X5D985_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 X5D985, Species HUMAN (Homo sapiens, Human), Gene NPAS3, Length 901 aa.

						>X5D985_HUMAN|X5D985|NPAS3
MAPTKPSFQQDPSSSLQALRKEKSRDAARSRRGKENFEFYELAKLLPLPAAITSQLDKASIIRLTISYLKMRDFANQGDPPWNLRMEGPPPNTSVKVIGAQRRRSPSALAIEVFEAHLGSHILQSLDGFVFALNQEGKFLYISETVSIYLGLSQVELTGSSVFDYVHPGDHVEMAEQLGMKLPPGRGLLSQGTAEDGASSASSSSQSETPEPVESTSPSLLTTDNTLERSFFIRMKSTLTKRGVHIKSSGYKVIHITGRLRLRVSLSHGRTVPSQIMGLVVVAHALPPPTINEVRIDCHMFVTRVNMDLNIIYCENRISDYMDLTPVDIVGKRCYHFIHAEDVEGIRHSHLDLLNKGQCVTKYYRWMQKNGGYIWIQSSATIAINAKNANEKNIIWVNYLLSNPEYKDTPMDIAQLPHLPEKTSESSETSDSESDSKDTSGITEDNENSKSDEKGNQSENSEDPEPDRKKSGNACDNDMNCNDDGHSSSNPDSRDSDDSFEHSDFENPKAGEDGFGALGAMQIKVERYVESESDLRLQNCESLTSDSAKDSDSAGEAGAQASSKHQKRKKRRKRQKGGSASRRRLSSASSPGGLDAGLVEPPRLLSSPNSASVLKIKTEISEPINFDNDSSIWNYPPNREISRNESPYSMTKPPSSEHFPSPQGGGGGGGGGGGLHVAIPDSVLTPPGADGAAARKTQFGASATAALAPVASDPLSPPLSASPRDKHPGNGGGGGGGGGGAGGGGPSASNSLLYTGDLEALQRLQAGNVVLPLVHRVTGTLAATSTAAQRVYTTGTIRYAPAEVTLAMQSNLLPNAHAVNFVDVNSPGFGLDPKTPMEMLYHHVHRLNMSGPFGGAVSAASLTQMPAGNVFTTAEGLFSTLPFPVYSNGIHAAQTLERKED
					

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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	47.9	Very low	52.6	Low	256 Å²	256	152.6 Å²	152.6	100%	1.261	82%	0.824	S	S	*	*				0	136.9	0	-78.2	168.9	160	0	0	108.6
2	A	42.4	Very low	53.4	Low	91 Å²	91	147.9 Å²	147.9	75%	0.752	81%	0.808	S	S	*	*			trans	-147.6	137.4	166.1	0	0	0	0	0	107.4	T4	A2-T4 PolarHBondContact O-N 3.29Å
3	P	56.7	Low	54	Low	130 Å²	130	141.2 Å²	141.2	84%	0.844	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-77.3	116.4	-174.7	29.6	-33.2	0	0	0	111.2	K5	P3-K5 PolarHBondContact O-N 3.36Å
4	T	55.8	Low	54.7	Low	134 Å²	134	134.9 Å²	134.9	82%	0.822	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65	123.9	164.8	43.9	0	0	0	0	109.4	A2	A2-T4 PolarHBondContact O-N 3.29Å
5	K	51.5	Low	56.1	Low	197 Å²	197	130.4 Å²	130.4	86%	0.857	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-57.6	139.5	173.3	-71	-177.7	176.3	-179.3	0	110	P3 S7	P3-K5 PolarHBondContact O-N 3.36Å; K5-S7 PolarHBondContact O-N 3.41Å
6	P	51.5	Low	57.4	Low	114 Å²	114	128.1 Å²	128.1	74%	0.74	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-64.1	132.5	171.9	28	-33.7	0	0	0	109.7	F8	P6-F8 PolarHBondContact O-N 3.48Å
7	S	50.3	Low	58.6	Low	108 Å²	108	126.5 Å²	126.5	76%	0.755	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-72.3	124	168.6	40.3	0	0	0	0	109.2	K5 Q9	K5-S7 PolarHBondContact O-N 3.41Å; S7-Q9 PolarHBondContact O-N 3.41Å
8	F	53.3	Low	59.9	Low	203 Å²	203	122.6 Å²	122.6	89%	0.89	69%	0.688	S	S	*	*			trans	-64.9	102.9	168.9	-84.8	-92.8	0	0	0	108.9	P6 Q10	P6-F8 PolarHBondContact O-N 3.48Å; F8-Q10 PolarHBondContact O-N 3.09Å; F8-Q10 VanDerWaalsContact O-N 3.08Å
9	Q	53.6	Low	61.2	Low	187 Å²	187	120.4 Å²	120.4	87%	0.874	67%	0.674	S	S	*	*			trans	-66.5	106.1	163.8	-78.8	-175.6	-38.4	0	0	108	S7 D11	S7-Q9 PolarHBondContact O-N 3.41Å; Q9-D11 PolarHBondContact O-N 3.01Å
10	Q	56.8	Low	62.5	Low	166 Å²	166	123 Å²	123	78%	0.776	67%	0.673	S	S	*	*			trans	-71.5	119.4	178.1	-163.1	173.8	36.4	0	0	108.9	F8	F8-Q10 PolarHBondContact O-N 3.09Å; F8-Q10 VanDerWaalsContact O-N 3.08Å
11	D	58.3	Low	63.8	Low	93 Å²	93	124.1 Å²	124.1	50%	0.497	67%	0.671	S	S	.	*			trans	-59.1	120.3	-168.7	-162.6	-44.9	0	0	0	111.1	Q9 S13 S14 S15	Q9-D11 PolarHBondContact O-N 3.01Å; D11-S13 VanDerWaalsContact CG-OG 3.23Å; D11-S13 PolarHBondContact O-N 3.21Å; D11-S13 VanDerWaalsContact O-N 3.13Å; D11-S13 WeakPolarHBondContact OD1-CB 3.2Å; D11-S13 PolarHBondContact OD1-N 3.14Å; D11-S13 VanDerWaalsContact OD1-N 3.16Å; D11-S13 PolarHBondContact OD1-OG 3.04Å; D11-S14 WeakPolarHBondContact O-CA 3.44Å; D11-S14 WeakPolarHBondContact O-CB 3.18Å; D11-S14 PolarHBondContact O-N 3.25Å; D11-S14 PolarHBondContact O-OG 3.18Å; D11-S15 PolarHBondContact O-N 2.82Å
12	P	62.2	Low	65.8	Low	96 Å²	96	115.8 Å²	115.8	62%	0.623	63%	0.629	S	S	*	*	H	α-helix	trans	-63.3	-24.2	-174.5	25.1	-34.4	0	0	0	112.3	S14 L16	P12-S14 VanDerWaalsContact C-N 3.34Å; P12-L16 WeakPolarHBondContact O-CG 3.34Å; P12-L16 PolarHBondContact O-N 2.86Å; P12-L16 VanDerWaalsContact O-N 3.1Å
13	S	61.9	Low	68.2	Low	60 Å²	60	118.3 Å²	118.3	42%	0.42	62%	0.623	S	S	.	*	H	α-helix	trans	-62.7	-40.6	171.4	70.8	0	0	0	0	111.9	D11 Q17	D11-S13 VanDerWaalsContact CG-OG 3.23Å; D11-S13 PolarHBondContact O-N 3.21Å; D11-S13 VanDerWaalsContact O-N 3.13Å; D11-S13 WeakPolarHBondContact OD1-CB 3.2Å; D11-S13 PolarHBondContact OD1-N 3.14Å; D11-S13 VanDerWaalsContact OD1-N 3.16Å; D11-S13 PolarHBondContact OD1-OG 3.04Å; S13-Q17 WeakPolarHBondContact O-CG 3.37Å; S13-Q17 PolarHBondContact O-N 3.22Å
14	S	64.2	Low	70	Confident	53 Å²	53	115.9 Å²	115.9	37%	0.371	61%	0.609	S	S	.	*	H	α-helix	trans	-70	-38.9	179.1	76.5	0	0	0	0	112	D11 P12 Q17 A18	D11-S14 WeakPolarHBondContact O-CA 3.44Å; D11-S14 WeakPolarHBondContact O-CB 3.18Å; D11-S14 PolarHBondContact O-N 3.25Å; D11-S14 PolarHBondContact O-OG 3.18Å; P12-S14 VanDerWaalsContact C-N 3.34Å; S14-Q17 PolarHBondContact O-N 3.42Å; S14-A18 PolarHBondContact O-N 2.98Å
15	S	74.4	Confident	71.9	Confident	68 Å²	68	115.1 Å²	115.1	48%	0.476	59%	0.591	S	S	.	*	H	α-helix	trans	-63.3	-44.8	175.1	-177.9	0	0	0	0	111.9	D11 Q17 A18 L19	D11-S15 PolarHBondContact O-N 2.82Å; S15-Q17 VanDerWaalsContact C-N 3.32Å; S15-Q17 PolarHBondContact O-N 2.69Å; S15-A18 WeakPolarHBondContact O-CB 3.39Å; S15-A18 PolarHBondContact O-N 2.59Å; S15-L19 PolarHBondContact O-N 3.38Å
16	L	77.4	Confident	74	Confident	94 Å²	94	108.5 Å²	108.5	49%	0.492	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-34.2	174.1	-72.7	172	0	0	0	112.8	P12 R20	P12-L16 WeakPolarHBondContact O-CG 3.34Å; P12-L16 PolarHBondContact O-N 2.86Å; P12-L16 VanDerWaalsContact O-N 3.1Å; L16-R20 WeakPolarHBondContact O-CD 3.45Å; L16-R20 VanDerWaalsContact O-CG 3.23Å; L16-R20 WeakPolarHBondContact O-CG 3.37Å; L16-R20 PolarHBondContact O-N 3.32Å; L16-R20 VanDerWaalsContact O-N 3.13Å
17	Q	78.4	Confident	76.1	Confident	101 Å²	101	105.9 Å²	105.9	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-68.1	-40.7	171.9	-73.7	-177.6	39.5	0	0	112.4	S13 S14 S15 R20 K21	S13-Q17 WeakPolarHBondContact O-CG 3.37Å; S13-Q17 PolarHBondContact O-N 3.22Å; S14-Q17 PolarHBondContact O-N 3.42Å; S15-Q17 VanDerWaalsContact C-N 3.32Å; S15-Q17 PolarHBondContact O-N 2.69Å; Q17-R20 PolarHBondContact O-N 3.35Å; Q17-K21 WeakPolarHBondContact O-CG 3.45Å; Q17-K21 PolarHBondContact O-N 3.29Å
18	A	81.8	Confident	78.3	Confident	56 Å²	56	101.4 Å²	101.4	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-60.3	-48.7	175.1	0	0	0	0	0	110.9	S14 S15 R20 K21 E22	S14-A18 PolarHBondContact O-N 2.98Å; S15-A18 WeakPolarHBondContact O-CB 3.39Å; S15-A18 PolarHBondContact O-N 2.59Å; A18-R20 VanDerWaalsContact C-N 3.31Å; A18-R20 PolarHBondContact O-N 3.41Å; A18-K21 PolarHBondContact O-N 2.85Å; A18-K21 VanDerWaalsContact O-N 3.12Å; A18-E22 WeakPolarHBondContact O-CB 3.25Å; A18-E22 PolarHBondContact O-N 2.99Å
19	L	85.3	Confident	80.3	Confident	80 Å²	80	99.1 Å²	99.1	42%	0.419	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-33.8	178	-174.1	63.1	0	0	0	113.2	S15 K23	S15-L19 PolarHBondContact O-N 3.38Å; L19-K23 WeakPolarHBondContact O-CB 3.26Å; L19-K23 WeakPolarHBondContact O-CG 3.46Å; L19-K23 PolarHBondContact O-N 3.04Å
20	R	86.8	Confident	82.4	Confident	173 Å²	173	93.5 Å²	93.5	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-68	-44.6	172.3	-72.8	167.2	-173.8	164.4	3.1	111.8	L16 Q17 A18 E22 S24	L16-R20 WeakPolarHBondContact O-CD 3.45Å; L16-R20 VanDerWaalsContact O-CG 3.23Å; L16-R20 WeakPolarHBondContact O-CG 3.37Å; L16-R20 PolarHBondContact O-N 3.32Å; L16-R20 VanDerWaalsContact O-N 3.13Å; Q17-R20 PolarHBondContact O-N 3.35Å; A18-R20 VanDerWaalsContact C-N 3.31Å; A18-R20 PolarHBondContact O-N 3.41Å; R20-E22 VanDerWaalsContact C-N 3.32Å; R20-S24 WeakPolarHBondContact O-CB 3.49Å; R20-S24 PolarHBondContact O-N 2.71Å
21	K	89.4	Confident	84.4	Confident	146 Å²	146	92.7 Å²	92.7	64%	0.635	48%	0.48	S	S	*	.	H	α-helix	trans	-63.4	-38.7	175.9	-73	172.5	179.1	176.5	0	111.5	Q17 A18 S24 R25	Q17-K21 WeakPolarHBondContact O-CG 3.45Å; Q17-K21 PolarHBondContact O-N 3.29Å; A18-K21 PolarHBondContact O-N 2.85Å; A18-K21 VanDerWaalsContact O-N 3.12Å; K21-S24 PolarHBondContact O-N 2.75Å; K21-R25 VanDerWaalsContact O-CB 3.3Å; K21-R25 WeakPolarHBondContact O-CB 3.3Å; K21-R25 PolarHBondContact O-N 2.91Å
22	E	90.7	Very high	86.3	Confident	82 Å²	82	95.3 Å²	95.3	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-53.9	176.1	-178.7	141.1	-97.9	0	0	112.2	A18 R20 S24 R25 D26	A18-E22 WeakPolarHBondContact O-CB 3.25Å; A18-E22 PolarHBondContact O-N 2.99Å; R20-E22 VanDerWaalsContact C-N 3.32Å; E22-S24 PolarHBondContact O-N 2.96Å; E22-R25 WeakPolarHBondContact O-CB 3.46Å; E22-R25 PolarHBondContact O-N 2.94Å; E22-R25 VanDerWaalsContact O-N 3.08Å; E22-R25 IonicContact OE1-CZ 2.68Å; E22-R25 IonicContact OE1-NH1 2.72Å; E22-R25 PolarHBondContact OE1-NH1 3.27Å; E22-R25 IonicContact OE1-NH2 3.39Å; E22-R25 PolarHBondContact OE1-NH2 3.4Å; E22-D26 PolarHBondContact O-N 2.8Å
23	K	92.6	Very high	87.9	Confident	143 Å²	143	92.8 Å²	92.8	62%	0.622	47%	0.473	S	S	*	.	H	α-helix	trans	-56.3	-39	174.4	-72.8	178.4	179.2	-174.2	0	112.3	L19 A27	L19-K23 WeakPolarHBondContact O-CB 3.26Å; L19-K23 WeakPolarHBondContact O-CG 3.46Å; L19-K23 PolarHBondContact O-N 3.04Å; K23-A27 WeakPolarHBondContact O-CB 3.5Å; K23-A27 PolarHBondContact O-N 3.24Å
24	S	94.5	Very high	89.7	Confident	80 Å²	80	96.7 Å²	96.7	56%	0.559	48%	0.483	S	S	*	.	H	α-helix	trans	-66.1	-45.4	174.7	-174.6	0	0	0	0	112.5	R20 K21 E22 D26 A28	R20-S24 WeakPolarHBondContact O-CB 3.49Å; R20-S24 PolarHBondContact O-N 2.71Å; K21-S24 PolarHBondContact O-N 2.75Å; E22-S24 PolarHBondContact O-N 2.96Å; S24-D26 PolarHBondContact O-N 2.87Å; S24-A28 VanDerWaalsContact O-CB 3.24Å; S24-A28 WeakPolarHBondContact O-CB 3.48Å; S24-A28 PolarHBondContact O-N 3.43Å
25	R	94.5	Very high	91.2	Very high	117 Å²	117	97.7 Å²	97.7	44%	0.442	48%	0.482	S	S	.	.	H	α-helix	trans	-58.9	-45.1	176.7	-178.4	-169.1	70	-152.3	-6	111.6	K21 E22 A28 R29	K21-R25 VanDerWaalsContact O-CB 3.3Å; K21-R25 WeakPolarHBondContact O-CB 3.3Å; K21-R25 PolarHBondContact O-N 2.91Å; E22-R25 WeakPolarHBondContact O-CB 3.46Å; E22-R25 PolarHBondContact O-N 2.94Å; E22-R25 VanDerWaalsContact O-N 3.08Å; E22-R25 IonicContact OE1-CZ 2.68Å; E22-R25 IonicContact OE1-NH1 2.72Å; E22-R25 PolarHBondContact OE1-NH1 3.27Å; E22-R25 IonicContact OE1-NH2 3.39Å; E22-R25 PolarHBondContact OE1-NH2 3.4Å; R25-A28 PolarHBondContact O-N 3.33Å; R25-R29 WeakPolarHBondContact O-CB 3.35Å; R25-R29 PolarHBondContact O-N 3.03Å
26	D	95.5	Very high	92.3	Very high	59 Å²	59	98.5 Å²	98.5	32%	0.316	48%	0.481	S	S	.	.	H	α-helix	trans	-81	-32.1	-174.4	-62.6	-33.2	0	0	0	112	E22 S24 R29 S30	E22-D26 PolarHBondContact O-N 2.8Å; S24-D26 PolarHBondContact O-N 2.87Å; D26-R29 PolarHBondContact O-N 2.7Å; D26-R29 IonicContact OD1-CZ 3.78Å; D26-R29 IonicContact OD1-NH1 2.67Å; D26-R29 PolarHBondContact OD1-NH1 2.96Å; D26-S30 WeakPolarHBondContact O-CB 3.45Å; D26-S30 PolarHBondContact O-N 3.36Å
27	A	96.3	Very high	93.3	Very high	59 Å²	59	99.5 Å²	99.5	49%	0.488	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-40	165.2	0	0	0	0	0	112.3	K23 S30 R31	K23-A27 WeakPolarHBondContact O-CB 3.5Å; K23-A27 PolarHBondContact O-N 3.24Å; A27-S30 PolarHBondContact O-N 2.85Å; A27-R31 WeakPolarHBondContact O-CB 3.45Å; A27-R31 PolarHBondContact O-N 2.91Å
28	A	96.3	Very high	94.2	Very high	14 Å²	14	100.4 Å²	100.4	12%	0.116	49%	0.485	C	S	.	.	H	α-helix	trans	-68.5	-37.4	175.1	0	0	0	0	0	112.4	S24 R25 R32	S24-A28 VanDerWaalsContact O-CB 3.24Å; S24-A28 WeakPolarHBondContact O-CB 3.48Å; S24-A28 PolarHBondContact O-N 3.43Å; R25-A28 PolarHBondContact O-N 3.33Å; A28-R32 VanDerWaalsContact O-CG 3.32Å; A28-R32 WeakPolarHBondContact O-CG 3.49Å; A28-R32 PolarHBondContact O-N 3.24Å
29	R	96.4	Very high	95	Very high	155 Å²	155	99.7 Å²	99.7	59%	0.585	47%	0.472	S	S	*	.	H	α-helix	trans	-64.3	-45.9	172.4	-176.4	-174.6	-80.2	146.7	-19.7	111.1	R25 D26 R32 G33	R25-R29 WeakPolarHBondContact O-CB 3.35Å; R25-R29 PolarHBondContact O-N 3.03Å; D26-R29 PolarHBondContact O-N 2.7Å; D26-R29 IonicContact OD1-CZ 3.78Å; D26-R29 IonicContact OD1-NH1 2.67Å; D26-R29 PolarHBondContact OD1-NH1 2.96Å; R29-R32 PolarHBondContact O-N 2.8Å; R29-G33 PolarHBondContact O-N 2.72Å
30	S	97.4	Very high	95.5	Very high	68 Å²	68	101.7 Å²	101.7	48%	0.476	48%	0.475	S	S	.	.	H	α-helix	trans	-61.1	-44.3	175.8	-176	0	0	0	0	111.8	D26 A27 G33 K34	D26-S30 WeakPolarHBondContact O-CB 3.45Å; D26-S30 PolarHBondContact O-N 3.36Å; A27-S30 PolarHBondContact O-N 2.85Å; S30-G33 PolarHBondContact O-N 3.5Å; S30-K34 PolarHBondContact O-N 3.26Å
31	R	97.9	Very high	96	Very high	150 Å²	150	96.2 Å²	96.2	57%	0.566	46%	0.457	S	S	*	.	H	α-helix	trans	-58.5	-50.6	174.7	-173.6	177.1	68.8	-111.8	6.5	111.7	A27 G33 K34 E35	A27-R31 WeakPolarHBondContact O-CB 3.45Å; A27-R31 PolarHBondContact O-N 2.91Å; R31-G33 VanDerWaalsContact C-N 3.28Å; R31-G33 PolarHBondContact O-N 3.49Å; R31-K34 PolarHBondContact O-N 3.03Å; R31-E35 VanDerWaalsContact O-CB 3.22Å; R31-E35 WeakPolarHBondContact O-CB 3.38Å; R31-E35 PolarHBondContact O-N 3.16Å
32	R	97.7	Very high	96.4	Very high	148 Å²	148	91.8 Å²	91.8	56%	0.558	44%	0.44	S	S	*	.	H	α-helix	trans	-60.9	-35.2	176.4	-72.1	171.6	-174.5	146.9	-2.2	112.6	A28 R29 N36	A28-R32 VanDerWaalsContact O-CG 3.32Å; A28-R32 WeakPolarHBondContact O-CG 3.49Å; A28-R32 PolarHBondContact O-N 3.24Å; R29-R32 PolarHBondContact O-N 2.8Å; R32-N36 VanDerWaalsContact O-CB 3.28Å; R32-N36 WeakPolarHBondContact O-CB 3.35Å; R32-N36 PolarHBondContact O-N 3.29Å; R32-N36 PolarHBondContact O-OD1 3.41Å
33	G	97.5	Very high	96.8	Very high	42 Å²	42	88 Å²	88	43%	0.433	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-47.9	175.9	0	0	0	0	0	112.2	R29 S30 R31 F37	R29-G33 PolarHBondContact O-N 2.72Å; S30-G33 PolarHBondContact O-N 3.5Å; R31-G33 VanDerWaalsContact C-N 3.28Å; R31-G33 PolarHBondContact O-N 3.49Å; G33-F37 PolarHBondContact O-N 3.38Å; G33-F37 VanDerWaalsContact O-N 3.12Å
34	K	97.9	Very high	97	Very high	142 Å²	142	86.1 Å²	86.1	62%	0.617	41%	0.414	S	S	*	.	H	α-helix	trans	-64	-48.8	174	-67.7	-172.1	176	-166.2	0	111.7	S30 R31 N36 F37 E38	S30-K34 PolarHBondContact O-N 3.26Å; R31-K34 PolarHBondContact O-N 3.03Å; K34-N36 VanDerWaalsContact C-N 3.33Å; K34-N36 PolarHBondContact O-N 3.35Å; K34-F37 WeakPolarHBondContact O-CA 3.09Å; K34-F37 WeakPolarHBondContact O-CB 3.4Å; K34-F37 PolarHBondContact O-N 2.84Å; K34-E38 WeakPolarHBondContact O-CG 3.47Å; K34-E38 PolarHBondContact O-N 3.48Å
35	E	97.4	Very high	97.2	Very high	74 Å²	74	89 Å²	89	35%	0.346	42%	0.422	S	S	.	.	H	α-helix	trans	-51.5	-49.8	175.7	-175.3	-156	132.1	0	0	111.7	R31 F37 E38 F39 K58	R31-E35 VanDerWaalsContact O-CB 3.22Å; R31-E35 WeakPolarHBondContact O-CB 3.38Å; R31-E35 PolarHBondContact O-N 3.16Å; E35-F37 VanDerWaalsContact C-N 3.3Å; E35-F37 PolarHBondContact O-N 3.05Å; E35-E38 PolarHBondContact O-N 2.8Å; E35-F39 HydrophobicContact CG-CD2 4.04Å; E35-F39 HydrophobicContact CG-CE2 3.89Å; E35-F39 WeakPolarHBondContact O-CD2 3.46Å; E35-F39 PolarHBondContact O-N 3.35Å; E35-K58 IonicContact OE1-NZ 3.12Å; E35-K58 PolarHBondContact OE1-NZ 2.72Å
36	N	97.1	Very high	97.3	Very high	85 Å²	85	84 Å²	84	46%	0.455	41%	0.405	S	S	.	.	H	α-helix	trans	-61.4	-35.8	176.2	-73.3	2.2	0	0	0	113	R32 K34 Y40 K58	R32-N36 VanDerWaalsContact O-CB 3.28Å; R32-N36 WeakPolarHBondContact O-CB 3.35Å; R32-N36 PolarHBondContact O-N 3.29Å; R32-N36 PolarHBondContact O-OD1 3.41Å; K34-N36 VanDerWaalsContact C-N 3.33Å; K34-N36 PolarHBondContact O-N 3.35Å; N36-Y40 WeakPolarHBondContact O-CB 3.37Å; N36-Y40 PolarHBondContact O-N 2.9Å; N36-Y40 VanDerWaalsContact O-N 3.08Å; N36-K58 VanDerWaalsContact OD1-CE 3.27Å; N36-K58 WeakPolarHBondContact OD1-CE 3.3Å; N36-K58 PolarHBondContact OD1-NZ 2.91Å
37	F	97.6	Very high	97.3	Very high	115 Å²	115	85.4 Å²	85.4	50%	0.504	42%	0.417	S	S	.	.	H	α-helix	trans	-67.2	-48.7	175.8	174.5	-96.7	0	0	0	111.3	G33 K34 E35 F39 Y40 E41	G33-F37 PolarHBondContact O-N 3.38Å; G33-F37 VanDerWaalsContact O-N 3.12Å; K34-F37 WeakPolarHBondContact O-CA 3.09Å; K34-F37 WeakPolarHBondContact O-CB 3.4Å; K34-F37 PolarHBondContact O-N 2.84Å; E35-F37 VanDerWaalsContact C-N 3.3Å; E35-F37 PolarHBondContact O-N 3.05Å; F37-F39 VanDerWaalsContact C-N 3.28Å; F37-F39 PolarHBondContact O-N 3Å; F37-Y40 PolarHBondContact O-N 2.99Å; F37-E41 HydrophobicContact CD1-CG 4.3Å; F37-E41 HydrophobicContact CD2-CG 4.4Å; F37-E41 HydrophobicContact CE1-CG 3.8Å; F37-E41 HydrophobicContact CE2-CG 3.91Å; F37-E41 WeakPolarHBondContact CE2-OE1 3.45Å; F37-E41 HydrophobicContact CZ-CG 3.58Å; F37-E41 PolarHBondContact O-N 2.67Å
38	E	98.2	Very high	97.3	Very high	120 Å²	120	84.3 Å²	84.3	56%	0.561	40%	0.402	S	S	*	.	H	α-helix	trans	-59.3	-39.3	175.8	-55.4	-50.9	143.8	0	0	111.7	K34 E35 Y40 L42	K34-E38 WeakPolarHBondContact O-CG 3.47Å; K34-E38 PolarHBondContact O-N 3.48Å; E35-E38 PolarHBondContact O-N 2.8Å; E38-Y40 VanDerWaalsContact C-N 3.33Å; E38-Y40 PolarHBondContact O-N 3.04Å; E38-L42 WeakPolarHBondContact O-CB 3.43Å; E38-L42 PolarHBondContact O-N 2.83Å
39	F	98.1	Very high	97.3	Very high	41 Å²	41	87.6 Å²	87.6	18%	0.18	42%	0.423	C	S	.	.	H	α-helix	trans	-59.6	-41.3	172.5	-91.6	-70.3	0	0	0	112.7	E35 F37 A43 K58 I61 I62	E35-F39 HydrophobicContact CG-CD2 4.04Å; E35-F39 HydrophobicContact CG-CE2 3.89Å; E35-F39 WeakPolarHBondContact O-CD2 3.46Å; E35-F39 PolarHBondContact O-N 3.35Å; F37-F39 VanDerWaalsContact C-N 3.28Å; F37-F39 PolarHBondContact O-N 3Å; F39-A43 WeakPolarHBondContact O-CB 3.43Å; F39-A43 PolarHBondContact O-N 2.72Å; F39-K58 HydrophobicContact CD1-CB 4.09Å; F39-K58 HydrophobicContact CD1-CD 4.45Å; F39-K58 HydrophobicContact CD1-CG 3.85Å; F39-K58 HydrophobicContact CD2-CD 3.76Å; F39-K58 VanDerWaalsContact CD2-CE 3.42Å; F39-K58 HydrophobicContact CD2-CG 4.02Å; F39-K58 HydrophobicContact CE1-CB 3.69Å; F39-K58 HydrophobicContact CE1-CD 4.28Å; F39-K58 HydrophobicContact CE1-CG 3.87Å; F39-K58 WeakPolarHBondContact CE1-O 3.25Å; F39-K58 HydrophobicContact CE2-CB 4.47Å; F39-K58 HydrophobicContact CE2-CD 3.6Å; F39-K58 HydrophobicContact CE2-CG 4.07Å; F39-K58 HydrophobicContact CG-CD 4.21Å; F39-K58 HydrophobicContact CG-CG 3.94Å; F39-K58 HydrophobicContact CZ-CB 3.92Å; F39-K58 HydrophobicContact CZ-CD 3.88Å; F39-K58 HydrophobicContact CZ-CG 4Å; F39-I61 HydrophobicContact CD1-CB 4.31Å; F39-I61 HydrophobicContact CD1-CD1 4.25Å; F39-I61 HydrophobicContact CD1-CG2 4.16Å; F39-I62 HydrophobicContact CE1-CD1 3.73Å; F39-I62 HydrophobicContact CE1-CG1 3.79Å; F39-I62 HydrophobicContact CZ-CD1 4.3Å; F39-I62 HydrophobicContact CZ-CG1 4.33Å
40	Y	96.1	Very high	97.2	Very high	122 Å²	122	83.9 Å²	83.9	48%	0.478	43%	0.425	S	S	.	.	H	α-helix	trans	-73.3	-40.9	-178.6	-170.7	-113.8	0	0	0	112.3	N36 F37 E38 A43 K44	N36-Y40 WeakPolarHBondContact O-CB 3.37Å; N36-Y40 PolarHBondContact O-N 2.9Å; N36-Y40 VanDerWaalsContact O-N 3.08Å; F37-Y40 PolarHBondContact O-N 2.99Å; E38-Y40 VanDerWaalsContact C-N 3.33Å; E38-Y40 PolarHBondContact O-N 3.04Å; Y40-A43 PolarHBondContact O-N 2.83Å; Y40-K44 WeakPolarHBondContact O-CG 3.31Å; Y40-K44 PolarHBondContact O-N 2.77Å
41	E	97.8	Very high	97.1	Very high	59 Å²	59	84 Å²	84	28%	0.276	43%	0.43	S	S	.	.	H	α-helix	trans	-65.8	-40.4	172.5	-60.5	-47.8	124.6	0	0	111.5	F37 A43 K44 L45	F37-E41 HydrophobicContact CD1-CG 4.3Å; F37-E41 HydrophobicContact CD2-CG 4.4Å; F37-E41 HydrophobicContact CE1-CG 3.8Å; F37-E41 HydrophobicContact CE2-CG 3.91Å; F37-E41 WeakPolarHBondContact CE2-OE1 3.45Å; F37-E41 HydrophobicContact CZ-CG 3.58Å; F37-E41 PolarHBondContact O-N 2.67Å; E41-A43 VanDerWaalsContact C-N 3.33Å; E41-A43 PolarHBondContact O-N 2.8Å; E41-K44 PolarHBondContact O-N 3.05Å; E41-K44 WeakPolarHBondContact OE1-CE 3.48Å; E41-K44 IonicContact OE1-NZ 3.43Å; E41-K44 PolarHBondContact OE1-NZ 2.64Å; E41-K44 IonicContact OE2-NZ 2.61Å; E41-K44 PolarHBondContact OE2-NZ 3.24Å; E41-L45 WeakPolarHBondContact O-CG 3.45Å; E41-L45 PolarHBondContact O-N 3.14Å
42	L	98.1	Very high	96.9	Very high	52 Å²	52	80.2 Å²	80.2	27%	0.272	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-39.3	174.2	-178.1	59.2	0	0	0	112.2	E38 K44 L45 I61 I62 T65	E38-L42 WeakPolarHBondContact O-CB 3.43Å; E38-L42 PolarHBondContact O-N 2.83Å; L42-K44 PolarHBondContact O-N 3.37Å; L42-L45 PolarHBondContact O-N 3.4Å; L42-L45 VanDerWaalsContact O-N 3.17Å; L42-I61 HydrophobicContact CB-CG2 4.27Å; L42-I61 HydrophobicContact CD2-CG2 3.9Å; L42-I61 HydrophobicContact CG-CG2 3.9Å; L42-I62 HydrophobicContact CD2-CD1 4.13Å; L42-T65 HydrophobicContact CD1-CG2 4Å; L42-T65 HydrophobicContact CD2-CG2 4.44Å
43	A	97.9	Very high	96.8	Very high	2 Å²	2	73.6 Å²	73.6	2%	0.017	40%	0.396	C	S	.	.	H	α-helix	trans	-61.6	-40.7	175.7	0	0	0	0	0	112.3	F39 Y40 E41 L45 L46 T53 I61	F39-A43 WeakPolarHBondContact O-CB 3.43Å; F39-A43 PolarHBondContact O-N 2.72Å; Y40-A43 PolarHBondContact O-N 2.83Å; E41-A43 VanDerWaalsContact C-N 3.33Å; E41-A43 PolarHBondContact O-N 2.8Å; A43-L45 PolarHBondContact O-N 2.91Å; A43-L46 WeakPolarHBondContact O-CB 3.35Å; A43-L46 PolarHBondContact O-N 2.97Å; A43-T53 VanDerWaalsContact O-CB 3.26Å; A43-T53 WeakPolarHBondContact O-CB 3.44Å; A43-T53 VanDerWaalsContact O-CG2 3.28Å; A43-T53 WeakPolarHBondContact O-CG2 3.47Å; A43-I61 HydrophobicContact CB-CD1 3.86Å; A43-I61 HydrophobicContact CB-CG1 3.98Å; A43-I61 HydrophobicContact CB-CG2 4.48Å
44	K	97.3	Very high	96.6	Very high	105 Å²	105	74.7 Å²	74.7	46%	0.457	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-25.9	175.4	-65.3	175.1	-162.1	167.3	0	113.6	Y40 E41 L42 L46	Y40-K44 WeakPolarHBondContact O-CG 3.31Å; Y40-K44 PolarHBondContact O-N 2.77Å; E41-K44 PolarHBondContact O-N 3.05Å; E41-K44 WeakPolarHBondContact OE1-CE 3.48Å; E41-K44 IonicContact OE1-NZ 3.43Å; E41-K44 PolarHBondContact OE1-NZ 2.64Å; E41-K44 IonicContact OE2-NZ 2.61Å; E41-K44 PolarHBondContact OE2-NZ 3.24Å; L42-K44 PolarHBondContact O-N 3.37Å; K44-L46 VanDerWaalsContact C-N 3.35Å
45	L	97.4	Very high	96.5	Very high	139 Å²	139	75.7 Å²	75.7	73%	0.728	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.1	-179.1	-65.6	171.9	0	0	0	113.4	E41 L42 A43	E41-L45 WeakPolarHBondContact O-CG 3.45Å; E41-L45 PolarHBondContact O-N 3.14Å; L42-L45 PolarHBondContact O-N 3.4Å; L42-L45 VanDerWaalsContact O-N 3.17Å; A43-L45 PolarHBondContact O-N 2.91Å
46	L	97.4	Very high	96.5	Very high	13 Å²	13	73.5 Å²	73.5	7%	0.068	40%	0.395	C	S	.	.	S	Bend	trans	-70.5	145.4	172.3	-66.5	173.2	0	0	0	110.7	A43 K44 L48 T53 L56 L64	A43-L46 WeakPolarHBondContact O-CB 3.35Å; A43-L46 PolarHBondContact O-N 2.97Å; K44-L46 VanDerWaalsContact C-N 3.35Å; L46-L48 PolarHBondContact O-N 2.74Å; L46-T53 HydrophobicContact CB-CG2 4.16Å; L46-L56 HydrophobicContact CD1-CD1 3.57Å; L46-L64 HydrophobicContact CD1-CB 4Å; L46-L64 HydrophobicContact CD1-CD1 3.98Å; L46-L64 HydrophobicContact CD2-CB 3.94Å
47	P	95.9	Very high	96.5	Very high	88 Å²	88	73.6 Å²	73.6	57%	0.571	40%	0.395	S	S	*	.	S	Bend	trans	-78.4	56.1	-179.6	36	-39.3	0	0	0	111.8	Y68	P47-Y68 HydrophobicContact CB-CE2 4.47Å; P47-Y68 HydrophobicContact CG-CD2 3.71Å; P47-Y68 HydrophobicContact CG-CE2 3.87Å; P47-Y68 HydrophobicContact CG-CG 4.4Å
48	L	95.5	Very high	96.4	Very high	36 Å²	36	71.9 Å²	71.9	19%	0.188	39%	0.388	C	S	.	.	S	Bend	trans	-136.4	151.2	-176.6	-68.8	174.8	0	0	0	110.3	L46 T53 L64 V155	L46-L48 PolarHBondContact O-N 2.74Å; L48-T53 HydrophobicContact CB-CG2 3.61Å; L48-L64 HydrophobicContact CD1-CD1 3.92Å; L48-V155 HydrophobicContact CD1-CG2 4.01Å
49	P	95.9	Very high	96.4	Very high	84 Å²	84	69.3 Å²	69.3	55%	0.545	39%	0.387	S	S	.	.			trans	-54.7	139.9	175.4	-27.1	34.7	0	0	0	113.2	A51 I52 T53	P49-A51 PolarHBondContact O-N 3.09Å; P49-A51 VanDerWaalsContact O-N 3.08Å; P49-I52 HydrophobicContact CG-CD1 4.43Å; P49-I52 WeakPolarHBondContact O-CA 3.42Å; P49-I52 WeakPolarHBondContact O-CB 3.14Å; P49-I52 PolarHBondContact O-N 3.4Å; P49-T53 PolarHBondContact O-N 3Å; P49-T53 VanDerWaalsContact O-N 3.14Å
50	A	94.6	Very high	96.4	Very high	77 Å²	77	68 Å²	68	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-57.3	-28.1	-177.8	0	0	0	0	0	114.1	I52 T53 S54	A50-I52 PolarHBondContact O-N 3.19Å; A50-T53 WeakPolarHBondContact CA-OG1 3.07Å; A50-S54 WeakPolarHBondContact O-CB 3.17Å; A50-S54 PolarHBondContact O-N 3.29Å; A50-S54 PolarHBondContact O-OG 3.08Å
51	A	95.2	Very high	96.5	Very high	69 Å²	69	62.5 Å²	62.5	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-64.4	-25.2	174.2	0	0	0	0	0	113.5	P49 Q55	P49-A51 PolarHBondContact O-N 3.09Å; P49-A51 VanDerWaalsContact O-N 3.08Å; A51-Q55 PolarHBondContact O-NE2 2.72Å
52	I	95.1	Very high	96.5	Very high	72 Å²	72	63 Å²	63	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-90.6	-50.3	175.6	-58.1	-178.1	0	0	0	109.8	P49 A50 S54 Q55 L56 V155	P49-I52 HydrophobicContact CG-CD1 4.43Å; P49-I52 WeakPolarHBondContact O-CA 3.42Å; P49-I52 WeakPolarHBondContact O-CB 3.14Å; P49-I52 PolarHBondContact O-N 3.4Å; A50-I52 PolarHBondContact O-N 3.19Å; I52-S54 VanDerWaalsContact C-N 3.26Å; I52-S54 PolarHBondContact O-N 2.67Å; I52-Q55 PolarHBondContact O-N 3.06Å; I52-L56 HydrophobicContact CG2-CD2 4.42Å; I52-V155 HydrophobicContact CG2-CG2 3.9Å
53	T	95.4	Very high	96.5	Very high	8 Å²	8	63.3 Å²	63.3	5%	0.049	36%	0.363	C	S	.	.	H	α-helix	trans	-63.5	-30.8	-173.2	58.9	0	0	0	0	113.7	A43 L46 L48 P49 A50 Q55 L56	A43-T53 VanDerWaalsContact O-CB 3.26Å; A43-T53 WeakPolarHBondContact O-CB 3.44Å; A43-T53 VanDerWaalsContact O-CG2 3.28Å; A43-T53 WeakPolarHBondContact O-CG2 3.47Å; L46-T53 HydrophobicContact CB-CG2 4.16Å; L48-T53 HydrophobicContact CB-CG2 3.61Å; P49-T53 PolarHBondContact O-N 3Å; P49-T53 VanDerWaalsContact O-N 3.14Å; A50-T53 WeakPolarHBondContact CA-OG1 3.07Å; T53-Q55 PolarHBondContact O-N 2.87Å; T53-L56 HydrophobicContact CG2-CD1 4.38Å; T53-L56 PolarHBondContact O-N 2.99Å
54	S	93.7	Very high	96.5	Very high	66 Å²	66	63.9 Å²	63.9	46%	0.462	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-12.9	174.4	52.7	0	0	0	0	115	A50 I52	A50-S54 WeakPolarHBondContact O-CB 3.17Å; A50-S54 PolarHBondContact O-N 3.29Å; A50-S54 PolarHBondContact O-OG 3.08Å; I52-S54 VanDerWaalsContact C-N 3.26Å; I52-S54 PolarHBondContact O-N 2.67Å
55	Q	95	Very high	96.6	Very high	162 Å²	162	60.1 Å²	60.1	76%	0.757	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	1.9	-177.3	-59.5	-175.8	59	0	0	113.6	A51 I52 T53	A51-Q55 PolarHBondContact O-NE2 2.72Å; I52-Q55 PolarHBondContact O-N 3.06Å; T53-Q55 PolarHBondContact O-N 2.87Å
56	L	96.6	Very high	96.6	Very high	29 Å²	29	57.8 Å²	57.8	15%	0.152	34%	0.339	C	S	.	.			trans	-71.2	141.3	-177.7	-65.2	173.6	0	0	0	112.5	L46 I52 T53 I61 L64 V155	L46-L56 HydrophobicContact CD1-CD1 3.57Å; I52-L56 HydrophobicContact CG2-CD2 4.42Å; T53-L56 HydrophobicContact CG2-CD1 4.38Å; T53-L56 PolarHBondContact O-N 2.99Å; L56-I61 HydrophobicContact CB-CD1 4.17Å; L56-I61 HydrophobicContact CB-CG1 3.68Å; L56-I61 HydrophobicContact CD1-CG1 4.12Å; L56-L64 HydrophobicContact CD1-CD1 3.84Å; L56-L64 HydrophobicContact CD2-CD1 4.1Å; L56-V155 HydrophobicContact CD2-CG1 3.53Å; L56-V155 HydrophobicContact CD2-CG2 4.48Å
57	D	96.9	Very high	96.7	Very high	86 Å²	86	57.5 Å²	57.5	46%	0.46	34%	0.338	S	S	.	.			trans	-75	159.5	166.6	78.8	-87.3	0	0	0	111.7	A59 S60 I61	D57-A59 VanDerWaalsContact C-N 3.33Å; D57-A59 PolarHBondContact O-N 2.83Å; D57-A59 WeakPolarHBondContact OD2-CA 3.39Å; D57-A59 VanDerWaalsContact OD2-CB 3.3Å; D57-A59 WeakPolarHBondContact OD2-CB 3.42Å; D57-A59 PolarHBondContact OD2-N 2.74Å; D57-S60 PolarHBondContact O-N 3.03Å; D57-S60 WeakPolarHBondContact OD1-CB 3.31Å; D57-S60 PolarHBondContact OD1-OG 3.46Å; D57-S60 PolarHBondContact OD2-N 3.12Å; D57-I61 WeakPolarHBondContact O-CG1 3.48Å; D57-I61 PolarHBondContact O-N 3.16Å
58	K	97.2	Very high	96.8	Very high	79 Å²	79	58.2 Å²	58.2	34%	0.343	33%	0.33	S	S	.	.	H	α-helix	trans	-58.3	-38.1	-178.3	-74.7	-173.4	168.9	-175.9	0	114.3	E35 N36 F39 I61 I62	E35-K58 IonicContact OE1-NZ 3.12Å; E35-K58 PolarHBondContact OE1-NZ 2.72Å; N36-K58 VanDerWaalsContact OD1-CE 3.27Å; N36-K58 WeakPolarHBondContact OD1-CE 3.3Å; N36-K58 PolarHBondContact OD1-NZ 2.91Å; F39-K58 HydrophobicContact CD1-CB 4.09Å; F39-K58 HydrophobicContact CD1-CD 4.45Å; F39-K58 HydrophobicContact CD1-CG 3.85Å; F39-K58 HydrophobicContact CD2-CD 3.76Å; F39-K58 VanDerWaalsContact CD2-CE 3.42Å; F39-K58 HydrophobicContact CD2-CG 4.02Å; F39-K58 HydrophobicContact CE1-CB 3.69Å; F39-K58 HydrophobicContact CE1-CD 4.28Å; F39-K58 HydrophobicContact CE1-CG 3.87Å; F39-K58 WeakPolarHBondContact CE1-O 3.25Å; F39-K58 HydrophobicContact CE2-CB 4.47Å; F39-K58 HydrophobicContact CE2-CD 3.6Å; F39-K58 HydrophobicContact CE2-CG 4.07Å; F39-K58 HydrophobicContact CG-CD 4.21Å; F39-K58 HydrophobicContact CG-CG 3.94Å; F39-K58 HydrophobicContact CZ-CB 3.92Å; F39-K58 HydrophobicContact CZ-CD 3.88Å; F39-K58 HydrophobicContact CZ-CG 4Å; K58-I61 PolarHBondContact O-N 3.25Å; K58-I62 PolarHBondContact O-N 2.92Å
59	A	97.8	Very high	96.9	Very high	66 Å²	66	60.2 Å²	60.2	55%	0.545	34%	0.341	S	S	.	.	H	α-helix	trans	-72.3	-41.1	-179	0	0	0	0	0	110.5	D57 I61 I62 R63	D57-A59 VanDerWaalsContact C-N 3.33Å; D57-A59 PolarHBondContact O-N 2.83Å; D57-A59 WeakPolarHBondContact OD2-CA 3.39Å; D57-A59 VanDerWaalsContact OD2-CB 3.3Å; D57-A59 WeakPolarHBondContact OD2-CB 3.42Å; D57-A59 PolarHBondContact OD2-N 2.74Å; A59-I61 PolarHBondContact O-N 2.76Å; A59-I62 PolarHBondContact O-N 2.95Å; A59-R63 WeakPolarHBondContact O-CB 3.47Å; A59-R63 PolarHBondContact O-N 3.24Å
60	S	97.4	Very high	96.9	Very high	13 Å²	13	60.2 Å²	60.2	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-37.7	172.4	-64.8	0	0	0	0	112.9	D57 I62 R63 L64	D57-S60 PolarHBondContact O-N 3.03Å; D57-S60 WeakPolarHBondContact OD1-CB 3.31Å; D57-S60 PolarHBondContact OD1-OG 3.46Å; D57-S60 PolarHBondContact OD2-N 3.12Å; S60-I62 PolarHBondContact O-N 3.29Å; S60-R63 PolarHBondContact O-N 3.24Å; S60-R63 PolarHBondContact OG-NH2 3.16Å; S60-L64 VanDerWaalsContact O-CB 3.29Å; S60-L64 WeakPolarHBondContact O-CB 3.46Å; S60-L64 WeakPolarHBondContact O-CG 3.49Å; S60-L64 PolarHBondContact O-N 2.88Å
61	I	98.4	Very high	96.9	Very high	8 Å²	8	57.8 Å²	57.8	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-56.6	-52.2	174.1	-67.2	161	0	0	0	110.4	F39 L42 A43 L56 D57 K58 A59 T65	F39-I61 HydrophobicContact CD1-CB 4.31Å; F39-I61 HydrophobicContact CD1-CD1 4.25Å; F39-I61 HydrophobicContact CD1-CG2 4.16Å; L42-I61 HydrophobicContact CB-CG2 4.27Å; L42-I61 HydrophobicContact CD2-CG2 3.9Å; L42-I61 HydrophobicContact CG-CG2 3.9Å; A43-I61 HydrophobicContact CB-CD1 3.86Å; A43-I61 HydrophobicContact CB-CG1 3.98Å; A43-I61 HydrophobicContact CB-CG2 4.48Å; L56-I61 HydrophobicContact CB-CD1 4.17Å; L56-I61 HydrophobicContact CB-CG1 3.68Å; L56-I61 HydrophobicContact CD1-CG1 4.12Å; D57-I61 WeakPolarHBondContact O-CG1 3.48Å; D57-I61 PolarHBondContact O-N 3.16Å; K58-I61 PolarHBondContact O-N 3.25Å; A59-I61 PolarHBondContact O-N 2.76Å; I61-T65 WeakPolarHBondContact O-CB 3.33Å; I61-T65 PolarHBondContact O-N 3.41Å; I61-T65 PolarHBondContact O-OG1 3.36Å
62	I	98.4	Very high	96.8	Very high	70 Å²	70	60.6 Å²	60.6	36%	0.359	30%	0.304	S	S	.	.	H	α-helix	trans	-63.4	-45	178.1	-58.8	-54.1	0	0	0	111.9	F39 L42 K58 A59 S60 L64 T65 I66	F39-I62 HydrophobicContact CE1-CD1 3.73Å; F39-I62 HydrophobicContact CE1-CG1 3.79Å; F39-I62 HydrophobicContact CZ-CD1 4.3Å; F39-I62 HydrophobicContact CZ-CG1 4.33Å; L42-I62 HydrophobicContact CD2-CD1 4.13Å; K58-I62 PolarHBondContact O-N 2.92Å; A59-I62 PolarHBondContact O-N 2.95Å; S60-I62 PolarHBondContact O-N 3.29Å; I62-L64 PolarHBondContact O-N 3.44Å; I62-T65 PolarHBondContact O-N 2.93Å; I62-I66 HydrophobicContact CG2-CD1 3.6Å; I62-I66 HydrophobicContact CG2-CG1 4.17Å; I62-I66 WeakPolarHBondContact O-CB 3.47Å; I62-I66 WeakPolarHBondContact O-CG1 3.45Å; I62-I66 PolarHBondContact O-N 3.39Å
63	R	98.1	Very high	96.6	Very high	58 Å²	58	61.4 Å²	61.4	22%	0.219	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-43.7	-178.7	-175.9	169.8	57.8	91.1	10.1	111.6	A59 S60 S67 V155 E156 T158 S160	A59-R63 WeakPolarHBondContact O-CB 3.47Å; A59-R63 PolarHBondContact O-N 3.24Å; S60-R63 PolarHBondContact O-N 3.24Å; S60-R63 PolarHBondContact OG-NH2 3.16Å; R63-S67 VanDerWaalsContact O-CB 3.31Å; R63-S67 WeakPolarHBondContact O-CB 3.49Å; R63-S67 PolarHBondContact O-N 3.09Å; R63-S67 PolarHBondContact O-OG 3.3Å; R63-V155 PolarHBondContact NH1-O 2.83Å; R63-V155 PolarHBondContact NH2-O 3.28Å; R63-E156 PolarHBondContact NH1-O 2.93Å; R63-T158 PolarHBondContact NH1-O 2.86Å; R63-S160 PolarHBondContact NH1-OG 2.82Å
64	L	98.4	Very high	96.5	Very high	13 Å²	13	61.4 Å²	61.4	7%	0.068	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-42.3	174.1	-67.6	172.7	0	0	0	112	L46 L48 L56 S60 I62 S67 Y68 V155 T158	L46-L64 HydrophobicContact CD1-CB 4Å; L46-L64 HydrophobicContact CD1-CD1 3.98Å; L46-L64 HydrophobicContact CD2-CB 3.94Å; L48-L64 HydrophobicContact CD1-CD1 3.92Å; L56-L64 HydrophobicContact CD1-CD1 3.84Å; L56-L64 HydrophobicContact CD2-CD1 4.1Å; S60-L64 VanDerWaalsContact O-CB 3.29Å; S60-L64 WeakPolarHBondContact O-CB 3.46Å; S60-L64 WeakPolarHBondContact O-CG 3.49Å; S60-L64 PolarHBondContact O-N 2.88Å; I62-L64 PolarHBondContact O-N 3.44Å; L64-S67 PolarHBondContact O-N 3.11Å; L64-Y68 VanDerWaalsContact O-CB 3.31Å; L64-Y68 WeakPolarHBondContact O-CB 3.34Å; L64-Y68 PolarHBondContact O-N 2.8Å; L64-V155 HydrophobicContact CD1-CG1 4.31Å; L64-T158 HydrophobicContact CD2-CG2 3.82Å
65	T	98.4	Very high	96.3	Very high	27 Å²	27	58.9 Å²	58.9	17%	0.166	29%	0.291	C	S	.	.	H	α-helix	trans	-60.2	-48.7	176	-60.1	0	0	0	0	111.8	L42 I61 I62 S67 Y68 L69	L42-T65 HydrophobicContact CD1-CG2 4Å; L42-T65 HydrophobicContact CD2-CG2 4.44Å; I61-T65 WeakPolarHBondContact O-CB 3.33Å; I61-T65 PolarHBondContact O-N 3.41Å; I61-T65 PolarHBondContact O-OG1 3.36Å; I62-T65 PolarHBondContact O-N 2.93Å; T65-S67 VanDerWaalsContact C-N 3.33Å; T65-S67 PolarHBondContact O-N 3.19Å; T65-Y68 PolarHBondContact O-N 2.94Å; T65-L69 HydrophobicContact CG2-CD1 4.03Å; T65-L69 WeakPolarHBondContact O-CB 3.24Å; T65-L69 VanDerWaalsContact O-CG 3.3Å; T65-L69 WeakPolarHBondContact O-CG 3.44Å; T65-L69 PolarHBondContact O-N 3.33Å
66	I	98.3	Very high	96	Very high	90 Å²	90	54.7 Å²	54.7	46%	0.462	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-44.5	178.1	-69.7	173.3	0	0	0	110.3	I62 L69 K70	I62-I66 HydrophobicContact CG2-CD1 3.6Å; I62-I66 HydrophobicContact CG2-CG1 4.17Å; I62-I66 WeakPolarHBondContact O-CB 3.47Å; I62-I66 WeakPolarHBondContact O-CG1 3.45Å; I62-I66 PolarHBondContact O-N 3.39Å; I66-L69 PolarHBondContact O-N 2.99Å; I66-K70 PolarHBondContact O-N 3Å
67	S	98.2	Very high	95.4	Very high	7 Å²	7	56 Å²	56	5%	0.049	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-43.5	-179.3	-55	0	0	0	0	111.8	R63 L64 T65 L69 K70 M71 G159	R63-S67 VanDerWaalsContact O-CB 3.31Å; R63-S67 WeakPolarHBondContact O-CB 3.49Å; R63-S67 PolarHBondContact O-N 3.09Å; R63-S67 PolarHBondContact O-OG 3.3Å; L64-S67 PolarHBondContact O-N 3.11Å; T65-S67 VanDerWaalsContact C-N 3.33Å; T65-S67 PolarHBondContact O-N 3.19Å; S67-L69 PolarHBondContact O-N 3.42Å; S67-K70 PolarHBondContact O-N 2.74Å; S67-M71 WeakPolarHBondContact O-CB 3.31Å; S67-M71 PolarHBondContact O-N 2.74Å; S67-G159 WeakPolarHBondContact OG-CA 3.18Å; S67-G159 PolarHBondContact OG-N 3.41Å
68	Y	97.9	Very high	94.3	Very high	102 Å²	102	52.1 Å²	52.1	40%	0.4	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-42.1	174.3	174.2	-105.4	0	0	0	112.4	P47 L64 T65 M71 R72	P47-Y68 HydrophobicContact CB-CE2 4.47Å; P47-Y68 HydrophobicContact CG-CD2 3.71Å; P47-Y68 HydrophobicContact CG-CE2 3.87Å; P47-Y68 HydrophobicContact CG-CG 4.4Å; L64-Y68 VanDerWaalsContact O-CB 3.31Å; L64-Y68 WeakPolarHBondContact O-CB 3.34Å; L64-Y68 PolarHBondContact O-N 2.8Å; T65-Y68 PolarHBondContact O-N 2.94Å; Y68-M71 PolarHBondContact O-N 2.63Å; Y68-R72 WeakPolarHBondContact O-CB 3.36Å; Y68-R72 PolarHBondContact O-N 3.05Å
69	L	97.6	Very high	93.3	Very high	78 Å²	78	54.8 Å²	54.8	41%	0.408	28%	0.278	S	S	.	.	H	α-helix	trans	-66.5	-46.5	176.8	-69.6	172.7	0	0	0	111.8	T65 I66 S67 M71 R72 D73	T65-L69 HydrophobicContact CG2-CD1 4.03Å; T65-L69 WeakPolarHBondContact O-CB 3.24Å; T65-L69 VanDerWaalsContact O-CG 3.3Å; T65-L69 WeakPolarHBondContact O-CG 3.44Å; T65-L69 PolarHBondContact O-N 3.33Å; I66-L69 PolarHBondContact O-N 2.99Å; S67-L69 PolarHBondContact O-N 3.42Å; L69-M71 VanDerWaalsContact C-N 3.32Å; L69-M71 PolarHBondContact O-N 2.85Å; L69-R72 PolarHBondContact O-N 3.4Å; L69-D73 WeakPolarHBondContact O-CB 3.39Å; L69-D73 PolarHBondContact O-N 3.31Å; L69-D73 VanDerWaalsContact O-N 3.07Å
70	K	95.9	Very high	92.3	Very high	84 Å²	84	56 Å²	56	37%	0.365	28%	0.279	S	S	.	.	H	α-helix	trans	-60.8	-38.9	172.5	-79.5	-161.9	174.3	-162	0	111.8	I66 S67 D73 F74 E136 L140	I66-K70 PolarHBondContact O-N 3Å; S67-K70 PolarHBondContact O-N 2.74Å; K70-D73 PolarHBondContact O-N 3.12Å; K70-F74 VanDerWaalsContact O-CB 3.31Å; K70-F74 WeakPolarHBondContact O-CB 3.34Å; K70-F74 PolarHBondContact O-N 3.44Å; K70-E136 IonicContact NZ-OE1 3.97Å; K70-E136 IonicContact NZ-OE2 2.65Å; K70-E136 PolarHBondContact NZ-OE2 2.94Å; K70-L140 HydrophobicContact CB-CD2 3.55Å; K70-L140 HydrophobicContact CD-CD2 4.09Å; K70-L140 HydrophobicContact CG-CD2 4.47Å
