A0A024RCW8_HUMAN Loading...

Decapping nuclease

Decapping enzyme for NAD-capped RNAs: specifically hydrolyzes the nicotinamide adenine dinucleotide (NAD) cap from a subset of RNAs by removing the entire NAD moiety from the 5'-end of an NAD-capped RNA.

AlphaFold DB (O77932), UniProt , Accession A0A024RCW8, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 396 aa.

Structure Viewer

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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	42.3	Very low	42.9	Very low	253 Å²	253	153.8 Å²	153.8	100%	1.246	83%	0.831	S	S	*	*				0	86.6	0	-70.9	-173.8	-171.2	0	0	107.8
2	D	44.3	Very low	42.6	Very low	113 Å²	113	158.1 Å²	158.1	60%	0.604	84%	0.836	S	S	*	*			trans	-160.8	160.1	170.5	-149.9	21.1	0	0	0	100.4	R4	D2-R4 IonicContact OD2-CZ 2.72Å; D2-R4 IonicContact OD2-NE 2.86Å; D2-R4 PolarHBondContact OD2-NE 3.39Å; D2-R4 IonicContact OD2-NH2 3.02Å; D2-R4 PolarHBondContact OD2-NH2 3.13Å
3	P	49.9	Very low	42.7	Very low	103 Å²	103	155.3 Å²	155.3	67%	0.669	83%	0.829	S	S	*	*			cis	-148	159	20.2	35.5	-11.2	0	0	0	118.4
4	R	42.4	Very low	42.7	Very low	218 Å²	218	158.1 Å²	158.1	82%	0.823	84%	0.835	S	S	*	*				44.8	137.8	126.3	-54	170.6	-150.9	-164.8	3.4	121.9	D2	D2-R4 IonicContact OD2-CZ 2.72Å; D2-R4 IonicContact OD2-NE 2.86Å; D2-R4 PolarHBondContact OD2-NE 3.39Å; D2-R4 IonicContact OD2-NH2 3.02Å; D2-R4 PolarHBondContact OD2-NH2 3.13Å
5	G	41.7	Very low	43	Very low	68 Å²	68	156.1 Å²	156.1	70%	0.701	83%	0.831	S	S	*	*			trans	166.6	57.2	150.5	0	0	0	0	0	120.2
6	T	42	Very low	43.1	Very low	131 Å²	131	152.3 Å²	152.3	80%	0.804	83%	0.828	S	S	*	*			trans	44.7	124.1	132.5	8	0	0	0	0	123
7	K	46	Very low	43.3	Very low	186 Å²	186	153.9 Å²	153.9	81%	0.809	83%	0.828	S	S	*	*				146	129.7	109.1	-94.3	173	-178.2	178.6	0	114.7
8	R	42.7	Very low	43.6	Very low	248 Å²	248	152.2 Å²	152.2	94%	0.936	83%	0.827	S	S	*	*			trans	19.4	142.5	140.6	-65.8	177.9	171.8	-175.8	-4.1	118.4
9	G	39.8	Very low	43.6	Very low	77 Å²	77	157 Å²	157	79%	0.794	83%	0.832	S	S	*	*			cis	169.7	159.3	19.1	0	0	0	0	0	107.5
10	A	40.7	Very low	43.6	Very low	104 Å²	104	157.4 Å²	157.4	86%	0.86	83%	0.834	S	S	*	*			trans	-79.6	150.6	-154.4	0	0	0	0	0	117
11	E	40.5	Very low	43.7	Very low	191 Å²	191	159.4 Å²	159.4	89%	0.893	84%	0.836	S	S	*	*			trans	-143.9	113.1	147.7	-134.7	170.4	-166.3	0	0	108
12	K	39.2	Very low	43.8	Very low	205 Å²	205	155 Å²	155	89%	0.891	82%	0.817	S	S	*	*			trans	-97.3	113.2	175.1	-85.2	-175.4	174.8	-175.8	0	107.6
13	T	43.8	Very low	43.9	Very low	122 Å²	122	155.2 Å²	155.2	75%	0.748	82%	0.824	S	S	*	*			trans	-97.3	104.8	169.1	-42	0	0	0	0	108	V15	T13-V15 PolarHBondContact O-N 2.88Å
14	E	41.8	Very low	44	Very low	194 Å²	194	161.7 Å²	161.7	91%	0.907	84%	0.835	S	S	*	*			trans	-69.3	112.7	166.1	-81.8	-177.9	152.5	0	0	108.8
15	V	47.3	Very low	44.9	Very low	129 Å²	129	157.1 Å²	157.1	78%	0.782	83%	0.834	S	S	*	*			trans	-95.4	109.1	169.2	-178.7	0	0	0	0	107.3	T13 E17	T13-V15 PolarHBondContact O-N 2.88Å; V15-E17 PolarHBondContact O-N 3.01Å
16	A	45.3	Very low	46.5	Very low	94 Å²	94	157.6 Å²	157.6	78%	0.777	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.4	124.3	175.1	0	0	0	0	0	110.8
17	E	46.9	Very low	48.7	Very low	180 Å²	180	155.5 Å²	155.5	84%	0.841	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-66.6	140.6	172.4	-74.7	-176.1	151.7	0	0	111.6	V15 R19	V15-E17 PolarHBondContact O-N 3.01Å; E17-R19 PolarHBondContact O-N 3.16Å
18	P	47.4	Very low	51.1	Low	124 Å²	124	149.6 Å²	149.6	81%	0.805	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-74.5	119.7	178.3	27.9	-27.1	0	0	0	110.1	N20	P18-N20 PolarHBondContact O-N 3.41Å
19	R	45.1	Very low	53.8	Low	243 Å²	243	138.6 Å²	138.6	92%	0.917	76%	0.761	S	S	*	*			trans	-51.9	111.9	169.8	-81.4	178.4	168.4	177.8	-3.8	110.5	E17 K21	E17-R19 PolarHBondContact O-N 3.16Å; R19-K21 PolarHBondContact O-N 3.37Å; R19-K21 VanDerWaalsContact O-N 3.08Å
20	N	42.8	Very low	56.5	Low	165 Å²	165	137.9 Å²	137.9	88%	0.882	74%	0.743	S	S	*	*			trans	-51.5	111.5	166.9	-96.4	-22.1	0	0	0	110.1	P18 L22	P18-N20 PolarHBondContact O-N 3.41Å; N20-L22 PolarHBondContact O-N 3.23Å
21	K	45.1	Very low	59.3	Low	199 Å²	199	133.5 Å²	133.5	87%	0.865	71%	0.706	S	S	*	*			trans	-71.9	115.9	167.5	-72.6	-179.3	178.9	176.1	0	107.6	R19	R19-K21 PolarHBondContact O-N 3.37Å; R19-K21 VanDerWaalsContact O-N 3.08Å
22	L	44.5	Very low	62	Low	162 Å²	162	128.9 Å²	128.9	85%	0.848	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-49.1	134.4	167.8	-80.2	148.6	0	0	0	109.6	N20 R24	N20-L22 PolarHBondContact O-N 3.23Å; L22-R24 PolarHBondContact O-N 3.31Å
23	P	46.7	Very low	64.8	Low	117 Å²	117	120.9 Å²	120.9	76%	0.76	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-59.4	130.1	178	21.6	-29.2	0	0	0	109.6
24	R	52	Low	67.4	Low	238 Å²	238	118.1 Å²	118.1	90%	0.898	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-56.1	132.6	174.4	-77.4	179.8	174.7	177.7	-2.6	108.5	L22 A26	L22-R24 PolarHBondContact O-N 3.31Å; R24-A26 PolarHBondContact O-N 3.43Å
25	P	62.6	Low	70.1	Confident	123 Å²	123	114 Å²	114	80%	0.799	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-57.9	138.4	175.3	23.1	-30.9	0	0	0	109.5
26	A	75	Confident	72.5	Confident	77 Å²	77	108.9 Å²	108.9	64%	0.636	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-56.7	143	176.5	0	0	0	0	0	110	R24 S28	R24-A26 PolarHBondContact O-N 3.43Å; A26-S28 PolarHBondContact O-N 2.73Å
27	P	87.7	Confident	75	Confident	88 Å²	88	108.3 Å²	108.3	57%	0.571	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-55.3	133.7	176.5	-22.3	32.2	0	0	0	111	F337	P27-F337 HydrophobicContact CB-CE2 3.88Å; P27-F337 HydrophobicContact CB-CZ 4.14Å
28	S	96.4	Very high	77.4	Confident	61 Å²	61	101.3 Å²	101.3	43%	0.427	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-146.2	157.9	176.7	61	0	0	0	0	110.6	A26 V361	A26-S28 PolarHBondContact O-N 2.73Å; S28-V361 CarbonylContact C-O 3.59Å; S28-V361 WeakPolarHBondContact CA-O 3.43Å; S28-V361 VanDerWaalsContact CB-O 3.3Å; S28-V361 WeakPolarHBondContact CB-O 3.39Å
29	L	98.4	Very high	79.8	Confident	17 Å²	17	101 Å²	101	9%	0.089	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.6	114	179.6	179	72.9	0	0	0	110.1	Y36 F330 A333 F334 F337 P360 V361	L29-Y36 WeakPolarHBondContact CD1-OH 3.3Å; L29-F330 HydrophobicContact CD2-CE2 3.9Å; L29-F330 HydrophobicContact CD2-CZ 4.42Å; L29-F330 HydrophobicContact CG-CE2 4.4Å; L29-A333 HydrophobicContact CD1-CB 4.3Å; L29-F334 HydrophobicContact CD2-CB 3.83Å; L29-F334 HydrophobicContact CD2-CD2 4.15Å; L29-F334 HydrophobicContact CD2-CG 4.48Å; L29-F337 HydrophobicContact CB-CD1 3.79Å; L29-F337 HydrophobicContact CB-CE1 4.02Å; L29-F337 HydrophobicContact CB-CG 4.1Å; L29-F337 HydrophobicContact CD1-CB 4.45Å; L29-F337 HydrophobicContact CD2-CB 4.21Å; L29-F337 HydrophobicContact CD2-CD1 4.24Å; L29-F337 HydrophobicContact CD2-CG 4.46Å; L29-P360 CarbonylContact O-C 3.59Å; L29-P360 VanDerWaalsContact O-CA 3.28Å; L29-P360 WeakPolarHBondContact O-CA 3.37Å; L29-P360 WeakPolarHBondContact O-CB 3.49Å; L29-V361 HydrophobicContact CB-CB 4.11Å; L29-V361 HydrophobicContact CB-CG2 4.35Å; L29-V361 HydrophobicContact CD2-CG2 4.39Å; L29-V361 PolarHBondContact N-O 3.31Å; L29-V361 PolarHBondContact O-N 3.44Å
30	P	98.3	Very high	82.4	Confident	62 Å²	62	93.6 Å²	93.6	40%	0.403	54%	0.535	S	S	.	.			trans	-67.3	153.4	177.3	30.3	-36.9	0	0	0	111.6	L35 Y36	P30-L35 HydrophobicContact CB-CD1 3.53Å; P30-L35 HydrophobicContact CG-CD1 3.5Å; P30-L35 VanDerWaalsContact CG-CD1 3.5Å; P30-Y36 WeakPolarHBondContact O-CE2 3.44Å; P30-Y36 PolarHBondContact O-OH 3.45Å
