-71.7	175.1	163.2	78.5	-1.9	110.9
901	K	29.9	Very low	30.1	Very low	206 Å²	206	161.8 Å²	161.8	90%	0.896	86%	0.857	S	S	*	*				-134.2	153.7	129.4	-155.3	171.5	179.8	-171.3	0	109.8
902	E	33.6	Very low	30.3	Very low	157 Å²	157	169.8 Å²	169.8	73%	0.734	87%	0.872	S	S	*	*			trans	-96.8	146.3	-176.1	-63.4	151.9	135	0	0	110.5
903	D	32.3	Very low	30.4	Very low	246 Å²	246	171.1 Å²	171.1	100%	1.316	88%	0.879	S	S	*	*			trans	-156.9	0	138.3	-85	-40.4	0	0	0	107.2

Retrieved 903 of 903 residues in 176.2 ms (Link to these results)

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