71	M	95.4	Very high	91.6	Very high	27 Å²	27	58.4 Å²	58.4	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-66.2	-43	179.2	-177	58.5	-177.3	0	0	112	S67 Y68 L69 D73 F74 A75 W82 A132 L140 Y141	S67-M71 WeakPolarHBondContact O-CB 3.31Å; S67-M71 PolarHBondContact O-N 2.74Å; Y68-M71 PolarHBondContact O-N 2.63Å; L69-M71 VanDerWaalsContact C-N 3.32Å; L69-M71 PolarHBondContact O-N 2.85Å; M71-D73 VanDerWaalsContact C-N 3.32Å; M71-D73 PolarHBondContact O-N 3.38Å; M71-F74 PolarHBondContact O-N 2.85Å; M71-F74 HydrophobicContact SD-CD1 4.46Å; M71-A75 VanDerWaalsContact O-CB 3.27Å; M71-A75 WeakPolarHBondContact O-CB 3.34Å; M71-A75 PolarHBondContact O-N 2.74Å; M71-W82 HydrophobicContact CE-CE3 4.27Å; M71-W82 HydrophobicContact CE-CH2 4.4Å; M71-W82 HydrophobicContact CE-CZ3 3.52Å; M71-A132 HydrophobicContact CE-CB 4.14Å; M71-A132 HydrophobicContact SD-CB 4.13Å; M71-L140 HydrophobicContact CB-CB 4.02Å; M71-L140 HydrophobicContact CG-CB 4.34Å; M71-L140 HydrophobicContact SD-CB 3.57Å; M71-L140 VanDerWaalsContact SD-CB 3.57Å; M71-L140 HydrophobicContact SD-CD1 4.45Å; M71-Y141 VanDerWaalsContact CE-CB 3.4Å; M71-Y141 HydrophobicContact CE-CG 3.99Å
72	R	93.3	Very high	90.9	Very high	128 Å²	128	63.4 Å²	63.4	48%	0.483	31%	0.313	S	S	.	.	H	α-helix	trans	-64.5	-38.1	174.8	-171.2	179	68	-177.8	1.7	111.6	Y68 L69 N76	Y68-R72 WeakPolarHBondContact O-CB 3.36Å; Y68-R72 PolarHBondContact O-N 3.05Å; L69-R72 PolarHBondContact O-N 3.4Å; R72-N76 PolarHBondContact O-N 3.23Å; R72-N76 PolarHBondContact O-ND2 3.21Å
73	D	91.3	Very high	89.6	Confident	89 Å²	89	64.6 Å²	64.6	48%	0.476	32%	0.321	S	S	.	.	H	α-helix	trans	-67.9	-44.4	175.6	-167.5	51.2	0	0	0	111.8	L69 K70 M71 N76 Q77	L69-D73 WeakPolarHBondContact O-CB 3.39Å; L69-D73 PolarHBondContact O-N 3.31Å; L69-D73 VanDerWaalsContact O-N 3.07Å; K70-D73 PolarHBondContact O-N 3.12Å; M71-D73 VanDerWaalsContact C-N 3.32Å; M71-D73 PolarHBondContact O-N 3.38Å; D73-N76 PolarHBondContact O-N 3.42Å; D73-Q77 WeakPolarHBondContact O-CG 3.41Å; D73-Q77 PolarHBondContact O-N 2.91Å; D73-Q77 PolarHBondContact O-NE2 3.02Å; D73-Q77 PolarHBondContact OD1-NE2 3.28Å; D73-Q77 PolarHBondContact OD2-NE2 3.12Å
74	F	91.8	Very high	87.4	Confident	8 Å²	8	69.9 Å²	69.9	4%	0.035	35%	0.352	C	S	.	.	H	α-helix	trans	-59	-49.6	172.8	178.2	-87.9	0	0	0	111.7	K70 M71 N76 Q77 W82 A132 L140 R261 M277 V280	K70-F74 VanDerWaalsContact O-CB 3.31Å; K70-F74 WeakPolarHBondContact O-CB 3.34Å; K70-F74 PolarHBondContact O-N 3.44Å; M71-F74 PolarHBondContact O-N 2.85Å; M71-F74 HydrophobicContact SD-CD1 4.46Å; F74-N76 PolarHBondContact O-N 2.83Å; F74-Q77 PolarHBondContact O-N 3.42Å; F74-W82 HydrophobicContact CD1-CH2 4.41Å; F74-W82 AromaticContact CE1-CH2 3.86Å; F74-W82 HydrophobicContact CE1-CH2 3.86Å; F74-W82 HydrophobicContact CE1-CZ2 4.1Å; F74-A132 HydrophobicContact CE1-CB 4.31Å; F74-L140 HydrophobicContact CB-CD1 3.56Å; F74-L140 HydrophobicContact CD1-CD1 4.34Å; F74-L140 HydrophobicContact CD2-CD1 3.76Å; F74-L140 HydrophobicContact CG-CD1 3.65Å; F74-R261 HydrophobicContact CE2-CB 4.47Å; F74-R261 HydrophobicContact CZ-CB 4.06Å; F74-R261 PolarHBondContact O-NH1 2.67Å; F74-M277 HydrophobicContact CB-CE 4.46Å; F74-M277 HydrophobicContact CD2-CB 3.92Å; F74-M277 HydrophobicContact CD2-CE 3.81Å; F74-M277 HydrophobicContact CE2-CB 3.69Å; F74-M277 HydrophobicContact CE2-CE 4.3Å; F74-M277 WeakPolarHBondContact CE2-O 3.25Å; F74-M277 HydrophobicContact CG-CE 4.15Å; F74-M277 WeakPolarHBondContact O-CE 3.39Å; F74-V280 HydrophobicContact CE1-CG2 3.73Å; F74-V280 HydrophobicContact CZ-CG2 3.6Å
75	A	90.6	Very high	85	Confident	12 Å²	12	80.1 Å²	80.1	10%	0.099	39%	0.39	C	S	.	.	H	α-helix	trans	-54.3	-37.7	179.8	0	0	0	0	0	112.9	M71 P81 W82 R261	M71-A75 VanDerWaalsContact O-CB 3.27Å; M71-A75 WeakPolarHBondContact O-CB 3.34Å; M71-A75 PolarHBondContact O-N 2.74Å; A75-P81 WeakPolarHBondContact O-CA 3.46Å; A75-W82 HydrophobicContact CB-CB 4.29Å; A75-W82 HydrophobicContact CB-CD2 4.35Å; A75-W82 HydrophobicContact CB-CE3 4.04Å; A75-W82 HydrophobicContact CB-CG 4.5Å; A75-W82 PolarHBondContact O-N 2.93Å; A75-R261 PolarHBondContact O-NH2 2.89Å
76	N	87.4	Confident	82.3	Confident	74 Å²	74	86.3 Å²	86.3	40%	0.396	42%	0.419	S	S	.	.	H	α-helix	trans	-82	-22.8	-177.8	-75.5	-31.9	0	0	0	115.8	R72 D73 F74 N83	R72-N76 PolarHBondContact O-N 3.23Å; R72-N76 PolarHBondContact O-ND2 3.21Å; D73-N76 PolarHBondContact O-N 3.42Å; F74-N76 PolarHBondContact O-N 2.83Å; N76-N83 PolarHBondContact OD1-ND2 3.03Å
77	Q	83.9	Confident	79.4	Confident	57 Å²	57	90.5 Å²	90.5	27%	0.266	44%	0.437	S	S	.	.	H	α-helix	trans	-100.1	-16.7	-166.4	-77.7	173.9	112.5	0	0	115.9	D73 F74 M277	D73-Q77 WeakPolarHBondContact O-CG 3.41Å; D73-Q77 PolarHBondContact O-N 2.91Å; D73-Q77 PolarHBondContact O-NE2 3.02Å; D73-Q77 PolarHBondContact OD1-NE2 3.28Å; D73-Q77 PolarHBondContact OD2-NE2 3.12Å; F74-Q77 PolarHBondContact O-N 3.42Å; Q77-M277 HydrophobicContact CB-CE 3.64Å; Q77-M277 HydrophobicContact CB-SD 4.38Å
78	G	75.6	Confident	76.8	Confident	4 Å²	4	92.6 Å²	92.6	4%	0.041	46%	0.459	C	S	.	.	S	Bend	trans	-98.8	164.6	174.3	0	0	0	0	0	111.7	P80 R261	G78-P80 CarbonylContact O-C 3.59Å; G78-P80 VanDerWaalsContact O-O 3.05Å; G78-R261 PolarHBondContact O-NH2 2.97Å
79	D	74.3	Confident	74.2	Confident	136 Å²	136	92.9 Å²	92.9	73%	0.727	47%	0.473	S	S	*	.	S	Bend	trans	-94.2	136.8	-175.9	-165.3	21	0	0	0	112.1
80	P	77.6	Confident	71.4	Confident	90 Å²	90	93.1 Å²	93.1	58%	0.584	48%	0.48	S	S	*	.	S	Bend	cis	-65.1	156.9	-24.9	31.5	-35.2	0	0	0	111.1	G78 W82 R261	G78-P80 CarbonylContact O-C 3.59Å; G78-P80 VanDerWaalsContact O-O 3.05Å; P80-W82 VanDerWaalsContact O-CD1 3.26Å; P80-W82 PolarHBondContact O-N 3.27Å; P80-R261 PolarHBondContact O-NH2 3.11Å
81	P	82.8	Confident	69	Low	65 Å²	65	95.1 Å²	95.1	42%	0.422	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-66.1	129.1	170.3	27.8	-33.7	0	0	0	109.4	A75 N83	A75-P81 WeakPolarHBondContact O-CA 3.46Å; P81-N83 CarbonylContact O-C 3.55Å; P81-N83 PolarHBondContact O-N 2.7Å
82	W	84.6	Confident	66.5	Low	112 Å²	112	101.4 Å²	101.4	42%	0.424	54%	0.535	S	S	.	.	S	Bend	trans	-71.7	-14.5	-171.2	-59.1	-10.5	0	0	0	113.9	M71 F74 A75 P80 L84 V280	M71-W82 HydrophobicContact CE-CE3 4.27Å; M71-W82 HydrophobicContact CE-CH2 4.4Å; M71-W82 HydrophobicContact CE-CZ3 3.52Å; F74-W82 HydrophobicContact CD1-CH2 4.41Å; F74-W82 AromaticContact CE1-CH2 3.86Å; F74-W82 HydrophobicContact CE1-CH2 3.86Å; F74-W82 HydrophobicContact CE1-CZ2 4.1Å; A75-W82 HydrophobicContact CB-CB 4.29Å; A75-W82 HydrophobicContact CB-CD2 4.35Å; A75-W82 HydrophobicContact CB-CE3 4.04Å; A75-W82 HydrophobicContact CB-CG 4.5Å; A75-W82 PolarHBondContact O-N 2.93Å; P80-W82 VanDerWaalsContact O-CD1 3.26Å; P80-W82 PolarHBondContact O-N 3.27Å; W82-L84 VanDerWaalsContact C-N 3.25Å; W82-L84 PolarHBondContact O-N 3.39Å; W82-V280 HydrophobicContact CH2-CG1 3.89Å; W82-V280 HydrophobicContact CH2-CG2 3.98Å; W82-V280 HydrophobicContact CZ2-CG1 4.05Å; W82-V280 HydrophobicContact CZ2-CG2 3.92Å
83	N	69.9	Low	64.2	Low	96 Å²	96	99.8 Å²	99.8	51%	0.513	54%	0.54	S	S	.	.			trans	-72.6	87.1	162.1	-76.6	-57.6	0	0	0	109	N76 P81 R85	N76-N83 PolarHBondContact OD1-ND2 3.03Å; P81-N83 CarbonylContact O-C 3.55Å; P81-N83 PolarHBondContact O-N 2.7Å; N83-R85 PolarHBondContact O-N 3.25Å
84	L	52.2	Low	62	Low	168 Å²	168	101.3 Å²	101.3	88%	0.88	56%	0.558	S	S	*	*			trans	-56	89.7	151.6	-77.4	169.1	0	0	0	107.6	W82 M86	W82-L84 VanDerWaalsContact C-N 3.25Å; W82-L84 PolarHBondContact O-N 3.39Å; L84-M86 PolarHBondContact O-N 2.98Å
85	R	47.3	Very low	59.6	Low	228 Å²	228	106.5 Å²	106.5	86%	0.86	59%	0.59	S	S	*	*			trans	-57.6	115.4	152.2	-86.8	-171	171.4	-112.2	-0.3	105.1	N83 E87	N83-R85 PolarHBondContact O-N 3.25Å; R85-E87 PolarHBondContact O-N 3.4Å
86	M	42.8	Very low	57.4	Low	157 Å²	157	114.8 Å²	114.8	77%	0.773	62%	0.623	S	S	*	*			trans	-50.6	100.2	151.9	-77.4	-75	179.5	0	0	106.1	L84 G88 E115	L84-M86 PolarHBondContact O-N 2.98Å; M86-G88 PolarHBondContact O-N 2.98Å; M86-E115 WeakPolarHBondContact CE-OE1 3.13Å
87	E	37.5	Very low	55.1	Low	179 Å²	179	116.9 Å²	116.9	84%	0.836	64%	0.639	S	S	*	*			trans	-73	89.9	-178.9	-171.5	151.7	-147.3	0	0	106.9	R85	R85-E87 PolarHBondContact O-N 3.4Å
88	G	44.3	Very low	53.2	Low	50 Å²	50	121 Å²	121	52%	0.515	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-50.9	142.2	172.1	0	0	0	0	0	108.9	M86	M86-G88 PolarHBondContact O-N 2.98Å
89	P	42.3	Very low	51.6	Low	108 Å²	108	124.7 Å²	124.7	70%	0.701	70%	0.699	S	S	*	*	S	Bend	trans	-49.6	133.7	-167.3	19.7	-33.2	0	0	0	110.7
90	P	39.7	Very low	49.8	Very low	83 Å²	83	121.7 Å²	121.7	54%	0.539	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-55	141.6	-162	19.1	-33	0	0	0	111.1	N92 T93	P90-N92 PolarHBondContact O-N 3.26Å; P90-T93 PolarHBondContact O-N 3.46Å; P90-T93 PolarHBondContact O-OG1 3.03Å
91	P	44.4	Very low	48.1	Very low	127 Å²	127	126.5 Å²	126.5	83%	0.825	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	69.1	-167.3	31.1	-37.4	0	0	0	112.5
92	N	43.2	Very low	46.3	Very low	158 Å²	158	134 Å²	134	85%	0.845	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.8	-4.5	164.4	-94.6	-31.8	0	0	0	114.3	P90 S94	P90-N92 PolarHBondContact O-N 3.26Å; N92-S94 VanDerWaalsContact C-N 3.33Å; N92-S94 PolarHBondContact O-N 2.84Å
93	T	45.5	Very low	44.4	Very low	95 Å²	95	140 Å²	140	58%	0.583	75%	0.751	S	S	*	*			trans	-84.7	67.8	177.2	47.9	0	0	0	0	113	P90 V95	P90-T93 PolarHBondContact O-N 3.46Å; P90-T93 PolarHBondContact O-OG1 3.03Å; T93-V95 PolarHBondContact O-N 2.93Å
94	S	43.4	Very low	43.5	Very low	121 Å²	121	144.6 Å²	144.6	85%	0.846	76%	0.761	S	S	*	*			trans	-75	54.8	179.4	67.1	0	0	0	0	114.1	N92	N92-S94 VanDerWaalsContact C-N 3.33Å; N92-S94 PolarHBondContact O-N 2.84Å
95	V	43.1	Very low	43.5	Very low	117 Å²	117	138.8 Å²	138.8	71%	0.709	73%	0.734	S	S	*	*			trans	-95.2	111.9	173.9	-178.1	0	0	0	0	109.6	T93 V97	T93-V95 PolarHBondContact O-N 2.93Å; V95-V97 HydrophobicContact CG1-CG2 4.48Å; V95-V97 PolarHBondContact O-N 2.81Å
96	K	44	Very low	43.9	Very low	185 Å²	185	133.4 Å²	133.4	80%	0.804	73%	0.728	S	S	*	*			trans	-67.3	92.5	171.7	-90.4	179	167.3	-179.8	0	110.5	I98	K96-I98 HydrophobicContact CB-CD1 4.34Å; K96-I98 HydrophobicContact CB-CG1 4.28Å; K96-I98 HydrophobicContact CD-CD1 4.1Å; K96-I98 PolarHBondContact O-N 3.29Å
97	V	39.1	Very low	44.3	Very low	118 Å²	118	129.3 Å²	129.3	72%	0.715	72%	0.715	S	S	*	*			trans	-74.6	73.6	164.9	-173.3	0	0	0	0	109.3	V95 A100	V95-V97 HydrophobicContact CG1-CG2 4.48Å; V95-V97 PolarHBondContact O-N 2.81Å; V97-A100 HydrophobicContact CG1-CB 4.1Å
98	I	43.9	Very low	45.4	Very low	144 Å²	144	122.2 Å²	122.2	74%	0.738	69%	0.688	S	S	*	*			trans	-78.2	130.2	165.3	-66.6	170	0	0	0	107.2	K96	K96-I98 HydrophobicContact CB-CD1 4.34Å; K96-I98 HydrophobicContact CB-CG1 4.28Å; K96-I98 HydrophobicContact CD-CD1 4.1Å; K96-I98 PolarHBondContact O-N 3.29Å
99	G	42.8	Very low	46.1	Very low	81 Å²	81	123.8 Å²	123.8	84%	0.835	68%	0.683	S	S	*	*			trans	97.8	24.8	169.3	0	0	0	0	0	117.1
100	A	36.2	Very low	46.9	Very low	74 Å²	74	120.5 Å²	120.5	61%	0.612	67%	0.666	S	S	*	*			trans	-103.5	90.8	163.1	0	0	0	0	0	110.3	V97 R102	V97-A100 HydrophobicContact CG1-CB 4.1Å; A100-R102 PolarHBondContact O-N 2.87Å
101	Q	41	Very low	48	Very low	191 Å²	191	121.4 Å²	121.4	89%	0.893	67%	0.665	S	S	*	*			trans	-64.3	104.6	171.8	-159.8	131.7	-46.7	0	0	108	R103	Q101-R103 PolarHBondContact O-N 3.17Å
102	R	45.8	Very low	49	Very low	221 Å²	221	120.2 Å²	120.2	83%	0.834	65%	0.648	S	S	*	*			trans	-56.9	99	179.2	-88.4	-167	178.7	-166.4	1.6	109.2	A100 R104	A100-R102 PolarHBondContact O-N 2.87Å; R102-R104 VanDerWaalsContact C-N 3.31Å; R102-R104 PolarHBondContact O-N 2.93Å
103	R	44	Very low	50.3	Low	240 Å²	240	116.9 Å²	116.9	91%	0.906	63%	0.634	S	S	*	*			trans	-59.6	102.9	152.4	-72	-169.3	-180	-152.6	2.5	105.2	Q101 S105	Q101-R103 PolarHBondContact O-N 3.17Å; R103-S105 VanDerWaalsContact C-N 3.32Å; R103-S105 PolarHBondContact O-N 3.17Å
104	R	52	Low	51.5	Low	192 Å²	192	118.5 Å²	118.5	73%	0.725	63%	0.633	S	S	*	*			trans	-60.5	101.1	167.2	-76.1	-174.2	171.4	114.2	-6.3	106.2	R102	R102-R104 VanDerWaalsContact C-N 3.31Å; R102-R104 PolarHBondContact O-N 2.93Å
105	S	51.9	Low	53.2	Low	46 Å²	46	117.8 Å²	117.8	32%	0.322	62%	0.616	S	S	.	*			trans	-65.7	148.8	172.9	56.7	0	0	0	0	108.6	R103 S107 A108 L109	R103-S105 VanDerWaalsContact C-N 3.32Å; R103-S105 PolarHBondContact O-N 3.17Å; S105-S107 WeakPolarHBondContact CB-OG 3.48Å; S105-S107 PolarHBondContact O-N 3.23Å; S105-S107 VanDerWaalsContact O-N 3.15Å; S105-S107 PolarHBondContact OG-OG 2.91Å; S105-A108 PolarHBondContact O-N 3.25Å; S105-A108 PolarHBondContact OG-N 3.3Å; S105-L109 PolarHBondContact O-N 3.12Å
106	P	54.3	Low	54.8	Low	114 Å²	114	115.7 Å²	115.7	74%	0.74	61%	0.611	S	S	*	*	H	α-helix	trans	-54.5	-30.9	170.6	-27.4	36.1	0	0	0	112.4	L109 A110	P106-L109 PolarHBondContact O-N 2.81Å; P106-A110 WeakPolarHBondContact O-CB 3.43Å; P106-A110 PolarHBondContact O-N 2.7Å
107	S	51.9	Low	56.8	Low	71 Å²	71	111.8 Å²	111.8	50%	0.497	60%	0.595	S	S	.	*	H	α-helix	trans	-63.8	-36.4	173.1	54.7	0	0	0	0	114.1	S105 A110 I111	S105-S107 WeakPolarHBondContact CB-OG 3.48Å; S105-S107 PolarHBondContact O-N 3.23Å; S105-S107 VanDerWaalsContact O-N 3.15Å; S105-S107 PolarHBondContact OG-OG 2.91Å; S107-A110 PolarHBondContact O-N 2.81Å; S107-I111 WeakPolarHBondContact O-CD1 3.47Å; S107-I111 VanDerWaalsContact O-CG1 3.23Å; S107-I111 WeakPolarHBondContact O-CG1 3.41Å; S107-I111 PolarHBondContact O-N 3.35Å
108	A	59.9	Low	59	Low	31 Å²	31	110.6 Å²	110.6	26%	0.256	59%	0.585	S	S	.	*	H	α-helix	trans	-67.7	-41.1	177.8	0	0	0	0	0	111.5	S105 I111 E112	S105-A108 PolarHBondContact O-N 3.25Å; S105-A108 PolarHBondContact OG-N 3.3Å; A108-I111 PolarHBondContact O-N 2.79Å; A108-E112 WeakPolarHBondContact O-CG 3.44Å; A108-E112 PolarHBondContact O-N 3.12Å
109	L	59.8	Low	61.1	Low	82 Å²	82	106 Å²	106	43%	0.429	57%	0.573	S	S	.	*	H	α-helix	trans	-69.2	-35.8	174.9	-72.3	167.8	0	0	0	112.3	S105 P106 E112 V113	S105-L109 PolarHBondContact O-N 3.12Å; P106-L109 PolarHBondContact O-N 2.81Å; L109-E112 PolarHBondContact O-N 2.9Å; L109-V113 WeakPolarHBondContact O-CB 3.43Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.19Å; L109-V113 PolarHBondContact O-N 2.94Å
110	A	58.7	Low	63.4	Low	40 Å²	40	104.9 Å²	104.9	33%	0.331	55%	0.552	S	S	.	*	H	α-helix	trans	-63	-44.3	172.9	0	0	0	0	0	111.4	P106 S107 V113 F114	P106-A110 WeakPolarHBondContact O-CB 3.43Å; P106-A110 PolarHBondContact O-N 2.7Å; S107-A110 PolarHBondContact O-N 2.81Å; A110-V113 PolarHBondContact O-N 3.07Å; A110-F114 HydrophobicContact CB-CD2 4.37Å; A110-F114 HydrophobicContact CB-CE2 4.33Å; A110-F114 WeakPolarHBondContact O-CD2 3.46Å; A110-F114 PolarHBondContact O-N 3.37Å
111	I	62.3	Low	66	Low	102 Å²	102	105.3 Å²	105.3	52%	0.523	54%	0.541	S	S	.	.	H	α-helix	trans	-60	-52.5	174	-68.5	162.2	0	0	0	110	S107 A108 V113 F114 E115	S107-I111 WeakPolarHBondContact O-CD1 3.47Å; S107-I111 VanDerWaalsContact O-CG1 3.23Å; S107-I111 WeakPolarHBondContact O-CG1 3.41Å; S107-I111 PolarHBondContact O-N 3.35Å; A108-I111 PolarHBondContact O-N 2.79Å; I111-V113 PolarHBondContact O-N 2.82Å; I111-V113 VanDerWaalsContact O-N 3.15Å; I111-F114 PolarHBondContact O-N 3.16Å; I111-E115 WeakPolarHBondContact O-CB 3.39Å; I111-E115 PolarHBondContact O-N 3.22Å
112	E	67	Low	68.5	Low	101 Å²	101	100.2 Å²	100.2	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-55.1	-34.4	178.6	-74.6	172.1	-172.9	0	0	112.8	A108 L109 A116	A108-E112 WeakPolarHBondContact O-CG 3.44Å; A108-E112 PolarHBondContact O-N 3.12Å; L109-E112 PolarHBondContact O-N 2.9Å; E112-A116 WeakPolarHBondContact O-CB 3.4Å
113	V	69.9	Low	70.8	Confident	89 Å²	89	90.9 Å²	90.9	54%	0.539	49%	0.486	S	S	.	.	H	α-helix	trans	-78.9	-44.2	178.3	169	0	0	0	0	113.3	L109 A110 I111 H117	L109-V113 WeakPolarHBondContact O-CB 3.43Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.19Å; L109-V113 PolarHBondContact O-N 2.94Å; A110-V113 PolarHBondContact O-N 3.07Å; I111-V113 PolarHBondContact O-N 2.82Å; I111-V113 VanDerWaalsContact O-N 3.15Å; V113-H117 PolarHBondContact O-ND1 3.12Å
114	F	71.3	Confident	73.2	Confident	129 Å²	129	86.5 Å²	86.5	57%	0.566	48%	0.476	S	S	*	.	H	α-helix	trans	-74.8	-34.9	-179.8	-70.9	-57.5	0	0	0	112.4	A110 I111 H117 L118	A110-F114 HydrophobicContact CB-CD2 4.37Å; A110-F114 HydrophobicContact CB-CE2 4.33Å; A110-F114 WeakPolarHBondContact O-CD2 3.46Å; A110-F114 PolarHBondContact O-N 3.37Å; I111-F114 PolarHBondContact O-N 3.16Å; F114-H117 PolarHBondContact O-N 3.33Å; F114-L118 WeakPolarHBondContact O-CA 3.49Å; F114-L118 PolarHBondContact O-N 3.19Å
115	E	77.7	Confident	75.1	Confident	105 Å²	105	82.4 Å²	82.4	49%	0.491	48%	0.477	S	S	.	.	H	α-helix	trans	-64.2	-41.8	176.7	-172	172.2	-167	0	0	111.2	M86 I111 H117 L118	M86-E115 WeakPolarHBondContact CE-OE1 3.13Å; I111-E115 WeakPolarHBondContact O-CB 3.39Å; I111-E115 PolarHBondContact O-N 3.22Å; E115-H117 PolarHBondContact O-N 3.04Å; E115-L118 WeakPolarHBondContact O-CB 3.24Å; E115-L118 PolarHBondContact O-N 3.25Å
116	A	78.1	Confident	77.1	Confident	73 Å²	73	82.9 Å²	82.9	60%	0.603	48%	0.475	S	S	*	.	H	α-helix	trans	-61.1	-24.7	178.5	0	0	0	0	0	114.5	E112	E112-A116 WeakPolarHBondContact O-CB 3.4Å
117	H	84.6	Confident	78.8	Confident	103 Å²	103	82.9 Å²	82.9	48%	0.477	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	8.7	-178.1	-56.1	91.9	0	0	0	113.1	V113 F114 E115 G119 S120 H121	V113-H117 PolarHBondContact O-ND1 3.12Å; F114-H117 PolarHBondContact O-N 3.33Å; E115-H117 PolarHBondContact O-N 3.04Å; H117-G119 VanDerWaalsContact C-N 3.32Å; H117-G119 PolarHBondContact O-N 2.86Å; H117-S120 PolarHBondContact O-N 2.81Å; H117-H121 PolarHBondContact O-N 3Å
118	L	86.8	Confident	80.9	Confident	94 Å²	94	79.5 Å²	79.5	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-54.8	-43.3	-169.2	-179.6	59.7	0	0	0	113	F114 E115 S120 H121 I122	F114-L118 WeakPolarHBondContact O-CA 3.49Å; F114-L118 PolarHBondContact O-N 3.19Å; E115-L118 WeakPolarHBondContact O-CB 3.24Å; E115-L118 PolarHBondContact O-N 3.25Å; L118-S120 PolarHBondContact O-N 2.83Å; L118-H121 PolarHBondContact O-N 2.95Å; L118-I122 HydrophobicContact CD1-CD1 3.96Å; L118-I122 HydrophobicContact CD1-CG1 4.18Å; L118-I122 HydrophobicContact CG-CD1 3.84Å; L118-I122 HydrophobicContact CG-CG1 4.49Å; L118-I122 WeakPolarHBondContact O-CB 3.28Å; L118-I122 VanDerWaalsContact O-CG1 3.26Å; L118-I122 WeakPolarHBondContact O-CG1 3.3Å; L118-I122 PolarHBondContact O-N 2.87Å
119	G	88.1	Confident	82.7	Confident	48 Å²	48	78 Å²	78	50%	0.495	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-42.5	177.9	0	0	0	0	0	113.3	H117 L123	H117-G119 VanDerWaalsContact C-N 3.32Å; H117-G119 PolarHBondContact O-N 2.86Å; G119-L123 WeakPolarHBondContact O-CG 3.42Å; G119-L123 PolarHBondContact O-N 3.08Å; G119-L123 VanDerWaalsContact O-N 3.1Å
120	S	89.8	Confident	84.5	Confident	57 Å²	57	75.6 Å²	75.6	40%	0.399	42%	0.422	S	S	.	.	H	α-helix	trans	-68.9	-40	176.5	-58.4	0	0	0	0	111.7	H117 L118 L123 Q124	H117-S120 PolarHBondContact O-N 2.81Å; L118-S120 PolarHBondContact O-N 2.83Å; S120-L123 PolarHBondContact O-N 2.81Å; S120-Q124 VanDerWaalsContact O-CB 3.24Å; S120-Q124 WeakPolarHBondContact O-CB 3.39Å; S120-Q124 WeakPolarHBondContact O-CG 3.4Å; S120-Q124 PolarHBondContact O-N 2.85Å
121	H	91.3	Very high	86.4	Confident	82 Å²	82	73.8 Å²	73.8	38%	0.38	41%	0.406	S	S	.	.	H	α-helix	trans	-64	-44.1	175.3	-70.8	-28.5	0	0	0	112.3	H117 L118 L123 Q124 S125	H117-H121 PolarHBondContact O-N 3Å; L118-H121 PolarHBondContact O-N 2.95Å; H121-L123 PolarHBondContact O-N 2.84Å; H121-Q124 PolarHBondContact O-N 2.86Å; H121-S125 WeakPolarHBondContact O-CB 3.17Å; H121-S125 PolarHBondContact O-N 3.01Å; H121-S125 PolarHBondContact O-OG 2.75Å
122	I	93.6	Very high	88.1	Confident	85 Å²	85	69 Å²	69	44%	0.436	38%	0.382	S	S	.	.	H	α-helix	trans	-56.3	-51.8	174.4	-70.8	164.7	0	0	0	110.4	L118 Q124 S125 L126	L118-I122 HydrophobicContact CD1-CD1 3.96Å; L118-I122 HydrophobicContact CD1-CG1 4.18Å; L118-I122 HydrophobicContact CG-CD1 3.84Å; L118-I122 HydrophobicContact CG-CG1 4.49Å; L118-I122 WeakPolarHBondContact O-CB 3.28Å; L118-I122 VanDerWaalsContact O-CG1 3.26Å; L118-I122 WeakPolarHBondContact O-CG1 3.3Å; L118-I122 PolarHBondContact O-N 2.87Å; I122-Q124 VanDerWaalsContact C-N 3.34Å; I122-Q124 PolarHBondContact O-N 2.89Å; I122-S125 PolarHBondContact O-N 3.23Å; I122-L126 HydrophobicContact CG2-CD1 4.09Å; I122-L126 WeakPolarHBondContact O-CG 3.33Å; I122-L126 PolarHBondContact O-N 3.1Å
123	L	94.8	Very high	89.6	Confident	24 Å²	24	64.1 Å²	64.1	13%	0.126	36%	0.359	C	S	.	.	H	α-helix	trans	-69.3	-29.2	-177.2	-67.2	-178.8	0	0	0	113.5	G119 S120 H121 V130 T145	G119-L123 WeakPolarHBondContact O-CG 3.42Å; G119-L123 PolarHBondContact O-N 3.08Å; G119-L123 VanDerWaalsContact O-N 3.1Å; S120-L123 PolarHBondContact O-N 2.81Å; H121-L123 PolarHBondContact O-N 2.84Å; L123-V130 HydrophobicContact CD2-CG2 4.12Å; L123-T145 HydrophobicContact CB-CG2 4.14Å
124	Q	92.8	Very high	90.8	Very high	148 Å²	148	60.1 Å²	60.1	69%	0.692	34%	0.335	S	S	*	.	H	α-helix	trans	-83.8	-19.1	177.7	-70.9	171.1	-3	0	0	113.9	S120 H121 I122	S120-Q124 VanDerWaalsContact O-CB 3.24Å; S120-Q124 WeakPolarHBondContact O-CB 3.39Å; S120-Q124 WeakPolarHBondContact O-CG 3.4Å; S120-Q124 PolarHBondContact O-N 2.85Å; H121-Q124 PolarHBondContact O-N 2.86Å; I122-Q124 VanDerWaalsContact C-N 3.34Å; I122-Q124 PolarHBondContact O-N 2.89Å
125	S	93.6	Very high	91.8	Very high	107 Å²	107	57.5 Å²	57.5	75%	0.748	32%	0.324	S	S	*	.	H	α-helix	trans	-91.2	-13.8	175.3	-66.1	0	0	0	0	114.1	H121 I122	H121-S125 WeakPolarHBondContact O-CB 3.17Å; H121-S125 PolarHBondContact O-N 3.01Å; H121-S125 PolarHBondContact O-OG 2.75Å; I122-S125 PolarHBondContact O-N 3.23Å
126	L	93.4	Very high	92.6	Very high	55 Å²	55	54.9 Å²	54.9	29%	0.288	31%	0.312	S	S	.	.	S	Bend	trans	-85.5	122.9	173.7	-71.3	169.9	0	0	0	110.3	I122 G128 V130 V282	I122-L126 HydrophobicContact CG2-CD1 4.09Å; I122-L126 WeakPolarHBondContact O-CG 3.33Å; I122-L126 PolarHBondContact O-N 3.1Å; L126-G128 PolarHBondContact O-N 3.18Å; L126-V130 HydrophobicContact CD1-CG2 3.51Å; L126-V282 HydrophobicContact CD2-CG1 4.23Å
127	D	90.4	Very high	93.4	Very high	114 Å²	114	51.4 Å²	51.4	61%	0.61	28%	0.283	S	S	*	.	S	Bend	trans	-78.3	70.6	169.4	-166.9	20.7	0	0	0	110.5	Y149 H284	D127-Y149 WeakPolarHBondContact CA-OH 3.41Å; D127-Y149 VanDerWaalsContact OD1-CE1 3.27Å; D127-Y149 WeakPolarHBondContact OD1-CE1 3.26Å; D127-Y149 VanDerWaalsContact OD1-CZ 3.32Å; D127-Y149 PolarHBondContact OD1-OH 2.87Å; D127-H284 PolarHBondContact O-ND1 3.21Å
128	G	94.7	Very high	94.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	165.7	-156.1	-176.6	0	0	0	0	0	114.2	L126 T145 Y149 A283	L126-G128 PolarHBondContact O-N 3.18Å; G128-T145 PolarHBondContact O-OG1 2.88Å; G128-Y149 VanDerWaalsContact CA-CE2 3.47Å; G128-Y149 VanDerWaalsContact N-CZ 3.27Å; G128-Y149 PolarHBondContact N-OH 2.88Å; G128-Y149 VanDerWaalsContact N-OH 3.15Å; G128-Y149 WeakPolarHBondContact O-CE2 3.32Å; G128-A283 CarbonylContact C-O 3.59Å; G128-A283 VanDerWaalsContact CA-O 3.25Å; G128-A283 WeakPolarHBondContact CA-O 3.41Å
129	F	97.9	Very high	94.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	148.6	178.3	58.4	-83.2	0	0	0	111.7	F131 I142 S143 T145 V146 Y149 L150 M235 I254 A283	F129-F131 AromaticContact CD2-CD1 3.92Å; F129-F131 HydrophobicContact CD2-CD1 3.92Å; F129-F131 HydrophobicContact CD2-CE1 4.48Å; F129-F131 AromaticContact CE2-CD1 3.75Å; F129-F131 HydrophobicContact CE2-CD1 3.75Å; F129-F131 AromaticContact CE2-CE1 3.9Å; F129-F131 HydrophobicContact CE2-CE1 3.9Å; F129-I142 HydrophobicContact CD2-CD1 3.78Å; F129-I142 HydrophobicContact CD2-CG1 4.13Å; F129-I142 HydrophobicContact CE2-CD1 3.97Å; F129-S143 WeakPolarHBondContact CA-OG 3.45Å; F129-S143 WeakPolarHBondContact CB-OG 3.48Å; F129-T145 WeakPolarHBondContact CA-OG1 3.44Å; F129-T145 WeakPolarHBondContact CB-OG1 3.49Å; F129-V146 HydrophobicContact CB-CB 4Å; F129-V146 HydrophobicContact CD1-CB 4.44Å; F129-V146 HydrophobicContact CD1-CG2 4.23Å; F129-V146 HydrophobicContact CD2-CB 4Å; F129-V146 HydrophobicContact CD2-CG2 3.79Å; F129-V146 HydrophobicContact CE1-CG2 4.34Å; F129-V146 HydrophobicContact CE2-CG2 3.91Å; F129-V146 HydrophobicContact CG-CB 3.91Å; F129-V146 HydrophobicContact CG-CG2 3.96Å; F129-V146 HydrophobicContact CZ-CG2 4.19Å; F129-Y149 HydrophobicContact CD1-CD2 4.19Å; F129-Y149 HydrophobicContact CD1-CG 4.37Å; F129-L150 HydrophobicContact CE1-CD1 4.3Å; F129-L150 HydrophobicContact CE1-CG 4.44Å; F129-L150 HydrophobicContact CZ-CD1 3.92Å; F129-M235 HydrophobicContact CE2-SD 4.43Å; F129-M235 HydrophobicContact CZ-SD 4.08Å; F129-I254 HydrophobicContact CE1-CD1 4.07Å; F129-I254 HydrophobicContact CZ-CD1 4.29Å; F129-I254 HydrophobicContact CZ-CG1 4.39Å; F129-I254 HydrophobicContact CZ-CG2 4.15Å; F129-A283 HydrophobicContact CD1-CB 4.36Å; F129-A283 HydrophobicContact CD2-CB 4Å; F129-A283 HydrophobicContact CE1-CB 4.06Å; F129-A283 HydrophobicContact CE2-CB 3.69Å; F129-A283 HydrophobicContact CG-CB 4.33Å; F129-A283 HydrophobicContact CZ-CB 3.72Å; F129-A283 PolarHBondContact N-O 2.65Å; F129-A283 PolarHBondContact O-N 3.04Å
130	V	98.4	Very high	95.1	Very high	32 Å²	32	44.8 Å²	44.8	19%	0.194	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136	-177.2	-178	0	0	0	0	108.4	L123 L126 Y141 I142 S143 V281 V282	L123-V130 HydrophobicContact CD2-CG2 4.12Å; L126-V130 HydrophobicContact CD1-CG2 3.51Å; V130-Y141 HydrophobicContact CB-CE1 4.47Å; V130-Y141 HydrophobicContact CG1-CE1 4.44Å; V130-I142 CarbonylContact O-C 3.47Å; V130-I142 VanDerWaalsContact O-CA 3.31Å; V130-I142 WeakPolarHBondContact O-CA 3.48Å; V130-S143 PolarHBondContact N-OG 2.87Å; V130-S143 PolarHBondContact O-N 3.01Å; V130-V281 WeakPolarHBondContact CA-O 3.34Å; V130-V281 WeakPolarHBondContact CG1-O 3.5Å; V130-V282 HydrophobicContact CG2-CG2 4.42Å
131	F	98.4	Very high	95.5	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	158	173.2	66.6	-103.4	0	0	0	114.1	F129 L133 F139 Y141 I142 I256 V281 A283	F129-F131 AromaticContact CD2-CD1 3.92Å; F129-F131 HydrophobicContact CD2-CD1 3.92Å; F129-F131 HydrophobicContact CD2-CE1 4.48Å; F129-F131 AromaticContact CE2-CD1 3.75Å; F129-F131 HydrophobicContact CE2-CD1 3.75Å; F129-F131 AromaticContact CE2-CE1 3.9Å; F129-F131 HydrophobicContact CE2-CE1 3.9Å; F131-L133 HydrophobicContact CD2-CD1 4.46Å; F131-L133 HydrophobicContact CD2-CD2 3.94Å; F131-L133 HydrophobicContact CD2-CG 3.82Å; F131-L133 HydrophobicContact CE2-CD1 3.87Å; F131-L133 HydrophobicContact CE2-CD2 4.09Å; F131-L133 HydrophobicContact CE2-CG 3.73Å; F131-F139 HydrophobicContact CB-CD1 4.16Å; F131-F139 HydrophobicContact CB-CE1 4.29Å; F131-F139 HydrophobicContact CD1-CE1 4.42Å; F131-F139 HydrophobicContact CD2-CD1 4.27Å; F131-F139 HydrophobicContact CD2-CE1 4.02Å; F131-F139 HydrophobicContact CE2-CE1 4.39Å; F131-F139 HydrophobicContact CG-CD1 4.32Å; F131-F139 HydrophobicContact CG-CE1 4.03Å; F131-Y141 CarbonylContact C-O 3.56Å; F131-Y141 VanDerWaalsContact CA-O 3.28Å; F131-Y141 WeakPolarHBondContact CA-O 3.44Å; F131-Y141 VanDerWaalsContact CB-O 3.31Å; F131-Y141 WeakPolarHBondContact CB-O 3.32Å; F131-I142 HydrophobicContact CB-CB 3.93Å; F131-I142 HydrophobicContact CB-CD1 3.91Å; F131-I142 HydrophobicContact CB-CG1 3.87Å; F131-I142 HydrophobicContact CD1-CD1 4.2Å; F131-I142 HydrophobicContact CG-CD1 4.36Å; F131-I256 HydrophobicContact CZ-CD1 3.85Å; F131-I256 HydrophobicContact CZ-CG1 4.27Å; F131-V281 HydrophobicContact CD1-CB 4.2Å; F131-V281 HydrophobicContact CD1-CG1 4.09Å; F131-V281 HydrophobicContact CD2-CB 3.92Å; F131-V281 HydrophobicContact CD2-CG2 4.11Å; F131-V281 HydrophobicContact CE1-CB 4.03Å; F131-V281 HydrophobicContact CE1-CG1 3.61Å; F131-V281 HydrophobicContact CE2-CB 3.71Å; F131-V281 HydrophobicContact CE2-CG1 4.1Å; F131-V281 HydrophobicContact CE2-CG2 3.55Å; F131-V281 HydrophobicContact CG-CB 4.17Å; F131-V281 HydrophobicContact CZ-CB 3.78Å; F131-V281 HydrophobicContact CZ-CG1 3.62Å; F131-V281 HydrophobicContact CZ-CG2 3.84Å; F131-V281 PolarHBondContact N-O 2.89Å; F131-V281 PolarHBondContact O-N 2.55Å; F131-A283 HydrophobicContact CD1-CB 4.14Å; F131-A283 HydrophobicContact CE1-CB 3.7Å
132	A	98.3	Very high	95.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.5	172.1	0	0	0	0	0	109.2	M71 F74 L140 Y141 L279	M71-A132 HydrophobicContact CE-CB 4.14Å; M71-A132 HydrophobicContact SD-CB 4.13Å; F74-A132 HydrophobicContact CE1-CB 4.31Å; A132-L140 PolarHBondContact O-N 3.18Å; A132-Y141 PolarHBondContact N-O 2.9Å; A132-Y141 PolarHBondContact O-N 3.48Å; A132-L279 CarbonylContact C-O 3.5Å; A132-L279 WeakPolarHBondContact CA-O 3.44Å
133	L	98.2	Very high	96.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	151.3	169.8	-55.3	-178.7	0	0	0	109.5	F131 K138 F139 V162 M174 L178 G278 L279	F131-L133 HydrophobicContact CD2-CD1 4.46Å; F131-L133 HydrophobicContact CD2-CD2 3.94Å; F131-L133 HydrophobicContact CD2-CG 3.82Å; F131-L133 HydrophobicContact CE2-CD1 3.87Å; F131-L133 HydrophobicContact CE2-CD2 4.09Å; F131-L133 HydrophobicContact CE2-CG 3.73Å; L133-K138 WeakPolarHBondContact CA-O 3.41Å; L133-F139 HydrophobicContact CD2-CB 4.45Å; L133-F139 HydrophobicContact CD2-CD1 3.42Å; L133-F139 VanDerWaalsContact CD2-CD1 3.42Å; L133-F139 HydrophobicContact CD2-CE1 3.69Å; L133-F139 HydrophobicContact CD2-CG 3.88Å; L133-F139 HydrophobicContact CD2-CZ 4.36Å; L133-V162 HydrophobicContact CD1-CB 4.06Å; L133-V162 HydrophobicContact CD1-CG1 4.09Å; L133-V162 HydrophobicContact CD1-CG2 4.12Å; L133-V162 HydrophobicContact CD2-CB 4.17Å; L133-M174 HydrophobicContact CD1-CE 3.47Å; L133-M174 VanDerWaalsContact CD1-CE 3.47Å; L133-L178 HydrophobicContact CB-CD2 4.42Å; L133-L178 HydrophobicContact CD1-CD1 4.33Å; L133-L178 HydrophobicContact CD1-CD2 4.1Å; L133-G278 CarbonylContact O-C 3.58Å; L133-G278 VanDerWaalsContact O-CA 3.3Å; L133-G278 WeakPolarHBondContact O-CA 3.22Å; L133-L279 HydrophobicContact CB-CB 4.39Å; L133-L279 PolarHBondContact N-O 2.79Å; L133-L279 PolarHBondContact O-N 3.02Å
134	N	95.3	Very high	96.2	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	21%	0.21	C	C	.	.			trans	-87	-179.5	163	71.2	-6.4	0	0	0	112	E136 G137 K138 L140 M277 G278	N134-E136 PolarHBondContact ND2-OE2 3.04Å; N134-E136 PolarHBondContact O-N 3.28Å; N134-E136 VanDerWaalsContact O-N 3.13Å; N134-E136 WeakPolarHBondContact OD1-CA 3.37Å; N134-E136 WeakPolarHBondContact OD1-CB 3.42Å; N134-E136 PolarHBondContact OD1-N 3.08Å; N134-E136 VanDerWaalsContact OD1-N 3.08Å; N134-G137 PolarHBondContact O-N 2.97Å; N134-G137 PolarHBondContact OD1-N 3.46Å; N134-K138 PolarHBondContact N-O 2.78Å; N134-K138 VanDerWaalsContact N-O 3.09Å; N134-K138 PolarHBondContact OD1-N 3.16Å; N134-K138 PolarHBondContact OD1-O 2.94Å; N134-L140 HydrophobicContact CB-CD1 3.9Å; N134-L140 HydrophobicContact CB-CD2 3.98Å; N134-L140 HydrophobicContact CB-CG 3.89Å; N134-M277 CarbonylContact C-O 3.54Å; N134-M277 VanDerWaalsContact CA-O 3.29Å; N134-M277 WeakPolarHBondContact CA-O 3.42Å; N134-G278 VanDerWaalsContact C-CA 3.47Å
135	Q	91.9	Very high	96.4	Very high	75 Å²	75	35.2 Å²	35.2	35%	0.35	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.6	175.3	71.3	-79.4	-3.7	0	0	114.8	M180 I276 M277	Q135-M180 WeakPolarHBondContact O-CE 3.46Å; Q135-I276 WeakPolarHBondContact CB-O 3.34Å; Q135-M277 PolarHBondContact N-O 3.22Å; Q135-M277 PolarHBondContact OE1-O 3.16Å
136	E	93.9	Very high	96.5	Very high	50 Å²	50	30.1 Å²	30.1	23%	0.234	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	6.8	173.5	-56.9	122.2	-138.7	0	0	112.2	K70 N134 K138 P212	K70-E136 IonicContact NZ-OE1 3.97Å; K70-E136 IonicContact NZ-OE2 2.65Å; K70-E136 PolarHBondContact NZ-OE2 2.94Å; N134-E136 PolarHBondContact ND2-OE2 3.04Å; N134-E136 PolarHBondContact O-N 3.28Å; N134-E136 VanDerWaalsContact O-N 3.13Å; N134-E136 WeakPolarHBondContact OD1-CA 3.37Å; N134-E136 WeakPolarHBondContact OD1-CB 3.42Å; N134-E136 PolarHBondContact OD1-N 3.08Å; N134-E136 VanDerWaalsContact OD1-N 3.08Å; E136-K138 HydrophobicContact CB-CG 4.28Å; E136-K138 PolarHBondContact O-N 2.65Å; E136-P212 HydrophobicContact CG-CG 4.14Å
137	G	95.9	Very high	96.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	70.3	13.3	-178.6	0	0	0	0	0	114.4	N134 V162	N134-G137 PolarHBondContact O-N 2.97Å; N134-G137 PolarHBondContact OD1-N 3.46Å; G137-V162 VanDerWaalsContact O-CB 3.25Å; G137-V162 WeakPolarHBondContact O-CB 3.38Å; G137-V162 VanDerWaalsContact O-CG1 3.24Å; G137-V162 WeakPolarHBondContact O-CG1 3.36Å; G137-V162 PolarHBondContact O-N 2.88Å
138	K	98.1	Very high	96.7	Very high	96 Å²	96	30.2 Å²	30.2	42%	0.417	15%	0.149	S	C	.	.	B	Isolated β-bridge	trans	-89.4	138.6	179.6	-55.7	-165.2	-178.5	-165.5	0	111.3	L133 N134 E136 L140 S160	L133-K138 WeakPolarHBondContact CA-O 3.41Å; N134-K138 PolarHBondContact N-O 2.78Å; N134-K138 VanDerWaalsContact N-O 3.09Å; N134-K138 PolarHBondContact OD1-N 3.16Å; N134-K138 PolarHBondContact OD1-O 2.94Å; E136-K138 HydrophobicContact CB-CG 4.28Å; E136-K138 PolarHBondContact O-N 2.65Å; K138-L140 PolarHBondContact O-N 2.99Å; K138-S160 VanDerWaalsContact CA-O 3.3Å; K138-S160 WeakPolarHBondContact CA-O 3.33Å
139	F	98.6	Very high	96.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	105	177.6	-66.2	-78	0	0	0	111	F131 L133 I142 L157 G159 S160 V162 Y165 M235	F131-F139 HydrophobicContact CB-CD1 4.16Å; F131-F139 HydrophobicContact CB-CE1 4.29Å; F131-F139 HydrophobicContact CD1-CE1 4.42Å; F131-F139 HydrophobicContact CD2-CD1 4.27Å; F131-F139 HydrophobicContact CD2-CE1 4.02Å; F131-F139 HydrophobicContact CE2-CE1 4.39Å; F131-F139 HydrophobicContact CG-CD1 4.32Å; F131-F139 HydrophobicContact CG-CE1 4.03Å; L133-F139 HydrophobicContact CD2-CB 4.45Å; L133-F139 HydrophobicContact CD2-CD1 3.42Å; L133-F139 VanDerWaalsContact CD2-CD1 3.42Å; L133-F139 HydrophobicContact CD2-CE1 3.69Å; L133-F139 HydrophobicContact CD2-CG 3.88Å; L133-F139 HydrophobicContact CD2-CZ 4.36Å; F139-I142 HydrophobicContact CD1-CB 4.34Å; F139-I142 HydrophobicContact CD1-CD1 4.08Å; F139-I142 HydrophobicContact CE1-CD1 3.78Å; F139-I142 HydrophobicContact CZ-CD1 4.45Å; F139-L157 HydrophobicContact CD2-CB 4.36Å; F139-L157 HydrophobicContact CD2-CD2 4.4Å; F139-L157 WeakPolarHBondContact CD2-O 3.45Å; F139-L157 HydrophobicContact CE2-CD2 3.86Å; F139-L157 HydrophobicContact CZ-CD2 4.3Å; F139-G159 PolarHBondContact O-N 2.82Å; F139-S160 PolarHBondContact N-O 3.12Å; F139-S160 VanDerWaalsContact N-O 3.11Å; F139-V162 HydrophobicContact CE2-CB 4.25Å; F139-V162 HydrophobicContact CE2-CG2 4.41Å; F139-V162 HydrophobicContact CZ-CB 4.2Å; F139-V162 HydrophobicContact CZ-CG2 3.91Å; F139-Y165 HydrophobicContact CE2-CD2 4.24Å; F139-M235 HydrophobicContact CZ-CE 4.15Å
140	L	98.1	Very high	96.4	Very high	9 Å²	9	32 Å²	32	5%	0.047	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-35.4	168.3	-62.1	-171.2	0	0	0	111.1	K70 M71 F74 A132 N134 K138	K70-L140 HydrophobicContact CB-CD2 3.55Å; K70-L140 HydrophobicContact CD-CD2 4.09Å; K70-L140 HydrophobicContact CG-CD2 4.47Å; M71-L140 HydrophobicContact CB-CB 4.02Å; M71-L140 HydrophobicContact CG-CB 4.34Å; M71-L140 HydrophobicContact SD-CB 3.57Å; M71-L140 VanDerWaalsContact SD-CB 3.57Å; M71-L140 HydrophobicContact SD-CD1 4.45Å; F74-L140 HydrophobicContact CB-CD1 3.56Å; F74-L140 HydrophobicContact CD1-CD1 4.34Å; F74-L140 HydrophobicContact CD2-CD1 3.76Å; F74-L140 HydrophobicContact CG-CD1 3.65Å; A132-L140 PolarHBondContact O-N 3.18Å; N134-L140 HydrophobicContact CB-CD1 3.9Å; N134-L140 HydrophobicContact CB-CD2 3.98Å; N134-L140 HydrophobicContact CB-CG 3.89Å; K138-L140 PolarHBondContact O-N 2.99Å
141	Y	98.4	Very high	96.2	Very high	72 Å²	72	31.8 Å²	31.8	28%	0.282	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	147.4	174.8	169.9	-94.2	0	0	0	110	M71 V130 F131 A132	M71-Y141 VanDerWaalsContact CE-CB 3.4Å; M71-Y141 HydrophobicContact CE-CG 3.99Å; V130-Y141 HydrophobicContact CB-CE1 4.47Å; V130-Y141 HydrophobicContact CG1-CE1 4.44Å; F131-Y141 CarbonylContact C-O 3.56Å; F131-Y141 VanDerWaalsContact CA-O 3.28Å; F131-Y141 WeakPolarHBondContact CA-O 3.44Å; F131-Y141 VanDerWaalsContact CB-O 3.31Å; F131-Y141 WeakPolarHBondContact CB-O 3.32Å; A132-Y141 PolarHBondContact N-O 2.9Å; A132-Y141 PolarHBondContact O-N 3.48Å
142	I	98.5	Very high	96	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	145.9	162.5	-173.9	148.9	0	0	0	108.6	F129 V130 F131 F139 V146 Q154 L157	F129-I142 HydrophobicContact CD2-CD1 3.78Å; F129-I142 HydrophobicContact CD2-CG1 4.13Å; F129-I142 HydrophobicContact CE2-CD1 3.97Å; V130-I142 CarbonylContact O-C 3.47Å; V130-I142 VanDerWaalsContact O-CA 3.31Å; V130-I142 WeakPolarHBondContact O-CA 3.48Å; F131-I142 HydrophobicContact CB-CB 3.93Å; F131-I142 HydrophobicContact CB-CD1 3.91Å; F131-I142 HydrophobicContact CB-CG1 3.87Å; F131-I142 HydrophobicContact CD1-CD1 4.2Å; F131-I142 HydrophobicContact CG-CD1 4.36Å; F139-I142 HydrophobicContact CD1-CB 4.34Å; F139-I142 HydrophobicContact CD1-CD1 4.08Å; F139-I142 HydrophobicContact CE1-CD1 3.78Å; F139-I142 HydrophobicContact CZ-CD1 4.45Å; I142-V146 HydrophobicContact CD1-CB 4.18Å; I142-V146 HydrophobicContact CD1-CG1 4.41Å; I142-V146 HydrophobicContact CD1-CG2 3.98Å; I142-V146 HydrophobicContact CG1-CB 4.11Å; I142-V146 HydrophobicContact CG1-CG1 4.16Å; I142-V146 HydrophobicContact CG1-CG2 4.46Å; I142-Q154 HydrophobicContact CG2-CB 4.48Å; I142-Q154 HydrophobicContact CG2-CG 4.14Å; I142-Q154 WeakPolarHBondContact O-CG 3.45Å; I142-Q154 PolarHBondContact O-NE2 3.07Å; I142-L157 HydrophobicContact CD1-CD1 4.12Å; I142-L157 HydrophobicContact CG2-CB 3.89Å; I142-L157 HydrophobicContact CG2-CD1 4.46Å