31	T	98.6	Very high	85	Confident	13 Å²	13	86.7 Å²	86.7	8%	0.08	50%	0.5	C	S	.	.			trans	-122.3	1.2	-169.2	51.9	0	0	0	0	113.3	T141 P142 F330 W355 G359 V361	T31-T141 HydrophobicContact CG2-CG2 3.79Å; T31-P142 WeakPolarHBondContact O-CA 3.33Å; T31-P142 WeakPolarHBondContact O-CB 3.2Å; T31-F330 HydrophobicContact CG2-CD2 4.44Å; T31-F330 HydrophobicContact CG2-CE2 3.52Å; T31-F330 HydrophobicContact CG2-CZ 3.92Å; T31-W355 PolarHBondContact OG1-NE1 3.26Å; T31-G359 PolarHBondContact OG1-O 3.2Å; T31-V361 HydrophobicContact CG2-CG2 3.86Å
32	D	98	Very high	87.6	Confident	93 Å²	93	82.1 Å²	82.1	50%	0.497	48%	0.48	S	S	.	.			trans	-58.6	124.4	179.4	-172.4	-34.2	0	0	0	111	A34 L35 Y36	D32-A34 PolarHBondContact O-N 3.37Å; D32-A34 VanDerWaalsContact O-N 3.07Å; D32-A34 WeakPolarHBondContact OD1-CB 3.34Å; D32-A34 PolarHBondContact OD1-N 3.41Å; D32-L35 HydrophobicContact CB-CD1 4.19Å; D32-L35 HydrophobicContact CB-CG 4.27Å; D32-L35 WeakPolarHBondContact O-CB 3.48Å; D32-L35 PolarHBondContact O-N 3.02Å; D32-L35 VanDerWaalsContact O-N 3.1Å; D32-Y36 WeakPolarHBondContact O-CD2 3.26Å
33	P	98	Very high	90.2	Very high	37 Å²	37	75.7 Å²	75.7	24%	0.24	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-46.2	-35.9	174.9	-32.8	37.2	0	0	0	115.4	L35 Y36 S37 P142 Y143 V326	P33-L35 PolarHBondContact O-N 3.12Å; P33-Y36 PolarHBondContact O-N 2.99Å; P33-Y36 VanDerWaalsContact O-N 3.08Å; P33-S37 PolarHBondContact O-N 3.31Å; P33-P142 HydrophobicContact CB-CB 4.47Å; P33-P142 WeakPolarHBondContact CD-O 3.38Å; P33-P142 HydrophobicContact CG-CB 3.84Å; P33-P142 WeakPolarHBondContact CG-O 3.39Å; P33-Y143 HydrophobicContact CB-CE1 4.19Å; P33-Y143 HydrophobicContact CG-CD1 4.25Å; P33-Y143 HydrophobicContact CG-CE1 4.01Å; P33-V326 HydrophobicContact CB-CG1 3.91Å
34	A	97.4	Very high	92.6	Very high	65 Å²	65	73.7 Å²	73.7	54%	0.537	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-59.6	-33.3	-176.6	0	0	0	0	0	112.4	D32 Y36 S37	D32-A34 PolarHBondContact O-N 3.37Å; D32-A34 VanDerWaalsContact O-N 3.07Å; D32-A34 WeakPolarHBondContact OD1-CB 3.34Å; D32-A34 PolarHBondContact OD1-N 3.41Å; A34-Y36 PolarHBondContact O-N 3.25Å; A34-S37 PolarHBondContact O-OG 3.39Å
35	L	98.3	Very high	94.8	Very high	107 Å²	107	72 Å²	72	56%	0.56	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-71	-16.7	-179.5	-60.3	174.8	0	0	0	113.4	P30 D32 P33	P30-L35 HydrophobicContact CB-CD1 3.53Å; P30-L35 HydrophobicContact CG-CD1 3.5Å; P30-L35 VanDerWaalsContact CG-CD1 3.5Å; D32-L35 HydrophobicContact CB-CD1 4.19Å; D32-L35 HydrophobicContact CB-CG 4.27Å; D32-L35 WeakPolarHBondContact O-CB 3.48Å; D32-L35 PolarHBondContact O-N 3.02Å; D32-L35 VanDerWaalsContact O-N 3.1Å; P33-L35 PolarHBondContact O-N 3.12Å
36	Y	98.6	Very high	96.4	Very high	21 Å²	21	66.7 Å²	66.7	8%	0.082	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-119.3	13.1	-171.9	-57.5	-70.4	0	0	0	113.1	L29 P30 D32 P33 A34 G38 V326 N329 F330 A333	L29-Y36 WeakPolarHBondContact CD1-OH 3.3Å; P30-Y36 WeakPolarHBondContact O-CE2 3.44Å; P30-Y36 PolarHBondContact O-OH 3.45Å; D32-Y36 WeakPolarHBondContact O-CD2 3.26Å; P33-Y36 PolarHBondContact O-N 2.99Å; P33-Y36 VanDerWaalsContact O-N 3.08Å; A34-Y36 PolarHBondContact O-N 3.25Å; Y36-G38 PolarHBondContact O-N 2.88Å; Y36-G38 VanDerWaalsContact O-N 3.1Å; Y36-V326 WeakPolarHBondContact O-CA 3.42Å; Y36-N329 HydrophobicContact CD1-CB 4.24Å; Y36-N329 PolarHBondContact O-ND2 2.71Å; Y36-F330 HydrophobicContact CD1-CB 4.19Å; Y36-F330 HydrophobicContact CD2-CB 3.91Å; Y36-F330 HydrophobicContact CD2-CD2 4.2Å; Y36-F330 HydrophobicContact CE1-CB 4.42Å; Y36-F330 HydrophobicContact CE1-CD2 4.4Å; Y36-F330 HydrophobicContact CE2-CB 4.17Å; Y36-F330 AromaticContact CE2-CD2 3.61Å; Y36-F330 HydrophobicContact CE2-CD2 3.61Å; Y36-F330 HydrophobicContact CE2-CG 4.35Å; Y36-F330 HydrophobicContact CG-CB 3.92Å; Y36-F330 AromaticContact CZ-CD2 3.72Å; Y36-A333 HydrophobicContact CD1-CB 4.38Å; Y36-A333 HydrophobicContact CE1-CB 3.57Å
37	S	97.3	Very high	97.5	Very high	82 Å²	82	64.7 Å²	64.7	57%	0.573	36%	0.363	S	S	*	.			trans	-73.6	7.1	-175.2	59.4	0	0	0	0	115.6	P33 A34	P33-S37 PolarHBondContact O-N 3.31Å; A34-S37 PolarHBondContact O-OG 3.39Å
38	G	97.6	Very high	98	Very high	34 Å²	34	62.9 Å²	62.9	35%	0.351	35%	0.347	S	S	.	.	S	Bend	trans	-67.7	-175.2	178.4	0	0	0	0	0	114.6	Y36 S325 N329	Y36-G38 PolarHBondContact O-N 2.88Å; Y36-G38 VanDerWaalsContact O-N 3.1Å; G38-S325 WeakPolarHBondContact O-CB 3.31Å; G38-N329 PolarHBondContact O-ND2 2.85Å
39	P	98.3	Very high	98.1	Very high	117 Å²	117	61.7 Å²	61.7	76%	0.76	34%	0.335	S	S	*	.	S	Bend	trans	-55	154.2	176.8	-24.1	34.3	0	0	0	112.6	N329	P39-N329 PolarHBondContact O-ND2 2.83Å; P39-N329 PolarHBondContact O-OD1 3.07Å
40	F	98.5	Very high	98	Very high	87 Å²	87	61.7 Å²	61.7	38%	0.382	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-62.2	124.7	175	-168.6	-90.4	0	0	0	109.4	F282 P324 S325 M328	F40-F282 HydrophobicContact CE1-CZ 4.21Å; F40-F282 AromaticContact CZ-CE1 3.93Å; F40-F282 HydrophobicContact CZ-CE1 3.93Å; F40-F282 HydrophobicContact CZ-CE2 4.43Å; F40-F282 AromaticContact CZ-CZ 3.55Å; F40-F282 HydrophobicContact CZ-CZ 3.55Å; F40-P324 HydrophobicContact CD2-CB 4.09Å; F40-P324 HydrophobicContact CE2-CB 3.81Å; F40-S325 WeakPolarHBondContact CA-OG 3.36Å; F40-S325 WeakPolarHBondContact CB-OG 3.28Å; F40-S325 PolarHBondContact N-OG 2.7Å; F40-M328 HydrophobicContact CD2-CG 4.45Å; F40-M328 HydrophobicContact CE2-CB 4.21Å; F40-M328 HydrophobicContact CE2-CG 3.52Å; F40-M328 HydrophobicContact CZ-CB 4.38Å; F40-M328 HydrophobicContact CZ-CG 3.6Å
41	P	98.6	Very high	98.1	Very high	21 Å²	21	60 Å²	60	14%	0.136	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-72.6	161.6	-176.1	31.4	-34.6	0	0	0	110.7	Y43 L224 M328 N329	P41-Y43 PolarHBondContact O-N 3.48Å; P41-L224 HydrophobicContact CB-CD1 4.27Å; P41-L224 HydrophobicContact CG-CD1 3.86Å; P41-M328 HydrophobicContact CG-CB 3.48Å; P41-M328 VanDerWaalsContact CG-CB 3.48Å; P41-N329 WeakPolarHBondContact CB-OD1 3.28Å; P41-N329 VanDerWaalsContact CD-OD1 3.3Å; P41-N329 WeakPolarHBondContact CD-OD1 3.36Å; P41-N329 WeakPolarHBondContact CG-OD1 3.44Å
42	F	98.6	Very high	98.1	Very high	102 Å²	102	59.4 Å²	59.4	45%	0.447	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-58.9	125.1	171.9	174.5	-93.1	0	0	0	110.3	R44 R223 G225	F42-R44 HydrophobicContact CE1-CB 3.81Å; F42-R44 HydrophobicContact CZ-CB 3.87Å; F42-R44 HydrophobicContact CZ-CG 4.41Å; F42-R223 HydrophobicContact CE1-CB 4.38Å; F42-R223 HydrophobicContact CE1-CG 4.32Å; F42-R223 VanDerWaalsContact CE1-NH2 3.25Å; F42-G225 PolarHBondContact O-N 2.66Å
43	Y	98.7	Very high	98.1	Very high	27 Å²	27	55 Å²	55	11%	0.106	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-127.1	116.7	167.8	-170	-116.7	0	0	0	108.6	P41 R45 P46 S222 R223 L224 L229 F282 L283 M328	P41-Y43 PolarHBondContact O-N 3.48Å; Y43-R45 PolarHBondContact O-N 3.29Å; Y43-P46 HydrophobicContact CE1-CG 4.06Å; Y43-S222 WeakPolarHBondContact CE2-OG 3.41Å; Y43-S222 VanDerWaalsContact CZ-OG 3.3Å; Y43-R223 CarbonylContact C-O 3.59Å; Y43-R223 WeakPolarHBondContact CA-O 3.33Å; Y43-L224 HydrophobicContact CD2-CB 3.96Å; Y43-L224 HydrophobicContact CD2-CD1 4.14Å; Y43-L224 HydrophobicContact CE2-CB 4.27Å; Y43-L229 HydrophobicContact CE2-CD1 4.16Å; Y43-F282 HydrophobicContact CD1-CD1 4.46Å; Y43-F282 AromaticContact CD1-CE1 3.54Å; Y43-F282 HydrophobicContact CD1-CE1 3.54Å; Y43-F282 AromaticContact CD1-CZ 3.78Å; Y43-F282 HydrophobicContact CD1-CZ 3.78Å; Y43-F282 HydrophobicContact CE1-CD1 4.39Å; Y43-F282 AromaticContact CE1-CE1 3.88Å; Y43-F282 HydrophobicContact CE1-CE1 3.88Å; Y43-F282 HydrophobicContact CE1-CZ 4.41Å; Y43-F282 HydrophobicContact CG-CE1 4.18Å; Y43-F282 HydrophobicContact CG-CZ 4.5Å; Y43-L283 HydrophobicContact CE2-CD2 4.46Å; Y43-L283 WeakPolarHBondContact OH-CA 3.32Å; Y43-L283 PolarHBondContact OH-O 3.03Å; Y43-M328 HydrophobicContact CD1-CE 4.37Å; Y43-M328 HydrophobicContact CD2-CE 3.55Å; Y43-M328 HydrophobicContact CE2-CE 3.97Å; Y43-M328 HydrophobicContact CG-CE 3.78Å