143	S	98.2	Very high	96	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.			trans	-74.1	148.4	179.3	61.8	0	0	0	0	112.1	F129 V130 T145 V146	F129-S143 WeakPolarHBondContact CA-OG 3.45Å; F129-S143 WeakPolarHBondContact CB-OG 3.48Å; V130-S143 PolarHBondContact N-OG 2.87Å; V130-S143 PolarHBondContact O-N 3.01Å; S143-T145 PolarHBondContact O-N 2.94Å; S143-T145 VanDerWaalsContact O-N 3.11Å; S143-T145 PolarHBondContact OG-OG1 2.83Å; S143-V146 VanDerWaalsContact O-CG1 3.29Å; S143-V146 WeakPolarHBondContact O-CG1 3.42Å; S143-V146 PolarHBondContact O-N 2.77Å; S143-V146 VanDerWaalsContact O-N 3.15Å
144	E	96.6	Very high	95.9	Very high	112 Å²	112	36.6 Å²	36.6	52%	0.523	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25	176.8	63.6	-170.2	164.9	0	0	113.4	V146 S147	E144-V146 PolarHBondContact O-N 3.3Å; E144-V146 VanDerWaalsContact O-N 3.14Å; E144-S147 WeakPolarHBondContact O-CB 3.22Å; E144-S147 PolarHBondContact O-N 3.01Å; E144-S147 PolarHBondContact O-OG 2.91Å
145	T	96.9	Very high	96.1	Very high	12 Å²	12	37.5 Å²	37.5	7%	0.074	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-18.6	176.9	59.8	0	0	0	0	114	L123 G128 F129 S143 S147 I148 Y149	L123-T145 HydrophobicContact CB-CG2 4.14Å; G128-T145 PolarHBondContact O-OG1 2.88Å; F129-T145 WeakPolarHBondContact CA-OG1 3.44Å; F129-T145 WeakPolarHBondContact CB-OG1 3.49Å; S143-T145 PolarHBondContact O-N 2.94Å; S143-T145 VanDerWaalsContact O-N 3.11Å; S143-T145 PolarHBondContact OG-OG1 2.83Å; T145-S147 PolarHBondContact O-N 2.98Å; T145-I148 HydrophobicContact CG2-CD1 4.25Å; T145-I148 VanDerWaalsContact O-CB 3.29Å; T145-I148 WeakPolarHBondContact O-CB 3.43Å; T145-I148 PolarHBondContact O-N 2.94Å; T145-Y149 VanDerWaalsContact O-CD2 3.27Å; T145-Y149 WeakPolarHBondContact O-CD2 3.19Å
146	V	97	Very high	96.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55	-28.5	173.2	71.1	0	0	0	0	112.6	F129 I142 S143 E144 I148 Y149 L150 L157	F129-V146 HydrophobicContact CB-CB 4Å; F129-V146 HydrophobicContact CD1-CB 4.44Å; F129-V146 HydrophobicContact CD1-CG2 4.23Å; F129-V146 HydrophobicContact CD2-CB 4Å; F129-V146 HydrophobicContact CD2-CG2 3.79Å; F129-V146 HydrophobicContact CE1-CG2 4.34Å; F129-V146 HydrophobicContact CE2-CG2 3.91Å; F129-V146 HydrophobicContact CG-CB 3.91Å; F129-V146 HydrophobicContact CG-CG2 3.96Å; F129-V146 HydrophobicContact CZ-CG2 4.19Å; I142-V146 HydrophobicContact CD1-CB 4.18Å; I142-V146 HydrophobicContact CD1-CG1 4.41Å; I142-V146 HydrophobicContact CD1-CG2 3.98Å; I142-V146 HydrophobicContact CG1-CB 4.11Å; I142-V146 HydrophobicContact CG1-CG1 4.16Å; I142-V146 HydrophobicContact CG1-CG2 4.46Å; S143-V146 VanDerWaalsContact O-CG1 3.29Å; S143-V146 WeakPolarHBondContact O-CG1 3.42Å; S143-V146 PolarHBondContact O-N 2.77Å; S143-V146 VanDerWaalsContact O-N 3.15Å; E144-V146 PolarHBondContact O-N 3.3Å; E144-V146 VanDerWaalsContact O-N 3.14Å; V146-I148 VanDerWaalsContact C-N 3.28Å; V146-I148 PolarHBondContact O-N 2.9Å; V146-Y149 PolarHBondContact O-N 3.25Å; V146-L150 HydrophobicContact CG2-CB 4.33Å; V146-L150 HydrophobicContact CG2-CD1 3.95Å; V146-L150 HydrophobicContact CG2-CG 4.38Å; V146-L150 PolarHBondContact O-N 2.96Å; V146-L157 HydrophobicContact CB-CD1 4.49Å; V146-L157 HydrophobicContact CG1-CD1 3.77Å; V146-L157 HydrophobicContact CG2-CD1 3.93Å
147	S	95.1	Very high	96.5	Very high	59 Å²	59	35.3 Å²	35.3	41%	0.413	19%	0.185	S	C	.	.	H	α-helix	trans	-63.8	-29.6	174.4	62.9	0	0	0	0	113.6	E144 T145 G151 L152	E144-S147 WeakPolarHBondContact O-CB 3.22Å; E144-S147 PolarHBondContact O-N 3.01Å; E144-S147 PolarHBondContact O-OG 2.91Å; T145-S147 PolarHBondContact O-N 2.98Å; S147-G151 WeakPolarHBondContact O-CA 3.16Å; S147-G151 PolarHBondContact O-N 2.87Å; S147-L152 VanDerWaalsContact CA-O 3.27Å; S147-L152 WeakPolarHBondContact CA-O 3.41Å; S147-L152 WeakPolarHBondContact CB-O 3.44Å; S147-L152 PolarHBondContact N-O 3.13Å
148	I	92.5	Very high	96.6	Very high	111 Å²	111	36 Å²	36	57%	0.569	19%	0.189	S	C	*	.	H	α-helix	trans	-72.1	-39.1	176.7	-52.7	173	0	0	0	110.3	T145 V146 L239	T145-I148 HydrophobicContact CG2-CD1 4.25Å; T145-I148 VanDerWaalsContact O-CB 3.29Å; T145-I148 WeakPolarHBondContact O-CB 3.43Å; T145-I148 PolarHBondContact O-N 2.94Å; V146-I148 VanDerWaalsContact C-N 3.28Å; V146-I148 PolarHBondContact O-N 2.9Å; I148-L239 WeakPolarHBondContact O-CD1 3.35Å
149	Y	92.1	Very high	96.6	Very high	38 Å²	38	32.2 Å²	32.2	15%	0.149	18%	0.177	C	C	.	.	H	α-helix	trans	-93.5	-33.4	-170.9	-65	-76.4	0	0	0	114.2	D127 G128 F129 T145 V146 L239 K252 A285	D127-Y149 WeakPolarHBondContact CA-OH 3.41Å; D127-Y149 VanDerWaalsContact OD1-CE1 3.27Å; D127-Y149 WeakPolarHBondContact OD1-CE1 3.26Å; D127-Y149 VanDerWaalsContact OD1-CZ 3.32Å; D127-Y149 PolarHBondContact OD1-OH 2.87Å; G128-Y149 VanDerWaalsContact CA-CE2 3.47Å; G128-Y149 VanDerWaalsContact N-CZ 3.27Å; G128-Y149 PolarHBondContact N-OH 2.88Å; G128-Y149 VanDerWaalsContact N-OH 3.15Å; G128-Y149 WeakPolarHBondContact O-CE2 3.32Å; F129-Y149 HydrophobicContact CD1-CD2 4.19Å; F129-Y149 HydrophobicContact CD1-CG 4.37Å; T145-Y149 VanDerWaalsContact O-CD2 3.27Å; T145-Y149 WeakPolarHBondContact O-CD2 3.19Å; V146-Y149 PolarHBondContact O-N 3.25Å; Y149-L239 WeakPolarHBondContact O-CD1 3.48Å; Y149-K252 WeakPolarHBondContact O-CD 3.42Å; Y149-K252 WeakPolarHBondContact O-CE 3.48Å; Y149-K252 PolarHBondContact O-NZ 2.77Å; Y149-A285 HydrophobicContact CD1-CB 3.88Å; Y149-A285 HydrophobicContact CG-CB 4.26Å
150	L	93.5	Very high	96.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-15.5	-178.7	-66	-179.7	0	0	0	113.9	F129 V146 L152 M235 K236 S237 T238 K252 I254	F129-L150 HydrophobicContact CE1-CD1 4.3Å; F129-L150 HydrophobicContact CE1-CG 4.44Å; F129-L150 HydrophobicContact CZ-CD1 3.92Å; V146-L150 HydrophobicContact CG2-CB 4.33Å; V146-L150 HydrophobicContact CG2-CD1 3.95Å; V146-L150 HydrophobicContact CG2-CG 4.38Å; V146-L150 PolarHBondContact O-N 2.96Å; L150-L152 HydrophobicContact CB-CB 4.46Å; L150-L152 HydrophobicContact CB-CD1 4.3Å; L150-L152 HydrophobicContact CB-CG 4.18Å; L150-L152 HydrophobicContact CD1-CD1 4.35Å; L150-L152 PolarHBondContact O-N 3.08Å; L150-M235 HydrophobicContact CD1-CB 3.88Å; L150-M235 HydrophobicContact CD1-CE 4.29Å; L150-M235 HydrophobicContact CD1-SD 4.27Å; L150-M235 HydrophobicContact CD2-CB 4.33Å; L150-K236 WeakPolarHBondContact CD2-O 3.41Å; L150-S237 CarbonylContact O-C 3.52Å; L150-S237 VanDerWaalsContact O-CA 3.28Å; L150-S237 WeakPolarHBondContact O-CA 3.28Å; L150-T238 PolarHBondContact O-N 3.38Å; L150-T238 PolarHBondContact O-OG1 3.14Å; L150-K252 HydrophobicContact CD2-CB 4.16Å; L150-K252 HydrophobicContact CD2-CD 4.32Å; L150-I254 HydrophobicContact CD2-CD1 4.03Å
151	G	94	Very high	96.6	Very high	28 Å²	28	33.4 Å²	33.4	29%	0.289	19%	0.187	S	C	.	.			trans	72.2	10.1	-174.7	0	0	0	0	0	114.4	S147 T238	S147-G151 WeakPolarHBondContact O-CA 3.16Å; S147-G151 PolarHBondContact O-N 2.87Å; G151-T238 VanDerWaalsContact CA-OG1 3.28Å; G151-T238 WeakPolarHBondContact CA-OG1 3.19Å; G151-T238 PolarHBondContact O-OG1 3.07Å
152	L	95.4	Very high	96.6	Very high	9 Å²	9	30 Å²	30	5%	0.047	17%	0.173	C	C	.	.			trans	-90.7	152.6	175.3	-63.5	177.6	0	0	0	110.8	S147 L150 L157 Y165 K236 T238	S147-L152 VanDerWaalsContact CA-O 3.27Å; S147-L152 WeakPolarHBondContact CA-O 3.41Å; S147-L152 WeakPolarHBondContact CB-O 3.44Å; S147-L152 PolarHBondContact N-O 3.13Å; L150-L152 HydrophobicContact CB-CB 4.46Å; L150-L152 HydrophobicContact CB-CD1 4.3Å; L150-L152 HydrophobicContact CB-CG 4.18Å; L150-L152 HydrophobicContact CD1-CD1 4.35Å; L150-L152 PolarHBondContact O-N 3.08Å; L152-L157 HydrophobicContact CB-CD1 3.77Å; L152-L157 HydrophobicContact CB-CG 4.35Å; L152-L157 HydrophobicContact CD1-CD1 4.39Å; L152-L157 HydrophobicContact CD1-CD2 4.22Å; L152-Y165 HydrophobicContact CD1-CD1 3.62Å; L152-Y165 HydrophobicContact CD1-CE1 4.06Å; L152-Y165 HydrophobicContact CD2-CE1 4.41Å; L152-K236 HydrophobicContact CD1-CB 4.43Å; L152-K236 WeakPolarHBondContact CD1-O 3.48Å; L152-T238 HydrophobicContact CD2-CG2 3.82Å
153	S	96.7	Very high	96.6	Very high	54 Å²	54	30.4 Å²	30.4	38%	0.378	18%	0.175	S	C	.	.			trans	-92.1	138.7	-178.6	179.3	0	0	0	0	112.4	V155 E156 L157	S153-V155 PolarHBondContact O-N 2.88Å; S153-V155 PolarHBondContact OG-N 3.04Å; S153-E156 WeakPolarHBondContact O-CB 3.47Å; S153-E156 PolarHBondContact O-N 2.9Å; S153-L157 PolarHBondContact O-N 2.95Å
154	Q	97.8	Very high	96.6	Very high	40 Å²	40	33.5 Å²	33.5	19%	0.187	19%	0.192	C	C	.	.	H	α-helix	trans	-52.7	-39.4	169.2	176.6	-172.2	57.9	0	0	111.9	I142 E156 L157 T158	I142-Q154 HydrophobicContact CG2-CB 4.48Å; I142-Q154 HydrophobicContact CG2-CG 4.14Å; I142-Q154 WeakPolarHBondContact O-CG 3.45Å; I142-Q154 PolarHBondContact O-NE2 3.07Å; Q154-E156 VanDerWaalsContact C-N 3.29Å; Q154-E156 PolarHBondContact O-N 2.91Å; Q154-L157 PolarHBondContact O-N 2.86Å; Q154-T158 VanDerWaalsContact O-CB 3.27Å; Q154-T158 WeakPolarHBondContact O-CB 3.45Å; Q154-T158 PolarHBondContact O-N 2.91Å; Q154-T158 PolarHBondContact O-OG1 2.99Å
155	V	97.7	Very high	96.6	Very high	22 Å²	22	29.3 Å²	29.3	13%	0.133	17%	0.171	C	C	.	.	H	α-helix	trans	-67.7	-29.9	178.3	166	0	0	0	0	112.1	L48 I52 L56 R63 L64 S153	L48-V155 HydrophobicContact CD1-CG2 4.01Å; I52-V155 HydrophobicContact CG2-CG2 3.9Å; L56-V155 HydrophobicContact CD2-CG1 3.53Å; L56-V155 HydrophobicContact CD2-CG2 4.48Å; R63-V155 PolarHBondContact NH1-O 2.83Å; R63-V155 PolarHBondContact NH2-O 3.28Å; L64-V155 HydrophobicContact CD1-CG1 4.31Å; S153-V155 PolarHBondContact O-N 2.88Å; S153-V155 PolarHBondContact OG-N 3.04Å
156	E	97	Very high	96.7	Very high	80 Å²	80	28.9 Å²	28.9	37%	0.374	17%	0.168	S	C	.	.	H	α-helix	trans	-78.8	-41.3	177.5	-165.6	-153	138.5	0	0	111.1	R63 S153 Q154 S160 Y165	R63-E156 PolarHBondContact NH1-O 2.93Å; S153-E156 WeakPolarHBondContact O-CB 3.47Å; S153-E156 PolarHBondContact O-N 2.9Å; Q154-E156 VanDerWaalsContact C-N 3.29Å; Q154-E156 PolarHBondContact O-N 2.91Å; E156-S160 PolarHBondContact O-OG 3.01Å; E156-Y165 VanDerWaalsContact OE1-CE1 3.23Å; E156-Y165 WeakPolarHBondContact OE1-CE1 3.38Å; E156-Y165 PolarHBondContact OE1-OH 2.75Å
157	L	98.2	Very high	96.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-76.8	-39.9	-177	-72.4	161	0	0	0	113.8	F139 I142 V146 L152 S153 Q154 G159 S160 Y165	F139-L157 HydrophobicContact CD2-CB 4.36Å; F139-L157 HydrophobicContact CD2-CD2 4.4Å; F139-L157 WeakPolarHBondContact CD2-O 3.45Å; F139-L157 HydrophobicContact CE2-CD2 3.86Å; F139-L157 HydrophobicContact CZ-CD2 4.3Å; I142-L157 HydrophobicContact CD1-CD1 4.12Å; I142-L157 HydrophobicContact CG2-CB 3.89Å; I142-L157 HydrophobicContact CG2-CD1 4.46Å; V146-L157 HydrophobicContact CB-CD1 4.49Å; V146-L157 HydrophobicContact CG1-CD1 3.77Å; V146-L157 HydrophobicContact CG2-CD1 3.93Å; L152-L157 HydrophobicContact CB-CD1 3.77Å; L152-L157 HydrophobicContact CB-CG 4.35Å; L152-L157 HydrophobicContact CD1-CD1 4.39Å; L152-L157 HydrophobicContact CD1-CD2 4.22Å; S153-L157 PolarHBondContact O-N 2.95Å; Q154-L157 PolarHBondContact O-N 2.86Å; L157-G159 PolarHBondContact O-N 3.22Å; L157-S160 WeakPolarHBondContact O-CB 3.45Å; L157-S160 PolarHBondContact O-N 3.03Å; L157-Y165 HydrophobicContact CD2-CD1 3.67Å; L157-Y165 HydrophobicContact CD2-CD2 3.59Å; L157-Y165 HydrophobicContact CD2-CE1 3.74Å; L157-Y165 HydrophobicContact CD2-CE2 3.7Å; L157-Y165 HydrophobicContact CD2-CG 3.58Å
158	T	98.6	Very high	96.6	Very high	14 Å²	14	32.7 Å²	32.7	9%	0.086	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	118.8	-172	-58.4	0	0	0	0	111.8	R63 L64 Q154	R63-T158 PolarHBondContact NH1-O 2.86Å; L64-T158 HydrophobicContact CD2-CG2 3.82Å; Q154-T158 VanDerWaalsContact O-CB 3.27Å; Q154-T158 WeakPolarHBondContact O-CB 3.45Å; Q154-T158 PolarHBondContact O-N 2.91Å; Q154-T158 PolarHBondContact O-OG1 2.99Å
159	G	97.9	Very high	96.7	Very high	17 Å²	17	30.2 Å²	30.2	18%	0.175	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-7.6	-176.2	0	0	0	0	0	115.7	S67 F139 L157	S67-G159 WeakPolarHBondContact OG-CA 3.18Å; S67-G159 PolarHBondContact OG-N 3.41Å; F139-G159 PolarHBondContact O-N 2.82Å; L157-G159 PolarHBondContact O-N 3.22Å
160	S	98.3	Very high	96.9	Very high	18 Å²	18	28.6 Å²	28.6	13%	0.126	18%	0.182	C	C	.	.	S	Bend	trans	-84	166.1	173.8	-50.6	0	0	0	0	110.8	R63 K138 F139 E156 L157	R63-S160 PolarHBondContact NH1-OG 2.82Å; K138-S160 VanDerWaalsContact CA-O 3.3Å; K138-S160 WeakPolarHBondContact CA-O 3.33Å; F139-S160 PolarHBondContact N-O 3.12Å; F139-S160 VanDerWaalsContact N-O 3.11Å; E156-S160 PolarHBondContact O-OG 3.01Å; L157-S160 WeakPolarHBondContact O-CB 3.45Å; L157-S160 PolarHBondContact O-N 3.03Å
161	S	98.2	Very high	97	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-79.8	142.3	178.8	-167.3	0	0	0	0	110.8	F163 D164 Y165	S161-F163 PolarHBondContact O-N 2.98Å; S161-D164 WeakPolarHBondContact CA-OD2 3.45Å; S161-D164 WeakPolarHBondContact CB-OD2 3.38Å; S161-D164 PolarHBondContact N-OD2 3.12Å; S161-D164 WeakPolarHBondContact O-CB 3.29Å; S161-D164 PolarHBondContact O-N 2.83Å; S161-Y165 WeakPolarHBondContact O-CD2 3.36Å
162	V	98.4	Very high	97.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-59.5	-37.6	172.3	69.7	0	0	0	0	111.1	L133 G137 F139 D164 Y165 V166 M174 L178	L133-V162 HydrophobicContact CD1-CB 4.06Å; L133-V162 HydrophobicContact CD1-CG1 4.09Å; L133-V162 HydrophobicContact CD1-CG2 4.12Å; L133-V162 HydrophobicContact CD2-CB 4.17Å; G137-V162 VanDerWaalsContact O-CB 3.25Å; G137-V162 WeakPolarHBondContact O-CB 3.38Å; G137-V162 VanDerWaalsContact O-CG1 3.24Å; G137-V162 WeakPolarHBondContact O-CG1 3.36Å; G137-V162 PolarHBondContact O-N 2.88Å; F139-V162 HydrophobicContact CE2-CB 4.25Å; F139-V162 HydrophobicContact CE2-CG2 4.41Å; F139-V162 HydrophobicContact CZ-CB 4.2Å; F139-V162 HydrophobicContact CZ-CG2 3.91Å; V162-D164 PolarHBondContact O-N 3.14Å; V162-Y165 PolarHBondContact O-N 3Å; V162-V166 HydrophobicContact CG2-CG2 3.8Å; V162-V166 WeakPolarHBondContact O-CG2 3.45Å; V162-V166 PolarHBondContact O-N 3.24Å; V162-M174 HydrophobicContact CG1-CE 4.19Å; V162-M174 HydrophobicContact CG1-CG 4.19Å; V162-M174 HydrophobicContact CG2-CE 4.09Å; V162-M174 HydrophobicContact CG2-SD 4.49Å; V162-L178 HydrophobicContact CG1-CD1 4.38Å
163	F	98	Very high	97.1	Very high	8 Å²	8	35 Å²	35	4%	0.035	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62.8	-24.6	179.5	-58.3	-73.4	0	0	0	113.3	S161 Y165 H171 M174 A175 L178 M180 P210	S161-F163 PolarHBondContact O-N 2.98Å; F163-Y165 PolarHBondContact O-N 3.17Å; F163-H171 HydrophobicContact CD1-CB 4.08Å; F163-H171 AromaticContact CD1-CG 3.84Å; F163-H171 HydrophobicContact CE1-CB 4.41Å; F163-H171 WeakPolarHBondContact CE1-O 3.48Å; F163-H171 PolarHBondContact O-CE1 3.43Å; F163-H171 VanDerWaalsContact O-CE1 3.24Å; F163-H171 PolarHBondContact O-NE2 3.36Å; F163-M174 HydrophobicContact CE1-CB 3.96Å; F163-M174 HydrophobicContact CE1-CG 3.97Å; F163-M174 HydrophobicContact CZ-CG 4.38Å; F163-A175 HydrophobicContact CE1-CB 4.26Å; F163-A175 HydrophobicContact CZ-CB 4.09Å; F163-L178 HydrophobicContact CZ-CD1 4.19Å; F163-M180 HydrophobicContact CE2-CE 4.09Å; F163-M180 HydrophobicContact CE2-SD 3.87Å; F163-M180 HydrophobicContact CZ-CE 4.47Å; F163-M180 HydrophobicContact CZ-SD 3.75Å; F163-P210 HydrophobicContact CD1-CG 4.5Å; F163-P210 HydrophobicContact CE1-CG 4.29Å; F163-P210 HydrophobicContact CZ-CG 4.31Å
164	D	97.8	Very high	97	Very high	66 Å²	66	32.4 Å²	32.4	35%	0.353	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-64.8	-22	173.7	-55.6	-32.7	0	0	0	111.7	S161 V162 K236	S161-D164 WeakPolarHBondContact CA-OD2 3.45Å; S161-D164 WeakPolarHBondContact CB-OD2 3.38Å; S161-D164 PolarHBondContact N-OD2 3.12Å; S161-D164 WeakPolarHBondContact O-CB 3.29Å; S161-D164 PolarHBondContact O-N 2.83Å; V162-D164 PolarHBondContact O-N 3.14Å; D164-K236 WeakPolarHBondContact O-CE 3.31Å; D164-K236 PolarHBondContact O-NZ 2.81Å
165	Y	97.8	Very high	96.8	Very high	24 Å²	24	30.5 Å²	30.5	9%	0.094	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-11.9	-173.3	-64.6	-83.9	0	0	0	114.4	F139 L152 E156 L157 S161 V162 F163 M235 K236	F139-Y165 HydrophobicContact CE2-CD2 4.24Å; L152-Y165 HydrophobicContact CD1-CD1 3.62Å; L152-Y165 HydrophobicContact CD1-CE1 4.06Å; L152-Y165 HydrophobicContact CD2-CE1 4.41Å; E156-Y165 VanDerWaalsContact OE1-CE1 3.23Å; E156-Y165 WeakPolarHBondContact OE1-CE1 3.38Å; E156-Y165 PolarHBondContact OE1-OH 2.75Å; L157-Y165 HydrophobicContact CD2-CD1 3.67Å; L157-Y165 HydrophobicContact CD2-CD2 3.59Å; L157-Y165 HydrophobicContact CD2-CE1 3.74Å; L157-Y165 HydrophobicContact CD2-CE2 3.7Å; L157-Y165 HydrophobicContact CD2-CG 3.58Å; S161-Y165 WeakPolarHBondContact O-CD2 3.36Å; V162-Y165 PolarHBondContact O-N 3Å; F163-Y165 PolarHBondContact O-N 3.17Å; Y165-M235 CarbonylContact O-C 3.45Å; Y165-M235 WeakPolarHBondContact O-CA 3.42Å; Y165-K236 WeakPolarHBondContact O-CG 3.12Å; Y165-K236 PolarHBondContact O-N 2.81Å
166	V	97.8	Very high	96.6	Very high	2 Å²	2	36 Å²	36	1%	0.012	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-90.1	146.2	174.6	179.8	0	0	0	0	110.4	V162 D170 H171 I233 R234 M235	V162-V166 HydrophobicContact CG2-CG2 3.8Å; V162-V166 WeakPolarHBondContact O-CG2 3.45Å; V162-V166 PolarHBondContact O-N 3.24Å; V166-D170 HydrophobicContact CG1-CB 3.86Å; V166-H171 PolarHBondContact O-NE2 3.04Å; V166-I233 HydrophobicContact CG1-CB 4.27Å; V166-I233 HydrophobicContact CG1-CD1 4.27Å; V166-I233 HydrophobicContact CG2-CD1 3.65Å; V166-R234 CarbonylContact C-O 3.59Å; V166-M235 HydrophobicContact CG2-CG 4.36Å
167	H	96.1	Very high	96.4	Very high	56 Å²	56	34.3 Å²	34.3	26%	0.259	20%	0.2	S	C	.	.			trans	-61	132.8	174.6	-178.4	-100.9	0	0	0	111	G169 D170 H171 R234 Y251	H167-G169 PolarHBondContact ND1-N 2.74Å; H167-G169 PolarHBondContact O-N 3.25Å; H167-G169 VanDerWaalsContact O-N 3.08Å; H167-D170 IonicContact ND1-OD1 3.78Å; H167-D170 PolarHBondContact O-N 3.01Å; H167-H171 PolarHBondContact O-CD2 3.33Å; H167-R234 HydrophobicContact CB-CB 3.67Å; H167-R234 WeakPolarHBondContact CB-O 3.41Å; H167-R234 PolarHBondContact N-O 2.83Å; H167-Y251 HydrophobicContact CB-CD1 3.85Å; H167-Y251 HydrophobicContact CB-CE1 3.72Å; H167-Y251 HydrophobicContact CB-CG 4.46Å; H167-Y251 AromaticContact CD2-CE2 3.8Å; H167-Y251 AromaticContact CD2-CZ 3.91Å
168	P	95.4	Very high	96.1	Very high	84 Å²	84	34.5 Å²	34.5	55%	0.545	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-54.2	-34.3	-175.1	-30.5	36.8	0	0	0	115.2	D170 H171	P168-D170 PolarHBondContact O-N 2.91Å; P168-D170 VanDerWaalsContact O-N 3.16Å; P168-H171 WeakPolarHBondContact O-CB 3.38Å; P168-H171 PolarHBondContact O-N 3.19Å
169	G	93.9	Very high	95.6	Very high	59 Å²	59	35.6 Å²	35.6	61%	0.608	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-64.6	-13.4	176	0	0	0	0	0	115.1	H167	H167-G169 PolarHBondContact ND1-N 2.74Å; H167-G169 PolarHBondContact O-N 3.25Å; H167-G169 VanDerWaalsContact O-N 3.08Å
170	D	96.5	Very high	95	Very high	3 Å²	3	36 Å²	36	2%	0.016	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-109.4	2.5	-178.7	-49.4	-15.3	0	0	0	111.5	V166 H167 P168 M174 I233 R234	V166-D170 HydrophobicContact CG1-CB 3.86Å; H167-D170 IonicContact ND1-OD1 3.78Å; H167-D170 PolarHBondContact O-N 3.01Å; P168-D170 PolarHBondContact O-N 2.91Å; P168-D170 VanDerWaalsContact O-N 3.16Å; D170-M174 WeakPolarHBondContact O-CB 3.3Å; D170-M174 PolarHBondContact O-N 2.87Å; D170-I233 HydrophobicContact CB-CB 4.41Å; D170-I233 HydrophobicContact CB-CG2 4.28Å; D170-R234 IonicContact OD1-CZ 3.61Å; D170-R234 VanDerWaalsContact OD1-CZ 3.3Å; D170-R234 IonicContact OD1-NE 3.8Å; D170-R234 PolarHBondContact OD1-NE 3.02Å; D170-R234 IonicContact OD1-NH2 2.76Å; D170-R234 PolarHBondContact OD1-NH2 2.88Å; D170-R234 VanDerWaalsContact OD2-CB 3.22Å; D170-R234 WeakPolarHBondContact OD2-CB 3.35Å; D170-R234 WeakPolarHBondContact OD2-CG 3.06Å; D170-R234 IonicContact OD2-CZ 2.83Å; D170-R234 PolarHBondContact OD2-N 3.06Å; D170-R234 IonicContact OD2-NE 2.73Å; D170-R234 PolarHBondContact OD2-NE 2.98Å; D170-R234 IonicContact OD2-NH2 2.74Å
171	H	96.3	Very high	93.5	Very high	34 Å²	34	41.6 Å²	41.6	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-38.3	-176.5	-76.1	-166.4	0	0	0	112.9	F163 V166 H167 P168 M174 A175	F163-H171 HydrophobicContact CD1-CB 4.08Å; F163-H171 AromaticContact CD1-CG 3.84Å; F163-H171 HydrophobicContact CE1-CB 4.41Å; F163-H171 WeakPolarHBondContact CE1-O 3.48Å; F163-H171 PolarHBondContact O-CE1 3.43Å; F163-H171 VanDerWaalsContact O-CE1 3.24Å; F163-H171 PolarHBondContact O-NE2 3.36Å; V166-H171 PolarHBondContact O-NE2 3.04Å; H167-H171 PolarHBondContact O-CD2 3.33Å; P168-H171 WeakPolarHBondContact O-CB 3.38Å; P168-H171 PolarHBondContact O-N 3.19Å; H171-M174 PolarHBondContact O-N 3.42Å; H171-A175 WeakPolarHBondContact O-CB 3.17Å; H171-A175 PolarHBondContact O-N 3.17Å
172	V	95.4	Very high	91.7	Very high	91 Å²	91	44 Å²	44	55%	0.552	25%	0.246	S	C	*	.	H	α-helix	trans	-62.9	-48.4	178.1	171.4	0	0	0	0	110.6	A175 E176 L182	V172-A175 PolarHBondContact O-N 2.69Å; V172-E176 PolarHBondContact O-N 2.93Å; V172-L182 HydrophobicContact CB-CD1 4.25Å; V172-L182 HydrophobicContact CG1-CD1 3.8Å; V172-L182 HydrophobicContact CG2-CD1 4.2Å
173	E	95	Very high	89.3	Confident	47 Å²	47	48.1 Å²	48.1	22%	0.22	27%	0.273	C	S	.	.	H	α-helix	trans	-60.9	-47.9	176.5	-176.3	-177.8	150.3	0	0	111.2	A175 E176 Q177 F231 K356	E173-A175 VanDerWaalsContact C-N 3.28Å; E173-A175 PolarHBondContact O-N 2.99Å; E173-E176 PolarHBondContact O-N 3.25Å; E173-Q177 HydrophobicContact CG-CG 4.33Å; E173-Q177 WeakPolarHBondContact O-CB 3.35Å; E173-Q177 WeakPolarHBondContact O-CG 3.34Å; E173-Q177 PolarHBondContact O-N 3.02Å; E173-F231 HydrophobicContact CG-CD2 4.49Å; E173-K356 IonicContact OE1-NZ 3.98Å; E173-K356 PolarHBondContact OE1-NZ 3.2Å; E173-K356 WeakPolarHBondContact OE2-CE 3.28Å; E173-K356 IonicContact OE2-NZ 3.56Å; E173-K356 PolarHBondContact OE2-NZ 3.18Å
174	M	95.4	Very high	86.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.2	-38.1	177.5	-173.5	71.2	-150.9	0	0	112.4	L133 V162 F163 D170 H171 L178 F231 I233 I256 L279	L133-M174 HydrophobicContact CD1-CE 3.47Å; L133-M174 VanDerWaalsContact CD1-CE 3.47Å; V162-M174 HydrophobicContact CG1-CE 4.19Å; V162-M174 HydrophobicContact CG1-CG 4.19Å; V162-M174 HydrophobicContact CG2-CE 4.09Å; V162-M174 HydrophobicContact CG2-SD 4.49Å; F163-M174 HydrophobicContact CE1-CB 3.96Å; F163-M174 HydrophobicContact CE1-CG 3.97Å; F163-M174 HydrophobicContact CZ-CG 4.38Å; D170-M174 WeakPolarHBondContact O-CB 3.3Å; D170-M174 PolarHBondContact O-N 2.87Å; H171-M174 PolarHBondContact O-N 3.42Å; M174-L178 HydrophobicContact CE-CD1 3.78Å; M174-L178 HydrophobicContact CE-CG 4.04Å; M174-L178 HydrophobicContact CG-CD1 4.3Å; M174-L178 WeakPolarHBondContact O-CB 3.35Å; M174-L178 WeakPolarHBondContact O-CD1 3.49Å; M174-L178 WeakPolarHBondContact O-CG 3.44Å; M174-L178 PolarHBondContact O-N 3.03Å; M174-L178 VanDerWaalsContact O-N 3.12Å; M174-F231 HydrophobicContact CE-CZ 4.25Å; M174-F231 HydrophobicContact SD-CE2 3.69Å; M174-F231 HydrophobicContact SD-CZ 3.75Å; M174-I233 HydrophobicContact SD-CD1 3.87Å; M174-I233 HydrophobicContact SD-CG2 4.5Å; M174-I256 HydrophobicContact SD-CD1 4.3Å; M174-L279 HydrophobicContact CE-CD2 4.25Å
175	A	94.1	Very high	84	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-69.2	-43.5	177.3	0	0	0	0	0	112.1	F163 H171 V172 E173 L178 G179 M180 L182	F163-A175 HydrophobicContact CE1-CB 4.26Å; F163-A175 HydrophobicContact CZ-CB 4.09Å; H171-A175 WeakPolarHBondContact O-CB 3.17Å; H171-A175 PolarHBondContact O-N 3.17Å; V172-A175 PolarHBondContact O-N 2.69Å; E173-A175 VanDerWaalsContact C-N 3.28Å; E173-A175 PolarHBondContact O-N 2.99Å; A175-L178 PolarHBondContact O-N 2.85Å; A175-G179 PolarHBondContact O-N 3.02Å; A175-M180 HydrophobicContact CB-CB 4.16Å; A175-M180 HydrophobicContact CB-SD 4.24Å; A175-M180 WeakPolarHBondContact O-CB 3.35Å; A175-M180 PolarHBondContact O-N 3.19Å; A175-L182 HydrophobicContact CB-CD1 4.45Å; A175-L182 HydrophobicContact CB-CD2 3.84Å; A175-L182 HydrophobicContact CB-CG 4.19Å
176	E	92.2	Very high	81.4	Confident	136 Å²	136	65.2 Å²	65.2	64%	0.636	37%	0.371	S	S	*	.	H	α-helix	trans	-60.7	-46.6	174.8	-174.8	-178.3	171.1	0	0	111.5	V172 E173 L178 G179	V172-E176 PolarHBondContact O-N 2.93Å; E173-E176 PolarHBondContact O-N 3.25Å; E176-L178 PolarHBondContact O-N 2.72Å; E176-G179 WeakPolarHBondContact O-CA 3.48Å; E176-G179 PolarHBondContact O-N 2.73Å
177	Q	93	Very high	78.3	Confident	46 Å²	46	68.6 Å²	68.6	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-63.5	-29.2	177.8	-62.7	-76.7	-13.4	0	0	112	E173 G179 R229 F231	E173-Q177 HydrophobicContact CG-CG 4.33Å; E173-Q177 WeakPolarHBondContact O-CB 3.35Å; E173-Q177 WeakPolarHBondContact O-CG 3.34Å; E173-Q177 PolarHBondContact O-N 3.02Å; Q177-G179 VanDerWaalsContact C-N 3.32Å; Q177-R229 WeakPolarHBondContact O-CD 3.24Å; Q177-R229 PolarHBondContact O-NE 2.9Å; Q177-F231 HydrophobicContact CB-CD1 4.08Å; Q177-F231 HydrophobicContact CB-CE1 3.62Å; Q177-F231 HydrophobicContact CB-CE2 4.1Å; Q177-F231 HydrophobicContact CB-CZ 3.64Å; Q177-F231 HydrophobicContact CG-CB 4.45Å; Q177-F231 HydrophobicContact CG-CD1 3.73Å; Q177-F231 HydrophobicContact CG-CD2 3.87Å; Q177-F231 HydrophobicContact CG-CE1 3.8Å; Q177-F231 HydrophobicContact CG-CE2 3.93Å; Q177-F231 HydrophobicContact CG-CG 3.78Å; Q177-F231 HydrophobicContact CG-CZ 3.9Å
178	L	91.8	Very high	75.5	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.5	170.7	-80.2	163.6	0	0	0	114.2	L133 V162 F163 M174 A175 E176 M180 L279	L133-L178 HydrophobicContact CB-CD2 4.42Å; L133-L178 HydrophobicContact CD1-CD1 4.33Å; L133-L178 HydrophobicContact CD1-CD2 4.1Å; V162-L178 HydrophobicContact CG1-CD1 4.38Å; F163-L178 HydrophobicContact CZ-CD1 4.19Å; M174-L178 HydrophobicContact CE-CD1 3.78Å; M174-L178 HydrophobicContact CE-CG 4.04Å; M174-L178 HydrophobicContact CG-CD1 4.3Å; M174-L178 WeakPolarHBondContact O-CB 3.35Å; M174-L178 WeakPolarHBondContact O-CD1 3.49Å; M174-L178 WeakPolarHBondContact O-CG 3.44Å; M174-L178 PolarHBondContact O-N 3.03Å; M174-L178 VanDerWaalsContact O-N 3.12Å; A175-L178 PolarHBondContact O-N 2.85Å; E176-L178 PolarHBondContact O-N 2.72Å; L178-M180 VanDerWaalsContact C-N 3.34Å; L178-M180 HydrophobicContact CB-CE 4.38Å; L178-M180 HydrophobicContact CB-CG 3.94Å; L178-M180 HydrophobicContact CB-SD 4.12Å; L178-M180 HydrophobicContact CD1-CE 3.85Å; L178-M180 HydrophobicContact CD1-SD 3.99Å; L178-L279 HydrophobicContact CD2-CB 3.78Å; L178-L279 HydrophobicContact CD2-CD2 4.37Å
179	G	87.9	Confident	72.5	Confident	36 Å²	36	78.6 Å²	78.6	37%	0.371	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	20.8	-173.3	0	0	0	0	0	113.9	A175 E176 Q177	A175-G179 PolarHBondContact O-N 3.02Å; E176-G179 WeakPolarHBondContact O-CA 3.48Å; E176-G179 PolarHBondContact O-N 2.73Å; Q177-G179 VanDerWaalsContact C-N 3.32Å
180	M	86.6	Confident	69.6	Low	27 Å²	27	80.7 Å²	80.7	13%	0.133	46%	0.461	C	S	.	.			trans	-76	132.3	177.1	-66.1	172.2	163.4	0	0	110.7	Q135 F163 A175 L178 L182	Q135-M180 WeakPolarHBondContact O-CE 3.46Å; F163-M180 HydrophobicContact CE2-CE 4.09Å; F163-M180 HydrophobicContact CE2-SD 3.87Å; F163-M180 HydrophobicContact CZ-CE 4.47Å; F163-M180 HydrophobicContact CZ-SD 3.75Å; A175-M180 HydrophobicContact CB-CB 4.16Å; A175-M180 HydrophobicContact CB-SD 4.24Å; A175-M180 WeakPolarHBondContact O-CB 3.35Å; A175-M180 PolarHBondContact O-N 3.19Å; L178-M180 VanDerWaalsContact C-N 3.34Å; L178-M180 HydrophobicContact CB-CE 4.38Å; L178-M180 HydrophobicContact CB-CG 3.94Å; L178-M180 HydrophobicContact CB-SD 4.12Å; L178-M180 HydrophobicContact CD1-CE 3.85Å; L178-M180 HydrophobicContact CD1-SD 3.99Å; M180-L182 PolarHBondContact O-N 3.2Å
181	K	67.1	Low	66.6	Low	135 Å²	135	89.1 Å²	89.1	59%	0.587	50%	0.5	S	S	*	.			trans	-78.9	103.6	169.2	-70.4	-177.2	179.3	176.9	0	109.3
182	L	60	Low	63.2	Low	67 Å²	67	91.3 Å²	91.3	35%	0.351	53%	0.532	S	S	.	.			trans	-61.5	143.8	165.8	-65.8	170.6	0	0	0	109.8	V172 A175 M180 P210	V172-L182 HydrophobicContact CB-CD1 4.25Å; V172-L182 HydrophobicContact CG1-CD1 3.8Å; V172-L182 HydrophobicContact CG2-CD1 4.2Å; A175-L182 HydrophobicContact CB-CD1 4.45Å; A175-L182 HydrophobicContact CB-CD2 3.84Å; A175-L182 HydrophobicContact CB-CG 4.19Å; M180-L182 PolarHBondContact O-N 3.2Å; L182-P210 HydrophobicContact CD2-CB 4.03Å; L182-P210 HydrophobicContact CD2-CG 4.09Å
183	P	48.2	Very low	60.1	Low	86 Å²	86	93.2 Å²	93.2	56%	0.558	54%	0.544	S	S	*	.			trans	-56.9	134.9	172.7	-25.1	34.8	0	0	0	111.2	G185	P183-G185 VanDerWaalsContact C-N 3.32Å; P183-G185 PolarHBondContact O-N 2.87Å
184	P	38.4	Very low	56.9	Low	143 Å²	143	95.9 Å²	95.9	93%	0.929	57%	0.574	S	S	*	*	S	Bend	trans	-72.8	83.9	-179.1	29.9	-34.9	0	0	0	110.5
185	G	44.6	Very low	53.9	Low	68 Å²	68	105.3 Å²	105.3	70%	0.701	62%	0.618	S	S	*	*	S	Bend	trans	-175.5	14	-171.8	0	0	0	0	0	119.6	P183	P183-G185 VanDerWaalsContact C-N 3.32Å; P183-G185 PolarHBondContact O-N 2.87Å
186	R	44.9	Very low	50.9	Low	246 Å²	246	113.6 Å²	113.6	93%	0.928	66%	0.663	S	S	*	*			trans	-161.3	92.2	166.3	-114.7	166.2	-167.6	-100.5	0.4	113
187	G	32.4	Very low	48	Very low	73 Å²	73	110.2 Å²	110.2	75%	0.753	66%	0.664	S	S	*	*			trans	-152.1	144.3	171.1	0	0	0	0	0	110.2
188	L	36	Very low	45	Very low	167 Å²	167	113.1 Å²	113.1	87%	0.874	70%	0.696	S	S	*	*			trans	60.8	83.8	179.2	-161.4	73.6	0	0	0	116.9
189	L	33.3	Very low	42.3	Very low	183 Å²	183	118.7 Å²	118.7	96%	0.958	74%	0.735	S	S	*	*			trans	-134.9	125.6	136.1	-80.9	-177.8	0	0	0	108.3
190	S	33.6	Very low	39.9	Very low	103 Å²	103	122.9 Å²	122.9	72%	0.72	76%	0.759	S	S	*	*			trans	-139.8	121.3	169.3	-171.1	0	0	0	0	109.8
191	Q	31.8	Very low	37.3	Very low	179 Å²	179	126 Å²	126	84%	0.836	79%	0.789	S	S	*	*			trans	64.5	91	153	-156.6	159.2	6.7	0	0	118.4
192	G	26.4	Very low	35.6	Very low	80 Å²	80	125.2 Å²	125.2	83%	0.825	80%	0.801	S	S	*	*			trans	-129	135.2	148.7	0	0	0	0	0	108.5
193	T	28.6	Very low	34.2	Very low	132 Å²	132	127.8 Å²	127.8	81%	0.81	82%	0.824	S	S	*	*			trans	-105.3	122	-170.8	47.4	0	0	0	0	112.9
194	A	28.9	Very low	33.3	Very low	103 Å²	103	128.7 Å²	128.7	85%	0.851	83%	0.832	S	S	*	*			trans	-156.1	141.3	154.7	0	0	0	0	0	108.7
195	E	31.9	Very low	33.3	Very low	197 Å²	197	127.8 Å²	127.8	92%	0.921	83%	0.83	S	S	*	*			trans	-106.4	131.5	175	-59.9	-177.3	127.8	0	0	108.9
196	D	31.6	Very low	32.8	Very low	175 Å²	175	132.1 Å²	132.1	94%	0.936	83%	0.831	S	S	*	*				-179.9	172.5	112.8	-135.8	-35.1	0	0	0	111.5
197	G	30.2	Very low	32.4	Very low	64 Å²	64	125.3 Å²	125.3	66%	0.66	82%	0.822	S	S	*	*			trans	117.8	42.3	152.5	0	0	0	0	0	121.3
198	A	31.5	Very low	32.7	Very low	108 Å²	108	130 Å²	130	89%	0.893	82%	0.824	S	S	*	*			trans	61.3	128.8	154.7	0	0	0	0	0	121.4
199	S	34.5	Very low	33.3	Very low	120 Å²	120	124.6 Å²	124.6	84%	0.839	80%	0.798	S	S	*	*			trans	-95.6	145.3	-175.7	-48	0	0	0	0	115.2
200	S	38.2	Very low	33.9	Very low	124 Å²	124	117.3 Å²	117.3	87%	0.867	76%	0.762	S	S	*	*			trans	178.6	145.5	135.2	-81.5	0	0	0	0	111
201	A	31.8	Very low	34.5	Very low	93 Å²	93	119.9 Å²	119.9	77%	0.769	76%	0.762	S	S	*	*			cis	168.3	108.3	-19.3	0	0	0	0	0	105.7
202	S	31.2	Very low	35	Very low	119 Å²	119	114.9 Å²	114.9	83%	0.832	75%	0.745	S	S	*	*			trans	-146.9	98.7	165.8	61.6	0	0	0	0	110
203	S	30.1	Very low	35.7	Very low	121 Å²	121	115.4 Å²	115.4	85%	0.846	73%	0.733	S	S	*	*			trans	-86.9	123.3	-175.1	55.5	0	0	0	0	112.4
204	S	29.6	Very low	36.1	Very low	105 Å²	105	118.4 Å²	118.4	73%	0.734	74%	0.737	S	S	*	*			trans	-125.7	100.1	161.9	56.7	0	0	0	0	109.6	Q206	S204-Q206 PolarHBondContact O-N 3.06Å
205	S	37.3	Very low	36.5	Very low	124 Å²	124	117.1 Å²	117.1	87%	0.867	72%	0.722	S	S	*	*			trans	-73.4	85.2	-178.4	-52.7	0	0	0	0	111.4
206	Q	35.3	Very low	36.5	Very low	158 Å²	158	114.9 Å²	114.9	74%	0.738	72%	0.722	S	S	*	*			trans	-110.2	113.7	161.9	-68.6	-169.6	0.6	0	0	109	S204 E208	S204-Q206 PolarHBondContact O-N 3.06Å; Q206-E208 PolarHBondContact O-N 3.24Å
207	S	35.9	Very low	36.8	Very low	104 Å²	104	110.3 Å²	110.3	73%	0.727	70%	0.704	S	S	*	*			trans	-72.4	97.3	156.3	49.5	0	0	0	0	106.9	T209	S207-T209 VanDerWaalsContact C-N 3.32Å; S207-T209 PolarHBondContact O-N 3.19Å
208	E	40	Very low	37.3	Very low	170 Å²	170	111.5 Å²	111.5	79%	0.794	70%	0.7	S	S	*	*			trans	-65.1	91.1	177.8	-66.9	-176.6	134.4	0	0	109.7	Q206	Q206-E208 PolarHBondContact O-N 3.24Å
209	T	47.8	Very low	38	Very low	54 Å²	54	109.6 Å²	109.6	33%	0.331	68%	0.68	S	S	.	*			trans	-62.6	135.1	170.5	47.9	0	0	0	0	109.3	S207 E211	S207-T209 VanDerWaalsContact C-N 3.32Å; S207-T209 PolarHBondContact O-N 3.19Å; T209-E211 PolarHBondContact O-N 3.05Å
210	P	46.3	Very low	38.5	Very low	31 Å²	31	111.4 Å²	111.4	20%	0.201	68%	0.679	C	S	.	*			trans	-58.4	106.4	175.3	-24.8	34.6	0	0	0	111.5	F163 L182	F163-P210 HydrophobicContact CD1-CG 4.5Å; F163-P210 HydrophobicContact CE1-CG 4.29Å; F163-P210 HydrophobicContact CZ-CG 4.31Å; L182-P210 HydrophobicContact CD2-CB 4.03Å; L182-P210 HydrophobicContact CD2-CG 4.09Å
211	E	45.1	Very low	39.1	Very low	156 Å²	156	108.6 Å²	108.6	73%	0.729	66%	0.655	S	S	*	*			trans	-76.5	133.3	174.2	-69.5	-125	123.4	0	0	110	T209 V213	T209-E211 PolarHBondContact O-N 3.05Å; E211-V213 PolarHBondContact O-N 3.23Å; E211-V213 VanDerWaalsContact O-N 3.12Å
212	P	42.4	Very low	39.6	Very low	74 Å²	74	109.3 Å²	109.3	48%	0.481	65%	0.649	S	S	.	*			trans	-73.5	106.3	-179	29.2	-33.5	0	0	0	110.4	E136 E214	E136-P212 HydrophobicContact CG-CG 4.14Å; P212-E214 PolarHBondContact O-N 2.82Å
213	V	41.1	Very low	40.4	Very low	92 Å²	92	108.7 Å²	108.7	56%	0.558	64%	0.641	S	S	*	*			trans	-64.9	114.6	177.6	-172.8	0	0	0	0	110.3	E211 S215	E211-V213 PolarHBondContact O-N 3.23Å; E211-V213 VanDerWaalsContact O-N 3.12Å; V213-S215 PolarHBondContact O-N 2.85Å; V213-S215 VanDerWaalsContact O-N 3.16Å
214	E	37.3	Very low	41.1	Very low	194 Å²	194	109.8 Å²	109.8	91%	0.907	64%	0.637	S	S	*	*			trans	-62.5	115.8	170.9	-68.3	-166.3	153	0	0	109.7	P212	P212-E214 PolarHBondContact O-N 2.82Å
215	S	36.5	Very low	42	Very low	76 Å²	76	111.2 Å²	111.2	53%	0.531	64%	0.637	S	S	.	*			trans	-153	116.8	179.7	-77.8	0	0	0	0	110.3	V213 S217	V213-S215 PolarHBondContact O-N 2.85Å; V213-S215 VanDerWaalsContact O-N 3.16Å; S215-S217 PolarHBondContact O-N 3.29Å
216	T	32.1	Very low	43.3	Very low	150 Å²	150	107.1 Å²	107.1	92%	0.92	61%	0.606	S	S	*	*			trans	-75.3	23.6	-163.4	-22	0	0	0	0	115.2
217	S	38.5	Very low	45.7	Very low	79 Å²	79	101.9 Å²	101.9	55%	0.552	58%	0.583	S	S	*	*			trans	-104.2	113.9	-176	-51.3	0	0	0	0	110.3	S215 S219	S215-S217 PolarHBondContact O-N 3.29Å; S217-S219 PolarHBondContact O-N 3.35Å
218	P	42	Very low	48.3	Very low	89 Å²	89	102.2 Å²	102.2	58%	0.578	57%	0.573	S	S	*	*			trans	-62.1	130.9	177.7	26.1	-33.5	0	0	0	110.3	L220	P218-L220 PolarHBondContact O-N 2.92Å
219	S	45.8	Very low	50.9	Low	68 Å²	68	95.7 Å²	95.7	48%	0.476	54%	0.541	S	S	.	.			trans	-74.1	118.2	176.1	-159.4	0	0	0	0	109.3	S217 L221	S217-S219 PolarHBondContact O-N 3.35Å; S219-L221 PolarHBondContact O-N 2.86Å
220	L	45	Very low	53.1	Low	158 Å²	158	97 Å²	97	83%	0.827	55%	0.553	S	S	*	*			trans	-77.6	70.6	178.7	-70.9	172.8	0	0	0	110.8	P218 T222	P218-L220 PolarHBondContact O-N 2.92Å; L220-T222 PolarHBondContact O-N 2.8Å
221	L	50.3	Low	55.5	Low	66 Å²	66	95.8 Å²	95.8	35%	0.346	54%	0.544	S	S	.	.			trans	-69.4	119.8	165.2	-63.9	-178.8	0	0	0	108.6	S219 L227 L260 I276	S219-L221 PolarHBondContact O-N 2.86Å; L221-L227 HydrophobicContact CD1-CD2 4.38Å; L221-L260 HydrophobicContact CD1-CD2 4.38Å; L221-I276 HydrophobicContact CD1-CD1 4.35Å
222	T	41.3	Very low	58	Low	107 Å²	107	88.9 Å²	88.9	66%	0.656	51%	0.512	S	S	*	.			trans	-67.4	131	-179.7	40.4	0	0	0	0	110.9	L220 D224 T226	L220-T222 PolarHBondContact O-N 2.8Å; T222-D224 PolarHBondContact O-N 3.2Å; T222-T226 WeakPolarHBondContact O-CB 3.47Å; T222-T226 WeakPolarHBondContact O-CG2 3.46Å; T222-T226 PolarHBondContact O-OG1 2.81Å
223	T	48.8	Very low	60.6	Low	107 Å²	107	85.4 Å²	85.4	66%	0.656	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-39.1	-149.1	-46.3	0	0	0	0	116
224	D	44.9	Very low	63.2	Low	144 Å²	144	83.7 Å²	83.7	77%	0.77	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-6.6	-151.2	-59.4	-31.2	0	0	0	116.5	T222	T222-D224 PolarHBondContact O-N 3.2Å
225	N	48.8	Very low	66	Low	135 Å²	135	74.4 Å²	74.4	72%	0.722	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.1	-1	176.1	-84	-67.5	0	0	0	115.1	L227	N225-L227 PolarHBondContact O-N 2.89Å
226	T	63.2	Low	68.8	Low	37 Å²	37	74.7 Å²	74.7	23%	0.227	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8.3	-163.6	58	0	0	0	0	115.9	T222 R229	T222-T226 WeakPolarHBondContact O-CB 3.47Å; T222-T226 WeakPolarHBondContact O-CG2 3.46Å; T222-T226 PolarHBondContact O-OG1 2.81Å; T226-R229 PolarHBondContact O-NH1 3.09Å; T226-R229 PolarHBondContact O-NH2 3.06Å
227	L	85.9	Confident	71.6	Confident	49 Å²	49	68.3 Å²	68.3	26%	0.257	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-17	-174.6	-55.5	-179.8	0	0	0	114.8	L221 N225 R259 L260 L262	L221-L227 HydrophobicContact CD1-CD2 4.38Å; N225-L227 PolarHBondContact O-N 2.89Å; L227-R259 CarbonylContact O-C 3.58Å; L227-R259 WeakPolarHBondContact O-CA 3.34Å; L227-L260 PolarHBondContact O-N 2.83Å; L227-L262 HydrophobicContact CD1-CD1 3.52Å; L227-L262 HydrophobicContact CD1-CG 4.13Å; L227-L262 HydrophobicContact CD2-CD1 3.79Å; L227-L262 HydrophobicContact CD2-CD2 4.17Å; L227-L262 HydrophobicContact CD2-CG 4.09Å; L227-L262 HydrophobicContact CG-CD1 4.3Å
228	E	91.8	Very high	74.1	Confident	110 Å²	110	68.8 Å²	68.8	51%	0.514	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	146	175.1	-52.8	-151.3	140.6	0	0	111	R259	E228-R259 HydrophobicContact CG-CG 4.33Å; E228-R259 IonicContact OE1-CZ 2.65Å; E228-R259 IonicContact OE1-NE 3.18Å; E228-R259 PolarHBondContact OE1-NE 2.73Å; E228-R259 IonicContact OE1-NH2 2.99Å; E228-R259 PolarHBondContact OE1-NH2 2.72Å
229	R	93.6	Very high	76.2	Confident	33 Å²	33	67.8 Å²	67.8	13%	0.125	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	122.7	-175.2	-65.2	-70.6	177.8	-85.5	3.7	109.1	Q177 T226 F231 T257 G258 L279	Q177-R229 WeakPolarHBondContact O-CD 3.24Å; Q177-R229 PolarHBondContact O-NE 2.9Å; T226-R229 PolarHBondContact O-NH1 3.09Å; T226-R229 PolarHBondContact O-NH2 3.06Å; R229-F231 HydrophobicContact CB-CD1 4.29Å; R229-F231 HydrophobicContact CB-CE1 4.12Å; R229-T257 CarbonylContact O-C 3.57Å; R229-T257 WeakPolarHBondContact O-CA 3.29Å; R229-G258 PolarHBondContact N-O 2.95Å; R229-G258 PolarHBondContact O-N 3.45Å; R229-L279 HydrophobicContact CB-CD1 4.07Å; R229-L279 HydrophobicContact CG-CD1 3.68Å
230	S	94.9	Very high	77.2	Confident	83 Å²	83	70 Å²	70	58%	0.58	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.4	109.6	175.2	-172.6	0	0	0	0	108.2	H255 I256	S230-H255 PolarHBondContact OG-NE2 2.82Å; S230-I256 VanDerWaalsContact CA-O 3.28Å; S230-I256 WeakPolarHBondContact CA-O 3.25Å
231	F	96	Very high	78	Confident	5 Å²	5	65.7 Å²	65.7	2%	0.022	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	165.8	-173.8	64.8	-80.6	0	0	0	111.7	E173 M174 Q177 R229 I233 I256	E173-F231 HydrophobicContact CG-CD2 4.49Å; M174-F231 HydrophobicContact CE-CZ 4.25Å; M174-F231 HydrophobicContact SD-CE2 3.69Å; M174-F231 HydrophobicContact SD-CZ 3.75Å; Q177-F231 HydrophobicContact CB-CD1 4.08Å; Q177-F231 HydrophobicContact CB-CE1 3.62Å; Q177-F231 HydrophobicContact CB-CE2 4.1Å; Q177-F231 HydrophobicContact CB-CZ 3.64Å; Q177-F231 HydrophobicContact CG-CB 4.45Å; Q177-F231 HydrophobicContact CG-CD1 3.73Å; Q177-F231 HydrophobicContact CG-CD2 3.87Å; Q177-F231 HydrophobicContact CG-CE1 3.8Å; Q177-F231 HydrophobicContact CG-CE2 3.93Å; Q177-F231 HydrophobicContact CG-CG 3.78Å; Q177-F231 HydrophobicContact CG-CZ 3.9Å; R229-F231 HydrophobicContact CB-CD1 4.29Å; R229-F231 HydrophobicContact CB-CE1 4.12Å; F231-I233 HydrophobicContact CD2-CG2 3.71Å; F231-I233 HydrophobicContact CE2-CG2 3.59Å; F231-I256 HydrophobicContact CD1-CB 4.27Å; F231-I256 HydrophobicContact CD1-CG2 3.93Å; F231-I256 HydrophobicContact CE1-CB 4.04Å; F231-I256 HydrophobicContact CE1-CD1 4.47Å; F231-I256 HydrophobicContact CE1-CG2 3.4Å; F231-I256 HydrophobicContact CE2-CD1 3.94Å; F231-I256 HydrophobicContact CZ-CB 4.17Å; F231-I256 HydrophobicContact CZ-CD1 3.77Å; F231-I256 HydrophobicContact CZ-CG2 3.78Å; F231-I256 PolarHBondContact N-O 2.85Å; F231-I256 VanDerWaalsContact N-O 3.12Å; F231-I256 PolarHBondContact O-N 2.84Å
232	F	97.1	Very high	78	Confident	11 Å²	11	73.8 Å²	73.8	5%	0.048	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.9	-176.1	-59.6	-84.4	0	0	0	111	V253 I254 H255 L286 D352 K356 C359 V360	F232-V253 HydrophobicContact CB-CG1 4.22Å; F232-V253 HydrophobicContact CD1-CG1 4.26Å; F232-I254 WeakPolarHBondContact CA-O 3.18Å; F232-H255 HydrophobicContact CD1-CB 3.8Å; F232-H255 AromaticContact CD1-CD2 3.92Å; F232-H255 HydrophobicContact CE1-CB 3.55Å; F232-H255 AromaticContact CE1-CD2 3.45Å; F232-H255 VanDerWaalsContact CE1-CD2 3.45Å; F232-H255 WeakPolarHBondContact CE1-CD2 3.46Å; F232-H255 AromaticContact CE1-CG 3.46Å; F232-H255 VanDerWaalsContact CE1-CG 3.46Å; F232-H255 AromaticContact CZ-CD2 3.64Å; F232-H255 AromaticContact CZ-CG 4Å; F232-H255 AromaticContact CZ-NE2 3.98Å; F232-L286 HydrophobicContact CD1-CD1 4.14Å; F232-L286 HydrophobicContact CE1-CD1 4.09Å; F232-D352 HydrophobicContact CD2-CB 4.29Å; F232-D352 WeakPolarHBondContact CD2-OD2 3.41Å; F232-K356 HydrophobicContact CB-CD 3.8Å; F232-K356 WeakPolarHBondContact O-CD 3.36Å; F232-K356 WeakPolarHBondContact O-CE 3.49Å; F232-K356 PolarHBondContact O-NZ 3.43Å; F232-C359 HydrophobicContact CE2-CB 4.39Å; F232-C359 HydrophobicContact CZ-CB 4.42Å; F232-V360 HydrophobicContact CE1-CB 4.23Å; F232-V360 HydrophobicContact CE1-CG2 4.45Å; F232-V360 HydrophobicContact CZ-CB 4.06Å; F232-V360 VanDerWaalsContact CZ-O 3.3Å; F232-V360 WeakPolarHBondContact CZ-O 3.06Å
233	I	96.8	Very high	78.2	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	156.8	173.8	61.2	171.5	0	0	0	111.4	V166 D170 M174 F231 M235 I254 I256	V166-I233 HydrophobicContact CG1-CB 4.27Å; V166-I233 HydrophobicContact CG1-CD1 4.27Å; V166-I233 HydrophobicContact CG2-CD1 3.65Å; D170-I233 HydrophobicContact CB-CB 4.41Å; D170-I233 HydrophobicContact CB-CG2 4.28Å; M174-I233 HydrophobicContact SD-CD1 3.87Å; M174-I233 HydrophobicContact SD-CG2 4.5Å; F231-I233 HydrophobicContact CD2-CG2 3.71Å; F231-I233 HydrophobicContact CE2-CG2 3.59Å; I233-M235 HydrophobicContact CD1-CG 3.89Å; I233-M235 HydrophobicContact CD1-SD 4.22Å; I233-M235 HydrophobicContact CG1-CG 4.08Å; I233-I254 HydrophobicContact CG1-CB 4.47Å; I233-I254 PolarHBondContact N-O 2.97Å; I233-I254 PolarHBondContact O-N 2.78Å; I233-I256 HydrophobicContact CD1-CD1 3.41Å; I233-I256 VanDerWaalsContact CD1-CD1 3.41Å; I233-I256 HydrophobicContact CD1-CG1 4.44Å; I233-I256 HydrophobicContact CG1-CD1 3.82Å; I233-I256 HydrophobicContact CG1-CG1 4.43Å
234	R	95.8	Very high	77.8	Confident	56 Å²	56	69.9 Å²	69.9	21%	0.211	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	113.4	174.4	-63.6	168.9	-77.1	-158.1	-2.9	109.4	V166 H167 D170 Y251 K252 V253 N355	V166-R234 CarbonylContact C-O 3.59Å; H167-R234 HydrophobicContact CB-CB 3.67Å; H167-R234 WeakPolarHBondContact CB-O 3.41Å; H167-R234 PolarHBondContact N-O 2.83Å; D170-R234 IonicContact OD1-CZ 3.61Å; D170-R234 VanDerWaalsContact OD1-CZ 3.3Å; D170-R234 IonicContact OD1-NE 3.8Å; D170-R234 PolarHBondContact OD1-NE 3.02Å; D170-R234 IonicContact OD1-NH2 2.76Å; D170-R234 PolarHBondContact OD1-NH2 2.88Å; D170-R234 VanDerWaalsContact OD2-CB 3.22Å; D170-R234 WeakPolarHBondContact OD2-CB 3.35Å; D170-R234 WeakPolarHBondContact OD2-CG 3.06Å; D170-R234 IonicContact OD2-CZ 2.83Å; D170-R234 PolarHBondContact OD2-N 3.06Å; D170-R234 IonicContact OD2-NE 2.73Å; D170-R234 PolarHBondContact OD2-NE 2.98Å; D170-R234 IonicContact OD2-NH2 2.74Å; R234-Y251 HydrophobicContact CB-CD1 4.33Å; R234-Y251 HydrophobicContact CB-CG 4.48Å; R234-K252 CarbonylContact C-O 3.12Å; R234-K252 VanDerWaalsContact CA-O 3.29Å; R234-K252 WeakPolarHBondContact CA-O 3.38Å; R234-V253 HydrophobicContact CG-CG2 4.31Å; R234-N355 PolarHBondContact NH1-O 3.32Å
235	M	96.3	Very high	77.3	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	146.4	177.5	-64.9	-167.8	73.2	0	0	112	F129 F139 L150 Y165 V166 I233 Y251 K252 I254	F129-M235 HydrophobicContact CE2-SD 4.43Å; F129-M235 HydrophobicContact CZ-SD 4.08Å; F139-M235 HydrophobicContact CZ-CE 4.15Å; L150-M235 HydrophobicContact CD1-CB 3.88Å; L150-M235 HydrophobicContact CD1-CE 4.29Å; L150-M235 HydrophobicContact CD1-SD 4.27Å; L150-M235 HydrophobicContact CD2-CB 4.33Å; Y165-M235 CarbonylContact O-C 3.45Å; Y165-M235 WeakPolarHBondContact O-CA 3.42Å; V166-M235 HydrophobicContact CG2-CG 4.36Å; I233-M235 HydrophobicContact CD1-CG 3.89Å; I233-M235 HydrophobicContact CD1-SD 4.22Å; I233-M235 HydrophobicContact CG1-CG 4.08Å; M235-Y251 CarbonylContact O-C 3.49Å; M235-Y251 WeakPolarHBondContact O-CA 3.25Å; M235-K252 PolarHBondContact N-O 2.96Å; M235-K252 PolarHBondContact O-N 3.04Å; M235-I254 HydrophobicContact CB-CG1 3.8Å; M235-I254 HydrophobicContact CG-CB 4.27Å; M235-I254 HydrophobicContact CG-CG1 3.76Å; M235-I254 HydrophobicContact SD-CB 4.35Å; M235-I254 HydrophobicContact SD-CG1 3.94Å; M235-I254 HydrophobicContact SD-CG2 4.34Å
236	K	94.9	Very high	77.1	Confident	82 Å²	82	70.9 Å²	70.9	36%	0.357	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	136	179	-73.6	-179.5	-174.1	168.5	0	111.3	L150 L152 D164 Y165 G250 Y251	L150-K236 WeakPolarHBondContact CD2-O 3.41Å; L152-K236 HydrophobicContact CD1-CB 4.43Å; L152-K236 WeakPolarHBondContact CD1-O 3.48Å; D164-K236 WeakPolarHBondContact O-CE 3.31Å; D164-K236 PolarHBondContact O-NZ 2.81Å; Y165-K236 WeakPolarHBondContact O-CG 3.12Å; Y165-K236 PolarHBondContact O-N 2.81Å; K236-G250 CarbonylContact C-O 3.54Å; K236-G250 VanDerWaalsContact CA-O 3.25Å; K236-G250 WeakPolarHBondContact CA-O 3.35Å; K236-Y251 HydrophobicContact CB-CE1 4.41Å; K236-Y251 WeakPolarHBondContact CE-OH 3.27Å; K236-Y251 HydrophobicContact CG-CD1 4.02Å; K236-Y251 HydrophobicContact CG-CE1 3.42Å; K236-Y251 VanDerWaalsContact CG-CE1 3.42Å
237	S	92.3	Very high	76.1	Confident	16 Å²	16	79 Å²	79	11%	0.112	40%	0.404	C	S	.	.			trans	-135.3	119.3	-178.2	170.1	0	0	0	0	110.2	L150 G250	L150-S237 CarbonylContact O-C 3.52Å; L150-S237 VanDerWaalsContact O-CA 3.28Å; L150-S237 WeakPolarHBondContact O-CA 3.28Å; S237-G250 PolarHBondContact N-O 2.92Å
238	T	90.7	Very high	74.6	Confident	89 Å²	89	79.9 Å²	79.9	55%	0.546	42%	0.415	S	S	.	.			trans	-84.4	-12.2	174.5	58.1	0	0	0	0	112.6	L150 G151 L152 T240	L150-T238 PolarHBondContact O-N 3.38Å; L150-T238 PolarHBondContact O-OG1 3.14Å; G151-T238 VanDerWaalsContact CA-OG1 3.28Å; G151-T238 WeakPolarHBondContact CA-OG1 3.19Å; G151-T238 PolarHBondContact O-OG1 3.07Å; L152-T238 HydrophobicContact CD2-CG2 3.82Å; T238-T240 PolarHBondContact O-N 3.29Å
239	L	85.1	Confident	73.2	Confident	67 Å²	67	79.3 Å²	79.3	35%	0.351	42%	0.423	S	S	.	.			trans	-64.9	114.4	178	-59.9	175.1	0	0	0	111.2	I148 Y149	I148-L239 WeakPolarHBondContact O-CD1 3.35Å; Y149-L239 WeakPolarHBondContact O-CD1 3.48Å
240	T	67.6	Low	72.9	Confident	116 Å²	116	79.2 Å²	79.2	71%	0.712	43%	0.432	S	S	*	.			trans	-75.3	128.5	172.6	50.8	0	0	0	0	110.4	T238 R242	T238-T240 PolarHBondContact O-N 3.29Å; T240-R242 VanDerWaalsContact C-N 3.35Å; T240-R242 PolarHBondContact O-N 3.5Å
241	K	62.3	Low	72.6	Confident	66 Å²	66	77.9 Å²	77.9	29%	0.287	42%	0.415	S	S	.	.			trans	-74.1	88.1	175.8	-169.1	172.6	-175.3	-178.2	0	110	G243 V244 T290	K241-G243 PolarHBondContact O-N 3.35Å; K241-V244 HydrophobicContact CD-CB 4.03Å; K241-V244 HydrophobicContact CD-CG2 3.83Å; K241-V244 HydrophobicContact CG-CB 4.25Å; K241-V244 HydrophobicContact CG-CG2 4.23Å; K241-V244 PolarHBondContact O-N 2.84Å; K241-T290 PolarHBondContact NZ-OG1 3.09Å
242	R	50.5	Low	72.4	Confident	237 Å²	237	80.8 Å²	80.8	89%	0.894	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	131.3	170.8	-59	-173.8	-167.2	174.9	5.2	109.1	T240	T240-R242 VanDerWaalsContact C-N 3.35Å; T240-R242 PolarHBondContact O-N 3.5Å
243	G	44.6	Very low	72.3	Confident	80 Å²	80	80.6 Å²	80.6	83%	0.825	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	1.4	174.5	0	0	0	0	0	117	K241	K241-G243 PolarHBondContact O-N 3.35Å
244	V	40.5	Very low	72.3	Confident	52 Å²	52	80.6 Å²	80.6	32%	0.315	43%	0.427	S	S	.	.			trans	-128.2	117.2	171.6	-178	0	0	0	0	110.4	K241 I246	K241-V244 HydrophobicContact CD-CB 4.03Å; K241-V244 HydrophobicContact CD-CG2 3.83Å; K241-V244 HydrophobicContact CG-CB 4.25Å; K241-V244 HydrophobicContact CG-CG2 4.23Å; K241-V244 PolarHBondContact O-N 2.84Å; V244-I246 HydrophobicContact CG1-CB 4.06Å; V244-I246 HydrophobicContact CG1-CD1 3.89Å; V244-I246 HydrophobicContact CG1-CG1 3.85Å; V244-I246 PolarHBondContact O-N 3.41Å
245	H	34.9	Very low	72.3	Confident	203 Å²	203	79.1 Å²	79.1	94%	0.94	42%	0.423	S	S	*	.			trans	-76.1	40.3	-179.8	-72.2	-81.8	0	0	0	113.9
246	I	44.4	Very low	72.3	Confident	96 Å²	96	79.1 Å²	79.1	49%	0.492	42%	0.423	S	S	.	.	S	Bend	trans	-107.6	128.5	171.2	-63.6	173.4	0	0	0	107.2	V244 S248	V244-I246 HydrophobicContact CG1-CB 4.06Å; V244-I246 HydrophobicContact CG1-CD1 3.89Å; V244-I246 HydrophobicContact CG1-CG1 3.85Å; V244-I246 PolarHBondContact O-N 3.41Å; I246-S248 VanDerWaalsContact C-N 3.3Å; I246-S248 PolarHBondContact O-N 2.82Å
247	K	42.7	Very low	72.4	Confident	207 Å²	207	77.4 Å²	77.4	90%	0.9	42%	0.419	S	S	*	.			trans	-65.9	92.2	168	-63.9	176.9	-176	175.1	0	107.6	S249	K247-S249 PolarHBondContact O-N 2.84Å
248	S	53.3	Low	72.6	Confident	69 Å²	69	77.5 Å²	77.5	48%	0.483	42%	0.423	S	S	.	.			trans	-55.5	139	171.1	49.8	0	0	0	0	108.6	I246 G250	I246-S248 VanDerWaalsContact C-N 3.3Å; I246-S248 PolarHBondContact O-N 2.82Å; S248-G250 PolarHBondContact O-N 3Å
249	S	63.3	Low	72.7	Confident	98 Å²	98	80 Å²	80	69%	0.685	42%	0.422	S	S	*	.			trans	-66	5.8	-172.4	52.6	0	0	0	0	114.8	K247 Y251	K247-S249 PolarHBondContact O-N 2.84Å; S249-Y251 VanDerWaalsContact C-N 3.32Å; S249-Y251 WeakPolarHBondContact O-CD2 3.47Å; S249-Y251 WeakPolarHBondContact O-CE2 3.31Å
250	G	86.2	Confident	73	Confident	30 Å²	30	77 Å²	77	31%	0.309	41%	0.407	S	S	.	.	S	Bend	trans	79.1	11.8	-168.9	0	0	0	0	0	113.6	K236 S237 S248	K236-G250 CarbonylContact C-O 3.54Å; K236-G250 VanDerWaalsContact CA-O 3.25Å; K236-G250 WeakPolarHBondContact CA-O 3.35Å; S237-G250 PolarHBondContact N-O 2.92Å; S248-G250 PolarHBondContact O-N 3Å
251	Y	90.4	Very high	74	Confident	56 Å²	56	72.6 Å²	72.6	22%	0.22	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	156.6	-179.3	-62.1	-92.8	0	0	0	113	H167 R234 M235 K236 S249	H167-Y251 HydrophobicContact CB-CD1 3.85Å; H167-Y251 HydrophobicContact CB-CE1 3.72Å; H167-Y251 HydrophobicContact CB-CG 4.46Å; H167-Y251 AromaticContact CD2-CE2 3.8Å; H167-Y251 AromaticContact CD2-CZ 3.91Å; R234-Y251 HydrophobicContact CB-CD1 4.33Å; R234-Y251 HydrophobicContact CB-CG 4.48Å; M235-Y251 CarbonylContact O-C 3.49Å; M235-Y251 WeakPolarHBondContact O-CA 3.25Å; K236-Y251 HydrophobicContact CB-CE1 4.41Å; K236-Y251 WeakPolarHBondContact CE-OH 3.27Å; K236-Y251 HydrophobicContact CG-CD1 4.02Å; K236-Y251 HydrophobicContact CG-CE1 3.42Å; K236-Y251 VanDerWaalsContact CG-CE1 3.42Å; S249-Y251 VanDerWaalsContact C-N 3.32Å; S249-Y251 WeakPolarHBondContact O-CD2 3.47Å; S249-Y251 WeakPolarHBondContact O-CE2 3.31Å
252	K	91.6	Very high	75	Confident	65 Å²	65	71.3 Å²	71.3	28%	0.283	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.2	164.5	-76.9	-172.1	-179.8	-177.5	0	110.3	Y149 L150 R234 M235	Y149-K252 WeakPolarHBondContact O-CD 3.42Å; Y149-K252 WeakPolarHBondContact O-CE 3.48Å; Y149-K252 PolarHBondContact O-NZ 2.77Å; L150-K252 HydrophobicContact CD2-CB 4.16Å; L150-K252 HydrophobicContact CD2-CD 4.32Å; R234-K252 CarbonylContact C-O 3.12Å; R234-K252 VanDerWaalsContact CA-O 3.29Å; R234-K252 WeakPolarHBondContact CA-O 3.38Å; M235-K252 PolarHBondContact N-O 2.96Å; M235-K252 PolarHBondContact O-N 3.04Å
253	V	93.6	Very high	76.2	Confident	8 Å²	8	65.3 Å²	65.3	5%	0.048	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	125.9	168.2	-172.9	0	0	0	0	109.4	F232 R234 L286 K356 Q358	F232-V253 HydrophobicContact CB-CG1 4.22Å; F232-V253 HydrophobicContact CD1-CG1 4.26Å; R234-V253 HydrophobicContact CG-CG2 4.31Å; V253-L286 HydrophobicContact CB-CD1 4.38Å; V253-L286 HydrophobicContact CG1-CD1 3.93Å; V253-L286 PolarHBondContact O-N 3.33Å; V253-K356 HydrophobicContact CG2-CB 4.48Å; V253-K356 WeakPolarHBondContact CG2-O 3.09Å; V253-Q358 HydrophobicContact CB-CB 4.03Å; V253-Q358 HydrophobicContact CB-CG 4.33Å; V253-Q358 HydrophobicContact CG1-CB 4.24Å; V253-Q358 HydrophobicContact CG2-CB 3.95Å; V253-Q358 HydrophobicContact CG2-CG 3.97Å
254	I	96.4	Very high	77.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.8	175.5	-59.4	-53.7	0	0	0	107.9	F129 L150 F232 I233 M235 I256 A283 H284 A285	F129-I254 HydrophobicContact CE1-CD1 4.07Å; F129-I254 HydrophobicContact CZ-CD1 4.29Å; F129-I254 HydrophobicContact CZ-CG1 4.39Å; F129-I254 HydrophobicContact CZ-CG2 4.15Å; L150-I254 HydrophobicContact CD2-CD1 4.03Å; F232-I254 WeakPolarHBondContact CA-O 3.18Å; I233-I254 HydrophobicContact CG1-CB 4.47Å; I233-I254 PolarHBondContact N-O 2.97Å; I233-I254 PolarHBondContact O-N 2.78Å; M235-I254 HydrophobicContact CB-CG1 3.8Å; M235-I254 HydrophobicContact CG-CB 4.27Å; M235-I254 HydrophobicContact CG-CG1 3.76Å; M235-I254 HydrophobicContact SD-CB 4.35Å; M235-I254 HydrophobicContact SD-CG1 3.94Å; M235-I254 HydrophobicContact SD-CG2 4.34Å; I254-I256 HydrophobicContact CG2-CG1 4.24Å; I254-A283 HydrophobicContact CG2-CB 3.73Å; I254-H284 WeakPolarHBondContact CA-O 3.39Å; I254-A285 HydrophobicContact CD1-CB 3.48Å; I254-A285 VanDerWaalsContact CD1-CB 3.48Å
255	H	97.1	Very high	78.1	Confident	25 Å²	25	66.5 Å²	66.5	12%	0.116	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.2	165.3	-175.9	-153.1	0	0	0	108.6	S230 F232 T257 A283 H284 L286	S230-H255 PolarHBondContact OG-NE2 2.82Å; F232-H255 HydrophobicContact CD1-CB 3.8Å; F232-H255 AromaticContact CD1-CD2 3.92Å; F232-H255 HydrophobicContact CE1-CB 3.55Å; F232-H255 AromaticContact CE1-CD2 3.45Å; F232-H255 VanDerWaalsContact CE1-CD2 3.45Å; F232-H255 WeakPolarHBondContact CE1-CD2 3.46Å; F232-H255 AromaticContact CE1-CG 3.46Å; F232-H255 VanDerWaalsContact CE1-CG 3.46Å; F232-H255 AromaticContact CZ-CD2 3.64Å; F232-H255 AromaticContact CZ-CG 4Å; F232-H255 AromaticContact CZ-NE2 3.98Å; H255-T257 WeakPolarHBondContact CE1-CG2 3.37Å; H255-A283 WeakPolarHBondContact O-CA 3.18Å; H255-H284 HydrophobicContact CB-CB 4.47Å; H255-H284 PolarHBondContact N-O 3.36Å; H255-H284 PolarHBondContact O-N 3.06Å; H255-L286 HydrophobicContact CB-CD2 4.16Å
256	I	96.8	Very high	79.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.7	172.8	-76.2	178.9	0	0	0	108.1	F131 M174 S230 F231 I233 I254 V281	F131-I256 HydrophobicContact CZ-CD1 3.85Å; F131-I256 HydrophobicContact CZ-CG1 4.27Å; M174-I256 HydrophobicContact SD-CD1 4.3Å; S230-I256 VanDerWaalsContact CA-O 3.28Å; S230-I256 WeakPolarHBondContact CA-O 3.25Å; F231-I256 HydrophobicContact CD1-CB 4.27Å; F231-I256 HydrophobicContact CD1-CG2 3.93Å; F231-I256 HydrophobicContact CE1-CB 4.04Å; F231-I256 HydrophobicContact CE1-CD1 4.47Å; F231-I256 HydrophobicContact CE1-CG2 3.4Å; F231-I256 HydrophobicContact CE2-CD1 3.94Å; F231-I256 HydrophobicContact CZ-CB 4.17Å; F231-I256 HydrophobicContact CZ-CD1 3.77Å; F231-I256 HydrophobicContact CZ-CG2 3.78Å; F231-I256 PolarHBondContact N-O 2.85Å; F231-I256 VanDerWaalsContact N-O 3.12Å; F231-I256 PolarHBondContact O-N 2.84Å; I233-I256 HydrophobicContact CD1-CD1 3.41Å; I233-I256 VanDerWaalsContact CD1-CD1 3.41Å; I233-I256 HydrophobicContact CD1-CG1 4.44Å; I233-I256 HydrophobicContact CG1-CD1 3.82Å; I233-I256 HydrophobicContact CG1-CG1 4.43Å; I254-I256 HydrophobicContact CG2-CG1 4.24Å; I256-V281 HydrophobicContact CB-CG1 4.22Å; I256-V281 HydrophobicContact CG1-CG1 4.09Å; I256-V281 HydrophobicContact CG2-CB 4.47Å; I256-V281 HydrophobicContact CG2-CG1 3.73Å; I256-V281 HydrophobicContact CG2-CG2 3.88Å
257	T	96.6	Very high	79.5	Confident	45 Å²	45	62 Å²	62	28%	0.276	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.5	164.7	64.3	0	0	0	0	109.4	R229 H255 V281 V282	R229-T257 CarbonylContact O-C 3.57Å; R229-T257 WeakPolarHBondContact O-CA 3.29Å; H255-T257 WeakPolarHBondContact CE1-CG2 3.37Å; T257-V281 CarbonylContact O-C 3.53Å; T257-V281 WeakPolarHBondContact O-CA 3.32Å; T257-V282 PolarHBondContact N-O 2.78Å; T257-V282 PolarHBondContact O-N 2.83Å; T257-V282 VanDerWaalsContact O-O 3.04Å; T257-V282 PolarHBondContact OG1-O 2.89Å
258	G	95.6	Very high	79.7	Confident	19 Å²	19	61.7 Å²	61.7	20%	0.196	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	-174.3	-171.3	0	0	0	0	0	115	R229 V280	R229-G258 PolarHBondContact N-O 2.95Å; R229-G258 PolarHBondContact O-N 3.45Å; G258-V280 CarbonylContact C-O 3.05Å; G258-V280 WeakPolarHBondContact CA-O 3.3Å
259	R	93.8	Very high	79.8	Confident	141 Å²	141	62.5 Å²	62.5	53%	0.532	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.7	176.3	-62.9	-171.7	178.9	91.7	4.2	111.5	L227 E228 V280	L227-R259 CarbonylContact O-C 3.58Å; L227-R259 WeakPolarHBondContact O-CA 3.34Å; E228-R259 HydrophobicContact CG-CG 4.33Å; E228-R259 IonicContact OE1-CZ 2.65Å; E228-R259 IonicContact OE1-NE 3.18Å; E228-R259 PolarHBondContact OE1-NE 2.73Å; E228-R259 IonicContact OE1-NH2 2.99Å; E228-R259 PolarHBondContact OE1-NH2 2.72Å; R259-V280 PolarHBondContact N-O 2.88Å; R259-V280 PolarHBondContact O-N 3.01Å
260	L	91.7	Very high	79.4	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.1	174.3	-162.4	72.1	0	0	0	108.7	L221 L227 I276 L279	L221-L260 HydrophobicContact CD1-CD2 4.38Å; L227-L260 PolarHBondContact O-N 2.83Å; L260-I276 HydrophobicContact CD1-CG2 3.85Å; L260-I276 HydrophobicContact CD2-CD1 3.88Å; L260-I276 HydrophobicContact CD2-CG1 3.86Å; L260-I276 HydrophobicContact CD2-CG2 4.05Å; L260-I276 HydrophobicContact CG-CG1 4.47Å; L260-I276 HydrophobicContact CG-CG2 3.92Å; L260-L279 HydrophobicContact CB-CD1 4.35Å; L260-L279 HydrophobicContact CD1-CB 4.21Å; L260-L279 HydrophobicContact CD1-CD1 4.01Å
261	R	88	Confident	77.8	Confident	22 Å²	22	71.6 Å²	71.6	8%	0.083	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.7	-174	-157.9	169.8	-178.8	-140.7	-0.4	110.1	F74 A75 G78 P80 M277 G278 V280	F74-R261 HydrophobicContact CE2-CB 4.47Å; F74-R261 HydrophobicContact CZ-CB 4.06Å; F74-R261 PolarHBondContact O-NH1 2.67Å; A75-R261 PolarHBondContact O-NH2 2.89Å; G78-R261 PolarHBondContact O-NH2 2.97Å; P80-R261 PolarHBondContact O-NH2 3.11Å; R261-M277 WeakPolarHBondContact O-CB 3.48Å; R261-M277 PolarHBondContact O-N 2.91Å; R261-G278 PolarHBondContact N-O 3.46Å; R261-V280 HydrophobicContact CB-CG2 4.44Å
262	L	83.3	Confident	76	Confident	40 Å²	40	72.7 Å²	72.7	21%	0.209	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	144.2	-175.3	-62.4	-179.2	0	0	0	111.5	L227 I276	L227-L262 HydrophobicContact CD1-CD1 3.52Å; L227-L262 HydrophobicContact CD1-CG 4.13Å; L227-L262 HydrophobicContact CD2-CD1 3.79Å; L227-L262 HydrophobicContact CD2-CD2 4.17Å; L227-L262 HydrophobicContact CD2-CG 4.09Å; L227-L262 HydrophobicContact CG-CD1 4.3Å; L262-I276 HydrophobicContact CD2-CG1 4.01Å
263	R	75.7	Confident	74.2	Confident	111 Å²	111	73.4 Å²	73.4	42%	0.419	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	111.5	167.9	-173.9	-177.6	-173.1	134.5	15.2	109.2	Q275 M277	R263-Q275 HydrophobicContact CB-CB 4.32Å; R263-Q275 PolarHBondContact N-O 2.82Å; R263-Q275 PolarHBondContact O-N 2.78Å; R263-M277 HydrophobicContact CB-CG 3.71Å; R263-M277 HydrophobicContact CB-SD 3.91Å
264	V	66	Low	72.7	Confident	89 Å²	89	74.6 Å²	74.6	54%	0.539	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131.7	170.3	-177.2	0	0	0	0	109.1	L266	V264-L266 HydrophobicContact CG1-CD2 4.36Å
265	S	59.4	Low	71.7	Confident	68 Å²	68	80.7 Å²	80.7	48%	0.476	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.4	174.3	-169.2	0	0	0	0	110
266	L	56.7	Low	71.1	Confident	148 Å²	148	80.8 Å²	80.8	78%	0.775	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	110.7	176.9	-65.4	176.1	0	0	0	109.4	V264 T271	V264-L266 HydrophobicContact CG1-CD2 4.36Å; L266-T271 HydrophobicContact CD2-CG2 4.42Å
267	S	51.3	Low	70.7	Confident	57 Å²	57	81.5 Å²	81.5	40%	0.399	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.4	175	68	0	0	0	0	111.4	G269 R270	S267-G269 VanDerWaalsContact C-N 3.32Å; S267-G269 PolarHBondContact O-N 3.25Å; S267-R270 PolarHBondContact O-N 2.93Å
268	H	47.3	Very low	70.5	Confident	199 Å²	199	79.3 Å²	79.3	92%	0.921	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.9	50.7	168.6	-61.7	97.8	0	0	0	116.5	R270	H268-R270 VanDerWaalsContact C-N 3.31Å; H268-R270 PolarHBondContact O-N 2.92Å
269	G	54.2	Low	70.5	Confident	87 Å²	87	78.4 Å²	78.4	90%	0.897	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	12.3	172.4	0	0	0	0	0	115.9	S267	S267-G269 VanDerWaalsContact C-N 3.32Å; S267-G269 PolarHBondContact O-N 3.25Å
270	R	54.9	Low	70.7	Confident	201 Å²	201	73.4 Å²	73.4	76%	0.758	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.9	171.1	-68.8	-173.7	175	-167	-2.6	110.7	S267 H268 V272	S267-R270 PolarHBondContact O-N 2.93Å; H268-R270 VanDerWaalsContact C-N 3.31Å; H268-R270 PolarHBondContact O-N 2.92Å; R270-V272 HydrophobicContact CB-CG2 4.39Å; R270-V272 PolarHBondContact O-N 2.7Å
271	T	54.2	Low	70.9	Confident	117 Å²	117	73.3 Å²	73.3	72%	0.718	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	99.1	170.6	46.3	0	0	0	0	109.1	L266	L266-T271 HydrophobicContact CD2-CG2 4.42Å
272	V	51.5	Low	71.4	Confident	80 Å²	80	74.3 Å²	74.3	49%	0.485	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	113.3	176.6	-177.1	0	0	0	0	108.8	R270	R270-V272 HydrophobicContact CB-CG2 4.39Å; R270-V272 PolarHBondContact O-N 2.7Å
273	P	54	Low	72.1	Confident	79 Å²	79	72.4 Å²	72.4	51%	0.513	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	158.2	172.8	33.4	-34.7	0	0	0	110.9
274	S	63.4	Low	72.9	Confident	33 Å²	33	69.9 Å²	69.9	23%	0.231	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	cis	-171	118.3	-21.1	-100.2	0	0	0	0	105.6	I276	S274-I276 PolarHBondContact O-N 2.94Å
275	Q	74.9	Confident	73.9	Confident	128 Å²	128	66.3 Å²	66.3	60%	0.598	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.9	-179.8	-169	177.2	8.3	0	0	109.7	R263 M277	R263-Q275 HydrophobicContact CB-CB 4.32Å; R263-Q275 PolarHBondContact N-O 2.82Å; R263-Q275 PolarHBondContact O-N 2.78Å; Q275-M277 PolarHBondContact O-N 3.11Å
276	I	84.3	Confident	75	Confident	28 Å²	28	63.8 Å²	63.8	14%	0.144	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	122.7	171.8	-65.3	163.4	0	0	0	108.3	Q135 L221 L260 L262 S274	Q135-I276 WeakPolarHBondContact CB-O 3.34Å; L221-I276 HydrophobicContact CD1-CD1 4.35Å; L260-I276 HydrophobicContact CD1-CG2 3.85Å; L260-I276 HydrophobicContact CD2-CD1 3.88Å; L260-I276 HydrophobicContact CD2-CG1 3.86Å; L260-I276 HydrophobicContact CD2-CG2 4.05Å; L260-I276 HydrophobicContact CG-CG1 4.47Å; L260-I276 HydrophobicContact CG-CG2 3.92Å; L262-I276 HydrophobicContact CD2-CG1 4.01Å; S274-I276 PolarHBondContact O-N 2.94Å
277	M	88.1	Confident	75.6	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.069	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-19.6	174.1	-62.5	173.6	59.3	0	0	112.2	F74 Q77 N134 Q135 R261 R263 Q275	F74-M277 HydrophobicContact CB-CE 4.46Å; F74-M277 HydrophobicContact CD2-CB 3.92Å; F74-M277 HydrophobicContact CD2-CE 3.81Å; F74-M277 HydrophobicContact CE2-CB 3.69Å; F74-M277 HydrophobicContact CE2-CE 4.3Å; F74-M277 WeakPolarHBondContact CE2-O 3.25Å; F74-M277 HydrophobicContact CG-CE 4.15Å; F74-M277 WeakPolarHBondContact O-CE 3.39Å; Q77-M277 HydrophobicContact CB-CE 3.64Å; Q77-M277 HydrophobicContact CB-SD 4.38Å; N134-M277 CarbonylContact C-O 3.54Å; N134-M277 VanDerWaalsContact CA-O 3.29Å; N134-M277 WeakPolarHBondContact CA-O 3.42Å; Q135-M277 PolarHBondContact N-O 3.22Å; Q135-M277 PolarHBondContact OE1-O 3.16Å; R261-M277 WeakPolarHBondContact O-CB 3.48Å; R261-M277 PolarHBondContact O-N 2.91Å; R263-M277 HydrophobicContact CB-CG 3.71Å; R263-M277 HydrophobicContact CB-SD 3.91Å; Q275-M277 PolarHBondContact O-N 3.11Å
278	G	92.5	Very high	76.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	128.8	-167.7	-173.3	0	0	0	0	0	112.9	L133 N134 R261	L133-G278 CarbonylContact O-C 3.58Å; L133-G278 VanDerWaalsContact O-CA 3.3Å; L133-G278 WeakPolarHBondContact O-CA 3.22Å; N134-G278 VanDerWaalsContact C-CA 3.47Å; R261-G278 PolarHBondContact N-O 3.46Å
279	L	95.9	Very high	76.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.5	-165.9	-173.9	72	0	0	0	111.1	A132 L133 M174 L178 R229 L260 V281	A132-L279 CarbonylContact C-O 3.5Å; A132-L279 WeakPolarHBondContact CA-O 3.44Å; L133-L279 HydrophobicContact CB-CB 4.39Å; L133-L279 PolarHBondContact N-O 2.79Å; L133-L279 PolarHBondContact O-N 3.02Å; M174-L279 HydrophobicContact CE-CD2 4.25Å; L178-L279 HydrophobicContact CD2-CB 3.78Å; L178-L279 HydrophobicContact CD2-CD2 4.37Å; R229-L279 HydrophobicContact CB-CD1 4.07Å; R229-L279 HydrophobicContact CG-CD1 3.68Å; L260-L279 HydrophobicContact CB-CD1 4.35Å; L260-L279 HydrophobicContact CD1-CB 4.21Å; L260-L279 HydrophobicContact CD1-CD1 4.01Å; L279-V281 HydrophobicContact CD2-CG2 3.56Å; L279-V281 HydrophobicContact CG-CG2 3.6Å
280	V	96.9	Very high	76.9	Confident	36 Å²	36	51.3 Å²	51.3	22%	0.218	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.4	175.9	-172.7	0	0	0	0	109.1	F74 W82 G258 R259 R261	F74-V280 HydrophobicContact CE1-CG2 3.73Å; F74-V280 HydrophobicContact CZ-CG2 3.6Å; W82-V280 HydrophobicContact CH2-CG1 3.89Å; W82-V280 HydrophobicContact CH2-CG2 3.98Å; W82-V280 HydrophobicContact CZ2-CG1 4.05Å; W82-V280 HydrophobicContact CZ2-CG2 3.92Å; G258-V280 CarbonylContact C-O 3.05Å; G258-V280 WeakPolarHBondContact CA-O 3.3Å; R259-V280 PolarHBondContact N-O 2.88Å; R259-V280 PolarHBondContact O-N 3.01Å; R261-V280 HydrophobicContact CB-CG2 4.44Å
281	V	97.1	Very high	77	Confident	3 Å²	3	45 Å²	45	2%	0.018	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.1	-162	174.7	0	0	0	0	112.4	V130 F131 I256 T257 L279 A283	V130-V281 WeakPolarHBondContact CA-O 3.34Å; V130-V281 WeakPolarHBondContact CG1-O 3.5Å; F131-V281 HydrophobicContact CD1-CB 4.2Å; F131-V281 HydrophobicContact CD1-CG1 4.09Å; F131-V281 HydrophobicContact CD2-CB 3.92Å; F131-V281 HydrophobicContact CD2-CG2 4.11Å; F131-V281 HydrophobicContact CE1-CB 4.03Å; F131-V281 HydrophobicContact CE1-CG1 3.61Å; F131-V281 HydrophobicContact CE2-CB 3.71Å; F131-V281 HydrophobicContact CE2-CG1 4.1Å; F131-V281 HydrophobicContact CE2-CG2 3.55Å; F131-V281 HydrophobicContact CG-CB 4.17Å; F131-V281 HydrophobicContact CZ-CB 3.78Å; F131-V281 HydrophobicContact CZ-CG1 3.62Å; F131-V281 HydrophobicContact CZ-CG2 3.84Å; F131-V281 PolarHBondContact N-O 2.89Å; F131-V281 PolarHBondContact O-N 2.55Å; I256-V281 HydrophobicContact CB-CG1 4.22Å; I256-V281 HydrophobicContact CG1-CG1 4.09Å; I256-V281 HydrophobicContact CG2-CB 4.47Å; I256-V281 HydrophobicContact CG2-CG1 3.73Å; I256-V281 HydrophobicContact CG2-CG2 3.88Å; T257-V281 CarbonylContact O-C 3.53Å; T257-V281 WeakPolarHBondContact O-CA 3.32Å; L279-V281 HydrophobicContact CD2-CG2 3.56Å; L279-V281 HydrophobicContact CG-CG2 3.6Å; V281-A283 HydrophobicContact CG1-CB 3.9Å
282	V	97.6	Very high	77.1	Confident	42 Å²	42	46.8 Å²	46.8	26%	0.255	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.4	151	-171.2	0	0	0	0	107.8	L126 V130 T257	L126-V282 HydrophobicContact CD2-CG1 4.23Å; V130-V282 HydrophobicContact CG2-CG2 4.42Å; T257-V282 PolarHBondContact N-O 2.78Å; T257-V282 PolarHBondContact O-N 2.83Å; T257-V282 VanDerWaalsContact O-O 3.04Å; T257-V282 PolarHBondContact OG1-O 2.89Å
283	A	97.5	Very high	77.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.4	-172.6	0	0	0	0	0	110.9	G128 F129 F131 I254 H255 V281	G128-A283 CarbonylContact C-O 3.59Å; G128-A283 VanDerWaalsContact CA-O 3.25Å; G128-A283 WeakPolarHBondContact CA-O 3.41Å; F129-A283 HydrophobicContact CD1-CB 4.36Å; F129-A283 HydrophobicContact CD2-CB 4Å; F129-A283 HydrophobicContact CE1-CB 4.06Å; F129-A283 HydrophobicContact CE2-CB 3.69Å; F129-A283 HydrophobicContact CG-CB 4.33Å; F129-A283 HydrophobicContact CZ-CB 3.72Å; F129-A283 PolarHBondContact N-O 2.65Å; F129-A283 PolarHBondContact O-N 3.04Å; F131-A283 HydrophobicContact CD1-CB 4.14Å; F131-A283 HydrophobicContact CE1-CB 3.7Å; I254-A283 HydrophobicContact CG2-CB 3.73Å; H255-A283 WeakPolarHBondContact O-CA 3.18Å; V281-A283 HydrophobicContact CG1-CB 3.9Å
284	H	93.1	Very high	77.7	Confident	58 Å²	58	47 Å²	47	27%	0.269	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124	-177.8	-58.3	-74.4	0	0	0	109.6	D127 I254 H255	D127-H284 PolarHBondContact O-ND1 3.21Å; I254-H284 WeakPolarHBondContact CA-O 3.39Å; H255-H284 HydrophobicContact CB-CB 4.47Å; H255-H284 PolarHBondContact N-O 3.36Å; H255-H284 PolarHBondContact O-N 3.06Å
285	A	87.8	Confident	77.7	Confident	15 Å²	15	54.1 Å²	54.1	12%	0.124	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	120.6	171.4	0	0	0	0	0	108.9	Y149 I254	Y149-A285 HydrophobicContact CD1-CB 3.88Å; Y149-A285 HydrophobicContact CG-CB 4.26Å; I254-A285 HydrophobicContact CD1-CB 3.48Å; I254-A285 VanDerWaalsContact CD1-CB 3.48Å
286	L	82.5	Confident	77.5	Confident	15 Å²	15	50.2 Å²	50.2	8%	0.079	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-66.1	143.2	-174.7	-61	-177.1	0	0	0	110.8	F232 V253 H255 Q358 V360	F232-L286 HydrophobicContact CD1-CD1 4.14Å; F232-L286 HydrophobicContact CE1-CD1 4.09Å; V253-L286 HydrophobicContact CB-CD1 4.38Å; V253-L286 HydrophobicContact CG1-CD1 3.93Å; V253-L286 PolarHBondContact O-N 3.33Å; H255-L286 HydrophobicContact CB-CD2 4.16Å; L286-Q358 HydrophobicContact CB-CB 4.39Å; L286-Q358 HydrophobicContact CD1-CB 3.63Å; L286-V360 HydrophobicContact CD1-CG2 4.32Å; L286-V360 HydrophobicContact CD2-CG2 3.53Å
287	P	69.7	Low	76.9	Confident	66 Å²	66	54 Å²	54	43%	0.429	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-56	155.5	-177.5	-28.2	35.8	0	0	0	113.2	Q358	P287-Q358 PolarHBondContact O-NE2 3.41Å
288	P	63.3	Low	75.8	Confident	63 Å²	63	57.7 Å²	57.7	41%	0.409	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-60.7	154.3	179	-20.6	32.6	0	0	0	112.8	T290 E293	P288-T290 PolarHBondContact O-N 2.79Å; P288-E293 WeakPolarHBondContact CB-OE2 3.43Å
289	P	56.7	Low	75.6	Confident	57 Å²	57	62.5 Å²	62.5	37%	0.37	33%	0.334	S	S	.	.	S	Bend	trans	-68	20.6	-177.8	28.9	-39.4	0	0	0	115.7	T381	P289-T381 HydrophobicContact CB-CG2 3.43Å; P289-T381 VanDerWaalsContact CB-CG2 3.43Å
290	T	60.1	Low	75.3	Confident	42 Å²	42	63.3 Å²	63.3	26%	0.258	34%	0.338	S	S	.	.			trans	-111.3	99.4	-167.7	7.3	0	0	0	0	110.2	K241 P288 N292 E293	K241-T290 PolarHBondContact NZ-OG1 3.09Å; P288-T290 PolarHBondContact O-N 2.79Å; T290-N292 PolarHBondContact O-N 3.04Å; T290-E293 WeakPolarHBondContact CB-OE2 3.48Å; T290-E293 WeakPolarHBondContact O-CB 3.33Å; T290-E293 PolarHBondContact O-N 3.35Å; T290-E293 PolarHBondContact OG1-OE2 2.89Å
291	I	56.5	Low	75.1	Confident	70 Å²	70	61.6 Å²	61.6	36%	0.359	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-49.1	-34.9	-179.2	-171	170.8	0	0	0	113.4	E293 V294 V302	I291-E293 PolarHBondContact O-N 3.39Å; I291-E293 VanDerWaalsContact O-N 3.09Å; I291-V294 WeakPolarHBondContact O-CB 3.35Å; I291-V294 PolarHBondContact O-N 2.99Å; I291-V302 HydrophobicContact CD1-CG1 4.07Å
292	N	55.2	Low	74.9	Confident	154 Å²	154	61.5 Å²	61.5	82%	0.824	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-61.8	-15	177	-60.3	14.7	0	0	0	114.8	T290	T290-N292 PolarHBondContact O-N 3.04Å
293	E	57.8	Low	74.8	Confident	119 Å²	119	59.5 Å²	59.5	56%	0.556	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-97.3	-11.1	177.8	-63.4	173.8	140.2	0	0	112.2	P288 T290 I291 R295	P288-E293 WeakPolarHBondContact CB-OE2 3.43Å; T290-E293 WeakPolarHBondContact CB-OE2 3.48Å; T290-E293 WeakPolarHBondContact O-CB 3.33Å; T290-E293 PolarHBondContact O-N 3.35Å; T290-E293 PolarHBondContact OG1-OE2 2.89Å; I291-E293 PolarHBondContact O-N 3.39Å; I291-E293 VanDerWaalsContact O-N 3.09Å; E293-R295 PolarHBondContact O-N 3.34Å
294	V	60.3	Low	74.6	Confident	43 Å²	43	62.9 Å²	62.9	26%	0.261	33%	0.328	S	S	.	.			trans	-78.2	111.8	177.2	-175.1	0	0	0	0	109.3	I291 I296 M300 V397	I291-V294 WeakPolarHBondContact O-CB 3.35Å; I291-V294 PolarHBondContact O-N 2.99Å; V294-I296 HydrophobicContact CG1-CG1 4.18Å; V294-I296 PolarHBondContact O-N 3.47Å; V294-M300 HydrophobicContact CG1-CE 4.46Å; V294-V397 HydrophobicContact CG1-CG1 4.43Å
295	R	64.3	Low	74.7	Confident	184 Å²	184	60.1 Å²	60.1	69%	0.694	32%	0.315	S	S	*	.			trans	-78.1	118.2	166.7	-63.2	-177.4	-176.9	178.8	2.3	108	E293 D297	E293-R295 PolarHBondContact O-N 3.34Å; R295-D297 PolarHBondContact O-N 3.46Å
296	I	70.8	Confident	75.1	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.236	33%	0.326	C	S	.	.			trans	-98	87.7	-174.9	-44.1	175.7	0	0	0	109.2	V294 M300 V302 E315 R317	V294-I296 HydrophobicContact CG1-CG1 4.18Å; V294-I296 PolarHBondContact O-N 3.47Å; I296-M300 HydrophobicContact CG2-CB 3.86Å; I296-V302 HydrophobicContact CD1-CG2 3.8Å; I296-V302 HydrophobicContact CG1-CG2 4.4Å; I296-E315 WeakPolarHBondContact CD1-OE1 3.27Å; I296-R317 PolarHBondContact O-NH1 3.36Å
297	D	72.1	Confident	75.7	Confident	106 Å²	106	65 Å²	65	57%	0.567	34%	0.338	S	S	*	.			trans	-66.8	178.7	177	-66.3	-35.6	0	0	0	112	R295 M300 R317	R295-D297 PolarHBondContact O-N 3.46Å; D297-M300 HydrophobicContact CB-SD 4.4Å; D297-R317 PolarHBondContact O-NH1 2.75Å
298	C	64.2	Low	77	Confident	93 Å²	93	64 Å²	64	63%	0.628	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	150.6	169.5	50.5	0	0	0	0	111	M300	C298-M300 VanDerWaalsContact C-N 3.29Å
299	H	87.4	Confident	78.6	Confident	100 Å²	100	61 Å²	61	46%	0.463	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	27.7	-173.7	-48.1	-81.5	0	0	0	114.2	Y321 L400	H299-Y321 PolarHBondContact N-OH 3.39Å; H299-L400 HydrophobicContact CB-CB 3.92Å; H299-L400 WeakPolarHBondContact O-CB 3.36Å; H299-L400 PolarHBondContact O-N 3.47Å
300	M	90.8	Very high	80.6	Confident	18 Å²	18	60.2 Å²	60.2	9%	0.089	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	145.3	169.9	-67.4	176.5	61.1	0	0	111.6	V294 I296 D297 C298 R317 V397 N398 Y399	V294-M300 HydrophobicContact CG1-CE 4.46Å; I296-M300 HydrophobicContact CG2-CB 3.86Å; D297-M300 HydrophobicContact CB-SD 4.4Å; C298-M300 VanDerWaalsContact C-N 3.29Å; M300-R317 WeakPolarHBondContact O-CD 3.5Å; M300-V397 HydrophobicContact CE-CG1 3.51Å; M300-N398 VanDerWaalsContact CA-O 3.28Å; M300-N398 WeakPolarHBondContact CA-O 3.33Å; M300-Y399 HydrophobicContact CE-CD1 3.9Å; M300-Y399 HydrophobicContact CE-CE1 3.36Å; M300-Y399 HydrophobicContact CG-CD1 3.78Å; M300-Y399 HydrophobicContact CG-CE1 4.23Å; M300-Y399 HydrophobicContact CG-CG 4.49Å; M300-Y399 HydrophobicContact SD-CD1 3.75Å; M300-Y399 HydrophobicContact SD-CE1 3.61Å