44	R	98.3	Very high	98.1	Very high	76 Å²	76	53.3 Å²	53.3	29%	0.287	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-62.7	138	178.9	-172.3	-176.4	-179	-92.1	3.4	108.6	F42 P46 S47 S222 R223	F42-R44 HydrophobicContact CE1-CB 3.81Å; F42-R44 HydrophobicContact CZ-CB 3.87Å; F42-R44 HydrophobicContact CZ-CG 4.41Å; R44-P46 VanDerWaalsContact O-CD 3.32Å; R44-P46 WeakPolarHBondContact O-CD 3.48Å; R44-P46 VanDerWaalsContact O-N 3.14Å; R44-S47 PolarHBondContact NH1-OG 3.02Å; R44-S222 PolarHBondContact O-OG 3.42Å; R44-R223 HydrophobicContact CB-CB 4.02Å; R44-R223 PolarHBondContact N-O 3.41Å
45	R	96.8	Very high	98.2	Very high	201 Å²	201	51.9 Å²	51.9	76%	0.758	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-54.2	122.1	168.4	-174.1	174.4	69.2	162.6	2.7	108.9	Y43	Y43-R45 PolarHBondContact O-N 3.29Å
46	P	97.9	Very high	98.2	Very high	13 Å²	13	48.4 Å²	48.4	8%	0.084	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-58.1	145.6	179.7	-24.8	34.5	0	0	0	111.5	Y43 R44 L220 R221 L283	Y43-P46 HydrophobicContact CE1-CG 4.06Å; R44-P46 VanDerWaalsContact O-CD 3.32Å; R44-P46 WeakPolarHBondContact O-CD 3.48Å; R44-P46 VanDerWaalsContact O-N 3.14Å; P46-L220 HydrophobicContact CB-CD2 3.86Å; P46-R221 WeakPolarHBondContact CA-O 3.26Å; P46-L283 WeakPolarHBondContact CG-O 3.28Å
47	S	97.2	Very high	98.2	Very high	35 Å²	35	53.7 Å²	53.7	25%	0.245	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.6	172.9	-50.2	0	0	0	0	107.6	R44 L49 L220 R221	R44-S47 PolarHBondContact NH1-OG 3.02Å; S47-L49 PolarHBondContact O-N 3.5Å; S47-L220 WeakPolarHBondContact O-CA 3.47Å; S47-R221 PolarHBondContact N-O 3.19Å; S47-R221 PolarHBondContact O-N 3.24Å
48	E	98.2	Very high	98.2	Very high	50 Å²	50	51.9 Å²	51.9	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127	173.6	-175.3	174.1	88.2	0	0	109.3	G50 S218 V219 P247 Y251	E48-G50 VanDerWaalsContact CG-O 3.28Å; E48-G50 WeakPolarHBondContact CG-O 3.32Å; E48-S218 VanDerWaalsContact OE2-CB 3.28Å; E48-S218 WeakPolarHBondContact OE2-CB 3.41Å; E48-S218 PolarHBondContact OE2-OG 3.45Å; E48-V219 CarbonylContact C-O 3.5Å; E48-V219 WeakPolarHBondContact CA-O 3.28Å; E48-P247 HydrophobicContact CB-CB 4.07Å; E48-P247 VanDerWaalsContact CD-CB 3.47Å; E48-P247 HydrophobicContact CG-CB 4.41Å; E48-P247 WeakPolarHBondContact OE1-CB 3.48Å; E48-P247 WeakPolarHBondContact OE1-CG 3.27Å; E48-Y251 PolarHBondContact OE1-OH 3.43Å; E48-Y251 VanDerWaalsContact OE2-CE2 3.24Å; E48-Y251 WeakPolarHBondContact OE2-CE2 3.49Å; E48-Y251 PolarHBondContact OE2-OH 3.05Å
49	L	97.4	Very high	98.3	Very high	36 Å²	36	55.8 Å²	55.8	19%	0.188	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-22.6	174.3	-62.2	-178	0	0	0	112	S47 W109 L117 E118 V219 R221 L230	S47-L49 PolarHBondContact O-N 3.5Å; L49-W109 HydrophobicContact CB-CH2 3.66Å; L49-W109 HydrophobicContact CB-CZ2 4.01Å; L49-W109 HydrophobicContact CD1-CH2 4.16Å; L49-L117 HydrophobicContact CD1-CD2 4.17Å; L49-E118 HydrophobicContact CD2-CB 4.46Å; L49-E118 HydrophobicContact CD2-CG 4.3Å; L49-V219 PolarHBondContact N-O 3.18Å; L49-R221 HydrophobicContact CD1-CB 3.9Å; L49-R221 HydrophobicContact CD2-CB 3.79Å; L49-R221 HydrophobicContact CG-CB 3.77Å; L49-L230 HydrophobicContact CD1-CD1 3.98Å; L49-L230 HydrophobicContact CD1-CG 4.47Å
50	G	98	Very high	98.3	Very high	17 Å²	17	52.2 Å²	52.2	18%	0.175	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.3	-167.2	-178.9	0	0	0	0	0	110.9	E48 V219	E48-G50 VanDerWaalsContact CG-O 3.28Å; E48-G50 WeakPolarHBondContact CG-O 3.32Å; G50-V219 PolarHBondContact O-N 3.19Å
51	C	98.7	Very high	98.3	Very high	27 Å²	27	50.1 Å²	50.1	18%	0.182	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	171.7	179.8	60.3	0	0	0	0	111.1	W109 F216 C217	C51-W109 PolarHBondContact O-NE1 2.61Å; C51-F216 HydrophobicContact CB-CE2 3.49Å; C51-F216 VanDerWaalsContact CB-CE2 3.49Å; C51-F216 HydrophobicContact CB-CZ 3.66Å; C51-C217 CarbonylContact C-O 3.55Å; C51-C217 WeakPolarHBondContact CA-O 3.33Å; C51-C217 VanDerWaalsContact CB-O 3.24Å; C51-C217 WeakPolarHBondContact CB-O 3.33Å
52	F	98.9	Very high	98.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	163.6	165.8	58.9	-91.1	0	0	0	109.9	Y60 H61 D63 H105 W109 W131 C217 V219 S232	F52-Y60 HydrophobicContact CB-CD2 4.16Å; F52-Y60 HydrophobicContact CB-CE2 3.41Å; F52-Y60 VanDerWaalsContact CB-CE2 3.41Å; F52-Y60 AromaticContact CD1-CE2 3.99Å; F52-Y60 HydrophobicContact CD1-CE2 3.99Å; F52-Y60 AromaticContact CD2-CD2 3.8Å; F52-Y60 HydrophobicContact CD2-CD2 3.8Å; F52-Y60 AromaticContact CD2-CE2 3.6Å; F52-Y60 HydrophobicContact CD2-CE2 3.6Å; F52-Y60 HydrophobicContact CE2-CD2 4.44Å; F52-Y60 HydrophobicContact CE2-CE2 4.33Å; F52-Y60 HydrophobicContact CG-CD2 4.08Å; F52-Y60 AromaticContact CG-CE2 3.4Å; F52-Y60 HydrophobicContact CG-CE2 3.4Å; F52-H61 CarbonylContact C-O 3.57Å; F52-H61 WeakPolarHBondContact CA-O 3.39Å; F52-H61 WeakPolarHBondContact CB-O 3.44Å; F52-D63 CarbonylContact C-O 3.51Å; F52-D63 VanDerWaalsContact C-O 3.23Å; F52-D63 WeakPolarHBondContact CA-O 3.39Å; F52-H105 HydrophobicContact CE2-CB 3.87Å; F52-H105 HydrophobicContact CZ-CB 4.2Å; F52-W109 HydrophobicContact CD1-CB 3.94Å; F52-W109 AromaticContact CD1-CD1 3.78Å; F52-W109 HydrophobicContact CD1-CG 4.01Å; F52-W109 HydrophobicContact CE1-CB 4.25Å; F52-W131 HydrophobicContact CE2-CH2 4.26Å; F52-W131 AromaticContact CZ-CH2 3.63Å; F52-W131 HydrophobicContact CZ-CH2 3.63Å; F52-W131 HydrophobicContact CZ-CZ3 4.05Å; F52-C217 HydrophobicContact CD1-CB 4.19Å; F52-C217 HydrophobicContact CD2-CB 3.93Å; F52-C217 HydrophobicContact CE1-CB 3.79Å; F52-C217 HydrophobicContact CE2-CB 3.49Å; F52-C217 VanDerWaalsContact CE2-CB 3.49Å; F52-C217 HydrophobicContact CG-CB 4.26Å; F52-C217 HydrophobicContact CZ-CB 3.41Å; F52-C217 VanDerWaalsContact CZ-CB 3.41Å; F52-C217 PolarHBondContact N-O 3.07Å; F52-C217 PolarHBondContact O-N 3.5Å; F52-V219 HydrophobicContact CD1-CG2 3.83Å; F52-V219 HydrophobicContact CE1-CG2 3.68Å; F52-S232 WeakPolarHBondContact CE1-OG 3.18Å
53	S	98.9	Very high	98.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.8	179	-62.5	0	0	0	0	110.7	H61 D63 R65 A66 A215	S53-H61 PolarHBondContact N-O 2.84Å; S53-H61 PolarHBondContact O-N 2.9Å; S53-D63 WeakPolarHBondContact CB-O 3.46Å; S53-D63 PolarHBondContact N-O 2.92Å; S53-D63 VanDerWaalsContact N-O 3.1Å; S53-D63 PolarHBondContact OG-O 2.88Å; S53-R65 PolarHBondContact OG-N 3.22Å; S53-R65 VanDerWaalsContact OG-N 3.14Å; S53-A66 PolarHBondContact OG-N 2.92Å; S53-A215 CarbonylContact C-O 3.6Å; S53-A215 WeakPolarHBondContact CA-O 3.42Å
54	L	98.8	Very high	98.3	Very high	2 Å²	2	50 Å²	50	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.3	165.6	-59.4	172.3	0	0	0	107.4	R58 Q59 H105 N213 V214 A215	L54-R58 VanDerWaalsContact CD1-NH1 3.31Å; L54-Q59 WeakPolarHBondContact CA-O 3.42Å; L54-H105 WeakPolarHBondContact CD1-ND1 3.39Å; L54-N213 WeakPolarHBondContact CB-O 3.29Å; L54-V214 VanDerWaalsContact O-CA 3.27Å; L54-V214 WeakPolarHBondContact O-CA 3.22Å; L54-A215 HydrophobicContact CB-CB 4.33Å; L54-A215 HydrophobicContact CD1-CB 4.37Å; L54-A215 PolarHBondContact N-O 3.39Å; L54-A215 PolarHBondContact O-N 3.39Å