301	F	92.4	Very high	82.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	147.5	169.3	72.6	-85	0	0	0	111.7	T303 E315 I318 Y321 M322 I376 N398 L400	F301-T303 HydrophobicContact CD2-CG2 4.44Å; F301-T303 HydrophobicContact CE2-CG2 4.1Å; F301-E315 WeakPolarHBondContact CA-OE2 3.35Å; F301-I318 HydrophobicContact CD2-CB 4.12Å; F301-I318 HydrophobicContact CD2-CD1 4.42Å; F301-I318 HydrophobicContact CD2-CG1 4.28Å; F301-I318 HydrophobicContact CE1-CG1 4.48Å; F301-I318 HydrophobicContact CE2-CB 4.28Å; F301-I318 HydrophobicContact CE2-CD1 3.77Å; F301-I318 HydrophobicContact CE2-CG1 3.95Å; F301-I318 HydrophobicContact CG-CB 4.44Å; F301-I318 HydrophobicContact CZ-CD1 4.07Å; F301-I318 HydrophobicContact CZ-CG1 4.06Å; F301-Y321 HydrophobicContact CD1-CD2 4.16Å; F301-M322 HydrophobicContact CE1-CE 4.06Å; F301-M322 HydrophobicContact CZ-CE 3.74Å; F301-I376 HydrophobicContact CE1-CD1 4.22Å; F301-I376 HydrophobicContact CZ-CD1 4.3Å; F301-N398 HydrophobicContact CD1-CB 3.94Å; F301-N398 HydrophobicContact CD2-CB 4.44Å; F301-N398 HydrophobicContact CE1-CB 3.59Å; F301-N398 HydrophobicContact CE2-CB 4.13Å; F301-N398 VanDerWaalsContact CE2-ND2 3.32Å; F301-N398 WeakPolarHBondContact CE2-ND2 3.49Å; F301-N398 HydrophobicContact CG-CB 4.35Å; F301-N398 HydrophobicContact CZ-CB 3.7Å; F301-N398 PolarHBondContact N-O 3.08Å; F301-N398 VanDerWaalsContact N-O 3.14Å; F301-N398 WeakPolarHBondContact O-CB 2.97Å; F301-N398 PolarHBondContact O-N 3.24Å; F301-N398 PolarHBondContact O-ND2 2.81Å; F301-L400 HydrophobicContact CD1-CD1 4.28Å; F301-L400 HydrophobicContact CE1-CD1 3.98Å
302	V	92.7	Very high	84.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.3	-177.5	-175.1	0	0	0	0	111.8	I291 I296 E315 I395 V397	I291-V302 HydrophobicContact CD1-CG1 4.07Å; I296-V302 HydrophobicContact CD1-CG2 3.8Å; I296-V302 HydrophobicContact CG1-CG2 4.4Å; V302-E315 HydrophobicContact CB-CG 4.23Å; V302-E315 PolarHBondContact N-OE2 3.46Å; V302-E315 PolarHBondContact O-N 3.43Å; V302-E315 VanDerWaalsContact O-N 3.12Å; V302-I395 HydrophobicContact CG1-CG2 3.88Å; V302-V397 HydrophobicContact CG2-CG2 4.34Å
303	T	94.7	Very high	86.2	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.2	163.5	41.3	0	0	0	0	110.7	F301 I311 Y313 C314 W396 N398	F301-T303 HydrophobicContact CD2-CG2 4.44Å; F301-T303 HydrophobicContact CE2-CG2 4.1Å; T303-I311 HydrophobicContact CG2-CG2 4.37Å; T303-Y313 CarbonylContact C-O 3.6Å; T303-Y313 WeakPolarHBondContact CA-O 3.36Å; T303-C314 HydrophobicContact CG2-CB 3.78Å; T303-C314 VanDerWaalsContact CG2-SG 3.57Å; T303-W396 PolarHBondContact N-O 3.36Å; T303-W396 PolarHBondContact O-N 3.14Å; T303-W396 PolarHBondContact OG1-O 2.84Å; T303-N398 PolarHBondContact OG1-ND2 3.49Å
304	R	94	Very high	88	Confident	70 Å²	70	50.6 Å²	50.6	26%	0.264	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.6	168	-177.3	-169.7	-172.9	-132.9	0.2	107.6	I312 Y313 E391 N393 I394 I395	R304-I312 HydrophobicContact CG-CD1 4.39Å; R304-I312 WeakPolarHBondContact O-CB 3.34Å; R304-I312 PolarHBondContact O-N 3.29Å; R304-Y313 HydrophobicContact CB-CD1 4.33Å; R304-Y313 PolarHBondContact N-O 3.43Å; R304-Y313 PolarHBondContact O-N 2.82Å; R304-Y313 VanDerWaalsContact O-N 3.14Å; R304-E391 IonicContact CZ-OE1 2.72Å; R304-E391 IonicContact NH1-OE1 2.75Å; R304-E391 IonicContact NH2-OE1 2.73Å; R304-E391 PolarHBondContact NH2-OE1 3.01Å; R304-N393 HydrophobicContact CG-CB 4.31Å; R304-N393 PolarHBondContact NE-OD1 3.19Å; R304-N393 PolarHBondContact NH2-ND2 2.79Å; R304-I394 WeakPolarHBondContact CA-O 3.45Å; R304-I395 HydrophobicContact CB-CD1 4.49Å; R304-I395 HydrophobicContact CG-CD1 4.16Å
305	V	95.8	Very high	89.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	155.4	-173.7	-47.2	0	0	0	0	111.4	L309 N310 I311 I394	V305-L309 HydrophobicContact CG2-CD2 3.74Å; V305-N310 CarbonylContact C-O 3.52Å; V305-N310 WeakPolarHBondContact CA-O 3.49Å; V305-N310 WeakPolarHBondContact CB-O 3.48Å; V305-I311 HydrophobicContact CG1-CB 4.44Å; V305-I311 HydrophobicContact CG1-CG1 4Å; V305-I394 HydrophobicContact CG2-CB 3.62Å; V305-I394 HydrophobicContact CG2-CD1 4.46Å; V305-I394 HydrophobicContact CG2-CG2 3.71Å; V305-I394 PolarHBondContact N-O 3.23Å; V305-I394 PolarHBondContact O-N 3.18Å
306	N	95.9	Very high	91	Very high	67 Å²	67	47.2 Å²	47.2	36%	0.358	24%	0.238	S	C	.	.			trans	-72.8	171.6	172	-88.7	-30	0	0	0	111.2	D308 L309 N310 I312	N306-D308 WeakPolarHBondContact CB-OD1 3.49Å; N306-D308 PolarHBondContact O-N 2.93Å; N306-L309 WeakPolarHBondContact O-CA 3.31Å; N306-L309 PolarHBondContact O-N 2.6Å; N306-N310 HydrophobicContact CB-CB 4.22Å; N306-N310 PolarHBondContact N-O 3.42Å; N306-I312 HydrophobicContact CB-CD1 4.44Å; N306-I312 VanDerWaalsContact OD1-CD1 3.24Å; N306-I312 WeakPolarHBondContact OD1-CD1 3.47Å
307	M	95.2	Very high	92	Very high	65 Å²	65	49 Å²	49	32%	0.32	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-4.4	177	-59.2	-56	-61.3	0	0	114.6	H350 L354 I382 K392 I394	M307-H350 PolarHBondContact O-NE2 2.92Å; M307-L354 HydrophobicContact CE-CD2 3.4Å; M307-L354 VanDerWaalsContact CE-CD2 3.4Å; M307-I382 HydrophobicContact CE-CD1 3.75Å; M307-I382 HydrophobicContact CE-CG1 4.26Å; M307-I382 HydrophobicContact SD-CG2 4.43Å; M307-K392 HydrophobicContact CG-CB 4.34Å; M307-K392 HydrophobicContact SD-CB 3.82Å; M307-I394 HydrophobicContact SD-CD1 4.22Å; M307-I394 HydrophobicContact SD-CG1 4.16Å
308	D	96.6	Very high	93	Very high	45 Å²	45	43.9 Å²	43.9	24%	0.241	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	11.2	174	70.8	-25.3	0	0	0	112.8	N306 N310 R333	N306-D308 WeakPolarHBondContact CB-OD1 3.49Å; N306-D308 PolarHBondContact O-N 2.93Å; D308-N310 VanDerWaalsContact C-N 3.28Å; D308-N310 PolarHBondContact O-N 2.9Å; D308-N310 WeakPolarHBondContact OD1-CB 3.12Å; D308-N310 PolarHBondContact OD1-N 3.15Å; D308-R333 IonicContact OD2-CZ 2.69Å; D308-R333 IonicContact OD2-NE 3.4Å; D308-R333 PolarHBondContact OD2-NE 2.76Å; D308-R333 IonicContact OD2-NH2 3.59Å; D308-R333 PolarHBondContact OD2-NH2 3.34Å
309	L	97.6	Very high	94.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.204	C	C	.	.			trans	59.5	24	-169.5	-51.4	-179.7	0	0	0	115.3	V305 N306 R333 C334 Y335 I346 H350 I394 W396	V305-L309 HydrophobicContact CG2-CD2 3.74Å; N306-L309 WeakPolarHBondContact O-CA 3.31Å; N306-L309 PolarHBondContact O-N 2.6Å; L309-R333 CarbonylContact O-C 3.57Å; L309-R333 VanDerWaalsContact O-CA 3.3Å; L309-R333 WeakPolarHBondContact O-CA 3.28Å; L309-C334 HydrophobicContact CB-CB 4.09Å; L309-C334 PolarHBondContact O-N 3.44Å; L309-C334 PolarHBondContact O-SG 3.49Å; L309-Y335 HydrophobicContact CD1-CE2 4.25Å; L309-I346 HydrophobicContact CD1-CG2 4.45Å; L309-H350 HydrophobicContact CD1-CB 4.21Å; L309-I394 HydrophobicContact CD2-CD1 4.1Å; L309-W396 HydrophobicContact CD1-CZ3 4.43Å; L309-W396 HydrophobicContact CD2-CE3 4.03Å; L309-W396 HydrophobicContact CD2-CZ3 3.85Å
310	N	97.9	Very high	94.8	Very high	41 Å²	41	43 Å²	43	22%	0.219	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-70.4	125.3	166.9	-168.7	-10.3	0	0	0	111	V305 N306 D308 I312 G331 K332 R333	V305-N310 CarbonylContact C-O 3.52Å; V305-N310 WeakPolarHBondContact CA-O 3.49Å; V305-N310 WeakPolarHBondContact CB-O 3.48Å; N306-N310 HydrophobicContact CB-CB 4.22Å; N306-N310 PolarHBondContact N-O 3.42Å; D308-N310 VanDerWaalsContact C-N 3.28Å; D308-N310 PolarHBondContact O-N 2.9Å; D308-N310 WeakPolarHBondContact OD1-CB 3.12Å; D308-N310 PolarHBondContact OD1-N 3.15Å; N310-I312 PolarHBondContact O-N 2.92Å; N310-G331 WeakPolarHBondContact OD1-CA 3.23Å; N310-G331 PolarHBondContact OD1-O 2.73Å; N310-G331 VanDerWaalsContact OD1-O 3.09Å; N310-K332 PolarHBondContact OD1-N 3.39Å; N310-K332 PolarHBondContact OD1-O 3.35Å; N310-R333 HydrophobicContact CB-CG 3.97Å
311	I	98	Very high	94.9	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	110.9	-174.2	-58.1	169.6	0	0	0	110	T303 V305 I329 V330 G331 K332 F337 W366	T303-I311 HydrophobicContact CG2-CG2 4.37Å; V305-I311 HydrophobicContact CG1-CB 4.44Å; V305-I311 HydrophobicContact CG1-CG1 4Å; I311-I329 HydrophobicContact CD1-CB 4.21Å; I311-I329 HydrophobicContact CD1-CD1 4.27Å; I311-I329 HydrophobicContact CD1-CG1 4.49Å; I311-I329 HydrophobicContact CG2-CD1 4.5Å; I311-V330 HydrophobicContact CG2-CG2 4.09Å; I311-V330 WeakPolarHBondContact O-CA 3.37Å; I311-G331 PolarHBondContact O-N 2.97Å; I311-K332 WeakPolarHBondContact CG1-O 3.35Å; I311-K332 PolarHBondContact N-O 2.89Å; I311-F337 HydrophobicContact CD1-CD2 4.28Å; I311-F337 HydrophobicContact CD1-CE2 4.1Å; I311-W366 HydrophobicContact CD1-CH2 4.32Å; I311-W366 HydrophobicContact CD1-CZ2 4.36Å
312	I	96.2	Very high	95	Very high	62 Å²	62	44.6 Å²	44.6	32%	0.318	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-34.4	178.9	-40.1	171.9	0	0	0	110.6	R304 N306 N310	R304-I312 HydrophobicContact CG-CD1 4.39Å; R304-I312 WeakPolarHBondContact O-CB 3.34Å; R304-I312 PolarHBondContact O-N 3.29Å; N306-I312 HydrophobicContact CB-CD1 4.44Å; N306-I312 VanDerWaalsContact OD1-CD1 3.24Å; N306-I312 WeakPolarHBondContact OD1-CD1 3.47Å; N310-I312 PolarHBondContact O-N 2.92Å
313	Y	95.8	Very high	95	Very high	118 Å²	118	47.2 Å²	47.2	46%	0.463	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	146.9	-176.6	164.9	-90.9	0	0	0	110.8	T303 R304 E315	T303-Y313 CarbonylContact C-O 3.6Å; T303-Y313 WeakPolarHBondContact CA-O 3.36Å; R304-Y313 HydrophobicContact CB-CD1 4.33Å; R304-Y313 PolarHBondContact N-O 3.43Å; R304-Y313 PolarHBondContact O-N 2.82Å; R304-Y313 VanDerWaalsContact O-N 3.14Å; Y313-E315 HydrophobicContact CE1-CG 4.04Å
314	C	95.9	Very high	95	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.014	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.8	169.2	-174	0	0	0	0	109.7	T303 P326 I329	T303-C314 HydrophobicContact CG2-CB 3.78Å; T303-C314 VanDerWaalsContact CG2-SG 3.57Å; C314-P326 HydrophobicContact CB-CB 4.09Å; C314-P326 HydrophobicContact CB-CG 4.36Å; C314-I329 HydrophobicContact CB-CD1 3.81Å; C314-I329 HydrophobicContact CB-CG1 4.41Å
315	E	92.9	Very high	95.1	Very high	33 Å²	33	46.9 Å²	46.9	15%	0.154	24%	0.237	C	C	.	.			trans	-67.4	141	168.7	-66.6	-178.4	139.4	0	0	111.9	I296 F301 V302 Y313 R317 I318	I296-E315 WeakPolarHBondContact CD1-OE1 3.27Å; F301-E315 WeakPolarHBondContact CA-OE2 3.35Å; V302-E315 HydrophobicContact CB-CG 4.23Å; V302-E315 PolarHBondContact N-OE2 3.46Å; V302-E315 PolarHBondContact O-N 3.43Å; V302-E315 VanDerWaalsContact O-N 3.12Å; Y313-E315 HydrophobicContact CE1-CG 4.04Å; E315-R317 PolarHBondContact O-N 3.1Å; E315-I318 WeakPolarHBondContact O-CG2 3.21Å; E315-I318 PolarHBondContact O-N 3.47Å
316	N	94	Very high	95.2	Very high	124 Å²	124	47.9 Å²	47.9	66%	0.663	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-57.3	-23.2	178.9	-63.9	2.2	0	0	0	113.9	I318 S319	N316-I318 PolarHBondContact O-N 3.14Å; N316-I318 VanDerWaalsContact O-N 3.12Å; N316-S319 WeakPolarHBondContact O-CB 3.26Å; N316-S319 PolarHBondContact O-N 3.34Å; N316-S319 VanDerWaalsContact O-N 3.1Å; N316-S319 PolarHBondContact O-OG 3.18Å
317	R	91.4	Very high	95.2	Very high	82 Å²	82	50.9 Å²	50.9	31%	0.309	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-60.3	-16.9	179.6	-155.7	-168.8	-69	-173.7	-1.3	113.6	I296 D297 M300 E315 S319 D320 Y321	I296-R317 PolarHBondContact O-NH1 3.36Å; D297-R317 PolarHBondContact O-NH1 2.75Å; M300-R317 WeakPolarHBondContact O-CD 3.5Å; E315-R317 PolarHBondContact O-N 3.1Å; R317-S319 PolarHBondContact O-N 2.96Å; R317-D320 HydrophobicContact CG-CB 4.46Å; R317-D320 WeakPolarHBondContact CG-OD2 3.4Å; R317-D320 WeakPolarHBondContact O-CB 3.27Å; R317-D320 PolarHBondContact O-N 2.89Å; R317-Y321 WeakPolarHBondContact CD-OH 3.35Å; R317-Y321 HydrophobicContact CG-CE2 3.94Å; R317-Y321 WeakPolarHBondContact O-CD2 3.42Å
318	I	94.4	Very high	95.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-53.1	-34.7	170.3	-167.7	174.2	0	0	0	112	F301 E315 N316 D320 Y321 M322 P326 I329	F301-I318 HydrophobicContact CD2-CB 4.12Å; F301-I318 HydrophobicContact CD2-CD1 4.42Å; F301-I318 HydrophobicContact CD2-CG1 4.28Å; F301-I318 HydrophobicContact CE1-CG1 4.48Å; F301-I318 HydrophobicContact CE2-CB 4.28Å; F301-I318 HydrophobicContact CE2-CD1 3.77Å; F301-I318 HydrophobicContact CE2-CG1 3.95Å; F301-I318 HydrophobicContact CG-CB 4.44Å; F301-I318 HydrophobicContact CZ-CD1 4.07Å; F301-I318 HydrophobicContact CZ-CG1 4.06Å; E315-I318 WeakPolarHBondContact O-CG2 3.21Å; E315-I318 PolarHBondContact O-N 3.47Å; N316-I318 PolarHBondContact O-N 3.14Å; N316-I318 VanDerWaalsContact O-N 3.12Å; I318-D320 PolarHBondContact O-N 3.39Å; I318-Y321 CarbonylContact O-C 3.47Å; I318-Y321 PolarHBondContact O-N 2.95Å; I318-M322 HydrophobicContact CD1-CE 4.35Å; I318-M322 HydrophobicContact CD1-SD 3.71Å; I318-M322 HydrophobicContact CG1-CB 4.26Å; I318-M322 HydrophobicContact CG1-CE 4.37Å; I318-M322 HydrophobicContact CG1-CG 4.06Å; I318-M322 HydrophobicContact CG1-SD 3.7Å; I318-M322 PolarHBondContact O-N 3.43Å; I318-P326 HydrophobicContact CG2-CG 3.89Å; I318-I329 HydrophobicContact CD1-CD1 3.46Å; I318-I329 VanDerWaalsContact CD1-CD1 3.46Å
319	S	94.9	Very high	95.2	Very high	56 Å²	56	47.3 Å²	47.3	39%	0.392	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-69.1	-13.1	178.9	-26.5	0	0	0	0	114	N316 R317 Y321	N316-S319 WeakPolarHBondContact O-CB 3.26Å; N316-S319 PolarHBondContact O-N 3.34Å; N316-S319 VanDerWaalsContact O-N 3.1Å; N316-S319 PolarHBondContact O-OG 3.18Å; R317-S319 PolarHBondContact O-N 2.96Å; S319-Y321 VanDerWaalsContact C-N 3.29Å
320	D	93.5	Very high	95.2	Very high	117 Å²	117	50.3 Å²	50.3	63%	0.626	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-82	-13.4	173.1	-57.1	-17.3	0	0	0	111.4	R317 I318	R317-D320 HydrophobicContact CG-CB 4.46Å; R317-D320 WeakPolarHBondContact CG-OD2 3.4Å; R317-D320 WeakPolarHBondContact O-CB 3.27Å; R317-D320 PolarHBondContact O-N 2.89Å; I318-D320 PolarHBondContact O-N 3.39Å
321	Y	92.9	Very high	95.2	Very high	39 Å²	39	50.8 Å²	50.8	15%	0.153	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-23.3	-167.2	-57.3	-35.2	0	0	0	114	H299 F301 R317 I318 S319 L400	H299-Y321 PolarHBondContact N-OH 3.39Å; F301-Y321 HydrophobicContact CD1-CD2 4.16Å; R317-Y321 WeakPolarHBondContact CD-OH 3.35Å; R317-Y321 HydrophobicContact CG-CE2 3.94Å; R317-Y321 WeakPolarHBondContact O-CD2 3.42Å; I318-Y321 CarbonylContact O-C 3.47Å; I318-Y321 PolarHBondContact O-N 2.95Å; S319-Y321 VanDerWaalsContact C-N 3.29Å; Y321-L400 HydrophobicContact CD1-CD2 4.02Å; Y321-L400 HydrophobicContact CD2-CD1 4.15Å; Y321-L400 HydrophobicContact CG-CD1 4.15Å; Y321-L400 HydrophobicContact CG-CD2 3.82Å
322	M	95.1	Very high	95.1	Very high	14 Å²	14	55.5 Å²	55.5	7%	0.069	30%	0.3	C	S	.	.	S	Bend	trans	-130.9	162.4	179.5	-60.5	-172.7	-175.7	0	0	111.4	F301 I318 L324 W366 Q368 I374 I376	F301-M322 HydrophobicContact CE1-CE 4.06Å; F301-M322 HydrophobicContact CZ-CE 3.74Å; I318-M322 HydrophobicContact CD1-CE 4.35Å; I318-M322 HydrophobicContact CD1-SD 3.71Å; I318-M322 HydrophobicContact CG1-CB 4.26Å; I318-M322 HydrophobicContact CG1-CE 4.37Å; I318-M322 HydrophobicContact CG1-CG 4.06Å; I318-M322 HydrophobicContact CG1-SD 3.7Å; I318-M322 PolarHBondContact O-N 3.43Å; M322-L324 HydrophobicContact CB-CB 4.2Å; M322-L324 PolarHBondContact O-N 3.2Å; M322-L324 HydrophobicContact SD-CB 4.41Å; M322-L324 HydrophobicContact SD-CD1 4.14Å; M322-W366 HydrophobicContact CE-CB 4.08Å; M322-W366 VanDerWaalsContact CE-CD1 3.48Å; M322-W366 HydrophobicContact CE-CD2 3.72Å; M322-W366 HydrophobicContact CE-CE3 4.41Å; M322-W366 HydrophobicContact CE-CG 3.51Å; M322-W366 HydrophobicContact SD-CG 4.39Å; M322-Q368 VanDerWaalsContact CA-OE1 3.25Å; M322-I374 HydrophobicContact CE-CD1 3.63Å; M322-I374 HydrophobicContact CE-CG1 4.1Å; M322-I374 HydrophobicContact CG-CD1 3.8Å; M322-I376 HydrophobicContact CE-CD1 3.65Å
323	D	93.2	Very high	95.2	Very high	55 Å²	55	58.2 Å²	58.2	29%	0.294	31%	0.306	S	S	.	.	S	Bend	trans	-82	10.9	165.6	62.2	-4.8	0	0	0	113.6	Q368 K369 N370	D323-Q368 WeakPolarHBondContact OD1-CA 3.45Å; D323-Q368 VanDerWaalsContact OD1-CB 3.31Å; D323-Q368 WeakPolarHBondContact OD1-CB 3.42Å; D323-Q368 PolarHBondContact OD1-OE1 2.79Å; D323-K369 HydrophobicContact CB-CB 4.32Å; D323-K369 VanDerWaalsContact CG-CB 3.47Å; D323-K369 WeakPolarHBondContact O-CD 3.22Å; D323-K369 WeakPolarHBondContact OD1-CB 3.5Å; D323-K369 PolarHBondContact OD1-N 3.5Å; D323-K369 WeakPolarHBondContact OD2-CB 3.27Å; D323-K369 PolarHBondContact OD2-N 3.31Å; D323-K369 VanDerWaalsContact OD2-N 3.09Å; D323-N370 PolarHBondContact OD2-N 2.59Å; D323-N370 PolarHBondContact OD2-ND2 3.38Å
324	L	94.3	Very high	95.3	Very high	9 Å²	9	52.7 Å²	52.7	5%	0.047	28%	0.284	C	S	.	.			trans	-106.6	133.4	174.6	-69.5	167	0	0	0	110.4	M322 D328 I329 F337 K369	M322-L324 HydrophobicContact CB-CB 4.2Å; M322-L324 PolarHBondContact O-N 3.2Å; M322-L324 HydrophobicContact SD-CB 4.41Å; M322-L324 HydrophobicContact SD-CD1 4.14Å; L324-D328 HydrophobicContact CD2-CB 3.69Å; L324-I329 HydrophobicContact CB-CG2 4.12Å; L324-I329 HydrophobicContact CD1-CG2 4.07Å; L324-I329 HydrophobicContact CD2-CG2 4.22Å; L324-I329 HydrophobicContact CG-CG2 4.38Å; L324-F337 HydrophobicContact CD1-CD1 4.16Å; L324-F337 HydrophobicContact CD1-CE1 4.24Å; L324-K369 HydrophobicContact CD2-CB 3.76Å; L324-K369 HydrophobicContact CD2-CD 4.25Å; L324-K369 HydrophobicContact CD2-CG 4.17Å; L324-K369 HydrophobicContact CG-CB 4.11Å
325	T	96.3	Very high	95.4	Very high	54 Å²	54	55.8 Å²	55.8	33%	0.331	30%	0.296	S	S	.	.			trans	-95.5	168	169.7	75.2	0	0	0	0	110.6	V327 D328	T325-V327 PolarHBondContact O-N 3.16Å; T325-V327 VanDerWaalsContact O-N 3.12Å; T325-V327 PolarHBondContact OG1-N 3.26Å; T325-D328 WeakPolarHBondContact CA-OD2 3.35Å; T325-D328 WeakPolarHBondContact CB-OD2 3.38Å; T325-D328 PolarHBondContact N-OD2 2.88Å; T325-D328 PolarHBondContact O-N 2.88Å; T325-D328 PolarHBondContact OG1-OD2 2.92Å
326	P	97.1	Very high	95.6	Very high	21 Å²	21	59.5 Å²	59.5	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-54.5	-30.2	172.2	-28	37.1	0	0	0	114	C314 I318 D328 I329 V330	C314-P326 HydrophobicContact CB-CB 4.09Å; C314-P326 HydrophobicContact CB-CG 4.36Å; I318-P326 HydrophobicContact CG2-CG 3.89Å; P326-D328 VanDerWaalsContact C-N 3.34Å; P326-I329 PolarHBondContact O-N 2.8Å; P326-V330 WeakPolarHBondContact O-CB 3.49Å; P326-V330 VanDerWaalsContact O-CG2 3.24Å; P326-V330 WeakPolarHBondContact O-CG2 3.43Å; P326-V330 PolarHBondContact O-N 2.88Å
327	V	96.2	Very high	95.8	Very high	131 Å²	131	54.4 Å²	54.4	79%	0.794	29%	0.285	S	S	*	.	H	α-helix	trans	-71	-30.3	179.8	-175.4	0	0	0	0	111.7	T325 I329	T325-V327 PolarHBondContact O-N 3.16Å; T325-V327 VanDerWaalsContact O-N 3.12Å; T325-V327 PolarHBondContact OG1-N 3.26Å; V327-I329 VanDerWaalsContact C-N 3.27Å; V327-I329 PolarHBondContact O-N 2.71Å
328	D	95.4	Very high	96.1	Very high	34 Å²	34	50.7 Å²	50.7	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-72.2	-21.5	178.1	-61.7	-85.1	0	0	0	113	L324 T325 P326 K332 K369	L324-D328 HydrophobicContact CD2-CB 3.69Å; T325-D328 WeakPolarHBondContact CA-OD2 3.35Å; T325-D328 WeakPolarHBondContact CB-OD2 3.38Å; T325-D328 PolarHBondContact N-OD2 2.88Å; T325-D328 PolarHBondContact O-N 2.88Å; T325-D328 PolarHBondContact OG1-OD2 2.92Å; P326-D328 VanDerWaalsContact C-N 3.34Å; D328-K332 WeakPolarHBondContact O-CD 3.23Å; D328-K332 WeakPolarHBondContact O-CE 3.38Å; D328-K332 PolarHBondContact O-NZ 3.06Å; D328-K369 IonicContact OD1-NZ 3.24Å; D328-K369 PolarHBondContact OD1-NZ 2.78Å; D328-K369 IonicContact OD2-NZ 3.56Å
329	I	96.5	Very high	96.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-119.4	-26.2	-167.8	69.2	166.2	0	0	0	115.6	I311 C314 I318 L324 P326 V327 K332 F337	I311-I329 HydrophobicContact CD1-CB 4.21Å; I311-I329 HydrophobicContact CD1-CD1 4.27Å; I311-I329 HydrophobicContact CD1-CG1 4.49Å; I311-I329 HydrophobicContact CG2-CD1 4.5Å; C314-I329 HydrophobicContact CB-CD1 3.81Å; C314-I329 HydrophobicContact CB-CG1 4.41Å; I318-I329 HydrophobicContact CD1-CD1 3.46Å; I318-I329 VanDerWaalsContact CD1-CD1 3.46Å; L324-I329 HydrophobicContact CB-CG2 4.12Å; L324-I329 HydrophobicContact CD1-CG2 4.07Å; L324-I329 HydrophobicContact CD2-CG2 4.22Å; L324-I329 HydrophobicContact CG-CG2 4.38Å; P326-I329 PolarHBondContact O-N 2.8Å; V327-I329 VanDerWaalsContact C-N 3.27Å; V327-I329 PolarHBondContact O-N 2.71Å; I329-K332 PolarHBondContact O-N 2.96Å; I329-F337 HydrophobicContact CB-CE2 3.91Å; I329-F337 HydrophobicContact CB-CZ 3.81Å; I329-F337 HydrophobicContact CG2-CE1 3.88Å; I329-F337 HydrophobicContact CG2-CE2 3.99Å; I329-F337 HydrophobicContact CG2-CZ 3.52Å
330	V	97.8	Very high	96.4	Very high	63 Å²	63	53.4 Å²	53.4	38%	0.382	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	138.7	177.6	166.7	0	0	0	0	110.3	I311 P326 K332	I311-V330 HydrophobicContact CG2-CG2 4.09Å; I311-V330 WeakPolarHBondContact O-CA 3.37Å; P326-V330 WeakPolarHBondContact O-CB 3.49Å; P326-V330 VanDerWaalsContact O-CG2 3.24Å; P326-V330 WeakPolarHBondContact O-CG2 3.43Å; P326-V330 PolarHBondContact O-N 2.88Å; V330-K332 VanDerWaalsContact C-N 3.3Å
331	G	96.8	Very high	96.6	Very high	51 Å²	51	54.1 Å²	54.1	53%	0.526	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	-10.1	-173.7	0	0	0	0	0	114.8	N310 I311	N310-G331 WeakPolarHBondContact OD1-CA 3.23Å; N310-G331 PolarHBondContact OD1-O 2.73Å; N310-G331 VanDerWaalsContact OD1-O 3.09Å; I311-G331 PolarHBondContact O-N 2.97Å
332	K	97.3	Very high	96.9	Very high	101 Å²	101	53.4 Å²	53.4	44%	0.439	29%	0.29	S	S	.	.	S	Bend	trans	-99.9	148.9	174.4	-65.6	167.3	-178.3	169.1	0	110.9	N310 I311 D328 I329 V330 F337	N310-K332 PolarHBondContact OD1-N 3.39Å; N310-K332 PolarHBondContact OD1-O 3.35Å; I311-K332 WeakPolarHBondContact CG1-O 3.35Å; I311-K332 PolarHBondContact N-O 2.89Å; D328-K332 WeakPolarHBondContact O-CD 3.23Å; D328-K332 WeakPolarHBondContact O-CE 3.38Å; D328-K332 PolarHBondContact O-NZ 3.06Å; I329-K332 PolarHBondContact O-N 2.96Å; V330-K332 VanDerWaalsContact C-N 3.3Å; K332-F337 HydrophobicContact CB-CE2 3.89Å; K332-F337 HydrophobicContact CB-CZ 4.16Å; K332-F337 HydrophobicContact CD-CE2 4.28Å; K332-F337 HydrophobicContact CD-CZ 3.67Å
333	R	97.5	Very high	97	Very high	119 Å²	119	54.9 Å²	54.9	45%	0.449	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-74.6	142.4	170.5	-67.4	177.9	174.6	153.9	-1.7	111.7	D308 L309 N310 Y335 H336	D308-R333 IonicContact OD2-CZ 2.69Å; D308-R333 IonicContact OD2-NE 3.4Å; D308-R333 PolarHBondContact OD2-NE 2.76Å; D308-R333 IonicContact OD2-NH2 3.59Å; D308-R333 PolarHBondContact OD2-NH2 3.34Å; L309-R333 CarbonylContact O-C 3.57Å; L309-R333 VanDerWaalsContact O-CA 3.3Å; L309-R333 WeakPolarHBondContact O-CA 3.28Å; N310-R333 HydrophobicContact CB-CG 3.97Å; R333-Y335 PolarHBondContact O-N 3.45Å; R333-H336 PolarHBondContact N-ND1 3.29Å; R333-H336 PolarHBondContact O-N 3.03Å; R333-H336 PolarHBondContact O-ND1 3.47Å
334	C	97.9	Very high	97.2	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.007	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-51.1	-31.7	177.1	-64.4	0	0	0	0	113.6	L309 H336 F337 I338	L309-C334 HydrophobicContact CB-CB 4.09Å; L309-C334 PolarHBondContact O-N 3.44Å; L309-C334 PolarHBondContact O-SG 3.49Å; C334-H336 PolarHBondContact O-N 2.95Å; C334-H336 VanDerWaalsContact O-N 3.16Å; C334-F337 PolarHBondContact O-N 2.86Å; C334-I338 HydrophobicContact CB-CD1 4.2Å; C334-I338 WeakPolarHBondContact O-CG1 3.19Å; C334-I338 PolarHBondContact O-N 3.23Å
335	Y	98.2	Very high	97.4	Very high	67 Å²	67	57.8 Å²	57.8	26%	0.263	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-58.8	-23.1	178.5	-64.8	-62	0	0	0	114.9	L309 R333 F337 I338 V343 I346 H350	L309-Y335 HydrophobicContact CD1-CE2 4.25Å; R333-Y335 PolarHBondContact O-N 3.45Å; Y335-F337 PolarHBondContact O-N 2.85Å; Y335-I338 HydrophobicContact CD1-CD1 4.08Å; Y335-V343 HydrophobicContact CD1-CG1 4.14Å; Y335-V343 HydrophobicContact CE1-CG1 4.45Å; Y335-I346 HydrophobicContact CE1-CG2 4.29Å; Y335-H350 PolarHBondContact OH-ND1 2.96Å; Y335-H350 VanDerWaalsContact OH-ND1 3.16Å
336	H	96.7	Very high	97.5	Very high	111 Å²	111	55.3 Å²	55.3	51%	0.514	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-72.5	-14.4	173.6	-54.5	93.9	0	0	0	113.2	R333 C334 M367	R333-H336 PolarHBondContact N-ND1 3.29Å; R333-H336 PolarHBondContact O-N 3.03Å; R333-H336 PolarHBondContact O-ND1 3.47Å; C334-H336 PolarHBondContact O-N 2.95Å; C334-H336 VanDerWaalsContact O-N 3.16Å; H336-M367 WeakPolarHBondContact O-CE 3.41Å
337	F	97.5	Very high	97.5	Very high	17 Å²	17	60 Å²	60	8%	0.075	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-6.9	-177.6	-56	-70	0	0	0	113.2	I311 L324 I329 K332 C334 Y335 W366 M367	I311-F337 HydrophobicContact CD1-CD2 4.28Å; I311-F337 HydrophobicContact CD1-CE2 4.1Å; L324-F337 HydrophobicContact CD1-CD1 4.16Å; L324-F337 HydrophobicContact CD1-CE1 4.24Å; I329-F337 HydrophobicContact CB-CE2 3.91Å; I329-F337 HydrophobicContact CB-CZ 3.81Å; I329-F337 HydrophobicContact CG2-CE1 3.88Å; I329-F337 HydrophobicContact CG2-CE2 3.99Å; I329-F337 HydrophobicContact CG2-CZ 3.52Å; K332-F337 HydrophobicContact CB-CE2 3.89Å; K332-F337 HydrophobicContact CB-CZ 4.16Å; K332-F337 HydrophobicContact CD-CE2 4.28Å; K332-F337 HydrophobicContact CD-CZ 3.67Å; C334-F337 PolarHBondContact O-N 2.86Å; Y335-F337 PolarHBondContact O-N 2.85Å; F337-W366 HydrophobicContact CB-CD2 4.26Å; F337-W366 HydrophobicContact CB-CG 4.34Å; F337-W366 HydrophobicContact CB-CZ2 4.17Å; F337-W366 HydrophobicContact CD2-CZ2 4.14Å; F337-W366 HydrophobicContact CG-CZ2 4.26Å; F337-W366 AromaticContact CG-NE1 3.78Å; F337-W366 CarbonylContact O-C 3.52Å; F337-W366 WeakPolarHBondContact O-CA 3.38Å; F337-M367 PolarHBondContact O-N 2.97Å
338	I	98.3	Very high	97.6	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.021	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-88.1	126.9	179.7	-66.7	156.9	0	0	0	108.2	C334 Y335 A340 D342 V343 I346 Y364	C334-I338 HydrophobicContact CB-CD1 4.2Å; C334-I338 WeakPolarHBondContact O-CG1 3.19Å; C334-I338 PolarHBondContact O-N 3.23Å; Y335-I338 HydrophobicContact CD1-CD1 4.08Å; I338-A340 PolarHBondContact O-N 3Å; I338-D342 HydrophobicContact CG2-CB 3.91Å; I338-V343 HydrophobicContact CB-CG2 4.22Å; I338-V343 HydrophobicContact CG2-CG2 3.81Å; I338-I346 HydrophobicContact CD1-CB 3.97Å; I338-I346 HydrophobicContact CD1-CG1 3.95Å; I338-I346 HydrophobicContact CD1-CG2 3.64Å; I338-I346 HydrophobicContact CG1-CG1 4.43Å; I338-I346 HydrophobicContact CG2-CG1 4.05Å; I338-Y364 HydrophobicContact CG1-CD2 4.07Å; I338-Y364 HydrophobicContact CG1-CE2 3.96Å; I338-Y364 HydrophobicContact CG2-CD2 4.43Å
339	H	98.4	Very high	97.7	Very high	32 Å²	32	57.4 Å²	57.4	15%	0.148	30%	0.295	C	S	.	.			trans	-54.9	133.8	175.3	-178.9	-93.6	0	0	0	110.9	E341 D342 V343 R365 M367	H339-E341 VanDerWaalsContact C-N 3.26Å; H339-E341 IonicContact CE1-OE2 3.9Å; H339-E341 PolarHBondContact O-N 2.7Å; H339-D342 PolarHBondContact O-N 3.17Å; H339-V343 PolarHBondContact O-N 3.26Å; H339-R365 HydrophobicContact CB-CB 3.64Å; H339-R365 PolarHBondContact CE1-NH1 3.2Å; H339-R365 VanDerWaalsContact CE1-NH1 3.27Å; H339-R365 PolarHBondContact N-O 3.47Å; H339-R365 VanDerWaalsContact ND1-CZ 3.26Å; H339-R365 PolarHBondContact ND1-NH1 2.79Å; H339-M367 HydrophobicContact CB-CG 4.33Å
340	A	97.8	Very high	97.8	Very high	82 Å²	82	58.1 Å²	58.1	68%	0.678	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-51.1	-39.8	-166.2	0	0	0	0	0	114.8	I338 D342 V343	I338-A340 PolarHBondContact O-N 3Å; A340-D342 VanDerWaalsContact C-N 3.28Å; A340-D342 PolarHBondContact O-N 3.26Å; A340-V343 WeakPolarHBondContact O-CB 3.28Å; A340-V343 PolarHBondContact O-N 3.24Å
341	E	98.1	Very high	97.8	Very high	131 Å²	131	59.1 Å²	59.1	61%	0.612	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-63.1	-28.7	177.7	-173.1	-177.3	-164.9	0	0	113.6	H339 R365	H339-E341 VanDerWaalsContact C-N 3.26Å; H339-E341 IonicContact CE1-OE2 3.9Å; H339-E341 PolarHBondContact O-N 2.7Å; E341-R365 IonicContact OE2-CZ 2.81Å; E341-R365 IonicContact OE2-NH1 3.32Å; E341-R365 PolarHBondContact OE2-NH1 3.38Å; E341-R365 IonicContact OE2-NH2 2.7Å; E341-R365 PolarHBondContact OE2-NH2 3.46Å
342	D	98.5	Very high	97.7	Very high	24 Å²	24	57.5 Å²	57.5	13%	0.128	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-89.5	-13	-178.8	-60.6	-30.8	0	0	0	113.2	I338 H339 A340 E344 G345 I346 R365	I338-D342 HydrophobicContact CG2-CB 3.91Å; H339-D342 PolarHBondContact O-N 3.17Å; A340-D342 VanDerWaalsContact C-N 3.28Å; A340-D342 PolarHBondContact O-N 3.26Å; D342-E344 VanDerWaalsContact C-N 3.31Å; D342-E344 PolarHBondContact O-N 3.14Å; D342-G345 WeakPolarHBondContact O-CA 3.31Å; D342-G345 PolarHBondContact O-N 2.99Å; D342-I346 PolarHBondContact O-N 3.07Å; D342-R365 VanDerWaalsContact CG-NH2 3.31Å; D342-R365 IonicContact OD1-CZ 2.72Å; D342-R365 IonicContact OD1-NE 3.53Å; D342-R365 IonicContact OD1-NH2 3.97Å; D342-R365 PolarHBondContact OD1-NH2 3.33Å; D342-R365 WeakPolarHBondContact OD2-CB 3.33Å; D342-R365 IonicContact OD2-CZ 2.7Å; D342-R365 PolarHBondContact OD2-N 2.86Å; D342-R365 IonicContact OD2-NE 2.67Å; D342-R365 PolarHBondContact OD2-NE 3Å; D342-R365 IonicContact OD2-NH2 3.61Å; D342-R365 PolarHBondContact OD2-NH2 2.91Å
343	V	98	Very high	97.6	Very high	45 Å²	45	52.7 Å²	52.7	27%	0.273	26%	0.26	S	S	.	.	H	α-helix	trans	-57.2	-41.1	-172.5	172.2	0	0	0	0	112	Y335 I338 H339 A340 G345 I346 R347	Y335-V343 HydrophobicContact CD1-CG1 4.14Å; Y335-V343 HydrophobicContact CE1-CG1 4.45Å; I338-V343 HydrophobicContact CB-CG2 4.22Å; I338-V343 HydrophobicContact CG2-CG2 3.81Å; H339-V343 PolarHBondContact O-N 3.26Å; A340-V343 WeakPolarHBondContact O-CB 3.28Å; A340-V343 PolarHBondContact O-N 3.24Å; V343-G345 VanDerWaalsContact C-N 3.34Å; V343-G345 PolarHBondContact O-N 3.38Å; V343-I346 PolarHBondContact O-N 2.88Å; V343-R347 WeakPolarHBondContact O-CB 3.27Å; V343-R347 PolarHBondContact O-N 2.8Å
344	E	97.5	Very high	97.4	Very high	105 Å²	105	50.6 Å²	50.6	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-36.5	177.4	179.4	55.9	-158.8	0	0	112.1	D342 I346 R347 H348	D342-E344 VanDerWaalsContact C-N 3.31Å; D342-E344 PolarHBondContact O-N 3.14Å; E344-I346 PolarHBondContact O-N 3.15Å; E344-R347 PolarHBondContact O-N 3.11Å; E344-R347 IonicContact OE1-CZ 3.21Å; E344-R347 IonicContact OE1-NE 3.4Å; E344-R347 IonicContact OE1-NH2 3.78Å; E344-R347 PolarHBondContact OE1-NH2 3.03Å; E344-R347 IonicContact OE2-CZ 2.8Å; E344-R347 IonicContact OE2-NE 3.18Å; E344-R347 PolarHBondContact OE2-NE 2.91Å; E344-R347 IonicContact OE2-NH2 2.71Å; E344-R347 PolarHBondContact OE2-NH2 3.48Å; E344-H348 WeakPolarHBondContact O-CB 3.19Å; E344-H348 PolarHBondContact O-N 2.71Å
345	G	97	Very high	97.3	Very high	20 Å²	20	55.1 Å²	55.1	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-38.6	174.3	0	0	0	0	0	112.6	D342 V343 S349	D342-G345 WeakPolarHBondContact O-CA 3.31Å; D342-G345 PolarHBondContact O-N 2.99Å; V343-G345 VanDerWaalsContact C-N 3.34Å; V343-G345 PolarHBondContact O-N 3.38Å; G345-S349 PolarHBondContact O-N 3.27Å; G345-S349 VanDerWaalsContact O-N 3.11Å; G345-S349 PolarHBondContact O-OG 2.83Å
346	I	98.4	Very high	97	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-75.5	-36.9	174.5	-58.3	-60.9	0	0	0	111.8	L309 Y335 I338 D342 V343 E344 H348 S349 H350 T361 Y364 W396	L309-I346 HydrophobicContact CD1-CG2 4.45Å; Y335-I346 HydrophobicContact CE1-CG2 4.29Å; I338-I346 HydrophobicContact CD1-CB 3.97Å; I338-I346 HydrophobicContact CD1-CG1 3.95Å; I338-I346 HydrophobicContact CD1-CG2 3.64Å; I338-I346 HydrophobicContact CG1-CG1 4.43Å; I338-I346 HydrophobicContact CG2-CG1 4.05Å; D342-I346 PolarHBondContact O-N 3.07Å; V343-I346 PolarHBondContact O-N 2.88Å; E344-I346 PolarHBondContact O-N 3.15Å; I346-H348 VanDerWaalsContact C-N 3.31Å; I346-H348 PolarHBondContact O-N 3.21Å; I346-S349 PolarHBondContact O-N 3.37Å; I346-H350 VanDerWaalsContact O-CB 3.31Å; I346-H350 WeakPolarHBondContact O-CB 3.27Å; I346-H350 PolarHBondContact O-N 3.25Å; I346-T361 HydrophobicContact CD1-CG2 3.68Å; I346-Y364 HydrophobicContact CD1-CD1 3.64Å; I346-Y364 HydrophobicContact CD1-CD2 4.27Å; I346-Y364 HydrophobicContact CD1-CE1 4.07Å; I346-Y364 HydrophobicContact CD1-CG 3.73Å; I346-Y364 HydrophobicContact CG1-CD2 4.4Å; I346-Y364 HydrophobicContact CG1-CG 4.21Å; I346-W396 HydrophobicContact CG2-CH2 4.29Å
347	R	98.4	Very high	96.8	Very high	121 Å²	121	48.5 Å²	48.5	46%	0.457	26%	0.258	S	S	.	.	H	α-helix	trans	-59.6	-41.9	174.4	-166.7	-171.3	70.7	84	3.6	111.5	V343 E344 H350 L351	V343-R347 WeakPolarHBondContact O-CB 3.27Å; V343-R347 PolarHBondContact O-N 2.8Å; E344-R347 PolarHBondContact O-N 3.11Å; E344-R347 IonicContact OE1-CZ 3.21Å; E344-R347 IonicContact OE1-NE 3.4Å; E344-R347 IonicContact OE1-NH2 3.78Å; E344-R347 PolarHBondContact OE1-NH2 3.03Å; E344-R347 IonicContact OE2-CZ 2.8Å; E344-R347 IonicContact OE2-NE 3.18Å; E344-R347 PolarHBondContact OE2-NE 2.91Å; E344-R347 IonicContact OE2-NH2 2.71Å; E344-R347 PolarHBondContact OE2-NH2 3.48Å; R347-H350 PolarHBondContact O-N 3.33Å; R347-L351 PolarHBondContact O-N 2.98Å
348	H	97.4	Very high	96.6	Very high	103 Å²	103	48.8 Å²	48.8	48%	0.477	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-46.9	173	-169.3	89.3	0	0	0	111.9	E344 I346 H350 L351 D352	E344-H348 WeakPolarHBondContact O-CB 3.19Å; E344-H348 PolarHBondContact O-N 2.71Å; I346-H348 VanDerWaalsContact C-N 3.31Å; I346-H348 PolarHBondContact O-N 3.21Å; H348-H350 VanDerWaalsContact C-N 3.25Å; H348-H350 PolarHBondContact O-N 3.03Å; H348-L351 WeakPolarHBondContact O-CB 3.46Å; H348-L351 PolarHBondContact O-N 3.15Å; H348-L351 VanDerWaalsContact O-N 3.12Å; H348-D352 PolarHBondContact O-N 3.33Å
349	S	98.1	Very high	96.4	Very high	7 Å²	7	48.6 Å²	48.6	5%	0.049	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-37.9	176.5	-53.8	0	0	0	0	112.1	G345 I346 D352 L353 C359	G345-S349 PolarHBondContact O-N 3.27Å; G345-S349 VanDerWaalsContact O-N 3.11Å; G345-S349 PolarHBondContact O-OG 2.83Å; I346-S349 PolarHBondContact O-N 3.37Å; S349-D352 WeakPolarHBondContact O-CB 3.3Å; S349-D352 PolarHBondContact O-N 3.02Å; S349-L353 WeakPolarHBondContact O-CB 3.29Å; S349-L353 PolarHBondContact O-N 2.93Å; S349-C359 PolarHBondContact O-SG 3.17Å; S349-C359 VanDerWaalsContact O-SG 3.35Å
350	H	98.2	Very high	96.3	Very high	15 Å²	15	48.2 Å²	48.2	7%	0.069	26%	0.258	C	S	.	.	H	α-helix	trans	-69.7	-38.4	176.7	-175.7	-162.5	0	0	0	112	M307 L309 Y335 I346 R347 H348 L353 L354	M307-H350 PolarHBondContact O-NE2 2.92Å; L309-H350 HydrophobicContact CD1-CB 4.21Å; Y335-H350 PolarHBondContact OH-ND1 2.96Å; Y335-H350 VanDerWaalsContact OH-ND1 3.16Å; I346-H350 VanDerWaalsContact O-CB 3.31Å; I346-H350 WeakPolarHBondContact O-CB 3.27Å; I346-H350 PolarHBondContact O-N 3.25Å; R347-H350 PolarHBondContact O-N 3.33Å; H348-H350 VanDerWaalsContact C-N 3.25Å; H348-H350 PolarHBondContact O-N 3.03Å; H350-L353 WeakPolarHBondContact O-CB 3.18Å; H350-L353 PolarHBondContact O-N 3.41Å; H350-L354 VanDerWaalsContact O-CG 3.31Å; H350-L354 WeakPolarHBondContact O-CG 3.42Å; H350-L354 PolarHBondContact O-N 2.94Å
351	L	97.4	Very high	96.3	Very high	83 Å²	83	44.5 Å²	44.5	44%	0.435	23%	0.227	S	C	.	.	H	α-helix	trans	-62.7	-42.2	173	-177.8	59.9	0	0	0	111.8	R347 H348 L354 N355	R347-L351 PolarHBondContact O-N 2.98Å; H348-L351 WeakPolarHBondContact O-CB 3.46Å; H348-L351 PolarHBondContact O-N 3.15Å; H348-L351 VanDerWaalsContact O-N 3.12Å; L351-L354 PolarHBondContact O-N 2.94Å; L351-N355 WeakPolarHBondContact CD1-ND2 3.29Å; L351-N355 WeakPolarHBondContact O-CB 3.11Å; L351-N355 VanDerWaalsContact O-CG 3.28Å; L351-N355 PolarHBondContact O-N 3.41Å; L351-N355 PolarHBondContact O-ND2 3.15Å
352	D	95.4	Very high	96.1	Very high	18 Å²	18	45.1 Å²	45.1	10%	0.096	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-47.2	171.5	-95.9	-34.7	0	0	0	111.9	F232 H348 S349 L354 N355 K356 C359	F232-D352 HydrophobicContact CD2-CB 4.29Å; F232-D352 WeakPolarHBondContact CD2-OD2 3.41Å; H348-D352 PolarHBondContact O-N 3.33Å; S349-D352 WeakPolarHBondContact O-CB 3.3Å; S349-D352 PolarHBondContact O-N 3.02Å; D352-L354 VanDerWaalsContact C-N 3.33Å; D352-L354 PolarHBondContact O-N 3.41Å; D352-N355 PolarHBondContact O-N 3.45Å; D352-K356 WeakPolarHBondContact O-CB 3.31Å; D352-K356 PolarHBondContact O-N 3.46Å; D352-K356 WeakPolarHBondContact OD1-CD 3.31Å; D352-K356 VanDerWaalsContact OD1-CE 3.26Å; D352-K356 WeakPolarHBondContact OD1-CE 3.42Å; D352-K356 IonicContact OD1-NZ 2.72Å; D352-K356 PolarHBondContact OD1-NZ 3.5Å; D352-C359 HydrophobicContact CB-CB 4.31Å
353	L	95.2	Very high	96.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-44.4	177.9	-179.9	60.2	0	0	0	112.4	S349 H350 G357 C359 A380 I382 I394 W396	S349-L353 WeakPolarHBondContact O-CB 3.29Å; S349-L353 PolarHBondContact O-N 2.93Å; H350-L353 WeakPolarHBondContact O-CB 3.18Å; H350-L353 PolarHBondContact O-N 3.41Å; L353-G357 CarbonylContact O-C 3.58Å; L353-G357 WeakPolarHBondContact O-CA 3.2Å; L353-G357 PolarHBondContact O-N 3.36Å; L353-C359 HydrophobicContact CB-CB 4.14Å; L353-A380 HydrophobicContact CD1-CB 4.06Å; L353-A380 HydrophobicContact CD2-CB 3.7Å; L353-I382 HydrophobicContact CD1-CG1 4.21Å; L353-I382 HydrophobicContact CG-CG1 4.39Å; L353-I382 WeakPolarHBondContact O-CD1 3.24Å; L353-I394 HydrophobicContact CD2-CD1 3.66Å; L353-I394 HydrophobicContact CD2-CG1 4.01Å; L353-I394 HydrophobicContact CD2-CG2 3.81Å; L353-I394 HydrophobicContact CG-CD1 4.34Å; L353-W396 HydrophobicContact CD2-CE3 4.38Å; L353-W396 HydrophobicContact CD2-CZ3 4.07Å
354	L	94.1	Very high	96.2	Very high	74 Å²	74	47.5 Å²	47.5	39%	0.387	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-41.1	177.9	-67.2	174.7	0	0	0	112.3	M307 H350 L351 D352	M307-L354 HydrophobicContact CE-CD2 3.4Å; M307-L354 VanDerWaalsContact CE-CD2 3.4Å; H350-L354 VanDerWaalsContact O-CG 3.31Å; H350-L354 WeakPolarHBondContact O-CG 3.42Å; H350-L354 PolarHBondContact O-N 2.94Å; L351-L354 PolarHBondContact O-N 2.94Å; D352-L354 VanDerWaalsContact C-N 3.33Å; D352-L354 PolarHBondContact O-N 3.41Å
355	N	93.9	Very high	96.2	Very high	96 Å²	96	43.7 Å²	43.7	51%	0.513	21%	0.212	S	C	.	.	H	α-helix	trans	-79.7	-34.5	-175.5	-72.4	-25.9	0	0	0	114.1	R234 L351 D352	R234-N355 PolarHBondContact NH1-O 3.32Å; L351-N355 WeakPolarHBondContact CD1-ND2 3.29Å; L351-N355 WeakPolarHBondContact O-CB 3.11Å; L351-N355 VanDerWaalsContact O-CG 3.28Å; L351-N355 PolarHBondContact O-N 3.41Å; L351-N355 PolarHBondContact O-ND2 3.15Å; D352-N355 PolarHBondContact O-N 3.45Å
356	K	93.2	Very high	96.3	Very high	19 Å²	19	42.8 Å²	42.8	8%	0.083	20%	0.203	C	C	.	.	H	α-helix	trans	-113.3	-20.5	-169.7	-61.7	167.1	-175.8	169.7	0	112.8	E173 F232 V253 D352	E173-K356 IonicContact OE1-NZ 3.98Å; E173-K356 PolarHBondContact OE1-NZ 3.2Å; E173-K356 WeakPolarHBondContact OE2-CE 3.28Å; E173-K356 IonicContact OE2-NZ 3.56Å; E173-K356 PolarHBondContact OE2-NZ 3.18Å; F232-K356 HydrophobicContact CB-CD 3.8Å; F232-K356 WeakPolarHBondContact O-CD 3.36Å; F232-K356 WeakPolarHBondContact O-CE 3.49Å; F232-K356 PolarHBondContact O-NZ 3.43Å; V253-K356 HydrophobicContact CG2-CB 4.48Å; V253-K356 WeakPolarHBondContact CG2-O 3.09Å; D352-K356 WeakPolarHBondContact O-CB 3.31Å; D352-K356 PolarHBondContact O-N 3.46Å; D352-K356 WeakPolarHBondContact OD1-CD 3.31Å; D352-K356 VanDerWaalsContact OD1-CE 3.26Å; D352-K356 WeakPolarHBondContact OD1-CE 3.42Å; D352-K356 IonicContact OD1-NZ 2.72Å; D352-K356 PolarHBondContact OD1-NZ 3.5Å
357	G	91.4	Very high	96.2	Very high	21 Å²	21	43.4 Å²	43.4	22%	0.216	21%	0.206	C	C	.	.	S	Bend	trans	98.1	-15.9	173.5	0	0	0	0	0	115.2	L353 I382	L353-G357 CarbonylContact O-C 3.58Å; L353-G357 WeakPolarHBondContact O-CA 3.2Å; L353-G357 PolarHBondContact O-N 3.36Å; G357-I382 PolarHBondContact O-N 2.73Å
358	Q	93	Very high	96.1	Very high	23 Å²	23	38 Å²	38	11%	0.107	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	147.7	178.2	-50.5	-169.7	-102.9	0	0	109.3	V253 L286 P287 A380 T381	V253-Q358 HydrophobicContact CB-CB 4.03Å; V253-Q358 HydrophobicContact CB-CG 4.33Å; V253-Q358 HydrophobicContact CG1-CB 4.24Å; V253-Q358 HydrophobicContact CG2-CB 3.95Å; V253-Q358 HydrophobicContact CG2-CG 3.97Å; L286-Q358 HydrophobicContact CB-CB 4.39Å; L286-Q358 HydrophobicContact CD1-CB 3.63Å; P287-Q358 PolarHBondContact O-NE2 3.41Å; Q358-A380 WeakPolarHBondContact CA-O 3.3Å; Q358-T381 HydrophobicContact CG-CG2 3.88Å; Q358-T381 WeakPolarHBondContact CG-OG1 3.33Å; Q358-T381 PolarHBondContact NE2-OG1 2.65Å
359	C	94.8	Very high	96	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	168.1	170.5	78.6	0	0	0	0	111.2	F232 S349 D352 L353 A380	F232-C359 HydrophobicContact CE2-CB 4.39Å; F232-C359 HydrophobicContact CZ-CB 4.42Å; S349-C359 PolarHBondContact O-SG 3.17Å; S349-C359 VanDerWaalsContact O-SG 3.35Å; D352-C359 HydrophobicContact CB-CB 4.31Å; L353-C359 HydrophobicContact CB-CB 4.14Å; C359-A380 PolarHBondContact N-O 3.16Å; C359-A380 PolarHBondContact O-N 2.75Å
360	V	95.9	Very high	95.6	Very high	23 Å²	23	42.4 Å²	42.4	14%	0.139	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132	164	178.7	0	0	0	0	107.5	F232 L286 Q377 S378	F232-V360 HydrophobicContact CE1-CB 4.23Å; F232-V360 HydrophobicContact CE1-CG2 4.45Å; F232-V360 HydrophobicContact CZ-CB 4.06Å; F232-V360 VanDerWaalsContact CZ-O 3.3Å; F232-V360 WeakPolarHBondContact CZ-O 3.06Å; L286-V360 HydrophobicContact CD1-CG2 4.32Å; L286-V360 HydrophobicContact CD2-CG2 3.53Å; V360-Q377 HydrophobicContact CG1-CG 4.04Å; V360-S378 WeakPolarHBondContact CA-O 3.4Å
361	T	97.6	Very high	95.4	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.025	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-72	163.3	-178.7	68.2	0	0	0	0	111.5	I346 Y364 Q377 S378 W396	I346-T361 HydrophobicContact CD1-CG2 3.68Å; T361-Y364 HydrophobicContact CG2-CE1 4.3Å; T361-Q377 WeakPolarHBondContact O-CG 3.43Å; T361-Q377 PolarHBondContact O-NE2 3.47Å; T361-S378 PolarHBondContact N-O 2.82Å; T361-S378 PolarHBondContact OG1-N 2.91Å; T361-W396 HydrophobicContact CG2-CH2 3.81Å; T361-W396 HydrophobicContact CG2-CZ2 3.71Å
362	K	95.6	Very high	95.4	Very high	145 Å²	145	37.8 Å²	37.8	63%	0.63	18%	0.184	S	C	*	.	P	Polyproline II helix	trans	-63.5	168.1	153	-66.2	171.9	-177.6	172	0	109.5	Y364	K362-Y364 PolarHBondContact O-N 2.97Å
363	Y	98.1	Very high	95.5	Very high	115 Å²	115	37.8 Å²	37.8	45%	0.451	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-62.7	132.2	165.5	-51.8	-31.2	0	0	0	108.7	I376 Q377 L401	Y363-I376 WeakPolarHBondContact CA-O 3.46Å; Y363-Q377 HydrophobicContact CD1-CB 3.97Å; Y363-Q377 HydrophobicContact CD1-CG 4.16Å; Y363-Q377 HydrophobicContact CE1-CB 4.29Å; Y363-Q377 HydrophobicContact CE1-CG 4.37Å; Y363-L401 HydrophobicContact CD1-CD1 3.47Å; Y363-L401 VanDerWaalsContact CD1-CD1 3.47Å; Y363-L401 HydrophobicContact CE1-CD1 4.01Å; Y363-L401 HydrophobicContact CG-CD1 3.8Å
364	Y	98.7	Very high	95.6	Very high	3 Å²	3	37.8 Å²	37.8	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	161	-179.1	74.2	-84.6	0	0	0	111.1	I338 I346 T361 K362 W366 W375 I376 S378 W396	I338-Y364 HydrophobicContact CG1-CD2 4.07Å; I338-Y364 HydrophobicContact CG1-CE2 3.96Å; I338-Y364 HydrophobicContact CG2-CD2 4.43Å; I346-Y364 HydrophobicContact CD1-CD1 3.64Å; I346-Y364 HydrophobicContact CD1-CD2 4.27Å; I346-Y364 HydrophobicContact CD1-CE1 4.07Å; I346-Y364 HydrophobicContact CD1-CG 3.73Å; I346-Y364 HydrophobicContact CG1-CD2 4.4Å; I346-Y364 HydrophobicContact CG1-CG 4.21Å; T361-Y364 HydrophobicContact CG2-CE1 4.3Å; K362-Y364 PolarHBondContact O-N 2.97Å; Y364-W366 HydrophobicContact CE2-CB 4.47Å; Y364-W366 AromaticContact CE2-CE3 3.87Å; Y364-W366 HydrophobicContact CE2-CE3 3.87Å; Y364-W366 WeakPolarHBondContact OH-CZ3 3.2Å; Y364-W375 WeakPolarHBondContact O-CA 3.47Å; Y364-I376 HydrophobicContact CD1-CB 4.45Å; Y364-I376 HydrophobicContact CD1-CG2 4.48Å; Y364-I376 WeakPolarHBondContact CD1-O 3.29Å; Y364-I376 HydrophobicContact CE1-CB 4.07Å; Y364-I376 HydrophobicContact CE1-CG2 3.69Å; Y364-I376 PolarHBondContact N-O 2.96Å; Y364-I376 PolarHBondContact O-N 3.5Å; Y364-S378 PolarHBondContact OH-OG 3.26Å; Y364-W396 PolarHBondContact OH-NE1 2.85Å
365	R	98.6	Very high	95.8	Very high	26 Å²	26	37.5 Å²	37.5	10%	0.098	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.8	-177.9	-66.6	162.6	-77.9	-171.1	-11	110.4	H339 E341 D342 Y373 I374 W375	H339-R365 HydrophobicContact CB-CB 3.64Å; H339-R365 PolarHBondContact CE1-NH1 3.2Å; H339-R365 VanDerWaalsContact CE1-NH1 3.27Å; H339-R365 PolarHBondContact N-O 3.47Å; H339-R365 VanDerWaalsContact ND1-CZ 3.26Å; H339-R365 PolarHBondContact ND1-NH1 2.79Å; E341-R365 IonicContact OE2-CZ 2.81Å; E341-R365 IonicContact OE2-NH1 3.32Å; E341-R365 PolarHBondContact OE2-NH1 3.38Å; E341-R365 IonicContact OE2-NH2 2.7Å; E341-R365 PolarHBondContact OE2-NH2 3.46Å; D342-R365 VanDerWaalsContact CG-NH2 3.31Å; D342-R365 IonicContact OD1-CZ 2.72Å; D342-R365 IonicContact OD1-NE 3.53Å; D342-R365 IonicContact OD1-NH2 3.97Å; D342-R365 PolarHBondContact OD1-NH2 3.33Å; D342-R365 WeakPolarHBondContact OD2-CB 3.33Å; D342-R365 IonicContact OD2-CZ 2.7Å; D342-R365 PolarHBondContact OD2-N 2.86Å; D342-R365 IonicContact OD2-NE 2.67Å; D342-R365 PolarHBondContact OD2-NE 3Å; D342-R365 IonicContact OD2-NH2 3.61Å; D342-R365 PolarHBondContact OD2-NH2 2.91Å; R365-Y373 HydrophobicContact CB-CD1 4.23Å; R365-Y373 HydrophobicContact CB-CD2 3.7Å; R365-Y373 HydrophobicContact CB-CE2 4.33Å; R365-Y373 HydrophobicContact CB-CG 3.67Å; R365-Y373 HydrophobicContact CG-CD1 4.25Å; R365-Y373 HydrophobicContact CG-CD2 3.45Å; R365-Y373 VanDerWaalsContact CG-CD2 3.45Å; R365-Y373 HydrophobicContact CG-CE1 4.34Å; R365-Y373 HydrophobicContact CG-CE2 3.59Å; R365-Y373 HydrophobicContact CG-CG 3.84Å; R365-I374 CarbonylContact C-O 3.49Å; R365-I374 WeakPolarHBondContact CA-O 3.35Å; R365-W375 HydrophobicContact CG-CD2 3.82Å; R365-W375 HydrophobicContact CG-CE3 3.73Å; R365-W375 HydrophobicContact CG-CH2 3.7Å; R365-W375 HydrophobicContact CG-CZ2 3.78Å; R365-W375 HydrophobicContact CG-CZ3 3.68Å
366	W	98.3	Very high	96	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.4	173.6	-167.2	-57.6	0	0	0	109.3	I311 M322 F337 Y364 Q368 Y373 I374 I376	I311-W366 HydrophobicContact CD1-CH2 4.32Å; I311-W366 HydrophobicContact CD1-CZ2 4.36Å; M322-W366 HydrophobicContact CE-CB 4.08Å; M322-W366 VanDerWaalsContact CE-CD1 3.48Å; M322-W366 HydrophobicContact CE-CD2 3.72Å; M322-W366 HydrophobicContact CE-CE3 4.41Å; M322-W366 HydrophobicContact CE-CG 3.51Å; M322-W366 HydrophobicContact SD-CG 4.39Å; F337-W366 HydrophobicContact CB-CD2 4.26Å; F337-W366 HydrophobicContact CB-CG 4.34Å; F337-W366 HydrophobicContact CB-CZ2 4.17Å; F337-W366 HydrophobicContact CD2-CZ2 4.14Å; F337-W366 HydrophobicContact CG-CZ2 4.26Å; F337-W366 AromaticContact CG-NE1 3.78Å; F337-W366 CarbonylContact O-C 3.52Å; F337-W366 WeakPolarHBondContact O-CA 3.38Å; Y364-W366 HydrophobicContact CE2-CB 4.47Å; Y364-W366 AromaticContact CE2-CE3 3.87Å; Y364-W366 HydrophobicContact CE2-CE3 3.87Å; Y364-W366 WeakPolarHBondContact OH-CZ3 3.2Å; W366-Q368 PolarHBondContact O-NE2 3.37Å; W366-Q368 VanDerWaalsContact O-NE2 3.14Å; W366-Y373 CarbonylContact O-C 3.51Å; W366-Y373 VanDerWaalsContact O-CA 3.25Å; W366-Y373 WeakPolarHBondContact O-CA 3.45Å; W366-Y373 WeakPolarHBondContact O-CB 3.42Å; W366-I374 HydrophobicContact CB-CG1 4.27Å; W366-I374 PolarHBondContact N-O 3.29Å; W366-I374 PolarHBondContact O-N 2.89Å; W366-I376 HydrophobicContact CB-CD1 3.73Å; W366-I376 HydrophobicContact CB-CG1 4.38Å; W366-I376 HydrophobicContact CD2-CD1 4.14Å; W366-I376 HydrophobicContact CE3-CD1 3.83Å; W366-I376 HydrophobicContact CG-CD1 4.13Å
367	M	97.7	Very high	96.2	Very high	15 Å²	15	34.5 Å²	34.5	7%	0.074	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	134.7	-177	-61.1	-170.5	-62.5	0	0	111.2	H336 F337 H339 G372 M411 D412	H336-M367 WeakPolarHBondContact O-CE 3.41Å; F337-M367 PolarHBondContact O-N 2.97Å; H339-M367 HydrophobicContact CB-CG 4.33Å; M367-G372 WeakPolarHBondContact CA-O 3.45Å; M367-M411 HydrophobicContact SD-CB 4.3Å; M367-D412 HydrophobicContact CE-CB 3.73Å; M367-D412 HydrophobicContact SD-CB 3.87Å
368	Q	96.4	Very high	96.4	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.037	15%	0.15	C	C	.	.			trans	-82	176.6	179.2	-63.5	-54	-87.7	0	0	111.1	M322 D323 W366 G371 G372 Q415	M322-Q368 VanDerWaalsContact CA-OE1 3.25Å; D323-Q368 WeakPolarHBondContact OD1-CA 3.45Å; D323-Q368 VanDerWaalsContact OD1-CB 3.31Å; D323-Q368 WeakPolarHBondContact OD1-CB 3.42Å; D323-Q368 PolarHBondContact OD1-OE1 2.79Å; W366-Q368 PolarHBondContact O-NE2 3.37Å; W366-Q368 VanDerWaalsContact O-NE2 3.14Å; Q368-G371 WeakPolarHBondContact CB-O 3.33Å; Q368-G372 PolarHBondContact N-O 2.92Å; Q368-Q415 WeakPolarHBondContact O-CG 3.3Å; Q368-Q415 PolarHBondContact O-NE2 3Å
369	K	94.1	Very high	96.5	Very high	89 Å²	89	33 Å²	33	39%	0.387	15%	0.149	S	C	.	.	S	Bend	trans	-75.1	-37.4	178.8	-170	171.5	179.6	165.7	0	112.9	D323 L324 D328 Q415	D323-K369 HydrophobicContact CB-CB 4.32Å; D323-K369 VanDerWaalsContact CG-CB 3.47Å; D323-K369 WeakPolarHBondContact O-CD 3.22Å; D323-K369 WeakPolarHBondContact OD1-CB 3.5Å; D323-K369 PolarHBondContact OD1-N 3.5Å; D323-K369 WeakPolarHBondContact OD2-CB 3.27Å; D323-K369 PolarHBondContact OD2-N 3.31Å; D323-K369 VanDerWaalsContact OD2-N 3.09Å; L324-K369 HydrophobicContact CD2-CB 3.76Å; L324-K369 HydrophobicContact CD2-CD 4.25Å; L324-K369 HydrophobicContact CD2-CG 4.17Å; L324-K369 HydrophobicContact CG-CB 4.11Å; D328-K369 IonicContact OD1-NZ 3.24Å; D328-K369 PolarHBondContact OD1-NZ 2.78Å; D328-K369 IonicContact OD2-NZ 3.56Å; K369-Q415 WeakPolarHBondContact O-CA 3.42Å
370	N	89.6	Confident	96.4	Very high	113 Å²	113	33 Å²	33	60%	0.604	15%	0.149	S	C	*	.	S	Bend	trans	-103	-7.3	-170.4	-59.6	-76	0	0	0	114.9	D323	D323-N370 PolarHBondContact OD2-N 2.59Å; D323-N370 PolarHBondContact OD2-ND2 3.38Å
371	G	94.2	Very high	96.2	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.01	15%	0.147	C	C	.	.	S	Bend	trans	140.9	156.7	-175.3	0	0	0	0	0	111.8	Q368 K407	Q368-G371 WeakPolarHBondContact CB-O 3.33Å; G371-K407 CarbonylContact C-O 3.49Å; G371-K407 WeakPolarHBondContact CA-O 3.37Å; G371-K407 WeakPolarHBondContact O-CA 3.23Å
372	G	97.1	Very high	95.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.153	C	C	.	.			trans	65.7	-159	-179.6	0	0	0	0	0	114.7	M367 Q368 E405 Y406 T409 Q415	M367-G372 WeakPolarHBondContact CA-O 3.45Å; Q368-G372 PolarHBondContact N-O 2.92Å; G372-E405 VanDerWaalsContact CA-O 3.25Å; G372-E405 WeakPolarHBondContact CA-O 3.21Å; G372-Y406 WeakPolarHBondContact CA-O 3.47Å; G372-Y406 PolarHBondContact N-O 3.22Å; G372-T409 PolarHBondContact N-O 3.37Å; G372-Q415 PolarHBondContact O-NE2 2.85Å
373	Y	97.8	Very high	95.4	Very high	18 Å²	18	27.7 Å²	27.7	7%	0.071	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	171.4	-172	61	-104.9	0	0	0	112.8	R365 W366 W375 P404 E405 Y406	R365-Y373 HydrophobicContact CB-CD1 4.23Å; R365-Y373 HydrophobicContact CB-CD2 3.7Å; R365-Y373 HydrophobicContact CB-CE2 4.33Å; R365-Y373 HydrophobicContact CB-CG 3.67Å; R365-Y373 HydrophobicContact CG-CD1 4.25Å; R365-Y373 HydrophobicContact CG-CD2 3.45Å; R365-Y373 VanDerWaalsContact CG-CD2 3.45Å; R365-Y373 HydrophobicContact CG-CE1 4.34Å; R365-Y373 HydrophobicContact CG-CE2 3.59Å; R365-Y373 HydrophobicContact CG-CG 3.84Å; W366-Y373 CarbonylContact O-C 3.51Å; W366-Y373 VanDerWaalsContact O-CA 3.25Å; W366-Y373 WeakPolarHBondContact O-CA 3.45Å; W366-Y373 WeakPolarHBondContact O-CB 3.42Å; Y373-W375 AromaticContact CE2-CD1 3.93Å; Y373-W375 AromaticContact CE2-CE2 3.98Å; Y373-W375 HydrophobicContact CE2-CZ2 4.49Å; Y373-W375 AromaticContact CE2-NE1 3.53Å; Y373-P404 WeakPolarHBondContact O-CA 3.46Å; Y373-E405 HydrophobicContact CD2-CB 4.28Å; Y373-E405 HydrophobicContact CE2-CB 3.68Å; Y373-E405 HydrophobicContact CE2-CG 4.2Å; Y373-E405 WeakPolarHBondContact CE2-OE2 3.28Å; Y373-E405 VanDerWaalsContact CZ-OE2 3.29Å; Y373-E405 PolarHBondContact N-O 3.24Å; Y373-E405 VanDerWaalsContact N-O 3.08Å; Y373-E405 PolarHBondContact O-N 3.27Å; Y373-E405 PolarHBondContact OH-OE2 2.87Å; Y373-Y406 AromaticContact CE1-CD2 3.9Å; Y373-Y406 HydrophobicContact CE1-CD2 3.9Å; Y373-Y406 AromaticContact CZ-CD2 3.86Å; Y373-Y406 WeakPolarHBondContact OH-CD2 3.26Å; Y373-Y406 WeakPolarHBondContact OH-CE2 3.45Å
374	I	97.7	Very high	94.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	150.6	160.1	62.9	172.5	0	0	0	111.7	M322 R365 W366 I376 L400 P404	M322-I374 HydrophobicContact CE-CD1 3.63Å; M322-I374 HydrophobicContact CE-CG1 4.1Å; M322-I374 HydrophobicContact CG-CD1 3.8Å; R365-I374 CarbonylContact C-O 3.49Å; R365-I374 WeakPolarHBondContact CA-O 3.35Å; W366-I374 HydrophobicContact CB-CG1 4.27Å; W366-I374 PolarHBondContact N-O 3.29Å; W366-I374 PolarHBondContact O-N 2.89Å; I374-I376 HydrophobicContact CD1-CD1 4.06Å; I374-I376 HydrophobicContact CD1-CG1 4.21Å; I374-I376 HydrophobicContact CG1-CD1 4.15Å; I374-I376 HydrophobicContact CG1-CG1 4.12Å; I374-L400 HydrophobicContact CD1-CD1 3.61Å; I374-L400 HydrophobicContact CD1-CD2 4.28Å; I374-L400 HydrophobicContact CD1-CG 3.93Å; I374-P404 HydrophobicContact CG2-CB 4.21Å; I374-P404 HydrophobicContact CG2-CG 3.77Å
375	W	98.4	Very high	93.3	Very high	69 Å²	69	28.1 Å²	28.1	26%	0.261	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133	172.3	-71.6	100.4	0	0	0	111.6	Y364 R365 Y373 L401 S402 E405	Y364-W375 WeakPolarHBondContact O-CA 3.47Å; R365-W375 HydrophobicContact CG-CD2 3.82Å; R365-W375 HydrophobicContact CG-CE3 3.73Å; R365-W375 HydrophobicContact CG-CH2 3.7Å; R365-W375 HydrophobicContact CG-CZ2 3.78Å; R365-W375 HydrophobicContact CG-CZ3 3.68Å; Y373-W375 AromaticContact CE2-CD1 3.93Å; Y373-W375 AromaticContact CE2-CE2 3.98Å; Y373-W375 HydrophobicContact CE2-CZ2 4.49Å; Y373-W375 AromaticContact CE2-NE1 3.53Å; W375-L401 HydrophobicContact CB-CB 3.8Å; W375-L401 HydrophobicContact CB-CD1 4.33Å; W375-L401 WeakPolarHBondContact O-CB 3.49Å; W375-L401 PolarHBondContact O-N 3.47Å; W375-S402 PolarHBondContact N-OG 2.9Å; W375-E405 PolarHBondContact NE1-OE1 2.93Å; W375-E405 PolarHBondContact NE1-OE2 2.95Å
376	I	98.2	Very high	92	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.3	179	-66.3	-175.4	0	0	0	110	F301 M322 Y363 Y364 W366 I374 S378 N398 Y399	F301-I376 HydrophobicContact CE1-CD1 4.22Å; F301-I376 HydrophobicContact CZ-CD1 4.3Å; M322-I376 HydrophobicContact CE-CD1 3.65Å; Y363-I376 WeakPolarHBondContact CA-O 3.46Å; Y364-I376 HydrophobicContact CD1-CB 4.45Å; Y364-I376 HydrophobicContact CD1-CG2 4.48Å; Y364-I376 WeakPolarHBondContact CD1-O 3.29Å; Y364-I376 HydrophobicContact CE1-CB 4.07Å; Y364-I376 HydrophobicContact CE1-CG2 3.69Å; Y364-I376 PolarHBondContact N-O 2.96Å; Y364-I376 PolarHBondContact O-N 3.5Å; W366-I376 HydrophobicContact CB-CD1 3.73Å; W366-I376 HydrophobicContact CB-CG1 4.38Å; W366-I376 HydrophobicContact CD2-CD1 4.14Å; W366-I376 HydrophobicContact CE3-CD1 3.83Å; W366-I376 HydrophobicContact CG-CD1 4.13Å; I374-I376 HydrophobicContact CD1-CD1 4.06Å; I374-I376 HydrophobicContact CD1-CG1 4.21Å; I374-I376 HydrophobicContact CG1-CD1 4.15Å; I374-I376 HydrophobicContact CG1-CG1 4.12Å; I376-S378 WeakPolarHBondContact CG2-OG 3.32Å; I376-N398 HydrophobicContact CG2-CB 4.03Å; I376-Y399 WeakPolarHBondContact CA-O 3.43Å
377	Q	97.3	Very high	90.9	Very high	51 Å²	51	41.3 Å²	41.3	24%	0.238	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146	152.4	-165.3	171.5	30.3	0	0	108.4	V360 T361 Y363 Y399 L401	V360-Q377 HydrophobicContact CG1-CG 4.04Å; T361-Q377 WeakPolarHBondContact O-CG 3.43Å; T361-Q377 PolarHBondContact O-NE2 3.47Å; Y363-Q377 HydrophobicContact CD1-CB 3.97Å; Y363-Q377 HydrophobicContact CD1-CG 4.16Å; Y363-Q377 HydrophobicContact CE1-CB 4.29Å; Y363-Q377 HydrophobicContact CE1-CG 4.37Å; Q377-Y399 PolarHBondContact N-O 3Å; Q377-Y399 VanDerWaalsContact N-O 3.08Å; Q377-Y399 WeakPolarHBondContact O-CB 3.39Å; Q377-Y399 WeakPolarHBondContact O-CD2 3.24Å; Q377-Y399 PolarHBondContact O-N 3.17Å; Q377-L401 HydrophobicContact CB-CD1 4.24Å
378	S	96.1	Very high	89.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.3	176.1	-54.9	0	0	0	0	112.7	V360 T361 Y364 I376 W396 V397 N398	V360-S378 WeakPolarHBondContact CA-O 3.4Å; T361-S378 PolarHBondContact N-O 2.82Å; T361-S378 PolarHBondContact OG1-N 2.91Å; Y364-S378 PolarHBondContact OH-OG 3.26Å; I376-S378 WeakPolarHBondContact CG2-OG 3.32Å; S378-W396 PolarHBondContact OG-NE1 3.31Å; S378-W396 VanDerWaalsContact OG-NE1 3.12Å; S378-V397 CarbonylContact C-O 3.58Å; S378-V397 WeakPolarHBondContact CA-O 3.38Å; S378-V397 WeakPolarHBondContact CB-O 3.19Å; S378-N398 PolarHBondContact OG-OD1 2.87Å
379	S	93.9	Very high	88.8	Confident	14 Å²	14	47.1 Å²	47.1	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.5	168.8	-176.1	0	0	0	0	108.2	V397	S379-V397 PolarHBondContact N-O 2.72Å; S379-V397 PolarHBondContact O-N 3.3Å
380	A	93.6	Very high	88	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.7	-172	0	0	0	0	0	111.2	L353 Q358 C359 I394 I395 W396	L353-A380 HydrophobicContact CD1-CB 4.06Å; L353-A380 HydrophobicContact CD2-CB 3.7Å; Q358-A380 WeakPolarHBondContact CA-O 3.3Å; C359-A380 PolarHBondContact N-O 3.16Å; C359-A380 PolarHBondContact O-N 2.75Å; A380-I394 HydrophobicContact CB-CG2 4.28Å; A380-I395 WeakPolarHBondContact CA-O 3.28Å; A380-W396 HydrophobicContact CB-CD2 3.97Å; A380-W396 HydrophobicContact CB-CE3 3.3Å; A380-W396 HydrophobicContact CB-CH2 4.45Å; A380-W396 HydrophobicContact CB-CZ3 3.59Å
381	T	92.1	Very high	87.6	Confident	13 Å²	13	47.8 Å²	47.8	8%	0.08	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	134	-176.4	-73.2	0	0	0	0	111.6	P289 Q358 A383 I394 I395	P289-T381 HydrophobicContact CB-CG2 3.43Å; P289-T381 VanDerWaalsContact CB-CG2 3.43Å; Q358-T381 HydrophobicContact CG-CG2 3.88Å; Q358-T381 WeakPolarHBondContact CG-OG1 3.33Å; Q358-T381 PolarHBondContact NE2-OG1 2.65Å; T381-A383 PolarHBondContact O-N 3.39Å; T381-I394 WeakPolarHBondContact O-CA 3.36Å; T381-I395 PolarHBondContact N-O 3.33Å; T381-I395 PolarHBondContact O-N 3.36Å
382	I	90.3	Very high	87.2	Confident	32 Å²	32	52.9 Å²	52.9	16%	0.164	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	114.9	173.8	-57.5	176.4	0	0	0	109.3	M307 L353 G357 K392 N393 I394	M307-I382 HydrophobicContact CE-CD1 3.75Å; M307-I382 HydrophobicContact CE-CG1 4.26Å; M307-I382 HydrophobicContact SD-CG2 4.43Å; L353-I382 HydrophobicContact CD1-CG1 4.21Å; L353-I382 HydrophobicContact CG-CG1 4.39Å; L353-I382 WeakPolarHBondContact O-CD1 3.24Å; G357-I382 PolarHBondContact O-N 2.73Å; I382-K392 HydrophobicContact CG2-CB 4.24Å; I382-N393 CarbonylContact C-O 3.58Å; I382-I394 HydrophobicContact CG1-CG1 4.04Å
383	A	84.9	Confident	86.9	Confident	14 Å²	14	53.4 Å²	53.4	12%	0.116	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.8	168.1	0	0	0	0	0	110.6	T381 N393 I395	T381-A383 PolarHBondContact O-N 3.39Å; A383-N393 PolarHBondContact N-O 3.42Å; A383-N393 PolarHBondContact O-N 2.97Å; A383-N393 PolarHBondContact O-ND2 2.84Å; A383-N393 VanDerWaalsContact O-O 3.1Å; A383-I395 HydrophobicContact CB-CD1 4.4Å; A383-I395 HydrophobicContact CB-CG1 3.85Å
384	I	80.4	Confident	86.7	Confident	77 Å²	77	52.5 Å²	52.5	40%	0.395	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.4	173.3	-57.4	175.1	0	0	0	107.7	A386 A389 K392	I384-A386 PolarHBondContact O-N 3.39Å; I384-A389 HydrophobicContact CG2-CB 4.32Å; I384-K392 HydrophobicContact CG1-CG 4.48Å
385	N	72.7	Confident	86.4	Confident	50 Å²	50	53.4 Å²	53.4	27%	0.267	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	120.7	176.3	-176.2	-11.5	0	0	0	110.4	K387 N388 E391	N385-K387 PolarHBondContact O-N 2.98Å; N385-K387 VanDerWaalsContact O-N 3.11Å; N385-K387 PolarHBondContact OD1-N 3.34Å; N385-N388 CarbonylContact O-C 3.53Å; N385-N388 PolarHBondContact O-N 3.49Å; N385-N388 VanDerWaalsContact O-O 3.07Å; N385-E391 HydrophobicContact CB-CB 4Å; N385-E391 HydrophobicContact CB-CG 4.48Å; N385-E391 PolarHBondContact N-O 2.92Å; N385-E391 PolarHBondContact ND2-OE2 3.36Å
386	A	71.2	Confident	86.2	Confident	104 Å²	104	50.2 Å²	50.2	86%	0.86	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.4	179.7	0	0	0	0	0	114.2	I384	I384-A386 PolarHBondContact O-N 3.39Å
387	K	75.4	Confident	86	Confident	199 Å²	199	50.7 Å²	50.7	87%	0.865	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-22.3	173.6	-63.5	-179.1	178.4	179.1	0	113.6	N385	N385-K387 PolarHBondContact O-N 2.98Å; N385-K387 VanDerWaalsContact O-N 3.11Å; N385-K387 PolarHBondContact OD1-N 3.34Å
388	N	74.5	Confident	85.9	Confident	77 Å²	77	48.2 Å²	48.2	41%	0.412	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	98.4	-177.1	-179.8	3.8	0	0	0	109.7	N385 N390 E391	N385-N388 CarbonylContact O-C 3.53Å; N385-N388 PolarHBondContact O-N 3.49Å; N385-N388 VanDerWaalsContact O-O 3.07Å; N388-N390 PolarHBondContact O-N 2.92Å; N388-N390 WeakPolarHBondContact OD1-CB 3.49Å; N388-N390 PolarHBondContact OD1-N 3.33Å; N388-E391 HydrophobicContact CB-CB 4.33Å; N388-E391 PolarHBondContact O-N 3.46Å
389	A	75.2	Confident	85.8	Confident	68 Å²	68	52.3 Å²	52.3	56%	0.562	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	-15.6	-176.2	0	0	0	0	0	114.4	I384	I384-A389 HydrophobicContact CG2-CB 4.32Å
390	N	76.5	Confident	85.9	Confident	147 Å²	147	52.7 Å²	52.7	79%	0.786	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	-23.9	176.4	-61.5	-8.4	0	0	0	112.2	N388 K392	N388-N390 PolarHBondContact O-N 2.92Å; N388-N390 WeakPolarHBondContact OD1-CB 3.49Å; N388-N390 PolarHBondContact OD1-N 3.33Å; N390-K392 PolarHBondContact O-N 2.9Å; N390-K392 VanDerWaalsContact O-N 3.16Å
391	E	81.8	Confident	86	Confident	70 Å²	70	56.7 Å²	56.7	33%	0.327	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	98.8	175.3	-169.3	-160	153.3	0	0	110.1	R304 N385 N388	R304-E391 IonicContact CZ-OE1 2.72Å; R304-E391 IonicContact NH1-OE1 2.75Å; R304-E391 IonicContact NH2-OE1 2.73Å; R304-E391 PolarHBondContact NH2-OE1 3.01Å; N385-E391 HydrophobicContact CB-CB 4Å; N385-E391 HydrophobicContact CB-CG 4.48Å; N385-E391 PolarHBondContact N-O 2.92Å; N385-E391 PolarHBondContact ND2-OE2 3.36Å; N388-E391 HydrophobicContact CB-CB 4.33Å; N388-E391 PolarHBondContact O-N 3.46Å
392	K	86.3	Confident	86.2	Confident	108 Å²	108	57 Å²	57	47%	0.47	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.9	172.8	-61.9	177.1	-174.4	171.3	0	109.8	M307 I382 I384 N390	M307-K392 HydrophobicContact CG-CB 4.34Å; M307-K392 HydrophobicContact SD-CB 3.82Å; I382-K392 HydrophobicContact CG2-CB 4.24Å; I384-K392 HydrophobicContact CG1-CG 4.48Å; N390-K392 PolarHBondContact O-N 2.9Å; N390-K392 VanDerWaalsContact O-N 3.16Å
393	N	90.6	Very high	86.4	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.053	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	158.2	173.6	59.3	107.6	0	0	0	108.7	R304 I382 A383	R304-N393 HydrophobicContact CG-CB 4.31Å; R304-N393 PolarHBondContact NE-OD1 3.19Å; R304-N393 PolarHBondContact NH2-ND2 2.79Å; I382-N393 CarbonylContact C-O 3.58Å; A383-N393 PolarHBondContact N-O 3.42Å; A383-N393 PolarHBondContact O-N 2.97Å; A383-N393 PolarHBondContact O-ND2 2.84Å; A383-N393 VanDerWaalsContact O-O 3.1Å
394	I	92.8	Very high	87	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.9	177.5	-70.6	158.8	0	0	0	108.1	R304 V305 M307 L309 L353 A380 T381 I382 W396	R304-I394 WeakPolarHBondContact CA-O 3.45Å; V305-I394 HydrophobicContact CG2-CB 3.62Å; V305-I394 HydrophobicContact CG2-CD1 4.46Å; V305-I394 HydrophobicContact CG2-CG2 3.71Å; V305-I394 PolarHBondContact N-O 3.23Å; V305-I394 PolarHBondContact O-N 3.18Å; M307-I394 HydrophobicContact SD-CD1 4.22Å; M307-I394 HydrophobicContact SD-CG1 4.16Å; L309-I394 HydrophobicContact CD2-CD1 4.1Å; L353-I394 HydrophobicContact CD2-CD1 3.66Å; L353-I394 HydrophobicContact CD2-CG1 4.01Å; L353-I394 HydrophobicContact CD2-CG2 3.81Å; L353-I394 HydrophobicContact CG-CD1 4.34Å; A380-I394 HydrophobicContact CB-CG2 4.28Å; T381-I394 WeakPolarHBondContact O-CA 3.36Å; I382-I394 HydrophobicContact CG1-CG1 4.04Å; I394-W396 HydrophobicContact CG2-CB 4.34Å; I394-W396 HydrophobicContact CG2-CE3 4.02Å
395	I	92.4	Very high	87.8	Confident	19 Å²	19	63.7 Å²	63.7	10%	0.097	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.6	163.3	-51.8	-57.1	0	0	0	106.7	V302 R304 A380 T381 A383 V397	V302-I395 HydrophobicContact CG1-CG2 3.88Å; R304-I395 HydrophobicContact CB-CD1 4.49Å; R304-I395 HydrophobicContact CG-CD1 4.16Å; A380-I395 WeakPolarHBondContact CA-O 3.28Å; T381-I395 PolarHBondContact N-O 3.33Å; T381-I395 PolarHBondContact O-N 3.36Å; A383-I395 HydrophobicContact CB-CD1 4.4Å; A383-I395 HydrophobicContact CB-CG1 3.85Å; I395-V397 HydrophobicContact CG2-CG2 4.22Å
396	W	94	Very high	88.9	Confident	1 Å²	1	68.6 Å²	68.6	0%	0.004	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	101.7	-173.5	-170.7	-78.9	0	0	0	107.8	T303 L309 I346 L353 T361 Y364 S378 A380 I394 N398	T303-W396 PolarHBondContact N-O 3.36Å; T303-W396 PolarHBondContact O-N 3.14Å; T303-W396 PolarHBondContact OG1-O 2.84Å; L309-W396 HydrophobicContact CD1-CZ3 4.43Å; L309-W396 HydrophobicContact CD2-CE3 4.03Å; L309-W396 HydrophobicContact CD2-CZ3 3.85Å; I346-W396 HydrophobicContact CG2-CH2 4.29Å; L353-W396 HydrophobicContact CD2-CE3 4.38Å; L353-W396 HydrophobicContact CD2-CZ3 4.07Å; T361-W396 HydrophobicContact CG2-CH2 3.81Å; T361-W396 HydrophobicContact CG2-CZ2 3.71Å; Y364-W396 PolarHBondContact OH-NE1 2.85Å; S378-W396 PolarHBondContact OG-NE1 3.31Å; S378-W396 VanDerWaalsContact OG-NE1 3.12Å; A380-W396 HydrophobicContact CB-CD2 3.97Å; A380-W396 HydrophobicContact CB-CE3 3.3Å; A380-W396 HydrophobicContact CB-CH2 4.45Å; A380-W396 HydrophobicContact CB-CZ3 3.59Å; I394-W396 HydrophobicContact CG2-CB 4.34Å; I394-W396 HydrophobicContact CG2-CE3 4.02Å; W396-N398 PolarHBondContact NE1-OD1 3.41Å; W396-N398 VanDerWaalsContact NE1-OD1 3.07Å; W396-N398 PolarHBondContact O-ND2 3.45Å
397	V	93.3	Very high	90	Very high	10 Å²	10	69.3 Å²	69.3	6%	0.061	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.1	-175.6	-177	0	0	0	0	108.3	V294 M300 V302 S378 S379 I395 Y399	V294-V397 HydrophobicContact CG1-CG1 4.43Å; M300-V397 HydrophobicContact CE-CG1 3.51Å; V302-V397 HydrophobicContact CG2-CG2 4.34Å; S378-V397 CarbonylContact C-O 3.58Å; S378-V397 WeakPolarHBondContact CA-O 3.38Å; S378-V397 WeakPolarHBondContact CB-O 3.19Å; S379-V397 PolarHBondContact N-O 2.72Å; S379-V397 PolarHBondContact O-N 3.3Å; I395-V397 HydrophobicContact CG2-CG2 4.22Å; V397-Y399 HydrophobicContact CB-CE2 4.45Å; V397-Y399 HydrophobicContact CG1-CE2 4.08Å
398	N	95.4	Very high	90.9	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.5	-176.4	-51.1	-79.6	0	0	0	110.1	M300 F301 T303 I376 S378 W396	M300-N398 VanDerWaalsContact CA-O 3.28Å; M300-N398 WeakPolarHBondContact CA-O 3.33Å; F301-N398 HydrophobicContact CD1-CB 3.94Å; F301-N398 HydrophobicContact CD2-CB 4.44Å; F301-N398 HydrophobicContact CE1-CB 3.59Å; F301-N398 HydrophobicContact CE2-CB 4.13Å; F301-N398 VanDerWaalsContact CE2-ND2 3.32Å; F301-N398 WeakPolarHBondContact CE2-ND2 3.49Å; F301-N398 HydrophobicContact CG-CB 4.35Å; F301-N398 HydrophobicContact CZ-CB 3.7Å; F301-N398 PolarHBondContact N-O 3.08Å; F301-N398 VanDerWaalsContact N-O 3.14Å; F301-N398 WeakPolarHBondContact O-CB 2.97Å; F301-N398 PolarHBondContact O-N 3.24Å; F301-N398 PolarHBondContact O-ND2 2.81Å; T303-N398 PolarHBondContact OG1-ND2 3.49Å; I376-N398 HydrophobicContact CG2-CB 4.03Å; S378-N398 PolarHBondContact OG-OD1 2.87Å; W396-N398 PolarHBondContact NE1-OD1 3.41Å; W396-N398 VanDerWaalsContact NE1-OD1 3.07Å; W396-N398 PolarHBondContact O-ND2 3.45Å
399	Y	94.3	Very high	91.8	Very high	85 Å²	85	65.5 Å²	65.5	33%	0.333	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.2	173.6	-56.9	-95.7	0	0	0	108.2	M300 I376 Q377 V397	M300-Y399 HydrophobicContact CE-CD1 3.9Å; M300-Y399 HydrophobicContact CE-CE1 3.36Å; M300-Y399 HydrophobicContact CG-CD1 3.78Å; M300-Y399 HydrophobicContact CG-CE1 4.23Å; M300-Y399 HydrophobicContact CG-CG 4.49Å; M300-Y399 HydrophobicContact SD-CD1 3.75Å; M300-Y399 HydrophobicContact SD-CE1 3.61Å; I376-Y399 WeakPolarHBondContact CA-O 3.43Å; Q377-Y399 PolarHBondContact N-O 3Å; Q377-Y399 VanDerWaalsContact N-O 3.08Å; Q377-Y399 WeakPolarHBondContact O-CB 3.39Å; Q377-Y399 WeakPolarHBondContact O-CD2 3.24Å; Q377-Y399 PolarHBondContact O-N 3.17Å; V397-Y399 HydrophobicContact CB-CE2 4.45Å; V397-Y399 HydrophobicContact CG1-CE2 4.08Å
400	L	95.3	Very high	92.7	Very high	23 Å²	23	65.3 Å²	65.3	12%	0.12	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.7	177.2	-122.8	80.4	0	0	0	110.6	H299 F301 Y321 I374	H299-L400 HydrophobicContact CB-CB 3.92Å; H299-L400 WeakPolarHBondContact O-CB 3.36Å; H299-L400 PolarHBondContact O-N 3.47Å; F301-L400 HydrophobicContact CD1-CD1 4.28Å; F301-L400 HydrophobicContact CE1-CD1 3.98Å; Y321-L400 HydrophobicContact CD1-CD2 4.02Å; Y321-L400 HydrophobicContact CD2-CD1 4.15Å; Y321-L400 HydrophobicContact CG-CD1 4.15Å; Y321-L400 HydrophobicContact CG-CD2 3.82Å; I374-L400 HydrophobicContact CD1-CD1 3.61Å; I374-L400 HydrophobicContact CD1-CD2 4.28Å; I374-L400 HydrophobicContact CD1-CG 3.93Å
401	L	96.3	Very high	93.6	Very high	83 Å²	83	62.1 Å²	62.1	44%	0.435	31%	0.31	S	S	.	.			trans	-115.7	-24.9	178.6	-51.6	175.8	0	0	0	112.8	Y363 W375 Q377	Y363-L401 HydrophobicContact CD1-CD1 3.47Å; Y363-L401 VanDerWaalsContact CD1-CD1 3.47Å; Y363-L401 HydrophobicContact CE1-CD1 4.01Å; Y363-L401 HydrophobicContact CG-CD1 3.8Å; W375-L401 HydrophobicContact CB-CB 3.8Å; W375-L401 HydrophobicContact CB-CD1 4.33Å; W375-L401 WeakPolarHBondContact O-CB 3.49Å; W375-L401 PolarHBondContact O-N 3.47Å; Q377-L401 HydrophobicContact CB-CD1 4.24Å
402	S	96.6	Very high	94.2	Very high	21 Å²	21	61.7 Å²	61.7	15%	0.147	31%	0.31	C	S	.	.			trans	-140.2	165.6	179.3	80.7	0	0	0	0	113	W375	W375-S402 PolarHBondContact N-OG 2.9Å
403	N	95.4	Very high	94.5	Very high	128 Å²	128	62.1 Å²	62.1	68%	0.684	32%	0.316	S	S	*	.	S	Bend	trans	-79	172	157.5	-65.9	-27.1	0	0	0	109.9	E405	N403-E405 PolarHBondContact O-N 3.37Å
404	P	96.3	Very high	94.4	Very high	68 Å²	68	65.3 Å²	65.3	44%	0.442	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-55.4	120.5	176.5	-30.4	37.7	0	0	0	114.6	Y373 I374	Y373-P404 WeakPolarHBondContact O-CA 3.46Å; I374-P404 HydrophobicContact CG2-CB 4.21Å; I374-P404 HydrophobicContact CG2-CG 3.77Å
405	E	97.3	Very high	94.5	Very high	66 Å²	66	65.8 Å²	65.8	31%	0.308	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-100.9	145.9	173.5	-66.8	-180	-169.9	0	0	110	G372 Y373 W375 N403 K407	G372-E405 VanDerWaalsContact CA-O 3.25Å; G372-E405 WeakPolarHBondContact CA-O 3.21Å; Y373-E405 HydrophobicContact CD2-CB 4.28Å; Y373-E405 HydrophobicContact CE2-CB 3.68Å; Y373-E405 HydrophobicContact CE2-CG 4.2Å; Y373-E405 WeakPolarHBondContact CE2-OE2 3.28Å; Y373-E405 VanDerWaalsContact CZ-OE2 3.29Å; Y373-E405 PolarHBondContact N-O 3.24Å; Y373-E405 VanDerWaalsContact N-O 3.08Å; Y373-E405 PolarHBondContact O-N 3.27Å; Y373-E405 PolarHBondContact OH-OE2 2.87Å; W375-E405 PolarHBondContact NE1-OE1 2.93Å; W375-E405 PolarHBondContact NE1-OE2 2.95Å; N403-E405 PolarHBondContact O-N 3.37Å; E405-K407 PolarHBondContact O-N 3.01Å
406	Y	96.6	Very high	94.4	Very high	154 Å²	154	68.9 Å²	68.9	60%	0.604	36%	0.362	S	S	*	.	S	Bend	trans	52.7	28.1	176.4	-55.6	-80	0	0	0	115.8	G372 Y373 D408 T409	G372-Y406 WeakPolarHBondContact CA-O 3.47Å; G372-Y406 PolarHBondContact N-O 3.22Å; Y373-Y406 AromaticContact CE1-CD2 3.9Å; Y373-Y406 HydrophobicContact CE1-CD2 3.9Å; Y373-Y406 AromaticContact CZ-CD2 3.86Å; Y373-Y406 WeakPolarHBondContact OH-CD2 3.26Å; Y373-Y406 WeakPolarHBondContact OH-CE2 3.45Å; Y406-D408 PolarHBondContact O-N 3.28Å; Y406-T409 PolarHBondContact O-N 3.12Å
407	K	94.2	Very high	93.6	Very high	119 Å²	119	74 Å²	74	52%	0.517	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-26.4	-176	58.3	161.2	-174.3	92	0	116.6	G371 E405 T409	G371-K407 CarbonylContact C-O 3.49Å; G371-K407 WeakPolarHBondContact CA-O 3.37Å; G371-K407 WeakPolarHBondContact O-CA 3.23Å; E405-K407 PolarHBondContact O-N 3.01Å; K407-T409 VanDerWaalsContact C-N 3.35Å
408	D	93.8	Very high	91.9	Very high	126 Å²	126	82.6 Å²	82.6	67%	0.674	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	4.3	-176.1	-52.4	-63	0	0	0	112.6	Y406	Y406-D408 PolarHBondContact O-N 3.28Å
409	T	93.6	Very high	90.2	Very high	69 Å²	69	87 Å²	87	42%	0.423	46%	0.458	S	S	.	.	S	Bend	trans	-121.5	112.4	-178.9	-55.9	0	0	0	0	110.7	G372 Y406 K407 M411	G372-T409 PolarHBondContact N-O 3.37Å; Y406-T409 PolarHBondContact O-N 3.12Å; K407-T409 VanDerWaalsContact C-N 3.35Å; T409-M411 HydrophobicContact CG2-CE 3.68Å; T409-M411 HydrophobicContact CG2-SD 4.1Å
410	P	94.7	Very high	88.1	Confident	64 Å²	64	88 Å²	88	42%	0.416	47%	0.474	S	S	.	.			trans	-72.6	134.9	172.9	29.8	-33.2	0	0	0	111	Q415 L416	P410-Q415 HydrophobicContact CB-CB 3.94Å; P410-L416 HydrophobicContact CB-CD2 3.84Å; P410-L416 HydrophobicContact CG-CD2 3.73Å
411	M	94.8	Very high	85.7	Confident	81 Å²	81	96 Å²	96	40%	0.399	51%	0.512	S	S	.	.			trans	-111.3	-26.3	-178.3	-54	-62.7	178.6	0	0	112.3	M367 T409	M367-M411 HydrophobicContact SD-CB 4.3Å; T409-M411 HydrophobicContact CG2-CE 3.68Å; T409-M411 HydrophobicContact CG2-SD 4.1Å
412	D	94.8	Very high	83.2	Confident	60 Å²	60	101 Å²	101	32%	0.321	53%	0.529	S	S	.	.	S	Bend	trans	-130	157.5	179.1	-179.7	-104.9	0	0	0	111.8	M367 A414 Q415	M367-D412 HydrophobicContact CE-CB 3.73Å; M367-D412 HydrophobicContact SD-CB 3.87Å; D412-A414 PolarHBondContact O-N 2.88Å; D412-A414 WeakPolarHBondContact OD1-CB 3.5Å; D412-A414 PolarHBondContact OD1-N 3.34Å; D412-Q415 WeakPolarHBondContact O-CB 3.35Å; D412-Q415 PolarHBondContact O-N 3.08Å
413	I	92.6	Very high	80.4	Confident	118 Å²	118	105.6 Å²	105.6	61%	0.605	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-58	-31.3	178.5	-164.7	170.3	0	0	0	113.2	Q415 L416 L419	I413-Q415 PolarHBondContact O-N 3.26Å; I413-L416 PolarHBondContact O-N 3Å; I413-L419 HydrophobicContact CD1-CD1 3.9Å; I413-L419 HydrophobicContact CG1-CD1 3.33Å
414	A	89	Confident	77.8	Confident	76 Å²	76	105.5 Å²	105.5	63%	0.628	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-68.3	-11.1	177	0	0	0	0	0	114.1	D412	D412-A414 PolarHBondContact O-N 2.88Å; D412-A414 WeakPolarHBondContact OD1-CB 3.5Å; D412-A414 PolarHBondContact OD1-N 3.34Å
415	Q	93.1	Very high	75.1	Confident	11 Å²	11	110.4 Å²	110.4	5%	0.051	58%	0.583	C	S	.	*	G	3₁₀ helix	trans	-94.4	-2.9	176.8	-58.4	-175.6	-42.5	0	0	113.3	Q368 K369 G372 P410 D412 I413	Q368-Q415 WeakPolarHBondContact O-CG 3.3Å; Q368-Q415 PolarHBondContact O-NE2 3Å; K369-Q415 WeakPolarHBondContact O-CA 3.42Å; G372-Q415 PolarHBondContact O-NE2 2.85Å; P410-Q415 HydrophobicContact CB-CB 3.94Å; D412-Q415 WeakPolarHBondContact O-CB 3.35Å; D412-Q415 PolarHBondContact O-N 3.08Å; I413-Q415 PolarHBondContact O-N 3.26Å
416	L	90.4	Very high	72.6	Confident	84 Å²	84	112.1 Å²	112.1	44%	0.44	60%	0.603	S	S	.	*	S	Bend	trans	-92.6	122.8	-179.2	-65.7	177	0	0	0	111.5	P410 I413 L419	P410-L416 HydrophobicContact CB-CD2 3.84Å; P410-L416 HydrophobicContact CG-CD2 3.73Å; I413-L416 PolarHBondContact O-N 3Å; L416-L419 HydrophobicContact CB-CD1 4Å; L416-L419 HydrophobicContact CD1-CD1 4.15Å
417	P	77.3	Confident	69.7	Low	107 Å²	107	110.4 Å²	110.4	70%	0.695	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	143.9	176.1	28.9	-34.4	0	0	0	111.7	L419	P417-L419 PolarHBondContact O-N 2.69Å
418	H	58.3	Low	67	Low	191 Å²	191	112.9 Å²	112.9	88%	0.884	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.7	30	170.9	-53.9	-58.9	0	0	0	117.3
419	L	58.5	Low	64.4	Low	93 Å²	93	113 Å²	113	49%	0.487	63%	0.632	S	S	.	*			trans	-71.2	133.2	153.1	-73.9	169.1	0	0	0	109.3	I413 L416 P417	I413-L419 HydrophobicContact CD1-CD1 3.9Å; I413-L419 HydrophobicContact CG1-CD1 3.33Å; L416-L419 HydrophobicContact CB-CD1 4Å; L416-L419 HydrophobicContact CD1-CD1 4.15Å; P417-L419 PolarHBondContact O-N 2.69Å