55	D	98.6	Very high	98.3	Very high	34 Å²	34	53.3 Å²	53.3	18%	0.182	27%	0.273	C	S	.	.			trans	-88.5	-173.5	-178.9	69	17.7	0	0	0	113	Q57 R58 Q59 H61 N213	D55-Q57 PolarHBondContact O-N 3.31Å; D55-Q57 VanDerWaalsContact O-N 3.14Å; D55-Q57 VanDerWaalsContact OD1-C 3.31Å; D55-Q57 WeakPolarHBondContact OD1-CA 3.49Å; D55-Q57 PolarHBondContact OD1-N 3.27Å; D55-R58 PolarHBondContact O-N 3.37Å; D55-R58 PolarHBondContact OD1-N 2.81Å; D55-R58 VanDerWaalsContact OD1-N 3.14Å; D55-Q59 PolarHBondContact N-O 2.86Å; D55-Q59 VanDerWaalsContact N-O 3.12Å; D55-Q59 PolarHBondContact OD1-N 2.85Å; D55-Q59 WeakPolarHBondContact OD2-CB 3.48Å; D55-H61 IonicContact OD2-CD2 3.51Å; D55-H61 IonicContact OD2-CE1 3.49Å; D55-H61 IonicContact OD2-NE2 2.66Å; D55-H61 PolarHBondContact OD2-NE2 2.97Å; D55-N213 CarbonylContact O-C 3.49Å
56	A	98.3	Very high	98.4	Very high	35 Å²	35	44.5 Å²	44.5	29%	0.289	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.7	-179.2	0	0	0	0	0	113.7	N211 V214	A56-N211 WeakPolarHBondContact CB-ND2 3.3Å; A56-N211 PolarHBondContact O-ND2 2.94Å; A56-V214 HydrophobicContact CB-CG2 4.16Å
57	Q	98.4	Very high	98.4	Very high	131 Å²	131	45.1 Å²	45.1	61%	0.612	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.4	15.4	176.3	-66.9	72.2	41.7	0	0	111.8	D55 Q59	D55-Q57 PolarHBondContact O-N 3.31Å; D55-Q57 VanDerWaalsContact O-N 3.14Å; D55-Q57 VanDerWaalsContact OD1-C 3.31Å; D55-Q57 WeakPolarHBondContact OD1-CA 3.49Å; D55-Q57 PolarHBondContact OD1-N 3.27Å; Q57-Q59 HydrophobicContact CB-CG 4.14Å; Q57-Q59 PolarHBondContact O-N 2.85Å; Q57-Q59 PolarHBondContact O-NE2 2.87Å
58	R	98.3	Very high	98.5	Very high	44 Å²	44	46.1 Å²	46.1	17%	0.166	24%	0.244	C	C	.	.			trans	60.6	22.6	-178.7	-157	60.2	175.8	176	0.3	113.8	L54 D55 E101 N213	L54-R58 VanDerWaalsContact CD1-NH1 3.31Å; D55-R58 PolarHBondContact O-N 3.37Å; D55-R58 PolarHBondContact OD1-N 2.81Å; D55-R58 VanDerWaalsContact OD1-N 3.14Å; R58-E101 WeakPolarHBondContact CG-OE1 3.4Å; R58-E101 IonicContact CZ-OE1 3.71Å; R58-E101 IonicContact CZ-OE2 2.8Å; R58-E101 IonicContact NE-OE1 3.74Å; R58-E101 PolarHBondContact NE-OE1 2.97Å; R58-E101 IonicContact NE-OE2 3.68Å; R58-E101 PolarHBondContact NE-OE2 3.03Å; R58-E101 IonicContact NH2-OE1 2.77Å; R58-E101 IonicContact NH2-OE2 2.78Å; R58-E101 PolarHBondContact NH2-OE2 3.42Å; R58-N213 HydrophobicContact CB-CB 4.07Å; R58-N213 VanDerWaalsContact CD-O 3.26Å; R58-N213 WeakPolarHBondContact CD-O 3.34Å; R58-N213 PolarHBondContact NH1-O 3.36Å
59	Q	98.6	Very high	98.5	Very high	117 Å²	117	46.6 Å²	46.6	55%	0.547	24%	0.244	S	C	.	.			trans	-82.2	140	177.9	-54.4	-58.5	-64.9	0	0	111	L54 D55 Q57 H61	L54-Q59 WeakPolarHBondContact CA-O 3.42Å; D55-Q59 PolarHBondContact N-O 2.86Å; D55-Q59 VanDerWaalsContact N-O 3.12Å; D55-Q59 PolarHBondContact OD1-N 2.85Å; D55-Q59 WeakPolarHBondContact OD2-CB 3.48Å; Q57-Q59 HydrophobicContact CB-CG 4.14Å; Q57-Q59 PolarHBondContact O-N 2.85Å; Q57-Q59 PolarHBondContact O-NE2 2.87Å; Q59-H61 PolarHBondContact O-CD2 2.97Å
60	Y	98.7	Very high	98.5	Very high	42 Å²	42	46.6 Å²	46.6	17%	0.165	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.1	178.9	176.4	-81.6	0	0	0	112.2	F52 H105 C108 W109 E112	F52-Y60 HydrophobicContact CB-CD2 4.16Å; F52-Y60 HydrophobicContact CB-CE2 3.41Å; F52-Y60 VanDerWaalsContact CB-CE2 3.41Å; F52-Y60 AromaticContact CD1-CE2 3.99Å; F52-Y60 HydrophobicContact CD1-CE2 3.99Å; F52-Y60 AromaticContact CD2-CD2 3.8Å; F52-Y60 HydrophobicContact CD2-CD2 3.8Å; F52-Y60 AromaticContact CD2-CE2 3.6Å; F52-Y60 HydrophobicContact CD2-CE2 3.6Å; F52-Y60 HydrophobicContact CE2-CD2 4.44Å; F52-Y60 HydrophobicContact CE2-CE2 4.33Å; F52-Y60 HydrophobicContact CG-CD2 4.08Å; F52-Y60 AromaticContact CG-CE2 3.4Å; F52-Y60 HydrophobicContact CG-CE2 3.4Å; Y60-H105 HydrophobicContact CD2-CB 4.2Å; Y60-H105 WeakPolarHBondContact CE2-O 3.36Å; Y60-C108 HydrophobicContact CD2-CB 4.34Å; Y60-C108 HydrophobicContact CE1-CB 4.47Å; Y60-C108 HydrophobicContact CE2-CB 4.17Å; Y60-W109 HydrophobicContact CE2-CB 4.29Å; Y60-W109 WeakPolarHBondContact OH-CA 3.2Å; Y60-W109 WeakPolarHBondContact OH-CB 3.04Å; Y60-W109 PolarHBondContact OH-N 2.93Å; Y60-E112 WeakPolarHBondContact CE1-OE1 3.27Å; Y60-E112 WeakPolarHBondContact CE1-OE2 3.36Å; Y60-E112 PolarHBondContact OH-OE2 3.06Å
61	H	98.7	Very high	98.5	Very high	42 Å²	42	46.9 Å²	46.9	19%	0.194	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.3	170.8	-57.6	-84.5	0	0	0	109.7	F52 S53 D55 Q59 D63 R65	F52-H61 CarbonylContact C-O 3.57Å; F52-H61 WeakPolarHBondContact CA-O 3.39Å; F52-H61 WeakPolarHBondContact CB-O 3.44Å; S53-H61 PolarHBondContact N-O 2.84Å; S53-H61 PolarHBondContact O-N 2.9Å; D55-H61 IonicContact OD2-CD2 3.51Å; D55-H61 IonicContact OD2-CE1 3.49Å; D55-H61 IonicContact OD2-NE2 2.66Å; D55-H61 PolarHBondContact OD2-NE2 2.97Å; Q59-H61 PolarHBondContact O-CD2 2.97Å; H61-D63 PolarHBondContact O-N 2.95Å; H61-R65 PolarHBondContact CE1-NH1 3.45Å; H61-R65 VanDerWaalsContact CG-NH1 3.31Å; H61-R65 PolarHBondContact ND1-NH1 2.81Å; H61-R65 PolarHBondContact ND1-NH2 2.77Å
62	G	98.3	Very high	98.4	Very high	47 Å²	47	48.2 Å²	48.2	49%	0.485	25%	0.249	S	C	.	.	S	Bend	trans	-73.9	47.2	179.6	0	0	0	0	0	114.4
63	D	98.6	Very high	98.2	Very high	57 Å²	57	49.9 Å²	49.9	31%	0.305	26%	0.26	S	S	.	.	S	Bend	trans	-149.5	-176.2	178.8	64.3	39.6	0	0	0	112.4	F52 S53 H61 R65	F52-D63 CarbonylContact C-O 3.51Å; F52-D63 VanDerWaalsContact C-O 3.23Å; F52-D63 WeakPolarHBondContact CA-O 3.39Å; S53-D63 WeakPolarHBondContact CB-O 3.46Å; S53-D63 PolarHBondContact N-O 2.92Å; S53-D63 VanDerWaalsContact N-O 3.1Å; S53-D63 PolarHBondContact OG-O 2.88Å; H61-D63 PolarHBondContact O-N 2.95Å; D63-R65 VanDerWaalsContact OD1-CB 3.31Å; D63-R65 WeakPolarHBondContact OD1-CB 3.5Å; D63-R65 WeakPolarHBondContact OD1-CG 3.31Å; D63-R65 IonicContact OD1-CZ 2.77Å; D63-R65 PolarHBondContact OD1-N 3.37Å; D63-R65 IonicContact OD1-NE 2.78Å; D63-R65 PolarHBondContact OD1-NE 3.26Å; D63-R65 IonicContact OD1-NH2 3.3Å; D63-R65 IonicContact OD2-CZ 3.48Å; D63-R65 VanDerWaalsContact OD2-CZ 3.3Å; D63-R65 IonicContact OD2-NE 2.67Å; D63-R65 PolarHBondContact OD2-NE 3.09Å; D63-R65 VanDerWaalsContact OD2-NE 3.12Å; D63-R65 IonicContact OD2-NH2 3.09Å; D63-R65 PolarHBondContact OD2-NH2 2.92Å
64	A	98.5	Very high	97.9	Very high	43 Å²	43	54.8 Å²	54.8	36%	0.355	29%	0.292	S	S	.	.	S	Bend	trans	-99.9	24.1	-176.2	0	0	0	0	0	114.2	A66 L67 F216	A64-A66 PolarHBondContact O-N 2.8Å; A64-A66 VanDerWaalsContact O-N 3.13Å; A64-L67 HydrophobicContact CB-CB 4.25Å; A64-L67 VanDerWaalsContact O-CB 3.29Å; A64-L67 WeakPolarHBondContact O-CB 3.28Å; A64-L67 PolarHBondContact O-N 2.94Å; A64-F216 HydrophobicContact CB-CD2 4.22Å; A64-F216 HydrophobicContact CB-CE2 3.6Å; A64-F216 HydrophobicContact CB-CZ 4.45Å
65	R	98.5	Very high	97.3	Very high	146 Å²	146	61.5 Å²	61.5	55%	0.551	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.2	-176	70.4	-175.9	64.1	-177.4	3.4	114.9	S53 H61 D63	S53-R65 PolarHBondContact OG-N 3.22Å; S53-R65 VanDerWaalsContact OG-N 3.14Å; H61-R65 PolarHBondContact CE1-NH1 3.45Å; H61-R65 VanDerWaalsContact CG-NH1 3.31Å; H61-R65 PolarHBondContact ND1-NH1 2.81Å; H61-R65 PolarHBondContact ND1-NH2 2.77Å; D63-R65 VanDerWaalsContact OD1-CB 3.31Å; D63-R65 WeakPolarHBondContact OD1-CB 3.5Å; D63-R65 WeakPolarHBondContact OD1-CG 3.31Å; D63-R65 IonicContact OD1-CZ 2.77Å; D63-R65 PolarHBondContact OD1-N 3.37Å; D63-R65 IonicContact OD1-NE 2.78Å; D63-R65 PolarHBondContact OD1-NE 3.26Å; D63-R65 IonicContact OD1-NH2 3.3Å; D63-R65 IonicContact OD2-CZ 3.48Å; D63-R65 VanDerWaalsContact OD2-CZ 3.3Å; D63-R65 IonicContact OD2-NE 2.67Å; D63-R65 PolarHBondContact OD2-NE 3.09Å; D63-R65 VanDerWaalsContact OD2-NE 3.12Å; D63-R65 IonicContact OD2-NH2 3.09Å; D63-R65 PolarHBondContact OD2-NH2 2.92Å
66	A	98.5	Very high	96.8	Very high	16 Å²	16	67.8 Å²	67.8	13%	0.132	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-2.7	177.4	0	0	0	0	0	113.4	S53 A64 R68 V214 A215 F216	S53-A66 PolarHBondContact OG-N 2.92Å; A64-A66 PolarHBondContact O-N 2.8Å; A64-A66 VanDerWaalsContact O-N 3.13Å; A66-R68 PolarHBondContact O-N 2.94Å; A66-V214 HydrophobicContact CB-CG1 3.95Å; A66-A215 VanDerWaalsContact CB-O 3.31Å; A66-A215 WeakPolarHBondContact CB-O 3.41Å; A66-F216 HydrophobicContact CB-CB 4.05Å
67	L	98.6	Very high	96.3	Very high	26 Å²	26	67.8 Å²	67.8	14%	0.136	37%	0.37	C	S	.	.			trans	-69.2	123.7	178.1	177.3	60.7	0	0	0	110	A64 F216 T238 Y251	A64-L67 HydrophobicContact CB-CB 4.25Å; A64-L67 VanDerWaalsContact O-CB 3.29Å; A64-L67 WeakPolarHBondContact O-CB 3.28Å; A64-L67 PolarHBondContact O-N 2.94Å; L67-F216 HydrophobicContact CB-CB 4.44Å; L67-F216 HydrophobicContact CB-CD1 4.15Å; L67-F216 HydrophobicContact CB-CD2 3.8Å; L67-F216 HydrophobicContact CB-CE1 4.4Å; L67-F216 HydrophobicContact CB-CE2 4.03Å; L67-F216 HydrophobicContact CB-CG 3.85Å; L67-F216 HydrophobicContact CB-CZ 4.33Å; L67-F216 HydrophobicContact CD1-CD1 3.59Å; L67-F216 HydrophobicContact CD1-CE1 3.68Å; L67-F216 HydrophobicContact CD1-CG 4.16Å; L67-F216 HydrophobicContact CD1-CZ 4.27Å; L67-F216 HydrophobicContact CD2-CE1 4.45Å; L67-F216 HydrophobicContact CD2-CZ 4.27Å; L67-F216 HydrophobicContact CG-CD1 4.39Å; L67-F216 HydrophobicContact CG-CE1 4.39Å; L67-T238 HydrophobicContact CD1-CG2 4.06Å; L67-T238 HydrophobicContact CD2-CG2 3.87Å; L67-T238 HydrophobicContact CG-CG2 4.04Å; L67-Y251 HydrophobicContact CD1-CE1 4.35Å
68	R	98.6	Very high	95.9	Very high	57 Å²	57	67.2 Å²	67.2	22%	0.215	38%	0.378	C	S	.	.			trans	-102.2	164.6	173.3	-61	178.9	-64.9	177.1	-4.9	111.6	A66 E192 C196 C237 T238	A66-R68 PolarHBondContact O-N 2.94Å; R68-E192 IonicContact CZ-OE2 2.69Å; R68-E192 IonicContact NH2-OE2 2.97Å; R68-E192 PolarHBondContact NH2-OE2 3.2Å; R68-C196 HydrophobicContact CB-CB 3.83Å; R68-C237 CarbonylContact O-C 3.55Å; R68-C237 WeakPolarHBondContact O-CA 3.47Å; R68-C237 VanDerWaalsContact O-CB 3.3Å; R68-C237 WeakPolarHBondContact O-CB 3.46Å; R68-T238 PolarHBondContact O-N 3.28Å
69	Y	98.6	Very high	95.6	Very high	60 Å²	60	67.8 Å²	67.8	24%	0.235	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.7	-175.2	-58.6	-86.6	0	0	0	110.9	S71 C196 A197 D198 K199 P200 T238 P240	Y69-S71 PolarHBondContact O-N 2.82Å; Y69-C196 CarbonylContact O-C 3.58Å; Y69-C196 VanDerWaalsContact O-CA 3.29Å; Y69-C196 WeakPolarHBondContact O-CA 3.13Å; Y69-A197 PolarHBondContact N-O 3.07Å; Y69-A197 PolarHBondContact O-N 3.14Å; Y69-D198 WeakPolarHBondContact CE2-O 3.33Å; Y69-K199 VanDerWaalsContact CD2-C 3.4Å; Y69-P200 HydrophobicContact CD1-CB 4.19Å; Y69-P200 HydrophobicContact CD1-CG 3.79Å; Y69-P200 HydrophobicContact CD2-CG 4.29Å; Y69-P200 HydrophobicContact CE1-CB 4.42Å; Y69-P200 HydrophobicContact CE1-CG 3.57Å; Y69-P200 HydrophobicContact CE2-CG 4.11Å; Y69-P200 HydrophobicContact CG-CB 4.44Å; Y69-P200 HydrophobicContact CG-CG 4.14Å; Y69-T238 CarbonylContact C-O 3.57Å; Y69-T238 WeakPolarHBondContact CA-O 3.46Å; Y69-T238 HydrophobicContact CD1-CG2 3.41Å; Y69-T238 VanDerWaalsContact CD1-CG2 3.41Å; Y69-T238 HydrophobicContact CE1-CG2 3.59Å; Y69-T238 HydrophobicContact CG-CG2 4.34Å; Y69-P240 HydrophobicContact CD1-CG 3.9Å; Y69-P240 HydrophobicContact CG-CG 4.47Å
70	Y	98.5	Very high	95.4	Very high	36 Å²	36	63.4 Å²	63.4	14%	0.141	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	120.9	176.2	-176.4	-119.6	0	0	0	110	P72 M195 T238 D239 V252 L254 V290	Y70-P72 HydrophobicContact CD1-CG 4.2Å; Y70-P72 HydrophobicContact CE1-CB 4.09Å; Y70-P72 HydrophobicContact CE1-CG 3.6Å; Y70-P72 HydrophobicContact CE2-CB 4.37Å; Y70-M195 HydrophobicContact CD2-CE 4.45Å; Y70-M195 HydrophobicContact CE2-CE 3.48Å; Y70-M195 VanDerWaalsContact CE2-CE 3.48Å; Y70-T238 PolarHBondContact N-O 3.48Å; Y70-D239 HydrophobicContact CD1-CB 4.18Å; Y70-V252 HydrophobicContact CD2-CG1 4.33Å; Y70-V252 HydrophobicContact CE2-CG1 4.44Å; Y70-L254 HydrophobicContact CD2-CD2 4.18Å; Y70-L254 HydrophobicContact CE2-CD2 4.06Å; Y70-V290 HydrophobicContact CE2-CB 4.41Å; Y70-V290 HydrophobicContact CE2-CG1 4.32Å; Y70-V290 HydrophobicContact CE2-CG2 4.1Å
71	S	97.7	Very high	95.4	Very high	23 Å²	23	66.8 Å²	66.8	16%	0.161	40%	0.4	C	S	.	.			trans	-138.7	76.3	-176.6	-164	0	0	0	0	109.3	Y69 M195 S202 P204	Y69-S71 PolarHBondContact O-N 2.82Å; S71-M195 PolarHBondContact N-O 2.96Å; S71-S202 PolarHBondContact OG-O 3.3Å; S71-P204 WeakPolarHBondContact O-CG 3.47Å
72	P	96.7	Very high	95.4	Very high	54 Å²	54	66 Å²	66	35%	0.351	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-69.4	166.6	-179.6	30.8	-36.1	0	0	0	111.9	Y70 M195	Y70-P72 HydrophobicContact CD1-CG 4.2Å; Y70-P72 HydrophobicContact CE1-CB 4.09Å; Y70-P72 HydrophobicContact CE1-CG 3.6Å; Y70-P72 HydrophobicContact CE2-CB 4.37Å; P72-M195 HydrophobicContact CB-CE 3.88Å
73	P	94.9	Very high	95.4	Very high	36 Å²	36	66 Å²	66	23%	0.234	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-49.5	140.7	171.9	-29.3	35.8	0	0	0	112.8	T75 P80 F82 L303	P73-T75 PolarHBondContact O-N 3.39Å; P73-P80 HydrophobicContact CG-CB 4.23Å; P73-F82 HydrophobicContact CG-CE1 4.26Å; P73-F82 HydrophobicContact CG-CE2 4.43Å; P73-F82 HydrophobicContact CG-CZ 3.55Å; P73-L303 HydrophobicContact CG-CD1 4.04Å
74	P	91.2	Very high	95.4	Very high	103 Å²	103	63.3 Å²	63.3	67%	0.669	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-56.3	137.5	176.4	-24.4	33.4	0	0	0	111.8	N76 G77	P74-N76 PolarHBondContact O-N 2.81Å; P74-G77 PolarHBondContact O-N 2.74Å
75	T	86.9	Confident	95.4	Very high	143 Å²	143	65.8 Å²	65.8	88%	0.877	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-31.8	-175.9	-46.5	0	0	0	0	113.9	P73	P73-T75 PolarHBondContact O-N 3.39Å
76	N	88.5	Confident	95.4	Very high	165 Å²	165	61.5 Å²	61.5	88%	0.882	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	12.5	-179.6	-60.5	-29.3	0	0	0	113.1	P74	P74-N76 PolarHBondContact O-N 2.81Å
77	G	87.7	Confident	95.4	Very high	35 Å²	35	61.4 Å²	61.4	36%	0.361	36%	0.36	S	S	.	.	S	Bend	trans	-90.5	179.4	177.8	0	0	0	0	0	112.9	P74	P74-G77 PolarHBondContact O-N 2.74Å
78	P	90.3	Very high	95.3	Very high	119 Å²	119	63.5 Å²	63.5	77%	0.773	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-57.6	151.7	165	27.6	-33.5	0	0	0	110.2
79	G	91	Very high	95.3	Very high	57 Å²	57	64.5 Å²	64.5	59%	0.588	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-58.2	165.8	170.4	0	0	0	0	0	112.1	N81	G79-N81 PolarHBondContact O-N 3.06Å
80	P	95.7	Very high	95.3	Very high	24 Å²	24	68.8 Å²	68.8	16%	0.156	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-58.1	138.4	177	27.8	-35.5	0	0	0	110.3	P73 F82 V300 S301 L303	P73-P80 HydrophobicContact CG-CB 4.23Å; P80-F82 HydrophobicContact CB-CD2 3.99Å; P80-F82 HydrophobicContact CB-CE1 4.29Å; P80-F82 HydrophobicContact CB-CE2 3.57Å; P80-F82 HydrophobicContact CB-CZ 3.77Å; P80-V300 CarbonylContact C-O 3.51Å; P80-S301 WeakPolarHBondContact O-CA 3.39Å; P80-L303 HydrophobicContact CB-CD1 4.18Å; P80-L303 HydrophobicContact CB-CG 4.34Å; P80-L303 HydrophobicContact CG-CD1 4.11Å; P80-L303 HydrophobicContact CG-CG 4.02Å
81	N	97	Very high	95.3	Very high	114 Å²	114	69.8 Å²	69.8	61%	0.61	41%	0.411	S	S	*	.			trans	-144.9	60.1	171.6	-174.4	36.6	0	0	0	108.8	G79 V300	G79-N81 PolarHBondContact O-N 3.06Å; N81-V300 WeakPolarHBondContact CA-O 3.3Å; N81-V300 PolarHBondContact N-O 3.18Å