420	P	51.5	Low	61.5	Low	105 Å²	105	115 Å²	115	68%	0.682	65%	0.649	S	S	*	*			trans	-67.8	137.6	175.2	28.3	-33.5	0	0	0	109.8	K422	P420-K422 VanDerWaalsContact C-N 3.35Å; P420-K422 PolarHBondContact O-N 2.76Å
421	E	45.7	Very low	58.9	Low	193 Å²	193	119.3 Å²	119.3	90%	0.902	67%	0.668	S	S	*	*			trans	-62.1	97.4	168	-70.5	-173.7	131.4	0	0	108.8	T423	E421-T423 PolarHBondContact O-N 2.61Å; E421-T423 VanDerWaalsContact O-N 3.14Å
422	K	43.6	Very low	56	Low	186 Å²	186	120.2 Å²	120.2	81%	0.809	68%	0.683	S	S	*	*			trans	-65.4	112.5	160.9	-79	-170.2	172.5	-174.1	0	106.7	P420 S424	P420-K422 VanDerWaalsContact C-N 3.35Å; P420-K422 PolarHBondContact O-N 2.76Å; K422-S424 PolarHBondContact O-N 3.05Å
423	T	37.2	Very low	53.3	Low	119 Å²	119	127.1 Å²	127.1	73%	0.73	71%	0.713	S	S	*	*			trans	-52.3	108.7	171.1	42.4	0	0	0	0	109.2	E421 E425	E421-T423 PolarHBondContact O-N 2.61Å; E421-T423 VanDerWaalsContact O-N 3.14Å; T423-E425 PolarHBondContact O-N 3.35Å
424	S	40	Very low	50.5	Low	126 Å²	126	127 Å²	127	88%	0.881	72%	0.723	S	S	*	*			trans	-73.9	64.5	176.4	-59.8	0	0	0	0	110.6	K422	K422-S424 PolarHBondContact O-N 3.05Å
425	E	41.2	Very low	47.8	Very low	170 Å²	170	130.8 Å²	130.8	79%	0.794	73%	0.732	S	S	*	*			trans	-65.2	145	165.6	-65.3	-168.2	151	0	0	109.5	T423 S427	T423-E425 PolarHBondContact O-N 3.35Å; E425-S427 PolarHBondContact O-N 3.13Å
426	S	44.5	Very low	44.9	Very low	103 Å²	103	134.4 Å²	134.4	72%	0.72	76%	0.759	S	S	*	*			trans	-67.6	111.6	-168.5	46.6	0	0	0	0	112.4	E428	S426-E428 PolarHBondContact O-N 3.32Å
427	S	36	Very low	42.3	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	78%	0.781	S	S	*	*			trans	-74.7	80.8	159.2	62.1	0	0	0	0	109.5	E425	E425-S427 PolarHBondContact O-N 3.13Å
428	E	37.3	Very low	40.2	Very low	172 Å²	172	142.1 Å²	142.1	80%	0.804	79%	0.785	S	S	*	*			trans	-61.8	142.2	161.9	-65	-167.2	134.3	0	0	109.4	S426 S430	S426-E428 PolarHBondContact O-N 3.32Å; E428-S430 PolarHBondContact O-N 2.97Å; E428-S430 VanDerWaalsContact O-N 3.09Å
429	T	37.5	Very low	38.8	Very low	128 Å²	128	140 Å²	140	79%	0.785	79%	0.786	S	S	*	*			trans	-79.4	92.8	-176.7	49	0	0	0	0	110.6	D431	T429-D431 PolarHBondContact O-N 3.41Å
430	S	33.4	Very low	37.8	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	80%	0.802	S	S	*	*			trans	-82.6	98.9	162	-70.9	0	0	0	0	109.5	E428 S432	E428-S430 PolarHBondContact O-N 2.97Å; E428-S430 VanDerWaalsContact O-N 3.09Å; S430-S432 PolarHBondContact O-N 3.12Å
431	D	39.1	Very low	36.8	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	80%	0.803	S	S	*	*			trans	-61.5	132.5	165.5	-68.9	-51.6	0	0	0	109.7	T429	T429-D431 PolarHBondContact O-N 3.41Å
432	S	35.4	Very low	36.3	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	80%	0.799	S	S	*	*			trans	-153.6	88.7	175.7	-74.8	0	0	0	0	109.7	S430 S434	S430-S432 PolarHBondContact O-N 3.12Å; S432-S434 PolarHBondContact O-N 3.03Å
433	E	37.5	Very low	35.7	Very low	205 Å²	205	133.9 Å²	133.9	96%	0.958	79%	0.791	S	S	*	*			trans	-56.6	129.5	170.9	-60.6	-172.5	126.8	0	0	109.8
434	S	33.6	Very low	35.6	Very low	116 Å²	116	136.2 Å²	136.2	81%	0.811	79%	0.793	S	S	*	*			trans	-140.3	105.1	171.7	36.9	0	0	0	0	108.6	S432	S432-S434 PolarHBondContact O-N 3.03Å
435	D	31.6	Very low	35.1	Very low	155 Å²	155	136.9 Å²	136.9	83%	0.829	79%	0.787	S	S	*	*			trans	-77.2	156.7	-171.9	-152.1	-25.6	0	0	0	111.9
436	S	34.2	Very low	34.7	Very low	87 Å²	87	134.6 Å²	134.6	61%	0.608	78%	0.78	S	S	*	*			trans	-46.9	146.3	-176.8	54.3	0	0	0	0	116.9
437	K	35	Very low	34.1	Very low	208 Å²	208	137 Å²	137	90%	0.904	78%	0.78	S	S	*	*				-160	130.1	126.3	-116.9	160	-171.5	159.8	0	115
438	D	32.5	Very low	33.8	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	77%	0.773	S	S	*	*			trans	-69.9	152.2	170.8	-50.4	-95.8	0	0	0	112.8
439	T	30.2	Very low	33.6	Very low	148 Å²	148	134.8 Å²	134.8	91%	0.908	77%	0.774	S	S	*	*			trans	-151.7	129.2	131.9	-60.5	0	0	0	0	108.6
440	S	36	Very low	33.2	Very low	118 Å²	118	137.6 Å²	137.6	83%	0.825	78%	0.775	S	S	*	*			trans	-110.1	142.3	175.9	54	0	0	0	0	110.7
441	G	31	Very low	33.2	Very low	69 Å²	69	137.2 Å²	137.2	71%	0.711	77%	0.772	S	S	*	*			trans	170.5	106.6	173.4	0	0	0	0	0	118.3
442	I	34.9	Very low	32.8	Very low	159 Å²	159	136.3 Å²	136.3	82%	0.815	77%	0.768	S	S	*	*				67.6	97.6	127.4	-61.7	175	0	0	0	118.9
443	T	32	Very low	32.6	Very low	102 Å²	102	138.7 Å²	138.7	63%	0.626	77%	0.767	S	S	*	*			trans	46	147.4	133	61.6	0	0	0	0	124
444	E	34.2	Very low	32.4	Very low	167 Å²	167	137.5 Å²	137.5	78%	0.78	76%	0.759	S	S	*	*			trans	72.8	142.8	152	-76.1	157.9	-144.8	0	0	116.8
445	D	30.1	Very low	32.1	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	76%	0.758	S	S	*	*			cis	-158.3	157.3	-8	-141.7	-4.3	0	0	0	114.3
446	N	32.5	Very low	32.1	Very low	122 Å²	122	135 Å²	135	65%	0.652	75%	0.754	S	S	*	*			trans	51.6	155.9	142.4	-149.4	18.2	0	0	0	125.2
447	E	33.2	Very low	32	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	76%	0.763	S	S	*	*			trans	61.6	127.8	165.5	-44.3	-152.3	173.7	0	0	120.2
448	N	27.7	Very low	31.9	Very low	126 Å²	126	134.1 Å²	134.1	67%	0.674	76%	0.756	S	S	*	*			cis	91.3	96.4	33	179.9	53	0	0	0	116.1
449	S	34.2	Very low	31.8	Very low	117 Å²	117	135 Å²	135	82%	0.818	76%	0.756	S	S	*	*			trans	179.3	128	150	-78.9	0	0	0	0	107.6
450	K	28.8	Very low	31.7	Very low	186 Å²	186	134.4 Å²	134.4	81%	0.809	75%	0.747	S	S	*	*			cis	88.8	78.5	17.2	-155	-165.2	178.2	-172.3	0	117
451	S	33.6	Very low	31.4	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	74%	0.738	S	S	*	*			trans	-159.5	131.7	148.7	51.9	0	0	0	0	106.2
452	D	31.1	Very low	31.4	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	75%	0.745	S	S	*	*				61.9	134.4	68.8	-61.6	-59.4	0	0	0	111.9
453	E	31.9	Very low	31.4	Very low	149 Å²	149	137.7 Å²	137.7	70%	0.696	74%	0.742	S	S	*	*			cis	-149.6	-179.8	19.9	-140.3	-176.2	130.9	0	0	115.1
454	K	31.4	Very low	32.1	Very low	180 Å²	180	138.3 Å²	138.3	78%	0.783	75%	0.748	S	S	*	*			trans	-52.8	164.2	-174.2	-49	136.1	-167.5	160.1	0	116.9
455	G	29.1	Very low	32.1	Very low	76 Å²	76	137.4 Å²	137.4	78%	0.784	74%	0.743	S	S	*	*			trans	-175	99.5	154.8	0	0	0	0	0	116.2
456	N	31.3	Very low	33.1	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	74%	0.743	S	S	*	*			trans	-23.8	132.8	168.9	-73.9	13	0	0	0	117.5
457	Q	30.5	Very low	33.1	Very low	169 Å²	169	134.4 Å²	134.4	79%	0.79	73%	0.733	S	S	*	*				77.5	148	67.7	-80.7	-168.7	-25.1	0	0	115.8
458	S	33.5	Very low	33.1	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	74%	0.74	S	S	*	*			trans	71.8	142.2	167.8	75.1	0	0	0	0	116.8
459	E	30.9	Very low	33.3	Very low	164 Å²	164	139.8 Å²	139.8	77%	0.766	74%	0.742	S	S	*	*			cis	-163.5	174	-18.4	-122.6	168.2	-148.1	0	0	109.2
460	N	28	Very low	33.2	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	74%	0.743	S	S	*	*			trans	27	145.4	142.2	-62.3	-24	0	0	0	120.8
461	S	30.5	Very low	33.2	Very low	90 Å²	90	139.5 Å²	139.5	63%	0.629	74%	0.74	S	S	*	*			cis	-174.4	170.6	15	37.3	0	0	0	0	111.9
462	E	29.8	Very low	32.9	Very low	185 Å²	185	138.3 Å²	138.3	86%	0.864	74%	0.744	S	S	*	*			trans	76.1	125.9	144.3	-77.8	157.5	164	0	0	122.6
463	D	34.1	Very low	32.9	Very low	139 Å²	139	139.6 Å²	139.6	74%	0.743	75%	0.751	S	S	*	*			trans	-71.3	158.3	163.4	-174.4	38.8	0	0	0	110.8	E465	D463-E465 PolarHBondContact OD1-N 3.08Å
464	P	48.5	Very low	32.9	Very low	116 Å²	116	136.5 Å²	136.5	75%	0.753	75%	0.751	S	S	*	*				-148.4	146.6	95.3	37.2	-19.9	0	0	0	117.1
465	E	34.3	Very low	32.9	Very low	147 Å²	147	133.1 Å²	133.1	69%	0.687	75%	0.748	S	S	*	*			trans	-62.9	162.5	159.3	-144	-155.4	-122.2	0	0	112.6	D463 D467	D463-E465 PolarHBondContact OD1-N 3.08Å; E465-D467 PolarHBondContact OE2-N 2.84Å
466	P	49.4	Very low	33	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	75%	0.745	S	S	*	*				-154.6	141.6	94.2	37.2	-17.6	0	0	0	119.6
467	D	33.9	Very low	32.9	Very low	84 Å²	84	135 Å²	135	45%	0.449	74%	0.741	S	S	.	*			trans	27	121	137.4	-179.4	42.9	0	0	0	120.7	E465 K469	E465-D467 PolarHBondContact OE2-N 2.84Å; D467-K469 IonicContact OD1-NZ 3.3Å; D467-K469 IonicContact OD2-NZ 3.95Å
468	R	32.1	Very low	32.9	Very low	225 Å²	225	134.3 Å²	134.3	85%	0.849	74%	0.742	S	S	*	*				-175.6	131.9	118.3	-97.2	152	-164.4	-153.9	5	118.5
469	K	32.9	Very low	33.1	Very low	167 Å²	167	135.9 Å²	135.9	73%	0.726	74%	0.739	S	S	*	*			trans	-16.3	154.8	151.8	-60.4	132.5	-173.9	146.4	0	116.8	D467	D467-K469 IonicContact OD1-NZ 3.3Å; D467-K469 IonicContact OD2-NZ 3.95Å
470	K	30.9	Very low	33.1	Very low	190 Å²	190	134.8 Å²	134.8	83%	0.826	74%	0.739	S	S	*	*				179.8	146.2	54.4	-156.8	-166.8	-179.3	-174.8	0	114.5
471	S	28.9	Very low	33.2	Very low	108 Å²	108	132.8 Å²	132.8	76%	0.755	73%	0.734	S	S	*	*			trans	48.5	142.4	145.8	61.3	0	0	0	0	124.4
472	G	27.7	Very low	33.3	Very low	76 Å²	76	135 Å²	135	78%	0.784	74%	0.739	S	S	*	*			trans	171.1	119.6	149.9	0	0	0	0	0	115.8
473	N	32.1	Very low	33.6	Very low	165 Å²	165	132 Å²	132	88%	0.882	73%	0.729	S	S	*	*			trans	-96.5	144.4	-178.7	-80.1	9.2	0	0	0	113.8
474	A	32.2	Very low	33.5	Very low	84 Å²	84	132.5 Å²	132.5	69%	0.694	73%	0.731	S	S	*	*			trans	61.4	131.8	131.9	0	0	0	0	0	124.2
475	C	30	Very low	32.7	Very low	109 Å²	109	129.8 Å²	129.8	74%	0.736	72%	0.724	S	S	*	*				82.5	136	125.2	76.1	0	0	0	0	124.7
476	D	31.3	Very low	32.6	Very low	133 Å²	133	131.3 Å²	131.3	71%	0.711	73%	0.731	S	S	*	*			trans	96.3	122.7	139.2	-79	21.5	0	0	0	123.9
477	N	29.2	Very low	31.6	Very low	125 Å²	125	130.9 Å²	130.9	67%	0.668	73%	0.731	S	S	*	*			trans	59.5	120.7	140.3	-55.8	-36.5	0	0	0	122.6
478	D	31.5	Very low	31.5	Very low	153 Å²	153	132 Å²	132	82%	0.818	75%	0.746	S	S	*	*				-178.1	162.8	114	-104.3	2.4	0	0	0	110.9
479	M	36.4	Very low	31.3	Very low	142 Å²	142	126.5 Å²	126.5	70%	0.7	74%	0.741	S	S	*	*			cis	-169.7	138.7	-45.3	-116.8	-61.8	-176.5	0	0	109.7
480	N	31.8	Very low	31.4	Very low	142 Å²	142	125.8 Å²	125.8	76%	0.759	75%	0.745	S	S	*	*			trans	58.6	167.3	166.1	-83.4	2.7	0	0	0	119.1
481	C	30.8	Very low	31.9	Very low	93 Å²	93	122.6 Å²	122.6	63%	0.628	74%	0.744	S	S	*	*			cis	-177.7	140.7	-43.5	-105.4	0	0	0	0	109.7
482	N	32.5	Very low	31.8	Very low	135 Å²	135	124.5 Å²	124.5	72%	0.722	75%	0.746	S	S	*	*			trans	58.4	153.8	139.3	-71.3	64.6	0	0	0	120.8
483	D	34.6	Very low	32.2	Very low	123 Å²	123	125.8 Å²	125.8	66%	0.658	74%	0.743	S	S	*	*			cis	-161.9	-174.8	-16.7	-145.7	-31	0	0	0	108.4
484	D	32.9	Very low	32.2	Very low	149 Å²	149	127.8 Å²	127.8	80%	0.797	74%	0.738	S	S	*	*			trans	67.2	146.8	164.3	-60.2	-52	0	0	0	118.2
485	G	31.3	Very low	32.1	Very low	59 Å²	59	129.8 Å²	129.8	61%	0.608	74%	0.737	S	S	*	*			cis	171.6	132.9	-9.4	0	0	0	0	0	114.7
486	H	31.2	Very low	32.1	Very low	180 Å²	180	129.2 Å²	129.2	83%	0.833	74%	0.735	S	S	*	*			trans	73.7	132.5	154.9	-62.7	-69.9	0	0	0	124.1
487	S	30.1	Very low	32	Very low	107 Å²	107	130 Å²	130	75%	0.748	74%	0.739	S	S	*	*			trans	81.3	113	135	-69.1	0	0	0	0	122.9
488	S	30.4	Very low	31.9	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	74%	0.741	S	S	*	*				140.4	137.7	96.3	58.6	0	0	0	0	118
489	S	29.3	Very low	31.8	Very low	108 Å²	108	127.5 Å²	127.5	76%	0.755	73%	0.733	S	S	*	*			trans	52.5	130.1	146.4	54.4	0	0	0	0	123.6
490	N	35.2	Very low	31.3	Very low	152 Å²	152	128.8 Å²	128.8	81%	0.813	73%	0.734	S	S	*	*			trans	-58.1	162.7	153.7	-60.9	2.7	0	0	0	112.2
491	P	40.8	Very low	31.1	Very low	123 Å²	123	129.4 Å²	129.4	80%	0.799	73%	0.733	S	S	*	*				-127.7	159.6	127.8	37.2	-30.4	0	0	0	113.7
492	D	27.1	Very low	31	Very low	148 Å²	148	133 Å²	133	79%	0.791	74%	0.74	S	S	*	*			trans	-77.8	-173.4	179	-60.6	-80.4	0	0	0	114.6
493	S	35.3	Very low	30.7	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	75%	0.746	S	S	*	*			trans	90.7	140.5	158.5	79.7	0	0	0	0	117.2
494	R	33.1	Very low	30.4	Very low	207 Å²	207	132.9 Å²	132.9	78%	0.781	75%	0.749	S	S	*	*			cis	-168.1	157.4	0.8	-123.9	175.6	168.7	142.4	-0	113.1
495	D	28.9	Very low	30.1	Very low	126 Å²	126	133.9 Å²	133.9	67%	0.674	75%	0.746	S	S	*	*			trans	57.3	158.3	148.9	-49.7	-27.3	0	0	0	118.8
496	S	30.9	Very low	29.9	Very low	98 Å²	98	139.3 Å²	139.3	69%	0.685	76%	0.756	S	S	*	*			cis	-147.2	153.9	16.6	-41.3	0	0	0	0	114.1
497	D	28	Very low	29.8	Very low	150 Å²	150	137 Å²	137	80%	0.802	75%	0.75	S	S	*	*				41.2	147	124.6	-53.5	-9.8	0	0	0	122.2
498	D	28.1	Very low	30.3	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	75%	0.749	S	S	*	*			cis	-175.3	-176	-14.2	-176.3	24	0	0	0	108.4
499	S	28.9	Very low	30.4	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	75%	0.75	S	S	*	*			trans	96.1	102.3	152.3	-63.9	0	0	0	0	122.6
500	F	27.1	Very low	30.5	Very low	169 Å²	169	140.1 Å²	140.1	74%	0.741	75%	0.752	S	S	*	*				47.7	115.5	124.5	-68.4	-76.4	0	0	0	124.6
501	E	27	Very low	30.2	Very low	155 Å²	155	136.3 Å²	136.3	72%	0.724	75%	0.749	S	S	*	*				51.6	131.1	120.5	-70	-171.1	-179.6	0	0	125.2
502	H	28	Very low	29.6	Very low	168 Å²	168	139.8 Å²	139.8	78%	0.778	76%	0.755	S	S	*	*			trans	56.4	110	138.8	-74.5	-64.8	0	0	0	122.7
503	S	27.5	Very low	29.6	Very low	121 Å²	121	140.1 Å²	140.1	85%	0.846	76%	0.756	S	S	*	*				176.9	168.5	129.8	34.6	0	0	0	0	111.1
504	D	26.4	Very low	29.4	Very low	135 Å²	135	138.4 Å²	138.4	72%	0.722	76%	0.755	S	S	*	*				-166.4	156.6	-51.6	-147.8	-14.6	0	0	0	107.9
505	F	27	Very low	29.1	Very low	170 Å²	170	138.5 Å²	138.5	75%	0.746	76%	0.761	S	S	*	*			trans	61.8	158	172.2	-79.2	-111.1	0	0	0	117.1
506	E	26.8	Very low	29	Very low	172 Å²	172	135.7 Å²	135.7	80%	0.804	76%	0.762	S	S	*	*			cis	-148.8	161.9	-13.2	-152.4	169.8	-163.1	0	0	109.8
507	N	30.6	Very low	28.8	Very low	133 Å²	133	136.2 Å²	136.2	71%	0.711	77%	0.772	S	S	*	*			trans	-149.3	130.4	177.3	176.9	18.1	0	0	0	113.1	K509	N507-K509 PolarHBondContact OD1-N 3.24Å
508	P	39.6	Very low	28.9	Very low	111 Å²	111	137.9 Å²	137.9	72%	0.721	78%	0.78	S	S	*	*			trans	-115.8	113.9	152.4	16.4	4.5	0	0	0	111.2
509	K	32.2	Very low	28.6	Very low	179 Å²	179	135.4 Å²	135.4	78%	0.778	79%	0.786	S	S	*	*				72.5	142.9	80.2	-77.9	-174.5	176.2	-173.3	0	114.5	N507	N507-K509 PolarHBondContact OD1-N 3.24Å
510	A	32.9	Very low	28.4	Very low	98 Å²	98	135.8 Å²	135.8	81%	0.81	80%	0.795	S	S	*	*			cis	-158.6	165.4	-0.9	0	0	0	0	0	110.1
511	G	27.6	Very low	28.2	Very low	72 Å²	72	137.1 Å²	137.1	74%	0.742	81%	0.806	S	S	*	*			cis	149.6	169	-7.8	0	0	0	0	0	113.6
512	E	28.2	Very low	28	Very low	196 Å²	196	137.8 Å²	137.8	92%	0.916	81%	0.809	S	S	*	*			trans	-133	137.9	164.5	-71.3	-170.4	122.1	0	0	109
513	D	27.1	Very low	27.8	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	81%	0.805	S	S	*	*			trans	-136.7	140.7	162.2	-83.5	-58.9	0	0	0	104.2
514	G	30.8	Very low	27.5	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	80%	0.802	S	S	*	*			cis	128	153	24.4	0	0	0	0	0	107.3
515	F	27.9	Very low	27.5	Very low	209 Å²	209	138 Å²	138	92%	0.917	80%	0.8	S	S	*	*			cis	-153.4	161.2	-8.1	-132.8	-92.5	0	0	0	106.4
516	G	27.1	Very low	27.3	Very low	67 Å²	67	137.5 Å²	137.5	69%	0.691	80%	0.8	S	S	*	*			trans	-97.5	156.6	175.4	0	0	0	0	0	113.2
517	A	26.8	Very low	27.3	Very low	108 Å²	108	136.4 Å²	136.4	89%	0.893	79%	0.789	S	S	*	*			trans	-167.2	141.8	148.2	0	0	0	0	0	114.3
518	L	28.7	Very low	27.1	Very low	186 Å²	186	135 Å²	135	97%	0.974	77%	0.774	S	S	*	*			trans	-55.7	143.5	175.1	-58.6	154.4	0	0	0	114.3
519	G	22.7	Very low	26.5	Very low	81 Å²	81	136.2 Å²	136.2	84%	0.835	78%	0.779	S	S	*	*			trans	-171.7	123.5	168.5	0	0	0	0	0	112.9
520	A	24.7	Very low	26.3	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	77%	0.774	S	S	*	*			trans	-79.1	154.8	-173.4	0	0	0	0	0	114.1
521	M	22.9	Very low	25.9	Very low	196 Å²	196	135.8 Å²	135.8	97%	0.966	78%	0.777	S	S	*	*			trans	-159	178.8	141.5	-114.1	175.5	-162.5	0	0	113.2
522	Q	22.4	Very low	25.9	Very low	169 Å²	169	141.4 Å²	141.4	79%	0.79	78%	0.784	S	S	*	*			trans	-146.1	164.3	-150.1	-138.7	-175.3	16.4	0	0	112.3
523	I	23.6	Very low	25.8	Very low	137 Å²	137	136.8 Å²	136.8	70%	0.703	77%	0.773	S	S	*	*			trans	74.8	113.7	157.3	-59.6	155.3	0	0	0	118.6
524	K	22.4	Very low	25.8	Very low	180 Å²	180	135.9 Å²	135.9	78%	0.783	77%	0.768	S	S	*	*				151.5	105.2	114.5	-146.6	171.3	-176.4	-174.8	0	110.3
525	V	26	Very low	25.6	Very low	113 Å²	113	138.5 Å²	138.5	69%	0.685	77%	0.766	S	S	*	*				75.3	108.7	57.4	180	0	0	0	0	114.6
526	E	23.1	Very low	25.4	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	76%	0.76	S	S	*	*			trans	-170.7	-178.6	133.5	-109.6	172.3	-148	0	0	113.2	S712	E526-S712 WeakPolarHBondContact O-CB 3.39Å; E526-S712 PolarHBondContact O-OG 3.44Å
527	R	25.4	Very low	25.3	Very low	149 Å²	149	141.6 Å²	141.6	56%	0.562	76%	0.76	S	S	*	*				-122	170.5	-120.6	-86.7	-151.6	168	176.9	-3.5	120	P709 V710 A711	R527-P709 PolarHBondContact NH2-O 2.9Å; R527-V710 VanDerWaalsContact CZ-O 3.27Å; R527-V710 PolarHBondContact NE-O 3.03Å; R527-V710 PolarHBondContact NH2-O 2.84Å; R527-A711 CarbonylContact C-O 3.57Å; R527-A711 VanDerWaalsContact CA-O 3.26Å; R527-A711 WeakPolarHBondContact CA-O 3.35Å; R527-A711 WeakPolarHBondContact CB-O 3.33Å; R527-A711 VanDerWaalsContact CG-O 3.3Å; R527-A711 WeakPolarHBondContact CG-O 3.45Å
528	Y	28	Very low	25.2	Very low	104 Å²	104	144.6 Å²	144.6	41%	0.408	76%	0.755	S	S	.	*			trans	-66	160.4	-177	-117.6	-165	0	0	0	115.4	E530 A711 S712 D713	Y528-E530 HydrophobicContact CD1-CG 3.51Å; Y528-E530 HydrophobicContact CE1-CG 3.58Å; Y528-E530 HydrophobicContact CG-CG 4.43Å; Y528-A711 WeakPolarHBondContact CB-O 3.41Å; Y528-A711 HydrophobicContact CD1-CB 3.31Å; Y528-A711 HydrophobicContact CD2-CB 4.22Å; Y528-A711 HydrophobicContact CE1-CB 3.6Å; Y528-A711 HydrophobicContact CE2-CB 4.41Å; Y528-A711 HydrophobicContact CG-CB 3.62Å; Y528-A711 PolarHBondContact N-O 3.39Å; Y528-S712 VanDerWaalsContact CD2-CA 3.49Å; Y528-S712 WeakPolarHBondContact CE2-O 3.48Å; Y528-D713 HydrophobicContact CD2-CB 3.84Å; Y528-D713 HydrophobicContact CE2-CB 3.93Å
529	V	25.9	Very low	24.9	Very low	137 Å²	137	142.2 Å²	142.2	83%	0.83	74%	0.743	S	S	*	*			trans	-139	135.3	132.9	-180	0	0	0	0	109.7
530	E	27.5	Very low	25	Very low	143 Å²	143	142 Å²	142	67%	0.668	73%	0.728	S	S	*	*			trans	-94.5	171	177.1	-61.3	162.6	116.1	0	0	112.2	Y528	Y528-E530 HydrophobicContact CD1-CG 3.51Å; Y528-E530 HydrophobicContact CE1-CG 3.58Å; Y528-E530 HydrophobicContact CG-CG 4.43Å
531	S	26.1	Very low	24.9	Very low	124 Å²	124	145.4 Å²	145.4	87%	0.867	73%	0.727	S	S	*	*			trans	-155.3	150.1	145.8	-80.5	0	0	0	0	112.1
532	E	26.1	Very low	25	Very low	190 Å²	190	141.2 Å²	141.2	89%	0.888	72%	0.717	S	S	*	*			trans	-84	-177.1	-171	-52.9	-176.9	115.4	0	0	111.6
533	S	27.5	Very low	25.3	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	72%	0.723	S	S	*	*			cis	-170.3	153.2	27.3	60.4	0	0	0	0	115.6
534	D	25.7	Very low	25.4	Very low	136 Å²	136	141 Å²	141	73%	0.727	73%	0.727	S	S	*	*			trans	81.9	133.6	133.6	-101.2	-8.7	0	0	0	126.5
535	L	26.7	Very low	25.7	Very low	122 Å²	122	137.2 Å²	137.2	64%	0.639	72%	0.723	S	S	*	*			trans	73	106.9	140.4	-61.6	168.6	0	0	0	124.9
536	R	25.2	Very low	25.7	Very low	209 Å²	209	139 Å²	139	79%	0.789	73%	0.729	S	S	*	*				72.5	118.1	119.9	-74.8	-175.9	178.1	173.8	-0.1	123.4
537	L	24.4	Very low	26.1	Very low	132 Å²	132	137 Å²	137	69%	0.691	73%	0.733	S	S	*	*				69.4	134.2	122.4	-68.3	172.4	0	0	0	122.5
538	Q	23.8	Very low	26.5	Very low	172 Å²	172	134.7 Å²	134.7	80%	0.804	75%	0.745	S	S	*	*			trans	67.5	139.5	145.8	-72.3	177.9	5.9	0	0	118.1
539	N	23.1	Very low	26.7	Very low	135 Å²	135	138.3 Å²	138.3	72%	0.722	76%	0.763	S	S	*	*			cis	171.2	172.2	0.6	-176.3	24.2	0	0	0	105.8
540	C	24.3	Very low	26.9	Very low	77 Å²	77	138.6 Å²	138.6	52%	0.52	76%	0.759	S	S	.	*			trans	62.7	105.9	158.1	-74.3	0	0	0	0	121.7
541	E	22.5	Very low	27.2	Very low	171 Å²	171	136.3 Å²	136.3	80%	0.799	76%	0.76	S	S	*	*				68.6	158.8	111.1	-68.6	176.2	114.6	0	0	123.8
542	S	24.7	Very low	27.4	Very low	109 Å²	109	137 Å²	137	76%	0.762	75%	0.754	S	S	*	*			trans	69.8	118.7	168.3	63.9	0	0	0	0	117.1
543	L	28.5	Very low	27.7	Very low	174 Å²	174	133.5 Å²	133.5	91%	0.911	75%	0.75	S	S	*	*			cis	81.6	94.7	47.7	-68	173.3	0	0	0	114.7
544	T	26.6	Very low	27.9	Very low	126 Å²	126	134 Å²	134	77%	0.773	76%	0.76	S	S	*	*			trans	-147.4	128.1	148.5	53.5	0	0	0	0	106.4
545	S	28	Very low	28.1	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	77%	0.765	S	S	*	*				61.7	128.1	51	84.1	0	0	0	0	112
546	D	26.5	Very low	28.3	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	78%	0.778	S	S	*	*			cis	-165.1	-169.2	1.9	-150.3	-26.6	0	0	0	109.3
547	S	31.8	Very low	28.5	Very low	116 Å²	116	130 Å²	130	81%	0.811	78%	0.783	S	S	*	*			trans	78.1	148.2	154.1	75.8	0	0	0	0	120.2
548	A	32.7	Very low	28.7	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	79%	0.789	S	S	*	*			trans	-106.5	179	-166.9	0	0	0	0	0	113.3
549	K	32.2	Very low	29.1	Very low	181 Å²	181	123.8 Å²	123.8	79%	0.787	79%	0.788	S	S	*	*			trans	-74.8	-178.1	164.5	-43.2	173.9	-176.1	174.2	0	110.1
550	D	31.2	Very low	29.4	Very low	142 Å²	142	126.2 Å²	126.2	76%	0.759	80%	0.795	S	S	*	*			cis	-128.6	-168.5	5.7	-63.7	-83.3	0	0	0	108.3
551	S	33.7	Very low	29.7	Very low	96 Å²	96	126.8 Å²	126.8	67%	0.671	81%	0.805	S	S	*	*			cis	-163	-179.8	16.5	-156.3	0	0	0	0	113
552	D	30.6	Very low	30.1	Very low	139 Å²	139	123.6 Å²	123.6	74%	0.743	80%	0.801	S	S	*	*			trans	79.8	103.3	150	-61.1	-7.3	0	0	0	123.1
553	S	32.8	Very low	30.7	Very low	116 Å²	116	123.3 Å²	123.3	81%	0.811	80%	0.799	S	S	*	*				88	126.5	126.7	77.4	0	0	0	0	122.7
554	A	31.8	Very low	31	Very low	110 Å²	110	123.1 Å²	123.1	91%	0.909	79%	0.791	S	S	*	*			trans	41	127	141.8	0	0	0	0	0	122.5
555	G	29.6	Very low	31.4	Very low	80 Å²	80	124.4 Å²	124.4	83%	0.825	79%	0.788	S	S	*	*			trans	161.8	131.8	160.5	0	0	0	0	0	113.3
556	E	29.4	Very low	31.7	Very low	195 Å²	195	125 Å²	125	91%	0.911	78%	0.779	S	S	*	*			trans	-82.8	155.5	-178.7	-65.1	-178.4	101.9	0	0	114.3
557	A	30.6	Very low	32.2	Very low	107 Å²	107	124.4 Å²	124.4	88%	0.884	77%	0.77	S	S	*	*			trans	63.9	157.9	149.7	0	0	0	0	0	120.2
558	G	28.7	Very low	32.3	Very low	80 Å²	80	128.1 Å²	128.1	83%	0.825	77%	0.766	S	S	*	*			trans	127.5	102.5	159.5	0	0	0	0	0	116.3
559	A	31.3	Very low	32.5	Very low	94 Å²	94	130.4 Å²	130.4	78%	0.777	76%	0.757	S	S	*	*			trans	-65.8	163.3	-177.9	0	0	0	0	0	117.2
560	Q	29.9	Very low	32.7	Very low	186 Å²	186	129.8 Å²	129.8	87%	0.869	76%	0.755	S	S	*	*			trans	67.5	101.3	144.9	-77	-179	-2.6	0	0	122.1
561	A	31.4	Very low	32.8	Very low	88 Å²	88	133.4 Å²	133.4	73%	0.727	76%	0.758	S	S	*	*				75	138	106.4	0	0	0	0	0	123.5
562	S	31.2	Very low	32.8	Very low	104 Å²	104	140.5 Å²	140.5	73%	0.727	77%	0.77	S	S	*	*			trans	94.2	106.9	138.4	80	0	0	0	0	121.6
563	S	35.3	Very low	32.8	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	78%	0.778	S	S	*	*				76.5	164.4	125.5	91.7	0	0	0	0	118.2
564	K	35.3	Very low	32.8	Very low	169 Å²	169	148 Å²	148	74%	0.735	78%	0.776	S	S	*	*			cis	-165.2	147.3	-16.2	-123.8	169.9	-171.3	169.2	0	107.7
565	H	34.5	Very low	32.7	Very low	153 Å²	153	149.4 Å²	149.4	71%	0.708	76%	0.764	S	S	*	*			trans	67.3	164.7	147.2	-76	-3.6	0	0	0	118
566	Q	36.3	Very low	32.9	Very low	114 Å²	114	155 Å²	155	53%	0.533	77%	0.765	S	S	.	*			cis	-157.5	140.3	-12.2	-120.5	-179.1	46	0	0	113.9
567	K	35.7	Very low	32.7	Very low	139 Å²	139	149.6 Å²	149.6	60%	0.604	76%	0.762	S	S	*	*			trans	62.2	140	132.9	-83.9	174.1	-154.4	155.6	0	123.9
568	R	34.3	Very low	32.6	Very low	194 Å²	194	148.2 Å²	148.2	73%	0.732	76%	0.758	S	S	*	*			trans	78.6	155.5	137.4	-71.7	168.2	161	-173.9	-2.5	117.5
569	K	37.6	Very low	32.5	Very low	147 Å²	147	150.6 Å²	150.6	64%	0.639	76%	0.762	S	S	*	*			cis	-161.7	140.8	3.5	-128.4	169.3	-176.2	179.2	0	115.4
570	K	35.8	Very low	32.4	Very low	168 Å²	168	150.2 Å²	150.2	73%	0.73	76%	0.759	S	S	*	*			trans	64.2	135.9	131.2	-98.9	-174.2	172.2	-173.4	0	125
571	R	32.8	Very low	32.3	Very low	218 Å²	218	146.8 Å²	146.8	82%	0.823	76%	0.755	S	S	*	*			trans	81.2	132.8	148	-62.1	161.2	95.7	164.6	6.9	117
572	R	34	Very low	32.3	Very low	246 Å²	246	152.2 Å²	152.2	93%	0.928	76%	0.757	S	S	*	*			cis	92.5	94.7	32.8	-87.3	-166.4	162.8	-171.2	-2.4	116
573	K	31.4	Very low	32.2	Very low	209 Å²	209	157.4 Å²	157.4	91%	0.909	76%	0.761	S	S	*	*			trans	-176	175.1	140	-124.3	-178.5	175.9	-174.8	0	110
574	R	31.8	Very low	31.8	Very low	202 Å²	202	164.1 Å²	164.1	76%	0.762	77%	0.77	S	S	*	*				-162.6	150.7	-84.8	-165.6	-163.9	-177.8	-146	12.1	108.7
575	Q	31	Very low	31.4	Very low	141 Å²	141	164.2 Å²	164.2	66%	0.659	78%	0.778	S	S	*	*			trans	79.8	116	157.5	-88.6	168.5	-65.1	0	0	123.2
576	K	31.9	Very low	31.1	Very low	196 Å²	196	162 Å²	162	85%	0.852	78%	0.779	S	S	*	*				88.6	113.8	111.9	-163.1	-175.7	-176.9	-171.9	0	122.5
577	G	26.5	Very low	30.7	Very low	83 Å²	83	162.4 Å²	162.4	86%	0.856	80%	0.795	S	S	*	*			trans	89.8	153	152.8	0	0	0	0	0	117
578	G	27.9	Very low	30.4	Very low	77 Å²	77	160.6 Å²	160.6	79%	0.794	81%	0.806	S	S	*	*			cis	166.9	136.8	-14.2	0	0	0	0	0	115.9
579	S	27.3	Very low	30.5	Very low	130 Å²	130	156.7 Å²	156.7	91%	0.909	81%	0.809	S	S	*	*			trans	74.1	160	160.9	-150.6	0	0	0	0	122.5
580	A	28.9	Very low	30.4	Very low	87 Å²	87	155.4 Å²	155.4	72%	0.719	82%	0.818	S	S	*	*			trans	84.5	76.8	153.8	0	0	0	0	0	123.9
581	S	28.1	Very low	31.3	Very low	113 Å²	113	153.8 Å²	153.8	79%	0.79	83%	0.825	S	S	*	*				25.1	127.6	125.7	-166	0	0	0	0	122.7
582	R	30.6	Very low	31.2	Very low	202 Å²	202	147 Å²	147	76%	0.762	82%	0.823	S	S	*	*				176.5	141.5	107.7	-96	177.9	-174.1	-170.7	3.5	117.1
583	R	28.5	Very low	31.1	Very low	214 Å²	214	138.8 Å²	138.8	81%	0.808	81%	0.814	S	S	*	*			trans	59.8	117.6	143.7	-66.2	-179.9	178.3	-176.5	-2.4	123.2
584	R	28.3	Very low	31.1	Very low	244 Å²	244	136.8 Å²	136.8	92%	0.921	81%	0.813	S	S	*	*			trans	11.9	139.7	136.1	-69.6	-174.5	174.3	-159.5	-1.1	120.5
585	L	25.9	Very low	31.1	Very low	172 Å²	172	134.6 Å²	134.6	90%	0.901	82%	0.816	S	S	*	*				-154	178.3	114.9	-111.2	170.3	0	0	0	111.3
586	S	28.6	Very low	31.3	Very low	105 Å²	105	132 Å²	132	73%	0.734	82%	0.819	S	S	*	*			trans	-152.5	134.5	-162.5	54.8	0	0	0	0	115.2
587	S	27.8	Very low	31.1	Very low	124 Å²	124	126.2 Å²	126.2	87%	0.867	82%	0.815	S	S	*	*			trans	-177.2	165.2	169.1	48.5	0	0	0	0	108.9
588	A	28.9	Very low	31.3	Very low	100 Å²	100	130.1 Å²	130.1	83%	0.826	82%	0.815	S	S	*	*			cis	-164.1	174.5	-29	0	0	0	0	0	108.1
589	S	38	Very low	31.3	Very low	113 Å²	113	133 Å²	133	79%	0.79	82%	0.817	S	S	*	*			trans	-140.5	145.1	-174.5	55.9	0	0	0	0	114.2
590	S	34.3	Very low	31.3	Very low	120 Å²	120	135 Å²	135	84%	0.839	81%	0.812	S	S	*	*			trans	-173.5	170.7	173.5	-78.9	0	0	0	0	109.2
591	P	54.7	Low	32.7	Very low	134 Å²	134	135.3 Å²	135.3	87%	0.87	81%	0.807	S	S	*	*			cis	-118.6	-175.2	-2.8	40.7	-26.9	0	0	0	112.8
592	G	31.1	Very low	33.6	Very low	76 Å²	76	134.9 Å²	134.9	78%	0.784	80%	0.801	S	S	*	*			cis	160.5	158.7	-11	0	0	0	0	0	114
593	G	31.4	Very low	33.6	Very low	73 Å²	73	135.4 Å²	135.4	75%	0.753	80%	0.803	S	S	*	*			trans	82.7	150.6	171.2	0	0	0	0	0	116.9
594	L	31.6	Very low	33.5	Very low	167 Å²	167	131.2 Å²	131.2	87%	0.874	80%	0.796	S	S	*	*			cis	-144.7	129.8	-5.6	-67.2	170.4	0	0	0	107.4
595	D	31.8	Very low	33.4	Very low	155 Å²	155	127.1 Å²	127.1	83%	0.829	79%	0.792	S	S	*	*				80	130.9	74.4	-142.6	62.6	0	0	0	113.3
596	A	35.4	Very low	33.5	Very low	88 Å²	88	124.2 Å²	124.2	73%	0.727	79%	0.786	S	S	*	*			cis	-163.3	166.1	-2.1	0	0	0	0	0	113.7
597	G	28.3	Very low	33.7	Very low	74 Å²	74	124.4 Å²	124.4	76%	0.763	79%	0.787	S	S	*	*			trans	99	150	160.3	0	0	0	0	0	118.2
598	L	29.9	Very low	35.1	Very low	164 Å²	164	123.6 Å²	123.6	86%	0.859	78%	0.779	S	S	*	*			cis	-167.6	153.6	-11.2	-130.4	167.7	0	0	0	111.1
599	V	28.9	Very low	35.4	Very low	138 Å²	138	125.9 Å²	125.9	84%	0.836	78%	0.777	S	S	*	*			trans	83.8	150.1	167.9	-168.4	0	0	0	0	118.8
600	E	25.9	Very low	35.1	Very low	171 Å²	171	124.9 Å²	124.9	80%	0.799	77%	0.771	S	S	*	*			trans	-143.3	178.9	-166.2	-135.7	-152.3	142.3	0	0	110.1
601	P	57.8	Low	35.1	Very low	95 Å²	95	123.1 Å²	123.1	62%	0.617	76%	0.763	S	S	*	*			cis	-125.7	-35.3	-27.1	8.7	13	0	0	0	123.9
602	P	49	Very low	34.1	Very low	103 Å²	103	122 Å²	122	67%	0.669	76%	0.758	S	S	*	*				-122.1	141.9	-104.5	39.1	-29	0	0	0	121.9
603	R	28.7	Very low	34.1	Very low	214 Å²	214	124.1 Å²	124.1	81%	0.808	76%	0.756	S	S	*	*			trans	77.6	119.1	132	-71.2	-85.7	176.4	155.2	-3.8	123.9
604	L	27.1	Very low	34	Very low	126 Å²	126	127.8 Å²	127.8	66%	0.66	76%	0.757	S	S	*	*			trans	77.4	127.6	140	-54.9	172.5	0	0	0	119.8
605	L	27	Very low	33.8	Very low	158 Å²	158	127.9 Å²	127.9	83%	0.827	75%	0.751	S	S	*	*				63.9	145.6	100.6	-55.7	-178.6	0	0	0	115.4
606	S	27.3	Very low	33.6	Very low	111 Å²	111	127.6 Å²	127.6	78%	0.776	75%	0.748	S	S	*	*			cis	-156.9	142.1	25	58.6	0	0	0	0	111.1
607	S	32.1	Very low	33.1	Very low	109 Å²	109	131.3 Å²	131.3	76%	0.762	75%	0.747	S	S	*	*				99.5	-170.8	84.1	-152.7	0	0	0	0	114.1
608	P	56.9	Low	33.2	Very low	106 Å²	106	133 Å²	133	69%	0.688	74%	0.743	S	S	*	*				-113.5	-173	-103.1	42.1	-27.4	0	0	0	114.1
609	N	35.2	Very low	33	Very low	148 Å²	148	132.8 Å²	132.8	79%	0.791	74%	0.738	S	S	*	*			cis	-156.4	-160.2	32.7	-140.1	-1.6	0	0	0	110.3
610	S	32.2	Very low	33.1	Very low	93 Å²	93	133.8 Å²	133.8	65%	0.65	74%	0.737	S	S	*	*			cis	-159.6	163	12.7	-145.4	0	0	0	0	114.9
611	A	35	Very low	33.2	Very low	83 Å²	83	131.5 Å²	131.5	69%	0.686	74%	0.74	S	S	*	*			trans	14.7	147.5	148.3	0	0	0	0	0	122.6
612	S	33.2	Very low	31.9	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	75%	0.751	S	S	*	*			cis	-156.2	143.9	14.9	-33.6	0	0	0	0	109.2
613	V	31.3	Very low	31.5	Very low	122 Å²	122	136.4 Å²	136.4	74%	0.739	76%	0.756	S	S	*	*				126	113.4	53.8	153.6	0	0	0	0	111.1
614	L	28.7	Very low	31.6	Very low	149 Å²	149	133.4 Å²	133.4	78%	0.78	75%	0.754	S	S	*	*			trans	63.1	155.8	153.4	-59.1	175	0	0	0	120.3
615	K	27.1	Very low	31.7	Very low	169 Å²	169	134 Å²	134	74%	0.735	76%	0.758	S	S	*	*			cis	-156.5	135.7	-7	-141	168.4	179.5	177.4	0	114.2
616	I	29.2	Very low	31.7	Very low	149 Å²	149	135.3 Å²	135.3	76%	0.764	76%	0.757	S	S	*	*			trans	10.2	125.9	143.8	-51.4	166.5	0	0	0	120.1
617	K	24.8	Very low	31.8	Very low	166 Å²	166	136.6 Å²	136.6	72%	0.722	76%	0.755	S	S	*	*				-169.1	151.2	101.7	-170.1	166.3	-177.7	-161.6	0	113.8	E619	K617-E619 WeakPolarHBondContact CE-OE1 3.5Å; K617-E619 IonicContact NZ-OE1 2.91Å; K617-E619 PolarHBondContact NZ-OE1 2.98Å
618	T	30.3	Very low	31.7	Very low	110 Å²	110	138 Å²	138	68%	0.675	76%	0.755	S	S	*	*			trans	-105.7	164.6	179.2	50.4	0	0	0	0	113.6
619	E	25.4	Very low	30.4	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	76%	0.756	S	S	*	*				-170.7	171.8	118	-102.1	156.2	-125.1	0	0	113.4	K617	K617-E619 WeakPolarHBondContact CE-OE1 3.5Å; K617-E619 IonicContact NZ-OE1 2.91Å; K617-E619 PolarHBondContact NZ-OE1 2.98Å
620	I	31	Very low	30.1	Very low	158 Å²	158	138.4 Å²	138.4	81%	0.81	76%	0.761	S	S	*	*			trans	-136.2	149.4	-167	-66.7	162.5	0	0	0	108.5
621	S	27.7	Very low	30	Very low	124 Å²	124	139.1 Å²	139.1	87%	0.867	77%	0.766	S	S	*	*			trans	-157.8	157.7	157.5	-82.7	0	0	0	0	112.9
622	E	30.2	Very low	29.8	Very low	182 Å²	182	143.2 Å²	143.2	85%	0.85	78%	0.775	S	S	*	*			trans	-105.1	175.5	-169.8	-110	-174.4	-173.5	0	0	113
623	P	41.1	Very low	29.6	Very low	119 Å²	119	148.7 Å²	148.7	77%	0.773	78%	0.779	S	S	*	*			trans	-78.5	160.5	-167.7	32.7	-37.3	0	0	0	114.5
624	I	30.1	Very low	29.4	Very low	151 Å²	151	150.5 Å²	150.5	77%	0.774	78%	0.784	S	S	*	*			trans	-117.1	136.7	173.4	-65.4	175	0	0	0	109.4	F626	I624-F626 HydrophobicContact CG2-CD2 3.93Å; I624-F626 HydrophobicContact CG2-CE2 4.44Å
625	N	30.1	Very low	29.4	Very low	137 Å²	137	153.8 Å²	153.8	73%	0.733	79%	0.788	S	S	*	*			trans	-110.8	141.2	174	-174.6	31	0	0	0	109.3
626	F	27.5	Very low	30.2	Very low	186 Å²	186	151.1 Å²	151.1	82%	0.816	79%	0.788	S	S	*	*			trans	-151	126.7	173.1	-110.1	-77	0	0	0	112.1	I624	I624-F626 HydrophobicContact CG2-CD2 3.93Å; I624-F626 HydrophobicContact CG2-CE2 4.44Å
627	D	28.8	Very low	30.8	Very low	138 Å²	138	149.4 Å²	149.4	74%	0.738	79%	0.786	S	S	*	*			trans	-89.9	167.9	169.4	-83.4	-61.4	0	0	0	111.9
628	N	29.8	Very low	31.2	Very low	140 Å²	140	149.2 Å²	149.2	75%	0.749	79%	0.793	S	S	*	*			trans	98.2	128.4	144.3	-147.1	82.1	0	0	0	120.4
629	D	28.6	Very low	31.2	Very low	133 Å²	133	153.9 Å²	153.9	71%	0.711	80%	0.799	S	S	*	*			trans	-3.7	132.4	165.9	-57.2	-32.3	0	0	0	121.1
630	S	30.5	Very low	31.4	Very low	128 Å²	128	152.4 Å²	152.4	90%	0.895	79%	0.792	S	S	*	*				-163.8	135.5	119.8	-83.6	0	0	0	0	112.8
631	S	29.7	Very low	31.5	Very low	109 Å²	109	152.6 Å²	152.6	76%	0.762	79%	0.793	S	S	*	*			trans	-91.6	141.1	173	59.5	0	0	0	0	112.2
632	I	30.4	Very low	31.5	Very low	169 Å²	169	152 Å²	152	87%	0.867	79%	0.788	S	S	*	*			trans	-158.2	151.6	150.6	-110.8	154.3	0	0	0	110.8
633	W	29.3	Very low	31.6	Very low	223 Å²	223	154.8 Å²	154.8	85%	0.845	79%	0.791	S	S	*	*			trans	-90.5	153.6	-176.7	-69.9	69.3	0	0	0	112.3
634	N	27.6	Very low	31.1	Very low	160 Å²	160	156.6 Å²	156.6	86%	0.856	79%	0.794	S	S	*	*				179.6	133.9	118.9	-87.5	-31.1	0	0	0	113.9
635	Y	27.4	Very low	31	Very low	219 Å²	219	159 Å²	159	86%	0.859	80%	0.802	S	S	*	*			trans	-97.1	177.1	149.6	-90.3	-88.6	0	0	0	107.5
636	P	44.1	Very low	31	Very low	112 Å²	112	158.2 Å²	158.2	73%	0.727	81%	0.807	S	S	*	*			cis	-121.1	-149.6	-3	39.6	-18.7	0	0	0	109.4
637	P	42.4	Very low	31.7	Very low	114 Å²	114	154.8 Å²	154.8	74%	0.74	80%	0.804	S	S	*	*			cis	-135.1	173.1	-4.6	42.1	-24	0	0	0	117.7
638	N	32.7	Very low	31.9	Very low	161 Å²	161	159.3 Å²	159.3	86%	0.861	81%	0.812	S	S	*	*			trans	-74.2	146.2	167.7	-66.1	-21.5	0	0	0	112
639	R	31.4	Very low	31.9	Very low	209 Å²	209	158.4 Å²	158.4	79%	0.789	82%	0.816	S	S	*	*			trans	-158.1	143.9	142.5	-130.2	-178.1	161.2	155	-0.8	114.7
640	E	28.2	Very low	31.9	Very low	129 Å²	129	160 Å²	160	60%	0.603	82%	0.822	S	S	*	*			trans	18.3	112.1	155.9	-69.6	139.1	-142.7	0	0	118.3
641	I	33.1	Very low	31.9	Very low	162 Å²	162	161 Å²	161	83%	0.831	82%	0.823	S	S	*	*				67.1	117.4	77.5	-62.6	164	0	0	0	113.9
642	S	28.1	Very low	32	Very low	110 Å²	110	165.2 Å²	165.2	77%	0.769	83%	0.827	S	S	*	*			trans	-145.1	136.4	148.2	58.4	0	0	0	0	111.4
643	R	33.4	Very low	32.3	Very low	241 Å²	241	162.8 Å²	162.8	91%	0.909	82%	0.822	S	S	*	*			trans	-110.3	144.1	161	-77.8	178.6	170.8	169.7	-5	106.7
644	N	29.1	Very low	33.1	Very low	157 Å²	157	158.2 Å²	158.2	84%	0.84	82%	0.822	S	S	*	*			trans	-104.7	110.6	170.2	-82.2	3.8	0	0	0	110.3
645	E	28.5	Very low	33.1	Very low	203 Å²	203	155.7 Å²	155.7	95%	0.949	82%	0.816	S	S	*	*			trans	-140.2	155.8	148.3	-77.1	-162.4	138.9	0	0	108.7
646	S	30.3	Very low	33.3	Very low	120 Å²	120	150.4 Å²	150.4	84%	0.839	81%	0.811	S	S	*	*			trans	-101.1	160.5	-163.9	41.7	0	0	0	0	114
647	P	43.2	Very low	32.6	Very low	114 Å²	114	153.6 Å²	153.6	74%	0.74	82%	0.816	S	S	*	*			trans	-106	163.5	-157.1	39.6	-35.6	0	0	0	115.2
648	Y	32.1	Very low	32.1	Very low	233 Å²	233	154.9 Å²	154.9	91%	0.914	81%	0.812	S	S	*	*			trans	-139.5	111.2	159.4	-101	-77.8	0	0	0	114.7
649	S	29.3	Very low	32	Very low	120 Å²	120	155.3 Å²	155.3	84%	0.839	81%	0.807	S	S	*	*			trans	60.1	164.6	151.7	-142.4	0	0	0	0	122.1
650	M	29.3	Very low	32.8	Very low	167 Å²	167	150.8 Å²	150.8	82%	0.823	81%	0.805	S	S	*	*			trans	-122.1	156.4	-170.3	-56.9	174.6	-77.4	0	0	112.2
651	T	30.6	Very low	33.1	Very low	150 Å²	150	150 Å²	150	92%	0.92	81%	0.814	S	S	*	*				-171	177	119.8	18.5	0	0	0	0	112.5
652	K	31.4	Very low	34.1	Very low	197 Å²	197	148 Å²	148	86%	0.857	81%	0.811	S	S	*	*			trans	-123.5	-166.1	-171.4	-58.1	176.8	177.8	177.4	0	110
653	P	37.8	Very low	34.5	Very low	117 Å²	117	152.2 Å²	152.2	76%	0.76	82%	0.819	S	S	*	*				-116.7	-173	-64.7	33.6	-15.3	0	0	0	111.4
654	P	45.5	Very low	34.6	Very low	128 Å²	128	144.5 Å²	144.5	83%	0.831	81%	0.814	S	S	*	*			trans	-104.2	163.9	-167.9	39.2	-35	0	0	0	117.1
655	S	27.5	Very low	34.7	Very low	106 Å²	106	141 Å²	141	74%	0.741	82%	0.815	S	S	*	*			trans	-156.1	111.8	167.3	58.7	0	0	0	0	115
656	S	30.5	Very low	34.8	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	81%	0.809	S	S	*	*			trans	49.9	150.7	137.5	61.5	0	0	0	0	125.3
657	E	29.9	Very low	34.9	Very low	179 Å²	179	133.7 Å²	133.7	84%	0.836	81%	0.813	S	S	*	*			trans	82.5	139.9	159.4	-65	-160.5	-177.3	0	0	119.9
658	H	32	Very low	34.4	Very low	141 Å²	141	132.1 Å²	132.1	65%	0.653	82%	0.817	S	S	*	*			cis	-164.6	173	-17.9	-159.3	24.7	0	0	0	112.9
659	F	30.3	Very low	34.4	Very low	171 Å²	171	125.1 Å²	125.1	75%	0.75	82%	0.816	S	S	*	*			trans	66	161.1	163.2	-72.9	-55	0	0	0	122.1
660	P	48.4	Very low	34.7	Very low	114 Å²	114	123.4 Å²	123.4	74%	0.74	82%	0.817	S	S	*	*			cis	-130.9	-172.4	-25	35	-15.9	0	0	0	114.6
661	S	35.6	Very low	34.9	Very low	113 Å²	113	119.6 Å²	119.6	79%	0.79	82%	0.821	S	S	*	*			trans	-147.5	163.3	173.9	-49.9	0	0	0	0	112.3
662	P	52.7	Low	35	Very low	119 Å²	119	116.5 Å²	116.5	77%	0.773	82%	0.819	S	S	*	*				-131	146.1	127.7	13.9	7.3	0	0	0	111.6
663	Q	37.7	Very low	35.1	Very low	199 Å²	199	111.3 Å²	111.3	93%	0.93	82%	0.821	S	S	*	*			cis	74.6	129.9	48.2	-168.3	-173.8	95.2	0	0	112.5
664	G	34.8	Very low	34.9	Very low	78 Å²	78	109.5 Å²	109.5	80%	0.804	82%	0.824	S	S	*	*			cis	-165.7	-174.3	-5	0	0	0	0	0	107.9
665	G	31	Very low	34.2	Very low	85 Å²	85	112.1 Å²	112.1	88%	0.876	83%	0.83	S	S	*	*			cis	-178.2	-174.1	0.9	0	0	0	0	0	107.2
666	G	31.3	Very low	34.3	Very low	80 Å²	80	115 Å²	115	83%	0.825	83%	0.831	S	S	*	*			cis	173.7	157.7	-5.4	0	0	0	0	0	111.5
667	G	32.5	Very low	34.4	Very low	88 Å²	88	116 Å²	116	91%	0.907	83%	0.832	S	S	*	*			trans	84.2	140.9	172.5	0	0	0	0	0	116.6
668	G	32.5	Very low	34.4	Very low	81 Å²	81	111.1 Å²	111.1	84%	0.835	82%	0.823	S	S	*	*			cis	168.4	148.6	-11.6	0	0	0	0	0	114.8
669	G	32.9	Very low	34.6	Very low	86 Å²	86	112.1 Å²	112.1	89%	0.887	83%	0.831	S	S	*	*			trans	96	150.8	163.3	0	0	0	0	0	117.7
670	G	34.5	Very low	34.8	Very low	84 Å²	84	109.6 Å²	109.6	87%	0.866	83%	0.832	S	S	*	*			trans	103.9	68.9	166.6	0	0	0	0	0	116.8
671	G	32.7	Very low	33.9	Very low	88 Å²	88	111.3 Å²	111.3	91%	0.907	84%	0.835	S	S	*	*			trans	-80.2	167.1	-179.3	0	0	0	0	0	115.8
672	G	34	Very low	33.9	Very low	85 Å²	85	111 Å²	111	88%	0.876	83%	0.832	S	S	*	*			trans	152.7	87.7	174.9	0	0	0	0	0	112.4
673	G	32.9	Very low	32.8	Very low	88 Å²	88	110.9 Å²	110.9	91%	0.907	83%	0.829	S	S	*	*			trans	-81.8	144.1	-175.6	0	0	0	0	0	114.3
674	G	32.8	Very low	32.4	Very low	78 Å²	78	109.9 Å²	109.9	80%	0.804	83%	0.829	S	S	*	*			trans	-161.7	91.9	174.4	0	0	0	0	0	111.7	H676	G674-H676 PolarHBondContact O-N 2.85Å
675	L	31.7	Very low	32.3	Very low	183 Å²	183	112 Å²	112	96%	0.958	83%	0.827	S	S	*	*			trans	-73.2	123.8	177.8	-74.1	165.5	0	0	0	110.9
676	H	30.2	Very low	32.5	Very low	166 Å²	166	113.7 Å²	113.7	77%	0.769	82%	0.823	S	S	*	*			trans	-138.7	121.2	159.3	-169	-82.4	0	0	0	110.5	G674	G674-H676 PolarHBondContact O-N 2.85Å
677	V	31.7	Very low	33	Very low	129 Å²	129	116 Å²	116	78%	0.782	82%	0.823	S	S	*	*			trans	-87.5	118.5	174	175.9	0	0	0	0	108.5
678	A	30	Very low	32.7	Very low	77 Å²	77	115.7 Å²	115.7	64%	0.636	82%	0.82	S	S	*	*			trans	-131.8	134.7	166.5	0	0	0	0	0	108.5
679	I	35.3	Very low	32.7	Very low	162 Å²	162	116.7 Å²	116.7	83%	0.831	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-88	123.8	-177.1	-61.4	168.2	0	0	0	108.1
680	P	34.5	Very low	32.5	Very low	118 Å²	118	121.3 Å²	121.3	77%	0.766	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-88.4	163.7	176.6	35.7	-34.7	0	0	0	112.8
681	D	30.6	Very low	32.3	Very low	151 Å²	151	120.9 Å²	120.9	81%	0.807	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.8	147.6	-176.7	-89	-63.1	0	0	0	115
682	S	34.5	Very low	32.1	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	82%	0.819	S	S	*	*			trans	72.2	163.8	136.9	-66.8	0	0	0	0	123.3
683	V	31.1	Very low	31.9	Very low	117 Å²	117	122.3 Å²	122.3	71%	0.709	82%	0.815	S	S	*	*			trans	75.9	116.5	162	-163.6	0	0	0	0	119
684	L	28.8	Very low	31.6	Very low	178 Å²	178	122.6 Å²	122.6	93%	0.932	81%	0.81	S	S	*	*				-142.1	106.8	129.1	-86.8	-171.3	0	0	0	110.8
685	T	33.2	Very low	31.5	Very low	124 Å²	124	130.3 Å²	130.3	76%	0.761	81%	0.814	S	S	*	*			trans	-138.2	145.2	157.8	-9	0	0	0	0	106.5
686	P	35.5	Very low	31.3	Very low	119 Å²	119	130.7 Å²	130.7	77%	0.773	81%	0.808	S	S	*	*			trans	-90.8	-177.8	-154.6	40.4	-38.5	0	0	0	113.1
687	P	40	Very low	31.2	Very low	128 Å²	128	128 Å²	128	83%	0.831	80%	0.804	S	S	*	*			trans	-83.2	158	-141.9	34.3	-36.3	0	0	0	114.7
688	G	28.3	Very low	31	Very low	83 Å²	83	129.3 Å²	129.3	86%	0.856	80%	0.801	S	S	*	*			trans	-94.3	-177.2	176.8	0	0	0	0	0	114.6
689	A	30.8	Very low	30.9	Very low	102 Å²	102	135 Å²	135	84%	0.843	81%	0.812	S	S	*	*			trans	-132.6	134.2	167.4	0	0	0	0	0	108.7
690	D	29	Very low	30.6	Very low	182 Å²	182	130.9 Å²	130.9	97%	0.973	81%	0.809	S	S	*	*			trans	-83.7	142.4	-174.8	-82.2	-60.6	0	0	0	113.3
691	G	29.8	Very low	30.3	Very low	75 Å²	75	130.1 Å²	130.1	77%	0.773	81%	0.813	S	S	*	*			trans	-143.5	120.4	174.8	0	0	0	0	0	110.8
692	A	29.5	Very low	30.3	Very low	107 Å²	107	128.9 Å²	128.9	88%	0.884	82%	0.816	S	S	*	*			trans	-82.6	175.3	-159.2	0	0	0	0	0	117
693	A	28.7	Very low	30.1	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	81%	0.813	S	S	*	*			trans	92.7	67.5	150.2	0	0	0	0	0	121.9
694	A	28.3	Very low	30.1	Very low	95 Å²	95	128.9 Å²	128.9	79%	0.785	82%	0.82	S	S	*	*				34	120.6	122.5	0	0	0	0	0	123.5
695	R	29.9	Very low	30.1	Very low	239 Å²	239	125.3 Å²	125.3	90%	0.902	82%	0.817	S	S	*	*				-175.8	128.5	129.7	-96.2	156	-172	-157.1	3	108.4
696	K	27.7	Very low	29.9	Very low	191 Å²	191	123.6 Å²	123.6	83%	0.83	82%	0.815	S	S	*	*				47.3	127	84.3	-72.1	-167.4	176.9	-177.6	0	113.5
697	T	27.4	Very low	29.5	Very low	111 Å²	111	126.6 Å²	126.6	68%	0.681	82%	0.824	S	S	*	*			cis	-164.2	144.9	11.5	-4.5	0	0	0	0	114.3
698	Q	28.3	Very low	29	Very low	155 Å²	155	124.8 Å²	124.8	72%	0.724	82%	0.82	S	S	*	*			trans	50.4	135.9	136.5	-87.6	176.5	-25.4	0	0	126.1
699	F	28.5	Very low	29.8	Very low	197 Å²	197	125.6 Å²	125.6	86%	0.864	81%	0.81	S	S	*	*			trans	71.4	139.4	141	-76.8	-56.4	0	0	0	123.3
700	G	27.5	Very low	29.6	Very low	75 Å²	75	125.2 Å²	125.2	77%	0.773	80%	0.797	S	S	*	*			trans	150.6	128.1	164.4	0	0	0	0	0	112.3
701	A	28.2	Very low	29.7	Very low	103 Å²	103	118 Å²	118	85%	0.851	76%	0.763	S	S	*	*			trans	-155.8	152.5	-177.9	0	0	0	0	0	115.6
702	S	30.4	Very low	29.7	Very low	124 Å²	124	117.8 Å²	117.8	87%	0.867	75%	0.75	S	S	*	*			trans	99.4	151.7	151.2	-149.9	0	0	0	0	121.6
703	A	30.6	Very low	29.8	Very low	80 Å²	80	117.7 Å²	117.7	66%	0.661	73%	0.734	S	S	*	*			trans	83.6	81.7	149.4	0	0	0	0	0	123.8
704	T	31.5	Very low	30.1	Very low	142 Å²	142	118.9 Å²	118.9	87%	0.871	73%	0.734	S	S	*	*				27.2	127.7	119.3	57.9	0	0	0	0	123.9
705	A	29.3	Very low	30.1	Very low	103 Å²	103	122.2 Å²	122.2	85%	0.851	74%	0.737	S	S	*	*			trans	-179.4	175.2	139.7	0	0	0	0	0	111.6
706	A	28.9	Very low	30.1	Very low	89 Å²	89	116.1 Å²	116.1	74%	0.736	73%	0.732	S	S	*	*				-169.2	162.3	-58.2	0	0	0	0	0	112.3
707	L	26.3	Very low	31.1	Very low	181 Å²	181	112.4 Å²	112.4	95%	0.948	73%	0.727	S	S	*	*			trans	77.8	167.8	157.4	-61.8	171.6	0	0	0	123.1
708	A	30.3	Very low	31.6	Very low	91 Å²	91	113.2 Å²	113.2	75%	0.752	73%	0.734	S	S	*	*			trans	-161.3	-151.1	-176.6	0	0	0	0	0	108.4
709	P	44.5	Very low	31.5	Very low	100 Å²	100	113.6 Å²	113.6	65%	0.649	74%	0.74	S	S	*	*			cis	-139.9	-150.4	-14.6	31.4	-4.3	0	0	0	114.7	R527	R527-P709 PolarHBondContact NH2-O 2.9Å
710	V	27.7	Very low	31.5	Very low	93 Å²	93	109.9 Å²	109.9	56%	0.564	74%	0.739	S	S	*	*			trans	82.7	153.5	161.1	-171.1	0	0	0	0	117.8	R527	R527-V710 VanDerWaalsContact CZ-O 3.27Å; R527-V710 PolarHBondContact NE-O 3.03Å; R527-V710 PolarHBondContact NH2-O 2.84Å
711	A	30.1	Very low	31.5	Very low	32 Å²	32	111.5 Å²	111.5	26%	0.264	75%	0.745	S	S	.	*			cis	-179.8	154.7	-45.2	0	0	0	0	0	108.8	R527 Y528	R527-A711 CarbonylContact C-O 3.57Å; R527-A711 VanDerWaalsContact CA-O 3.26Å; R527-A711 WeakPolarHBondContact CA-O 3.35Å; R527-A711 WeakPolarHBondContact CB-O 3.33Å; R527-A711 VanDerWaalsContact CG-O 3.3Å; R527-A711 WeakPolarHBondContact CG-O 3.45Å; Y528-A711 WeakPolarHBondContact CB-O 3.41Å; Y528-A711 HydrophobicContact CD1-CB 3.31Å; Y528-A711 HydrophobicContact CD2-CB 4.22Å; Y528-A711 HydrophobicContact CE1-CB 3.6Å; Y528-A711 HydrophobicContact CE2-CB 4.41Å; Y528-A711 HydrophobicContact CG-CB 3.62Å; Y528-A711 PolarHBondContact N-O 3.39Å
712	S	30.7	Very low	31.5	Very low	70 Å²	70	111.6 Å²	111.6	49%	0.49	74%	0.739	S	S	.	*			trans	-157.5	138.1	-168.3	-61	0	0	0	0	117.7	E526 Y528	E526-S712 WeakPolarHBondContact O-CB 3.39Å; E526-S712 PolarHBondContact O-OG 3.44Å; Y528-S712 VanDerWaalsContact CD2-CA 3.49Å; Y528-S712 WeakPolarHBondContact CE2-O 3.48Å
713	D	31.3	Very low	32	Very low	105 Å²	105	111.4 Å²	111.4	56%	0.561	74%	0.735	S	S	*	*			trans	-168	144.1	173.9	-172.9	43.5	0	0	0	111.8	Y528	Y528-D713 HydrophobicContact CD2-CB 3.84Å; Y528-D713 HydrophobicContact CE2-CB 3.93Å
714	P	34.5	Very low	31.9	Very low	120 Å²	120	117.3 Å²	117.3	78%	0.779	74%	0.74	S	S	*	*				-154.2	-176.8	118.6	40.6	-21.7	0	0	0	117.8
715	L	29.4	Very low	31.8	Very low	165 Å²	165	116 Å²	116	86%	0.864	73%	0.728	S	S	*	*			trans	-77.5	165.6	-164.7	-60.7	163.9	0	0	0	119.8
716	S	29.3	Very low	31.8	Very low	112 Å²	112	121 Å²	121	78%	0.783	73%	0.73	S	S	*	*			trans	-67.9	-178.3	166.6	-20.7	0	0	0	0	114.2
717	P	49	Very low	32	Very low	113 Å²	113	125 Å²	125	73%	0.734	73%	0.734	S	S	*	*			cis	-131.4	-163.1	8.6	41.1	-20.1	0	0	0	114.3
718	P	37.6	Very low	32.8	Very low	128 Å²	128	122.5 Å²	122.5	83%	0.831	73%	0.728	S	S	*	*				-150.5	-162.6	94.6	41.3	-21.9	0	0	0	115.4
719	L	26.3	Very low	32.8	Very low	163 Å²	163	121.5 Å²	121.5	85%	0.853	73%	0.726	S	S	*	*			trans	-122.3	159.4	-170	-76.3	169.5	0	0	0	115.3
720	S	28.1	Very low	32.3	Very low	118 Å²	118	125 Å²	125	83%	0.825	74%	0.74	S	S	*	*			trans	67.8	123.1	146.2	64.5	0	0	0	0	122.5
721	A	26.5	Very low	32.4	Very low	109 Å²	109	123.9 Å²	123.9	90%	0.901	75%	0.747	S	S	*	*			trans	-158.4	161.1	138.5	0	0	0	0	0	110.3
722	S	28.6	Very low	32.3	Very low	106 Å²	106	126.2 Å²	126.2	74%	0.741	77%	0.774	S	S	*	*			trans	-134.8	159.3	175	-173.1	0	0	0	0	109.2
723	P	40.5	Very low	32.4	Very low	119 Å²	119	127.1 Å²	127.1	77%	0.773	79%	0.794	S	S	*	*				-152	139.7	106.5	36.4	-18.1	0	0	0	118.4
724	R	28.8	Very low	32.5	Very low	204 Å²	204	126.3 Å²	126.3	77%	0.77	81%	0.811	S	S	*	*			trans	17.5	145.1	139.3	-75.3	-175.1	84.7	118.9	7.3	125
725	D	30.5	Very low	32.2	Very low	114 Å²	114	124.6 Å²	124.6	61%	0.61	82%	0.815	S	S	*	*			trans	68.4	111	138.5	-62	-11.7	0	0	0	121.8
726	K	28	Very low	32.3	Very low	209 Å²	209	120.4 Å²	120.4	91%	0.909	81%	0.812	S	S	*	*				-167.5	146.6	96.8	-100.4	170.9	-174.7	177.4	0	114.5
727	H	33.5	Very low	32.4	Very low	174 Å²	174	119.2 Å²	119.2	81%	0.806	82%	0.817	S	S	*	*			trans	-90.1	163.4	167.1	-116.9	-43.2	0	0	0	109.9
728	P	44.4	Very low	31.6	Very low	127 Å²	127	117.7 Å²	117.7	83%	0.825	82%	0.822	S	S	*	*				-132	-166.4	57.7	36.1	-16.5	0	0	0	112
729	G	29.9	Very low	31.4	Very low	70 Å²	70	115.6 Å²	115.6	72%	0.722	82%	0.824	S	S	*	*			cis	179.3	150.7	-9.8	0	0	0	0	0	109.9
730	N	33.2	Very low	31.7	Very low	175 Å²	175	111.8 Å²	111.8	94%	0.936	82%	0.823	S	S	*	*			trans	-108	148.5	-173.2	-179.4	66.1	0	0	0	113.1
731	G	30.3	Very low	32	Very low	69 Å²	69	111.2 Å²	111.2	71%	0.711	83%	0.826	S	S	*	*			trans	122.7	151.4	175.3	0	0	0	0	0	112.4
732	G	28.5	Very low	32.3	Very low	81 Å²	81	109.9 Å²	109.9	84%	0.835	82%	0.823	S	S	*	*			cis	165.4	116.1	-3	0	0	0	0	0	109.3
733	G	31.7	Very low	32.5	Very low	88 Å²	88	108.9 Å²	108.9	91%	0.907	83%	0.829	S	S	*	*			trans	-102.5	141.7	-172.6	0	0	0	0	0	113.9
734	G	33.2	Very low	32	Very low	88 Å²	88	107.2 Å²	107.2	91%	0.907	83%	0.833	S	S	*	*			trans	133.6	114.9	159.9	0	0	0	0	0	115.9
735	G	29.5	Very low	31.9	Very low	84 Å²	84	101.1 Å²	101.1	87%	0.866	83%	0.834	S	S	*	*			trans	162	117.1	166.8	0	0	0	0	0	112.3
736	G	30.7	Very low	32.7	Very low	78 Å²	78	101.7 Å²	101.7	80%	0.804	84%	0.844	S	S	*	*			cis	171.8	175	-8.7	0	0	0	0	0	112.9
737	G	32.3	Very low	32.7	Very low	87 Å²	87	97.2 Å²	97.2	90%	0.897	84%	0.839	S	S	*	*			trans	97.3	140.4	168.7	0	0	0	0	0	115.6
738	G	32.4	Very low	32.4	Very low	80 Å²	80	92.7 Å²	92.7	83%	0.825	83%	0.832	S	S	*	*			cis	-178.9	167.8	-4.7	0	0	0	0	0	114.5
739	G	32.3	Very low	31.8	Very low	85 Å²	85	92.3 Å²	92.3	88%	0.876	83%	0.832	S	S	*	*			trans	88.6	137.8	-174	0	0	0	0	0	112.6
740	G	32.6	Very low	31.5	Very low	82 Å²	82	97.2 Å²	97.2	85%	0.845	84%	0.842	S	S	*	*			cis	133.7	130.8	3.7	0	0	0	0	0	109.6
741	A	35.3	Very low	31.2	Very low	106 Å²	106	93.7 Å²	93.7	88%	0.876	83%	0.831	S	S	*	*			cis	-140.9	-163.7	4.2	0	0	0	0	0	111.2
742	G	32.1	Very low	31.3	Very low	82 Å²	82	97.6 Å²	97.6	85%	0.845	84%	0.835	S	S	*	*			trans	-71.6	-177.8	-172	0	0	0	0	0	115.9
743	G	32.1	Very low	31.3	Very low	84 Å²	84	100.3 Å²	100.3	87%	0.866	83%	0.83	S	S	*	*			cis	163	154.9	-0.5	0	0	0	0	0	111.9
744	G	30	Very low	31	Very low	84 Å²	84	105.9 Å²	105.9	87%	0.866	83%	0.825	S	S	*	*			trans	148.2	137.4	178.8	0	0	0	0	0	112.8
745	G	28.3	Very low	30.8	Very low	76 Å²	76	107.6 Å²	107.6	78%	0.784	82%	0.818	S	S	*	*			trans	-104.1	-166.2	164.2	0	0	0	0	0	110.9
746	P	45.6	Very low	30.7	Very low	126 Å²	126	107 Å²	107	82%	0.818	81%	0.812	S	S	*	*			cis	-132.3	-179.6	12	42.7	-27.1	0	0	0	115.3
747	S	28.8	Very low	30.8	Very low	116 Å²	116	110.8 Å²	110.8	81%	0.811	81%	0.813	S	S	*	*			trans	18	148.5	145.9	-154.2	0	0	0	0	123.1
748	A	27.5	Very low	30.8	Very low	78 Å²	78	114.9 Å²	114.9	65%	0.645	81%	0.814	S	S	*	*			trans	93	112.8	153.7	0	0	0	0	0	119.1
749	S	30.8	Very low	30.7	Very low	119 Å²	119	117.5 Å²	117.5	83%	0.832	80%	0.804	S	S	*	*			trans	43.9	99.5	130	-51.3	0	0	0	0	119.1
750	N	25	Very low	30.5	Very low	173 Å²	173	118 Å²	118	93%	0.925	80%	0.8	S	S	*	*			trans	-136.1	147	146.2	-96.1	-47.8	0	0	0	110.5
751	S	27.2	Very low	30.4	Very low	101 Å²	101	122 Å²	122	71%	0.706	80%	0.801	S	S	*	*			trans	-146.2	143.7	-177.8	179.2	0	0	0	0	107.9
752	L	30.4	Very low	30.3	Very low	151 Å²	151	125.6 Å²	125.6	79%	0.791	80%	0.8	S	S	*	*			trans	68	134.8	-177.6	-56.7	167	0	0	0	113.1
753	L	29.7	Very low	30.3	Very low	139 Å²	139	130.6 Å²	130.6	73%	0.728	79%	0.794	S	S	*	*			cis	-155.7	149.8	-2	-93.1	145.3	0	0	0	108
754	Y	26.2	Very low	30.2	Very low	205 Å²	205	133.9 Å²	133.9	80%	0.804	79%	0.79	S	S	*	*				177.3	142.6	116.3	-114.9	-107.7	0	0	0	113.9
755	T	27.9	Very low	30.5	Very low	124 Å²	124	139 Å²	139	76%	0.761	79%	0.791	S	S	*	*			trans	19.8	142.6	153.2	55.8	0	0	0	0	123.5
756	G	26.7	Very low	30.6	Very low	72 Å²	72	139.6 Å²	139.6	74%	0.742	79%	0.79	S	S	*	*			trans	171	108	151.2	0	0	0	0	0	113.2	L758	G756-L758 PolarHBondContact O-N 2.89Å
757	D	34.5	Very low	29.8	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	78%	0.784	S	S	*	*			trans	-67.8	118.4	-175.8	-56.6	-82.8	0	0	0	113.8
758	L	30.6	Very low	30.3	Very low	173 Å²	173	137.7 Å²	137.7	91%	0.906	78%	0.78	S	S	*	*			trans	-157.9	11.3	160.5	-140.5	72.4	0	0	0	118.4	G756	G756-L758 PolarHBondContact O-N 2.89Å
759	E	30.6	Very low	30.4	Very low	135 Å²	135	139.5 Å²	139.5	63%	0.631	78%	0.782	S	S	*	*	S	Bend	trans	-112.4	-1.7	173.9	-87	-144.4	169.7	0	0	115	L761 R763	E759-L761 VanDerWaalsContact C-N 3.28Å; E759-L761 PolarHBondContact O-N 3.41Å; E759-R763 IonicContact OE1-NH2 3.71Å; E759-R763 IonicContact OE2-CZ 2.74Å; E759-R763 IonicContact OE2-NH1 2.7Å; E759-R763 PolarHBondContact OE2-NH1 2.59Å; E759-R763 IonicContact OE2-NH2 2.98Å; E759-R763 PolarHBondContact OE2-NH2 3.16Å
760	A	29.3	Very low	30.4	Very low	95 Å²	95	140 Å²	140	79%	0.785	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-0.6	-174.6	0	0	0	0	0	115.1
761	L	30.8	Very low	30.5	Very low	166 Å²	166	138.6 Å²	138.6	87%	0.869	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.6	8.3	-168.8	-139	77.3	0	0	0	115.7	E759	E759-L761 VanDerWaalsContact C-N 3.28Å; E759-L761 PolarHBondContact O-N 3.41Å
762	Q	31.6	Very low	30.5	Very low	183 Å²	183	139.6 Å²	139.6	86%	0.855	78%	0.776	S	S	*	*	S	Bend	trans	-132.9	32.1	-176.8	-151.7	173.4	8.7	0	0	114
763	R	32	Very low	30.3	Very low	187 Å²	187	139.9 Å²	139.9	71%	0.706	78%	0.777	S	S	*	*			trans	-133.2	23.3	173.6	-64.5	-169.6	178.6	97.8	-1.4	113.9	E759	E759-R763 IonicContact OE1-NH2 3.71Å; E759-R763 IonicContact OE2-CZ 2.74Å; E759-R763 IonicContact OE2-NH1 2.7Å; E759-R763 PolarHBondContact OE2-NH1 2.59Å; E759-R763 IonicContact OE2-NH2 2.98Å; E759-R763 PolarHBondContact OE2-NH2 3.16Å
764	L	30.1	Very low	30.3	Very low	152 Å²	152	140 Å²	140	80%	0.796	78%	0.784	S	S	*	*			trans	-86.1	150.6	162.8	-76.8	163.9	0	0	0	109.3
765	Q	38	Very low	30.4	Very low	191 Å²	191	138.1 Å²	138.1	89%	0.893	78%	0.782	S	S	*	*	S	Bend	trans	85.7	60.4	-178.7	-54.6	-176.9	-42.5	0	0	118.4
766	A	30	Very low	30.3	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	78%	0.778	S	S	*	*	S	Bend	trans	-166	146.4	142.4	0	0	0	0	0	111.7
767	G	28.7	Very low	30.5	Very low	69 Å²	69	143.7 Å²	143.7	71%	0.711	78%	0.781	S	S	*	*			trans	90.5	71.2	163.5	0	0	0	0	0	117.8	V769	G767-V769 PolarHBondContact O-N 2.9Å
768	N	38.4	Very low	30.1	Very low	133 Å²	133	142.9 Å²	142.9	71%	0.711	78%	0.782	S	S	*	*			trans	-83	90.3	-178.2	-71.9	-3.6	0	0	0	114.6
769	V	30.4	Very low	30	Very low	116 Å²	116	137.9 Å²	137.9	70%	0.703	77%	0.773	S	S	*	*			trans	-145.8	117.1	144.9	-175.7	0	0	0	0	109.8	G767	G767-V769 PolarHBondContact O-N 2.9Å
770	V	29.5	Very low	29.8	Very low	129 Å²	129	137.9 Å²	137.9	78%	0.782	78%	0.782	S	S	*	*			trans	-129.1	122.8	168.2	178.2	0	0	0	0	108.5
771	L	27.3	Very low	29.8	Very low	144 Å²	144	141.9 Å²	141.9	75%	0.754	79%	0.789	S	S	*	*			trans	-70.2	145.1	173.4	-69.5	169.3	0	0	0	110.1	L773	L771-L773 PolarHBondContact O-N 3.13Å
772	P	28.8	Very low	29.6	Very low	122 Å²	122	138.4 Å²	138.4	79%	0.792	79%	0.785	S	S	*	*			trans	-66.3	98.4	-173	25.7	-34.6	0	0	0	112.5	V774	P772-V774 PolarHBondContact O-N 3.1Å
773	L	25.6	Very low	29.3	Very low	156 Å²	156	134.5 Å²	134.5	82%	0.817	78%	0.784	S	S	*	*			trans	-74.8	108.1	170	-93.4	150.8	0	0	0	109.7	L771 H775	L771-L773 PolarHBondContact O-N 3.13Å; L773-H775 PolarHBondContact O-N 3.25Å
774	V	28.9	Very low	29.1	Very low	142 Å²	142	132.1 Å²	132.1	86%	0.861	79%	0.79	S	S	*	*			trans	-68.8	91.4	176	-178.2	0	0	0	0	109.8	P772	P772-V774 PolarHBondContact O-N 3.1Å
775	H	28.1	Very low	29	Very low	165 Å²	165	130.8 Å²	130.8	76%	0.764	79%	0.793	S	S	*	*			trans	-82.5	122.2	176.6	-148.1	-76.3	0	0	0	110.9	L773	L773-H775 PolarHBondContact O-N 3.25Å
776	R	26.6	Very low	28.5	Very low	179 Å²	179	128 Å²	128	68%	0.675	79%	0.79	S	S	*	*			trans	-65.4	134.7	168.9	-87.7	178.3	163.9	172.8	-6.1	109.6
777	V	30.4	Very low	28.5	Very low	135 Å²	135	128.9 Å²	128.9	82%	0.818	80%	0.797	S	S	*	*			trans	-118	115.5	160.5	177.6	0	0	0	0	107.6	G779	V777-G779 PolarHBondContact O-N 2.66Å
778	T	26.1	Very low	28.4	Very low	138 Å²	138	130.5 Å²	130.5	85%	0.847	80%	0.804	S	S	*	*			trans	-91.8	93.5	173.2	43.9	0	0	0	0	109.8
779	G	28.8	Very low	27.9	Very low	69 Å²	69	133.5 Å²	133.5	71%	0.711	81%	0.813	S	S	*	*			trans	-111.3	130.1	166	0	0	0	0	0	110	V777	V777-G779 PolarHBondContact O-N 2.66Å
780	T	27	Very low	27.8	Very low	135 Å²	135	138 Å²	138	83%	0.828	82%	0.818	S	S	*	*			trans	-96.2	124.9	-178.9	49.7	0	0	0	0	111.7
781	L	28.1	Very low	27.7	Very low	178 Å²	178	138.6 Å²	138.6	93%	0.932	82%	0.821	S	S	*	*			trans	-168.7	167.7	144.2	-106.7	164.2	0	0	0	111.9
782	A	27.1	Very low	27.8	Very low	94 Å²	94	140.7 Å²	140.7	78%	0.777	82%	0.82	S	S	*	*			trans	-23.4	144.5	-173.2	0	0	0	0	0	120.2
783	A	25.9	Very low	27.7	Very low	101 Å²	101	141.5 Å²	141.5	84%	0.835	82%	0.823	S	S	*	*			trans	-111.9	134.9	174.5	0	0	0	0	0	112.5
784	T	26.7	Very low	27.9	Very low	137 Å²	137	139.4 Å²	139.4	84%	0.84	82%	0.817	S	S	*	*			trans	-140.9	109.4	170.1	42.9	0	0	0	0	113.3
785	S	27.6	Very low	27.9	Very low	124 Å²	124	136.1 Å²	136.1	87%	0.867	81%	0.812	S	S	*	*			trans	65.9	169	158.8	-147.3	0	0	0	0	119.2
786	T	28	Very low	27.9	Very low	133 Å²	133	134.7 Å²	134.7	82%	0.816	82%	0.815	S	S	*	*			trans	-133.7	136.8	-160.3	53.7	0	0	0	0	113.2
787	A	29.5	Very low	28	Very low	108 Å²	108	133.7 Å²	133.7	89%	0.893	82%	0.821	S	S	*	*			trans	-150.4	127.2	153.4	0	0	0	0	0	109.7
788	A	27.3	Very low	27.9	Very low	103 Å²	103	138.1 Å²	138.1	85%	0.851	82%	0.823	S	S	*	*			trans	-131.4	128	173.9	0	0	0	0	0	109.1
789	Q	29.2	Very low	27.8	Very low	196 Å²	196	143 Å²	143	92%	0.916	83%	0.828	S	S	*	*			trans	-108.2	158.5	176.4	-72.7	-165.6	-9.6	0	0	111.8
790	R	27.3	Very low	27.7	Very low	210 Å²	210	143.9 Å²	143.9	79%	0.792	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-89.7	129.4	-162.7	-60.5	171.2	179.2	166.9	-2.9	111.5	Y792	R790-Y792 HydrophobicContact CB-CE2 4.27Å
791	V	27	Very low	27.9	Very low	142 Å²	142	143.9 Å²	143.9	86%	0.861	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-85.1	122.1	163.7	-179.8	0	0	0	0	108.8
792	Y	29	Very low	27.9	Very low	187 Å²	187	140.1 Å²	140.1	73%	0.733	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-87.5	134.7	172.3	-77.2	-97.6	0	0	0	110.2	R790	R790-Y792 HydrophobicContact CB-CE2 4.27Å
793	T	28.2	Very low	27.8	Very low	140 Å²	140	145 Å²	145	86%	0.859	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-79.5	130.8	176.1	45.1	0	0	0	0	111.1
794	T	29.3	Very low	28	Very low	112 Å²	112	146.5 Å²	146.5	69%	0.687	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-76.2	130	177.8	43.7	0	0	0	0	111.5
795	G	28.9	Very low	28	Very low	72 Å²	72	146.5 Å²	146.5	74%	0.742	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-77.2	158.3	-167.5	0	0	0	0	0	116.4
796	T	28.3	Very low	28	Very low	136 Å²	136	148.3 Å²	148.3	83%	0.834	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-71.1	126.8	177.4	-44	0	0	0	0	112.1
797	I	27.8	Very low	27.9	Very low	158 Å²	158	146.6 Å²	146.6	81%	0.81	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-78.8	127.9	171.6	-60.8	177.3	0	0	0	109.6
798	R	28.2	Very low	27.7	Very low	228 Å²	228	150.3 Å²	150.3	86%	0.86	83%	0.831	S	S	*	*			trans	-104	150.5	168	-68.9	-173.9	176.8	-169.7	-0.3	110.3
799	Y	25.4	Very low	27.7	Very low	239 Å²	239	153.8 Å²	153.8	94%	0.937	83%	0.829	S	S	*	*			trans	-75.2	143.8	173.4	-78.5	-95.7	0	0	0	112
800	A	27.1	Very low	27.5	Very low	89 Å²	89	149.1 Å²	149.1	74%	0.736	82%	0.818	S	S	*	*			trans	-144.9	150.9	162.7	0	0	0	0	0	108.8
801	P	30.1	Very low	27.5	Very low	134 Å²	134	146.2 Å²	146.2	87%	0.87	82%	0.818	S	S	*	*			trans	-79.9	171.1	-174.5	33.7	-36.3	0	0	0	113.2
802	A	27.9	Very low	27.6	Very low	99 Å²	99	147.7 Å²	147.7	82%	0.818	82%	0.82	S	S	*	*			trans	-86.1	146.3	-176.8	0	0	0	0	0	113.5
803	E	26.3	Very low	27.6	Very low	196 Å²	196	145.9 Å²	145.9	92%	0.916	82%	0.823	S	S	*	*			trans	-127.8	168	159.3	-73.9	-156.1	140.8	0	0	110.6
804	V	28.6	Very low	28.1	Very low	134 Å²	134	145 Å²	145	81%	0.812	82%	0.82	S	S	*	*			trans	-113.3	131.8	-168.5	176.5	0	0	0	0	110.5
805	T	27.2	Very low	27.9	Very low	136 Å²	136	146.8 Å²	146.8	83%	0.834	83%	0.825	S	S	*	*			trans	-154.9	166.1	161.5	-13.1	0	0	0	0	112.6
806	L	27.1	Very low	27.9	Very low	163 Å²	163	148 Å²	148	85%	0.853	83%	0.828	S	S	*	*			trans	-84.5	162.1	-163.2	-81.5	63.3	0	0	0	114
807	A	26.2	Very low	27.9	Very low	97 Å²	97	150.4 Å²	150.4	80%	0.802	83%	0.829	S	S	*	*			trans	-90.9	155	172.9	0	0	0	0	0	112.6
808	M	26.3	Very low	27.9	Very low	186 Å²	186	147.5 Å²	147.5	92%	0.916	83%	0.829	S	S	*	*			trans	-155.6	165.7	152.2	-109	-178.9	90.3	0	0	112.1
809	Q	26.4	Very low	28	Very low	176 Å²	176	143.4 Å²	143.4	82%	0.822	83%	0.829	S	S	*	*			trans	-88.2	174.2	-177.7	-64.8	161.3	-45.3	0	0	110.5
810	S	25.6	Very low	28.1	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	82%	0.824	S	S	*	*			cis	-166.8	165.3	1.9	25.2	0	0	0	0	110.4
811	N	27.6	Very low	28	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	83%	0.832	S	S	*	*			trans	30.2	126.2	146.4	-53.5	-7.9	0	0	0	120.9
812	L	29.5	Very low	27.9	Very low	174 Å²	174	144.5 Å²	144.5	91%	0.911	83%	0.826	S	S	*	*				-177	158.4	102.8	-95.8	166.3	0	0	0	113.1
813	L	28.3	Very low	27.8	Very low	149 Å²	149	146.7 Å²	146.7	78%	0.78	82%	0.824	S	S	*	*			trans	-117.7	163.3	174.2	-98.4	174.3	0	0	0	107.8
814	P	37.4	Very low	27.9	Very low	122 Å²	122	144.5 Å²	144.5	79%	0.792	82%	0.824	S	S	*	*				-154.2	-171.4	60.1	42.3	-19.4	0	0	0	118.6
815	N	26.9	Very low	27.7	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	82%	0.823	S	S	*	*			trans	-55.6	158.7	-176.6	-64.6	-11.9	0	0	0	117.9
816	A	28.2	Very low	27.7	Very low	98 Å²	98	144.1 Å²	144.1	81%	0.81	82%	0.821	S	S	*	*			trans	-143.2	165.5	146.8	0	0	0	0	0	110.6
817	H	27.9	Very low	28.2	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.856	82%	0.82	S	S	*	*			trans	-94.7	166.9	-166.7	-75	-102.8	0	0	0	115.5
818	A	28.6	Very low	28.1	Very low	98 Å²	98	141.5 Å²	141.5	81%	0.81	82%	0.819	S	S	*	*			trans	-87.2	160.4	177.6	0	0	0	0	0	114
819	V	29.1	Very low	28	Very low	141 Å²	141	142.9 Å²	142.9	86%	0.855	82%	0.82	S	S	*	*			trans	-148.7	143	167.6	-125.3	0	0	0	0	110.4
820	N	27.1	Very low	28	Very low	155 Å²	155	138.1 Å²	138.1	83%	0.829	82%	0.818	S	S	*	*			trans	-97.7	151.2	174.7	-82.4	-24.2	0	0	0	111.4
821	F	24.9	Very low	28.1	Very low	210 Å²	210	141.7 Å²	141.7	92%	0.921	83%	0.829	S	S	*	*			trans	-151	164	157.4	-109.2	-79.5	0	0	0	111.2
822	V	29.1	Very low	28.2	Very low	120 Å²	120	141.9 Å²	141.9	73%	0.727	83%	0.83	S	S	*	*			trans	-129	145	-163.4	171.1	0	0	0	0	112.6
823	D	26.1	Very low	28.4	Very low	145 Å²	145	138.9 Å²	138.9	78%	0.775	82%	0.821	S	S	*	*			trans	18.6	129.8	163.7	-59.7	-22.4	0	0	0	123
824	V	27.1	Very low	28.6	Very low	151 Å²	151	139.4 Å²	139.4	92%	0.915	82%	0.817	S	S	*	*			trans	-140.5	148.8	140.8	-176.5	0	0	0	0	109.2
825	N	26.1	Very low	28.7	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	81%	0.81	S	S	*	*			trans	-94.5	165.4	-165.7	-78.6	-67.5	0	0	0	117.1
826	S	27	Very low	29.2	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	81%	0.806	S	S	*	*			trans	89.4	160.6	143.5	-111.7	0	0	0	0	119.1
827	P	36.5	Very low	29.6	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	80%	0.802	S	S	*	*				-131.8	170.5	-104.8	37.1	-18.2	0	0	0	115.9
828	G	24.6	Very low	30.3	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	78%	0.784	S	S	*	*			trans	-142.1	144.9	176.2	0	0	0	0	0	113.6
829	F	24.1	Very low	30.6	Very low	215 Å²	215	138.3 Å²	138.3	94%	0.943	78%	0.784	S	S	*	*			trans	-78.1	145.9	179.7	-93.2	-114.1	0	0	0	112.7
830	G	26.4	Very low	31.1	Very low	76 Å²	76	137.5 Å²	137.5	78%	0.784	77%	0.774	S	S	*	*			trans	-163.9	116.7	166.6	0	0	0	0	0	110.8
831	L	27.5	Very low	31.7	Very low	173 Å²	173	139.1 Å²	139.1	91%	0.906	77%	0.77	S	S	*	*			trans	-97.2	139.3	174.4	-68.9	167.5	0	0	0	109.2
832	D	29.3	Very low	32.3	Very low	153 Å²	153	135.8 Å²	135.8	82%	0.818	76%	0.757	S	S	*	*			trans	-138.5	138.3	174.9	-157.1	41	0	0	0	109.5
833	P	34.1	Very low	32.6	Very low	110 Å²	110	135.9 Å²	135.9	71%	0.714	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-85.8	124	-163.5	32.2	-32.5	0	0	0	112.9	T835	P833-T835 PolarHBondContact O-N 3.24Å
834	K	32.6	Very low	33.3	Very low	160 Å²	160	134 Å²	134	70%	0.696	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-66.7	131.5	173.8	-73.2	-179.2	157.1	-148.8	0	111.7	E838	K834-E838 WeakPolarHBondContact CD-OE2 3.33Å; K834-E838 WeakPolarHBondContact CE-OE1 3.16Å; K834-E838 IonicContact NZ-OE1 2.76Å; K834-E838 PolarHBondContact NZ-OE1 2.81Å; K834-E838 IonicContact NZ-OE2 3.79Å; K834-E838 PolarHBondContact NZ-OE2 2.86Å
835	T	40.7	Very low	33.9	Very low	108 Å²	108	133 Å²	133	66%	0.663	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-79.2	162.5	-179.9	50.9	0	0	0	0	112.4	P833 M837	P833-T835 PolarHBondContact O-N 3.24Å; T835-M837 PolarHBondContact O-N 2.95Å
836	P	36.3	Very low	34.5	Very low	108 Å²	108	135.5 Å²	135.5	70%	0.701	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	6	-166.8	-25	36.2	0	0	0	118
837	M	36.7	Very low	34.9	Very low	147 Å²	147	136.5 Å²	136.5	72%	0.724	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-29.8	-171.6	-141.8	69.5	177.1	0	0	113.7	T835 M839 L840	T835-M837 PolarHBondContact O-N 2.95Å; M837-M839 VanDerWaalsContact C-N 3.32Å; M837-M839 PolarHBondContact O-N 3.2Å; M837-L840 PolarHBondContact O-N 2.68Å
838	E	41.6	Very low	34.9	Very low	104 Å²	104	135.3 Å²	135.3	49%	0.486	71%	0.708	S	S	.	*	H	α-helix	trans	-67.1	-29.4	-176	-66.9	-169.2	171.5	0	0	113.4	K834 L840 Y841 H842	K834-E838 WeakPolarHBondContact CD-OE2 3.33Å; K834-E838 WeakPolarHBondContact CE-OE1 3.16Å; K834-E838 IonicContact NZ-OE1 2.76Å; K834-E838 PolarHBondContact NZ-OE1 2.81Å; K834-E838 IonicContact NZ-OE2 3.79Å; K834-E838 PolarHBondContact NZ-OE2 2.86Å; E838-L840 VanDerWaalsContact C-N 3.3Å; E838-L840 PolarHBondContact O-N 3.39Å; E838-Y841 PolarHBondContact O-N 3.45Å; E838-H842 PolarHBondContact O-N 3.33Å
839	M	36.3	Very low	35.3	Very low	163 Å²	163	139.6 Å²	139.6	80%	0.803	71%	0.71	S	S	*	*	H	α-helix	trans	-66.9	-29.5	178.6	-81	-176.9	62	0	0	113.4	M837	M837-M839 VanDerWaalsContact C-N 3.32Å; M837-M839 PolarHBondContact O-N 3.2Å
840	L	39.7	Very low	35.8	Very low	124 Å²	124	134.3 Å²	134.3	65%	0.649	70%	0.7	S	S	*	*	H	α-helix	trans	-72.4	-37.8	180	-154.1	73.6	0	0	0	111.2	M837 E838 H842 H843	M837-L840 PolarHBondContact O-N 2.68Å; E838-L840 VanDerWaalsContact C-N 3.3Å; E838-L840 PolarHBondContact O-N 3.39Å; L840-H842 VanDerWaalsContact C-N 3.34Å; L840-H842 PolarHBondContact O-N 3.08Å; L840-H843 PolarHBondContact O-N 2.72Å; L840-H843 VanDerWaalsContact O-N 3.16Å
841	Y	38.9	Very low	36.1	Very low	189 Å²	189	133.8 Å²	133.8	74%	0.741	70%	0.695	S	S	*	*	H	α-helix	trans	-62.8	-39.8	179.7	-143.7	-101.1	0	0	0	112	E838 H843	E838-Y841 PolarHBondContact O-N 3.45Å; Y841-H843 VanDerWaalsContact C-N 3.29Å; Y841-H843 PolarHBondContact O-N 3.44Å
842	H	37.2	Very low	36.4	Very low	140 Å²	140	131.9 Å²	131.9	65%	0.648	69%	0.693	S	S	*	*	H	α-helix	trans	-73.3	-11.8	176.9	-99.3	-56.1	0	0	0	115.2	E838 L840	E838-H842 PolarHBondContact O-N 3.33Å; L840-H842 VanDerWaalsContact C-N 3.34Å; L840-H842 PolarHBondContact O-N 3.08Å
843	H	35.4	Very low	36.3	Very low	121 Å²	121	135 Å²	135	56%	0.56	70%	0.699	S	S	*	*	H	α-helix	trans	-84.9	-45.1	176.7	-156.9	88	0	0	0	111.5	L840 Y841 H845 R846	L840-H843 PolarHBondContact O-N 2.72Å; L840-H843 VanDerWaalsContact O-N 3.16Å; Y841-H843 VanDerWaalsContact C-N 3.29Å; Y841-H843 PolarHBondContact O-N 3.44Å; H843-H845 VanDerWaalsContact C-N 3.3Å; H843-H845 PolarHBondContact O-N 2.98Å; H843-R846 PolarHBondContact O-N 3.49Å
844	V	41.9	Very low	36	Very low	105 Å²	105	133.9 Å²	133.9	64%	0.636	71%	0.708	S	S	*	*	H	α-helix	trans	-60.5	-41	177.8	-179	0	0	0	0	111.1	R846 L847	V844-R846 PolarHBondContact O-N 3.42Å; V844-R846 VanDerWaalsContact O-N 3.16Å; V844-L847 PolarHBondContact O-N 3.49Å
845	H	40.2	Very low	35.7	Very low	132 Å²	132	129.7 Å²	129.7	61%	0.611	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-8.6	-176.5	-141.9	-64.3	0	0	0	114.9	H843	H843-H845 VanDerWaalsContact C-N 3.3Å; H843-H845 PolarHBondContact O-N 2.98Å
846	R	38.1	Very low	35.1	Very low	201 Å²	201	129.7 Å²	129.7	76%	0.758	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-12.4	173	-92.2	-167.2	-76.4	-177.1	-6.3	114.7	H843 V844	H843-R846 PolarHBondContact O-N 3.49Å; V844-R846 PolarHBondContact O-N 3.42Å; V844-R846 VanDerWaalsContact O-N 3.16Å
847	L	34.8	Very low	34.7	Very low	133 Å²	133	131.5 Å²	131.5	70%	0.696	73%	0.73	S	S	*	*	S	Bend	trans	-91.8	-7.1	178	-72.1	169.3	0	0	0	113.7	V844	V844-L847 PolarHBondContact O-N 3.49Å
848	N	35.6	Very low	34.2	Very low	104 Å²	104	130 Å²	130	56%	0.556	73%	0.734	S	S	*	*	S	Bend	trans	-106.8	31	-173.8	-157.1	3.3	0	0	0	113.5
849	M	34.2	Very low	33.5	Very low	165 Å²	165	129.9 Å²	129.9	81%	0.813	75%	0.751	S	S	*	*			trans	-133.4	56.8	179.5	-71	-64.7	-73.8	0	0	111.6
850	S	33.7	Very low	33.1	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	75%	0.75	S	S	*	*			trans	-135	88.3	168.3	63.2	0	0	0	0	109.6
851	G	33.6	Very low	32.4	Very low	66 Å²	66	126.2 Å²	126.2	68%	0.68	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-73.9	151.9	171.3	0	0	0	0	0	111.5
852	P	33.8	Very low	31.9	Very low	133 Å²	133	124.7 Å²	124.7	86%	0.864	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-78.5	131.3	-175.6	30.9	-34.3	0	0	0	112.7
853	F	27.1	Very low	31.4	Very low	217 Å²	217	123 Å²	123	95%	0.952	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-92.6	132.1	159.6	-97	-93	0	0	0	109.3
854	G	27.2	Very low	31	Very low	87 Å²	87	126.1 Å²	126.1	90%	0.897	78%	0.776	S	S	*	*			trans	-179.1	43.3	-173.9	0	0	0	0	0	115.8
855	G	26.8	Very low	30.2	Very low	73 Å²	73	129.3 Å²	129.3	75%	0.753	79%	0.786	S	S	*	*			trans	-129.6	128	172.2	0	0	0	0	0	110.3
856	A	27.9	Very low	30.3	Very low	108 Å²	108	128.6 Å²	128.6	89%	0.893	79%	0.793	S	S	*	*			trans	-88.7	139.8	-171.9	0	0	0	0	0	112.9
857	V	27.3	Very low	29.9	Very low	145 Å²	145	123.8 Å²	123.8	88%	0.879	80%	0.796	S	S	*	*			trans	-134.2	139.6	165.7	-174.1	0	0	0	0	108.1
858	S	27	Very low	29.5	Very low	115 Å²	115	121 Å²	121	80%	0.804	80%	0.799	S	S	*	*			trans	-84.5	137.3	-172.2	-56.7	0	0	0	0	114
859	A	25.7	Very low	29.2	Very low	102 Å²	102	123.5 Å²	123.5	84%	0.843	81%	0.813	S	S	*	*			trans	44.7	108.3	147.4	0	0	0	0	0	120.6
860	A	28	Very low	28.8	Very low	95 Å²	95	122.4 Å²	122.4	79%	0.785	82%	0.815	S	S	*	*				-163.2	141	121.9	0	0	0	0	0	113.6
861	S	26.3	Very low	28.5	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	82%	0.818	S	S	*	*			trans	44.8	102.6	145.8	-58.1	0	0	0	0	123.5
862	L	27.3	Very low	28.3	Very low	157 Å²	157	129.8 Å²	129.8	82%	0.822	83%	0.827	S	S	*	*				77	126	113.7	-130.2	77.4	0	0	0	123.4
863	T	27.6	Very low	28	Very low	106 Å²	106	129.4 Å²	129.4	65%	0.65	82%	0.823	S	S	*	*			trans	77.7	119.4	141.4	28.9	0	0	0	0	124.6
864	Q	27.7	Very low	28	Very low	186 Å²	186	123.4 Å²	123.4	87%	0.869	81%	0.814	S	S	*	*			trans	91.4	123.3	132	-93	173.5	-28.9	0	0	124.2
865	M	24.8	Very low	28	Very low	172 Å²	172	128.9 Å²	128.9	85%	0.847	82%	0.816	S	S	*	*			trans	-62.4	179.2	157.8	-71.2	-83.9	-175.5	0	0	112.3
866	P	41.8	Very low	28	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	82%	0.815	S	S	*	*			cis	-149.3	167.3	20.9	43.6	-23.3	0	0	0	121
867	A	28.7	Very low	28	Very low	100 Å²	100	132.3 Å²	132.3	83%	0.826	82%	0.818	S	S	*	*			trans	62.6	147	137.6	0	0	0	0	0	123.9
868	G	26.8	Very low	27.9	Very low	74 Å²	74	134.7 Å²	134.7	76%	0.763	82%	0.816	S	S	*	*			trans	177.1	115.7	166	0	0	0	0	0	111.8
869	N	29.1	Very low	27.9	Very low	158 Å²	158	133.7 Å²	133.7	85%	0.845	81%	0.81	S	S	*	*			trans	-99.4	163.1	-174.8	-67.3	-16.4	0	0	0	112.8
870	V	27.4	Very low	27.9	Very low	141 Å²	141	135.2 Å²	135.2	86%	0.855	81%	0.809	S	S	*	*				163.5	150.9	119.7	158.5	0	0	0	0	112.4
871	F	25.8	Very low	27.9	Very low	183 Å²	183	138 Å²	138	80%	0.803	81%	0.81	S	S	*	*			trans	-92.5	158.2	-179.8	-74.9	-116.6	0	0	0	113.8
872	T	29.3	Very low	28.1	Very low	142 Å²	142	138.3 Å²	138.3	87%	0.871	81%	0.809	S	S	*	*			trans	-148	176.2	130.4	54.7	0	0	0	0	110.6
873	T	27.6	Very low	28.1	Very low	126 Å²	126	140.4 Å²	140.4	77%	0.773	81%	0.812	S	S	*	*			trans	-144.9	-177.5	-161.8	50.1	0	0	0	0	114.1
874	A	27.6	Very low	28.3	Very low	91 Å²	91	140.2 Å²	140.2	75%	0.752	81%	0.812	S	S	*	*			trans	76	126.9	-177.2	0	0	0	0	0	114.7
875	E	27.4	Very low	28.3	Very low	202 Å²	202	137.7 Å²	137.7	94%	0.944	81%	0.809	S	S	*	*			cis	78.5	129.8	40.2	-66	-153.6	142.6	0	0	115.4
876	G	27.4	Very low	28.4	Very low	71 Å²	71	140 Å²	140	73%	0.732	81%	0.81	S	S	*	*			trans	132	84.1	166.9	0	0	0	0	0	115.9
877	L	27.6	Very low	27.6	Very low	182 Å²	182	139.6 Å²	139.6	95%	0.953	81%	0.81	S	S	*	*				168.3	147.5	119.2	-87.9	170.2	0	0	0	111.8
878	F	25.1	Very low	27.6	Very low	194 Å²	194	143 Å²	143	85%	0.851	82%	0.815	S	S	*	*			trans	-111.7	161.6	-175.8	-109.1	-93.5	0	0	0	111.9
879	S	26	Very low	27.6	Very low	95 Å²	95	143.1 Å²	143.1	66%	0.664	82%	0.816	S	S	*	*			trans	55.4	118.3	152.9	60.1	0	0	0	0	119.9
880	T	27.1	Very low	27.7	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	82%	0.816	S	S	*	*				170.3	116.2	113.8	32.1	0	0	0	0	111.9
881	L	27.1	Very low	27.8	Very low	155 Å²	155	146 Å²	146	81%	0.812	82%	0.818	S	S	*	*			trans	-153.6	129.8	152.8	-81.8	-171.8	0	0	0	109.2
882	P	31.3	Very low	27.9	Very low	121 Å²	121	142 Å²	142	79%	0.786	82%	0.819	S	S	*	*			trans	-94.6	149.5	-179	35.6	-33.6	0	0	0	113.5
883	F	27.7	Very low	27.8	Very low	200 Å²	200	139.6 Å²	139.6	88%	0.877	81%	0.814	S	S	*	*			trans	-99.7	127.2	165.4	-72.1	-90.2	0	0	0	110.3	V885	F883-V885 PolarHBondContact O-N 2.91Å
884	P	31	Very low	27.8	Very low	103 Å²	103	143 Å²	143	67%	0.669	82%	0.821	S	S	*	*			trans	-83	106.6	169.5	31.2	-30.5	0	0	0	110.8	Y886	P884-Y886 HydrophobicContact CB-CE2 4.44Å
885	V	28.7	Very low	27.8	Very low	133 Å²	133	145.7 Å²	145.7	81%	0.806	83%	0.828	S	S	*	*			trans	-84	117	164.1	177.3	0	0	0	0	108.2	F883 S887	F883-V885 PolarHBondContact O-N 2.91Å; V885-S887 PolarHBondContact O-N 3.39Å
886	Y	25.9	Very low	27.8	Very low	219 Å²	219	144.3 Å²	144.3	86%	0.859	83%	0.826	S	S	*	*			trans	-80.5	116.3	173.9	-80.5	-82.3	0	0	0	110.8	P884	P884-Y886 HydrophobicContact CB-CE2 4.44Å
887	S	25.8	Very low	27.9	Very low	109 Å²	109	147.1 Å²	147.1	76%	0.762	82%	0.82	S	S	*	*			trans	-121.3	141.6	168.4	-173.2	0	0	0	0	109.2	V885 G889	V885-S887 PolarHBondContact O-N 3.39Å; S887-G889 PolarHBondContact O-N 3.34Å
888	N	28.3	Very low	27.9	Very low	172 Å²	172	147.8 Å²	147.8	92%	0.92	81%	0.81	S	S	*	*			trans	-76.7	120.7	179.3	-76.1	-20.2	0	0	0	110.4
889	G	27.3	Very low	28	Very low	76 Å²	76	146.3 Å²	146.3	78%	0.784	80%	0.803	S	S	*	*			trans	-147.3	122.9	175.1	0	0	0	0	0	111.4	S887	S887-G889 PolarHBondContact O-N 3.34Å
890	I	29.5	Very low	28.4	Very low	164 Å²	164	149 Å²	149	84%	0.841	81%	0.805	S	S	*	*			trans	-89.7	130.2	174.9	-62.2	165	0	0	0	108.2
891	H	29.3	Very low	28.8	Very low	194 Å²	194	154.4 Å²	154.4	90%	0.898	83%	0.829	S	S	*	*			trans	-175.1	164.4	140.5	-103.2	-68.9	0	0	0	110.5
892	A	28.7	Very low	28.9	Very low	101 Å²	101	154.4 Å²	154.4	84%	0.835	83%	0.83	S	S	*	*			trans	-133.1	140.4	-174	0	0	0	0	0	112.9
893	A	27.2	Very low	28.8	Very low	91 Å²	91	156.1 Å²	156.1	75%	0.752	83%	0.832	S	S	*	*			trans	-157.4	119.9	160.7	0	0	0	0	0	106.1
894	Q	28.1	Very low	28.8	Very low	198 Å²	198	153.7 Å²	153.7	93%	0.925	83%	0.83	S	S	*	*				59.8	103.2	81.3	-72.5	-165.9	-14.5	0	0	114
895	T	27.1	Very low	28.7	Very low	146 Å²	146	156.6 Å²	156.6	90%	0.896	84%	0.839	S	S	*	*			trans	-77.7	144	166.2	42.5	0	0	0	0	111.5
896	L	27.6	Very low	28.7	Very low	173 Å²	173	158.1 Å²	158.1	91%	0.906	84%	0.841	S	S	*	*			trans	-141.9	146.6	163.3	-152.6	140.5	0	0	0	109.6
897	E	29.8	Very low	28.9	Very low	131 Å²	131	154.1 Å²	154.1	61%	0.612	84%	0.84	S	S	*	*			trans	-90.6	171.9	-165.2	-51.3	174.9	94.3	0	0	114.8
898	R	27.1	Very low	29.1	Very low	196 Å²	196	157.3 Å²	157.3	74%	0.74	85%	0.846	S	S	*	*			trans	78.6	152.4	160	-63.5	179.1	-169.4	69.3	22.1	117.3
899	K	28.3	Very low	29.2	Very low	162 Å²	162	156.2 Å²	156.2	70%	0.704	84%	0.84	S	S	*	*			cis	-166.6	149.1	-25.6	175.8	172.1	179.3	-167.7	0	107.5
900	E	33.7	Very low	29.3	Very low	153 Å²	153	162.8 Å²	162.8	72%	0.715	84%	0.844	S	S	*	*			trans	-3.1	115.1	162.5	-56.4	170	148.8	0	0	117.4
901	D	35.5	Very low	29.3	Very low	245 Å²	245	162.7 Å²	162.7	100%	1.31	85%	0.845	S	S	*	*				-152.8	0	115.1	-94	-26.2	0	0	0	108.9

Retrieved 901 of 901 residues in 157.8 ms (Link to these results)

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