82	F	98.4	Very high	95.3	Very high	24 Å²	24	70.7 Å²	70.7	11%	0.105	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	117	-170.8	-50.8	-44.2	0	0	0	110.7	P73 P80 L84 F191 Y194 M195 F299 V300 L303	P73-F82 HydrophobicContact CG-CE1 4.26Å; P73-F82 HydrophobicContact CG-CE2 4.43Å; P73-F82 HydrophobicContact CG-CZ 3.55Å; P80-F82 HydrophobicContact CB-CD2 3.99Å; P80-F82 HydrophobicContact CB-CE1 4.29Å; P80-F82 HydrophobicContact CB-CE2 3.57Å; P80-F82 HydrophobicContact CB-CZ 3.77Å; F82-L84 HydrophobicContact CB-CD2 4.3Å; F82-L84 PolarHBondContact O-N 3.31Å; F82-F191 HydrophobicContact CD2-CD2 4.27Å; F82-F191 HydrophobicContact CD2-CE2 4.18Å; F82-F191 HydrophobicContact CE2-CE2 4.27Å; F82-Y194 HydrophobicContact CB-CD1 4.02Å; F82-Y194 HydrophobicContact CB-CD2 3.66Å; F82-Y194 HydrophobicContact CB-CE1 4.24Å; F82-Y194 HydrophobicContact CB-CE2 3.89Å; F82-Y194 HydrophobicContact CB-CG 3.72Å; F82-Y194 AromaticContact CD1-CD1 3.56Å; F82-Y194 HydrophobicContact CD1-CD1 3.56Å; F82-Y194 HydrophobicContact CD1-CE1 4.19Å; F82-Y194 AromaticContact CD1-CG 3.79Å; F82-Y194 HydrophobicContact CD1-CG 3.79Å; F82-Y194 HydrophobicContact CD2-CG 4.44Å; F82-Y194 HydrophobicContact CE1-CD1 4.23Å; F82-Y194 HydrophobicContact CE1-CG 4.46Å; F82-Y194 AromaticContact CG-CD1 3.99Å; F82-Y194 HydrophobicContact CG-CD1 3.99Å; F82-Y194 HydrophobicContact CG-CD2 4.19Å; F82-Y194 AromaticContact CG-CG 3.75Å; F82-Y194 HydrophobicContact CG-CG 3.75Å; F82-M195 HydrophobicContact CE2-CG 4.37Å; F82-M195 HydrophobicContact CE2-SD 3.53Å; F82-M195 VanDerWaalsContact CE2-SD 3.53Å; F82-M195 HydrophobicContact CZ-SD 3.84Å; F82-F299 CarbonylContact O-C 3.36Å; F82-F299 WeakPolarHBondContact O-CA 3.17Å; F82-V300 HydrophobicContact CB-CB 4.2Å; F82-V300 HydrophobicContact CD2-CB 3.95Å; F82-V300 HydrophobicContact CD2-CG1 3.98Å; F82-V300 PolarHBondContact N-O 3Å; F82-V300 VanDerWaalsContact N-O 3.13Å; F82-V300 PolarHBondContact O-N 3.47Å; F82-L303 HydrophobicContact CE2-CD1 4.39Å
83	D	98.5	Very high	95.4	Very high	48 Å²	48	71.5 Å²	71.5	26%	0.257	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	101.4	172.4	-172.6	-12.9	0	0	0	109.8	R85 D86 Y194 F299	D83-R85 PolarHBondContact O-N 3.46Å; D83-R85 WeakPolarHBondContact OD1-CA 3.42Å; D83-R85 WeakPolarHBondContact OD1-CB 3.37Å; D83-R85 PolarHBondContact OD1-N 2.92Å; D83-D86 HydrophobicContact CB-CB 4.06Å; D83-D86 WeakPolarHBondContact O-CB 3.44Å; D83-D86 PolarHBondContact O-N 2.68Å; D83-D86 PolarHBondContact OD1-N 3.21Å; D83-Y194 PolarHBondContact N-OH 3.23Å; D83-Y194 WeakPolarHBondContact O-CE2 3.44Å; D83-Y194 PolarHBondContact O-OH 3.06Å; D83-F299 HydrophobicContact CB-CD1 3.98Å; D83-F299 HydrophobicContact CB-CE1 3.49Å; D83-F299 VanDerWaalsContact CB-CE1 3.49Å; D83-F299 HydrophobicContact CB-CZ 3.98Å
84	L	98.7	Very high	95.5	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.7	-179.8	-54.8	-175.6	0	0	0	113.4	F82 Y186 M187 F191 Y194 T256 R294 G298 V300	F82-L84 HydrophobicContact CB-CD2 4.3Å; F82-L84 PolarHBondContact O-N 3.31Å; L84-Y186 WeakPolarHBondContact O-CD1 3.36Å; L84-Y186 VanDerWaalsContact O-CE1 3.28Å; L84-Y186 WeakPolarHBondContact O-CE1 3.25Å; L84-M187 HydrophobicContact CB-CB 3.75Å; L84-M187 HydrophobicContact CB-CE 3.8Å; L84-M187 HydrophobicContact CB-CG 3.71Å; L84-M187 HydrophobicContact CD1-CB 4.05Å; L84-M187 HydrophobicContact CD1-CE 4.08Å; L84-M187 HydrophobicContact CG-CE 4.5Å; L84-M187 WeakPolarHBondContact O-CG 3.3Å; L84-F191 HydrophobicContact CD1-CB 4.5Å; L84-F191 HydrophobicContact CD2-CB 3.74Å; L84-F191 HydrophobicContact CD2-CD2 4.34Å; L84-Y194 HydrophobicContact CD2-CD2 4.09Å; L84-Y194 HydrophobicContact CD2-CE2 4.29Å; L84-T256 HydrophobicContact CD1-CG2 4.02Å; L84-R294 HydrophobicContact CD1-CB 4.19Å; L84-G298 VanDerWaalsContact CB-O 3.23Å; L84-G298 WeakPolarHBondContact CB-O 3.17Å; L84-G298 WeakPolarHBondContact CG-O 3.48Å; L84-G298 PolarHBondContact N-O 2.79Å; L84-G298 VanDerWaalsContact N-O 3.11Å; L84-V300 HydrophobicContact CD1-CG2 3.54Å; L84-V300 HydrophobicContact CD2-CG2 4.07Å; L84-V300 HydrophobicContact CG-CG2 3.9Å
85	R	98.4	Very high	95.8	Very high	95 Å²	95	71.7 Å²	71.7	36%	0.358	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-18.1	175.4	-64.8	-176.2	163.7	149.2	8.7	112.6	D83 G87 Y88 E183 D297	D83-R85 PolarHBondContact O-N 3.46Å; D83-R85 WeakPolarHBondContact OD1-CA 3.42Å; D83-R85 WeakPolarHBondContact OD1-CB 3.37Å; D83-R85 PolarHBondContact OD1-N 2.92Å; R85-G87 PolarHBondContact O-N 3.34Å; R85-G87 VanDerWaalsContact O-N 3.12Å; R85-Y88 PolarHBondContact O-N 3.01Å; R85-E183 VanDerWaalsContact CD-OE1 3.24Å; R85-E183 WeakPolarHBondContact CD-OE1 3.49Å; R85-E183 WeakPolarHBondContact CG-OE1 3.37Å; R85-E183 IonicContact CZ-OE1 2.73Å; R85-E183 IonicContact NE-OE1 3.11Å; R85-E183 PolarHBondContact NE-OE1 3.45Å; R85-D297 PolarHBondContact NH1-O 3.48Å
86	D	98.5	Very high	96.3	Very high	56 Å²	56	69.3 Å²	69.3	30%	0.299	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	116.1	177.8	169.4	58.6	0	0	0	111.7	D83 R91 Y186 K190	D83-D86 HydrophobicContact CB-CB 4.06Å; D83-D86 WeakPolarHBondContact O-CB 3.44Å; D83-D86 PolarHBondContact O-N 2.68Å; D83-D86 PolarHBondContact OD1-N 3.21Å; D86-R91 IonicContact OD1-NH2 3.72Å; D86-R91 PolarHBondContact OD1-NH2 2.69Å; D86-R91 IonicContact OD2-CZ 3.9Å; D86-R91 IonicContact OD2-NH1 2.77Å; D86-R91 IonicContact OD2-NH2 3.7Å; D86-R91 PolarHBondContact OD2-NH2 3.28Å; D86-Y186 PolarHBondContact O-OH 3.43Å; D86-K190 WeakPolarHBondContact O-CE 3.48Å; D86-K190 PolarHBondContact O-NZ 3.13Å; D86-K190 IonicContact OD2-NZ 2.88Å; D86-K190 PolarHBondContact OD2-NZ 2.84Å
87	G	98.2	Very high	96.7	Very high	15 Å²	15	64.3 Å²	64.3	16%	0.155	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	96	-5.5	179.5	0	0	0	0	0	115.3	R85 P89 D90 R91 Y186	R85-G87 PolarHBondContact O-N 3.34Å; R85-G87 VanDerWaalsContact O-N 3.12Å; G87-P89 CarbonylContact O-C 3.58Å; G87-D90 PolarHBondContact O-N 3.32Å; G87-D90 VanDerWaalsContact O-N 3.11Å; G87-R91 PolarHBondContact O-N 3.5Å; G87-Y186 WeakPolarHBondContact CA-OH 3.42Å
88	Y	98.2	Very high	97.2	Very high	69 Å²	69	66.6 Å²	66.6	27%	0.271	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	131.9	175.3	-174.6	-99.3	0	0	0	112	R85 Y92 E183 Y186	R85-Y88 PolarHBondContact O-N 3.01Å; Y88-Y92 AromaticContact CD2-CD1 3.94Å; Y88-Y92 HydrophobicContact CD2-CD1 3.94Å; Y88-Y92 HydrophobicContact CD2-CG 4.47Å; Y88-Y92 AromaticContact CE2-CD1 3.76Å; Y88-Y92 HydrophobicContact CE2-CD1 3.76Å; Y88-Y92 HydrophobicContact CE2-CE1 4.18Å; Y88-E183 HydrophobicContact CD1-CB 4.39Å; Y88-E183 HydrophobicContact CD1-CG 4.02Å; Y88-E183 HydrophobicContact CE1-CB 3.96Å; Y88-E183 HydrophobicContact CE1-CG 4.08Å; Y88-E183 HydrophobicContact CG-CG 4.5Å; Y88-Y186 HydrophobicContact CD2-CD1 4.05Å; Y88-Y186 AromaticContact CD2-CD2 3.9Å; Y88-Y186 HydrophobicContact CD2-CD2 3.9Å; Y88-Y186 AromaticContact CD2-CG 3.61Å; Y88-Y186 HydrophobicContact CD2-CG 3.61Å; Y88-Y186 HydrophobicContact CE2-CG 4.46Å; Y88-Y186 HydrophobicContact CG-CD1 4.2Å; Y88-Y186 HydrophobicContact CG-CG 4.23Å
89	P	97.6	Very high	97.5	Very high	78 Å²	78	64.7 Å²	64.7	51%	0.506	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.1	-7.4	-4.8	36.9	-34.6	0	0	0	114.1	G87 R91 Y92	G87-P89 CarbonylContact O-C 3.58Å; P89-R91 VanDerWaalsContact C-N 3.3Å; P89-R91 PolarHBondContact O-N 3.01Å; P89-Y92 WeakPolarHBondContact O-CB 3.42Å; P89-Y92 PolarHBondContact O-N 3.09Å
90	D	98.3	Very high	97.7	Very high	151 Å²	151	66.2 Å²	66.2	81%	0.807	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.4	-163.9	-59.8	-30	0	0	0	115.2	G87	G87-D90 PolarHBondContact O-N 3.32Å; G87-D90 VanDerWaalsContact O-N 3.11Å
91	R	98.3	Very high	97.8	Very high	56 Å²	56	66.8 Å²	66.8	21%	0.211	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	28.1	177.5	-69.8	-172.4	-71.3	135.4	-6.7	112.1	D86 G87 P89 P206 S207 G208 E209 V210	D86-R91 IonicContact OD1-NH2 3.72Å; D86-R91 PolarHBondContact OD1-NH2 2.69Å; D86-R91 IonicContact OD2-CZ 3.9Å; D86-R91 IonicContact OD2-NH1 2.77Å; D86-R91 IonicContact OD2-NH2 3.7Å; D86-R91 PolarHBondContact OD2-NH2 3.28Å; G87-R91 PolarHBondContact O-N 3.5Å; P89-R91 VanDerWaalsContact C-N 3.3Å; P89-R91 PolarHBondContact O-N 3.01Å; R91-P206 PolarHBondContact NH1-O 2.95Å; R91-S207 PolarHBondContact NH1-O 3.33Å; R91-G208 PolarHBondContact NH1-O 2.97Å; R91-E209 HydrophobicContact CB-CG 4.33Å; R91-E209 WeakPolarHBondContact O-CA 3.24Å; R91-V210 PolarHBondContact O-N 3.4Å
92	Y	98.6	Very high	97.8	Very high	42 Å²	42	65.5 Å²	65.5	17%	0.165	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	118.9	178.5	-175.2	-148	0	0	0	112	Y88 P89 P94 Y186 V210 T212	Y88-Y92 AromaticContact CD2-CD1 3.94Å; Y88-Y92 HydrophobicContact CD2-CD1 3.94Å; Y88-Y92 HydrophobicContact CD2-CG 4.47Å; Y88-Y92 AromaticContact CE2-CD1 3.76Å; Y88-Y92 HydrophobicContact CE2-CD1 3.76Å; Y88-Y92 HydrophobicContact CE2-CE1 4.18Å; P89-Y92 WeakPolarHBondContact O-CB 3.42Å; P89-Y92 PolarHBondContact O-N 3.09Å; Y92-P94 HydrophobicContact CD1-CG 4.38Å; Y92-P94 HydrophobicContact CE1-CB 3.95Å; Y92-P94 HydrophobicContact CE1-CG 4.16Å; Y92-P94 HydrophobicContact CE2-CB 4.14Å; Y92-P94 VanDerWaalsContact O-CD 3.22Å; Y92-P94 WeakPolarHBondContact O-CD 3.41Å; Y92-Y186 AromaticContact CD1-CD2 3.97Å; Y92-Y186 HydrophobicContact CD1-CD2 3.97Å; Y92-Y186 AromaticContact CD2-CD2 3.46Å; Y92-Y186 HydrophobicContact CD2-CD2 3.46Å; Y92-Y186 VanDerWaalsContact CD2-CD2 3.46Å; Y92-Y186 AromaticContact CD2-CE2 3.97Å; Y92-Y186 HydrophobicContact CD2-CE2 3.97Å; Y92-Y186 HydrophobicContact CE1-CD2 4.42Å; Y92-Y186 AromaticContact CE2-CD2 3.95Å; Y92-Y186 HydrophobicContact CE2-CD2 3.95Å; Y92-Y186 AromaticContact CG-CD2 3.46Å; Y92-Y186 HydrophobicContact CG-CD2 3.46Å; Y92-Y186 VanDerWaalsContact CG-CD2 3.46Å; Y92-Y186 AromaticContact CG-CE2 3.95Å; Y92-Y186 HydrophobicContact CG-CE2 3.95Å; Y92-Y186 HydrophobicContact CG-CG 4.49Å; Y92-V210 HydrophobicContact CD2-CB 4.26Å; Y92-V210 HydrophobicContact CD2-CG1 4.15Å; Y92-V210 WeakPolarHBondContact CD2-O 3.42Å; Y92-V210 HydrophobicContact CE2-CG1 4.29Å; Y92-T212 HydrophobicContact CE2-CG2 3.84Å
93	Q	98.3	Very high	97.8	Very high	71 Å²	71	64.4 Å²	64.4	33%	0.332	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	83.9	173.3	-65.5	179.8	7.4	0	0	109.4	E209 V210 N211 T212	Q93-E209 PolarHBondContact NE2-OE1 3.15Å; Q93-E209 PolarHBondContact NE2-OE2 3.05Å; Q93-V210 PolarHBondContact N-O 2.87Å; Q93-N211 HydrophobicContact CB-CB 3.99Å; Q93-N211 WeakPolarHBondContact O-CA 3.46Å; Q93-N211 PolarHBondContact OE1-ND2 3.3Å; Q93-T212 PolarHBondContact O-N 2.77Å; Q93-T212 PolarHBondContact O-OG1 3.48Å
94	P	97.7	Very high	97.8	Very high	72 Å²	72	64.5 Å²	64.5	47%	0.468	32%	0.317	S	S	.	.			trans	-66.1	141.3	175.3	26.8	-33	0	0	0	111	Y92 T212	Y92-P94 HydrophobicContact CD1-CG 4.38Å; Y92-P94 HydrophobicContact CE1-CB 3.95Å; Y92-P94 HydrophobicContact CE1-CG 4.16Å; Y92-P94 HydrophobicContact CE2-CB 4.14Å; Y92-P94 VanDerWaalsContact O-CD 3.22Å; Y92-P94 WeakPolarHBondContact O-CD 3.41Å; P94-T212 VanDerWaalsContact CA-OG1 3.28Å; P94-T212 WeakPolarHBondContact CA-OG1 3.33Å
95	R	97.3	Very high	97.8	Very high	72 Å²	72	65.7 Å²	65.7	27%	0.272	32%	0.323	S	S	.	.			trans	-63.6	143.4	168.1	179	174.8	70.5	81.5	1.5	109.6	E97 E101 T212 N213	R95-E97 PolarHBondContact O-N 3.4Å; R95-E97 VanDerWaalsContact O-N 3.15Å; R95-E101 IonicContact NH1-OE2 3.66Å; R95-T212 PolarHBondContact N-OG1 3.27Å; R95-N213 WeakPolarHBondContact CA-OD1 3.32Å; R95-N213 WeakPolarHBondContact CG-OD1 3.46Å
96	D	97.7	Very high	97.8	Very high	93 Å²	93	61.2 Å²	61.2	50%	0.497	31%	0.306	S	S	.	.			trans	-69.5	108.6	173.9	-170.9	-6.4	0	0	0	110.7	E98 V99	D96-E98 VanDerWaalsContact C-N 3.3Å; D96-E98 WeakPolarHBondContact OD1-CB 3.26Å; D96-E98 PolarHBondContact OD1-N 3.18Å; D96-V99 HydrophobicContact CB-CG2 4.09Å; D96-V99 PolarHBondContact O-N 3.41Å
97	E	96.7	Very high	97.8	Very high	60 Å²	60	58.5 Å²	58.5	28%	0.28	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.3	178.4	-64.9	175.5	99.9	0	0	113.4	R95 V99 Q100 R177	R95-E97 PolarHBondContact O-N 3.4Å; R95-E97 VanDerWaalsContact O-N 3.15Å; E97-V99 VanDerWaalsContact C-N 3.3Å; E97-Q100 PolarHBondContact O-NE2 3.38Å; E97-R177 IonicContact OE1-CZ 3.85Å; E97-R177 IonicContact OE1-NH1 2.81Å; E97-R177 IonicContact OE1-NH2 3.4Å; E97-R177 PolarHBondContact OE1-NH2 2.8Å; E97-R177 IonicContact OE2-CZ 3.72Å; E97-R177 IonicContact OE2-NH1 2.7Å; E97-R177 PolarHBondContact OE2-NH1 2.89Å; E97-R177 IonicContact OE2-NH2 2.76Å; E97-R177 PolarHBondContact OE2-NH2 3.37Å
98	E	96.9	Very high	97.8	Very high	82 Å²	82	59.5 Å²	59.5	38%	0.383	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.3	169.7	-71.1	-64.5	116.3	0	0	111.7	D96 Q100 R171 R174	D96-E98 VanDerWaalsContact C-N 3.3Å; D96-E98 WeakPolarHBondContact OD1-CB 3.26Å; D96-E98 PolarHBondContact OD1-N 3.18Å; E98-Q100 PolarHBondContact O-N 2.91Å; E98-R171 IonicContact OE1-CZ 2.74Å; E98-R171 IonicContact OE1-NH1 2.54Å; E98-R171 PolarHBondContact OE1-NH1 3.23Å; E98-R171 IonicContact OE1-NH2 2.8Å; E98-R171 IonicContact OE2-CZ 2.6Å; E98-R171 IonicContact OE2-NH1 2.73Å; E98-R171 PolarHBondContact OE2-NH1 3.38Å; E98-R171 VanDerWaalsContact OE2-NH1 3.11Å; E98-R171 IonicContact OE2-NH2 3.99Å; E98-R171 PolarHBondContact OE2-NH2 3.31Å; E98-R174 IonicContact OE1-CZ 3.59Å; E98-R174 VanDerWaalsContact OE1-CZ 3.24Å; E98-R174 IonicContact OE1-NH1 3.64Å; E98-R174 PolarHBondContact OE1-NH1 2.88Å; E98-R174 IonicContact OE1-NH2 3.65Å; E98-R174 PolarHBondContact OE1-NH2 2.8Å
99	V	96.9	Very high	97.9	Very high	79 Å²	79	56.3 Å²	56.3	48%	0.479	28%	0.283	S	S	.	.	S	Bend	trans	-75.6	106.9	173.7	-176.9	0	0	0	0	109.8	D96 E97 E101	D96-V99 HydrophobicContact CB-CG2 4.09Å; D96-V99 PolarHBondContact O-N 3.41Å; E97-V99 VanDerWaalsContact C-N 3.3Å; V99-E101 HydrophobicContact CG1-CG 4.14Å; V99-E101 PolarHBondContact O-N 3.18Å
100	Q	95.5	Very high	97.8	Very high	89 Å²	89	52.6 Å²	52.6	42%	0.416	26%	0.259	S	S	.	.			trans	-87.2	85.8	179.5	-60.8	-64.5	-39.5	0	0	110.6	E97 E98 R102	E97-Q100 PolarHBondContact O-NE2 3.38Å; E98-Q100 PolarHBondContact O-N 2.91Å; Q100-R102 PolarHBondContact O-N 3.16Å
101	E	97.1	Very high	97.7	Very high	36 Å²	36	46.5 Å²	46.5	17%	0.168	23%	0.227	C	C	.	.			trans	-69.3	-17.3	-177.9	-57	173.2	144.1	0	0	114	R58 R95 V99 L103 D104 H105	R58-E101 WeakPolarHBondContact CG-OE1 3.4Å; R58-E101 IonicContact CZ-OE1 3.71Å; R58-E101 IonicContact CZ-OE2 2.8Å; R58-E101 IonicContact NE-OE1 3.74Å; R58-E101 PolarHBondContact NE-OE1 2.97Å; R58-E101 IonicContact NE-OE2 3.68Å; R58-E101 PolarHBondContact NE-OE2 3.03Å; R58-E101 IonicContact NH2-OE1 2.77Å; R58-E101 IonicContact NH2-OE2 2.78Å; R58-E101 PolarHBondContact NH2-OE2 3.42Å; R95-E101 IonicContact NH1-OE2 3.66Å; V99-E101 HydrophobicContact CG1-CG 4.14Å; V99-E101 PolarHBondContact O-N 3.18Å; E101-L103 PolarHBondContact O-N 2.84Å; E101-L103 VanDerWaalsContact O-N 3.16Å; E101-D104 VanDerWaalsContact O-CB 3.27Å; E101-D104 WeakPolarHBondContact O-CB 3.5Å; E101-D104 PolarHBondContact O-N 3.18Å; E101-H105 IonicContact OE1-CE1 3.86Å; E101-H105 PolarHBondContact OE1-CE1 3.42Å; E101-H105 IonicContact OE2-CE1 3.78Å
102	R	97.8	Very high	97.6	Very high	88 Å²	88	48.9 Å²	48.9	33%	0.332	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	47	-118.7	179.5	-57.5	-173.9	-169.2	-169.2	-1.4	111.9	Q100 W131 P370 Y371 A372 F373	Q100-R102 PolarHBondContact O-N 3.16Å; R102-W131 PolarHBondContact O-NE1 3.32Å; R102-P370 PolarHBondContact NH1-O 2.83Å; R102-P370 PolarHBondContact NH2-O 2.74Å; R102-Y371 PolarHBondContact NH1-O 2.81Å; R102-A372 PolarHBondContact NH1-O 3.18Å; R102-F373 VanDerWaalsContact CD-CB 3.48Å; R102-F373 VanDerWaalsContact NH1-CA 3.33Å; R102-F373 VanDerWaalsContact NH1-CB 3.3Å
103	L	98.7	Very high	97.5	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	2.8	178.5	-59.1	-172.7	0	0	0	113.2	E101 H105 L106 L107 W131 Y161 F373	E101-L103 PolarHBondContact O-N 2.84Å; E101-L103 VanDerWaalsContact O-N 3.16Å; L103-H105 PolarHBondContact O-N 3.44Å; L103-L106 WeakPolarHBondContact O-CA 3.35Å; L103-L106 WeakPolarHBondContact O-CB 3.47Å; L103-L106 PolarHBondContact O-N 3.39Å; L103-L107 HydrophobicContact CB-CD1 4.09Å; L103-L107 HydrophobicContact CB-CG 3.92Å; L103-L107 WeakPolarHBondContact O-CG 3.01Å; L103-L107 PolarHBondContact O-N 3.33Å; L103-W131 HydrophobicContact CD2-CG 4.23Å; L103-Y161 HydrophobicContact CD1-CD1 4.37Å; L103-F373 HydrophobicContact CD1-CD2 4.18Å; L103-F373 HydrophobicContact CD1-CE2 3.71Å; L103-F373 HydrophobicContact CG-CD2 4.41Å; L103-F373 HydrophobicContact CG-CE2 4.4Å
104	D	98.6	Very high	97	Very high	50 Å²	50	49.9 Å²	49.9	27%	0.267	24%	0.243	S	C	.	.	H	α-helix	trans	-55.4	-46.3	-160.3	-68.4	2	0	0	0	113	E101 L106 L107 C108 W377	E101-D104 VanDerWaalsContact O-CB 3.27Å; E101-D104 WeakPolarHBondContact O-CB 3.5Å; E101-D104 PolarHBondContact O-N 3.18Å; D104-L106 PolarHBondContact O-N 2.8Å; D104-L107 PolarHBondContact O-N 3.36Å; D104-L107 VanDerWaalsContact O-N 3.16Å; D104-C108 PolarHBondContact O-N 2.96Å; D104-C108 PolarHBondContact O-SG 2.84Å; D104-C108 VanDerWaalsContact O-SG 3.34Å; D104-W377 HydrophobicContact CB-CZ2 4.24Å
105	H	98.7	Very high	96.4	Very high	26 Å²	26	50.2 Å²	50.2	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-38	177.2	-61	146.6	0	0	0	113.5	F52 L54 Y60 E101 L103 C108 W109 W131	F52-H105 HydrophobicContact CE2-CB 3.87Å; F52-H105 HydrophobicContact CZ-CB 4.2Å; L54-H105 WeakPolarHBondContact CD1-ND1 3.39Å; Y60-H105 HydrophobicContact CD2-CB 4.2Å; Y60-H105 WeakPolarHBondContact CE2-O 3.36Å; E101-H105 IonicContact OE1-CE1 3.86Å; E101-H105 PolarHBondContact OE1-CE1 3.42Å; E101-H105 IonicContact OE2-CE1 3.78Å; L103-H105 PolarHBondContact O-N 3.44Å; H105-C108 PolarHBondContact O-N 2.94Å; H105-W109 PolarHBondContact O-N 2.93Å; H105-W109 VanDerWaalsContact O-N 3.14Å; H105-W131 HydrophobicContact CB-CH2 4.48Å; H105-W131 HydrophobicContact CB-CZ2 4.44Å
106	L	98.8	Very high	96	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69.7	-36.6	175	177.9	55.3	0	0	0	111.2	L103 D104 W109 L110 V129 T130 W131 V219 L230	L103-L106 WeakPolarHBondContact O-CA 3.35Å; L103-L106 WeakPolarHBondContact O-CB 3.47Å; L103-L106 PolarHBondContact O-N 3.39Å; D104-L106 PolarHBondContact O-N 2.8Å; L106-W109 PolarHBondContact O-N 2.71Å; L106-L110 WeakPolarHBondContact O-CB 3.39Å; L106-L110 PolarHBondContact O-N 2.85Å; L106-V129 HydrophobicContact CD2-CG1 3.93Å; L106-V129 HydrophobicContact CG-CG1 4.35Å; L106-T130 VanDerWaalsContact CD2-O 3.26Å; L106-T130 WeakPolarHBondContact CD2-O 3.46Å; L106-W131 HydrophobicContact CB-CH2 4.37Å; L106-W131 HydrophobicContact CB-CZ2 4.11Å; L106-V219 HydrophobicContact CD1-CG1 4.1Å; L106-V219 HydrophobicContact CD1-CG2 4.32Å; L106-L230 HydrophobicContact CD1-CD2 3.96Å; L106-L230 HydrophobicContact CG-CD2 4.5Å
107	L	98.7	Very high	95.7	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-36.5	175.5	-64.5	-178.5	0	0	0	111.8	L103 D104 L110 L111 Y161 L374 P375 W377 Y378	L103-L107 HydrophobicContact CB-CD1 4.09Å; L103-L107 HydrophobicContact CB-CG 3.92Å; L103-L107 WeakPolarHBondContact O-CG 3.01Å; L103-L107 PolarHBondContact O-N 3.33Å; D104-L107 PolarHBondContact O-N 3.36Å; D104-L107 VanDerWaalsContact O-N 3.16Å; L107-L110 PolarHBondContact O-N 2.87Å; L107-L111 PolarHBondContact O-N 3.36Å; L107-Y161 HydrophobicContact CD2-CD1 3.9Å; L107-Y161 HydrophobicContact CD2-CE1 3.65Å; L107-L374 HydrophobicContact CD1-CD2 3.88Å; L107-L374 HydrophobicContact CD2-CD2 4.38Å; L107-P375 HydrophobicContact CD1-CG 4.21Å; L107-W377 HydrophobicContact CB-CH2 3.58Å; L107-W377 HydrophobicContact CB-CZ2 4.45Å; L107-W377 HydrophobicContact CB-CZ3 4.22Å; L107-Y378 HydrophobicContact CB-CD2 3.74Å; L107-Y378 HydrophobicContact CB-CE2 4.08Å; L107-Y378 HydrophobicContact CB-CG 4.21Å; L107-Y378 HydrophobicContact CD1-CD1 4.33Å; L107-Y378 HydrophobicContact CD1-CG 4.18Å; L107-Y378 HydrophobicContact CD2-CD1 4.31Å; L107-Y378 HydrophobicContact CD2-CD2 4.23Å; L107-Y378 HydrophobicContact CD2-CE1 4.01Å; L107-Y378 HydrophobicContact CD2-CE2 3.96Å; L107-Y378 HydrophobicContact CD2-CG 4.42Å; L107-Y378 HydrophobicContact CG-CD2 4.37Å
108	C	98.4	Very high	95.3	Very high	36 Å²	36	56.2 Å²	56.2	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-52	170.6	-71	0	0	0	0	110.9	Y60 D104 H105 L110 L111 E112 W377	Y60-C108 HydrophobicContact CD2-CB 4.34Å; Y60-C108 HydrophobicContact CE1-CB 4.47Å; Y60-C108 HydrophobicContact CE2-CB 4.17Å; D104-C108 PolarHBondContact O-N 2.96Å; D104-C108 PolarHBondContact O-SG 2.84Å; D104-C108 VanDerWaalsContact O-SG 3.34Å; H105-C108 PolarHBondContact O-N 2.94Å; C108-L110 VanDerWaalsContact C-N 3.27Å; C108-L110 PolarHBondContact O-N 3.2Å; C108-L111 PolarHBondContact O-N 3.18Å; C108-E112 WeakPolarHBondContact O-CG 3.21Å; C108-E112 PolarHBondContact O-N 2.86Å; C108-W377 VanDerWaalsContact SG-CH2 3.55Å
109	W	98.5	Very high	94.8	Very high	1 Å²	1	54.6 Å²	54.6	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-56.6	-44	175.9	-176.1	92.1	0	0	0	111.6	L49 C51 F52 Y60 H105 L106 L111 E112 H113 L117 V219 L230	L49-W109 HydrophobicContact CB-CH2 3.66Å; L49-W109 HydrophobicContact CB-CZ2 4.01Å; L49-W109 HydrophobicContact CD1-CH2 4.16Å; C51-W109 PolarHBondContact O-NE1 2.61Å; F52-W109 HydrophobicContact CD1-CB 3.94Å; F52-W109 AromaticContact CD1-CD1 3.78Å; F52-W109 HydrophobicContact CD1-CG 4.01Å; F52-W109 HydrophobicContact CE1-CB 4.25Å; Y60-W109 HydrophobicContact CE2-CB 4.29Å; Y60-W109 WeakPolarHBondContact OH-CA 3.2Å; Y60-W109 WeakPolarHBondContact OH-CB 3.04Å; Y60-W109 PolarHBondContact OH-N 2.93Å; H105-W109 PolarHBondContact O-N 2.93Å; H105-W109 VanDerWaalsContact O-N 3.14Å; L106-W109 PolarHBondContact O-N 2.71Å; W109-L111 PolarHBondContact O-N 3.15Å; W109-E112 PolarHBondContact O-N 3.06Å; W109-H113 AromaticContact CD1-CE1 3.62Å; W109-H113 AromaticContact CD1-ND1 3.67Å; W109-H113 HydrophobicContact CD2-CB 4.42Å; W109-H113 AromaticContact CD2-ND1 3.7Å; W109-H113 AromaticContact CE2-CE1 3.86Å; W109-H113 AromaticContact CE2-CG 3.7Å; W109-H113 AromaticContact CE2-ND1 3.53Å; W109-H113 HydrophobicContact CE3-CB 4.32Å; W109-H113 AromaticContact CG-ND1 3.81Å; W109-H113 HydrophobicContact CH2-CB 3.91Å; W109-H113 HydrophobicContact CZ2-CB 4.02Å; W109-H113 AromaticContact CZ2-CD2 3.98Å; W109-H113 AromaticContact CZ2-CG 3.75Å; W109-H113 HydrophobicContact CZ3-CB 4.05Å; W109-H113 AromaticContact NE1-CE1 3.39Å; W109-H113 PolarHBondContact NE1-CE1 2.9Å; W109-H113 AromaticContact NE1-ND1 3.51Å; W109-H113 AromaticContact NE1-NE2 3.83Å; W109-H113 WeakPolarHBondContact O-CB 3.43Å; W109-H113 PolarHBondContact O-N 3Å; W109-H113 PolarHBondContact O-ND1 3.35Å; W109-L117 HydrophobicContact CH2-CD2 4Å; W109-L117 HydrophobicContact CZ3-CD2 3.93Å; W109-V219 HydrophobicContact CD2-CB 4.11Å; W109-V219 HydrophobicContact CD2-CG1 4.02Å; W109-V219 HydrophobicContact CD2-CG2 3.7Å; W109-V219 HydrophobicContact CE3-CB 4.32Å; W109-V219 HydrophobicContact CE3-CG1 3.71Å; W109-V219 HydrophobicContact CE3-CG2 4.22Å; W109-V219 HydrophobicContact CG-CG2 3.87Å; W109-V219 HydrophobicContact CH2-CB 4.23Å; W109-V219 HydrophobicContact CH2-CG1 3.79Å; W109-V219 HydrophobicContact CZ2-CB 3.98Å; W109-V219 HydrophobicContact CZ2-CG1 4.07Å; W109-V219 HydrophobicContact CZ2-CG2 4.36Å; W109-V219 HydrophobicContact CZ3-CB 4.39Å; W109-V219 HydrophobicContact CZ3-CG1 3.61Å; W109-L230 HydrophobicContact CZ3-CD1 4.26Å
110	L	97.4	Very high	94.3	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-41.7	-179	-172	59.6	0	0	0	111.5	L106 L107 C108 H113 R114 L117 L124 V129 Y161 L230 Y378	L106-L110 WeakPolarHBondContact O-CB 3.39Å; L106-L110 PolarHBondContact O-N 2.85Å; L107-L110 PolarHBondContact O-N 2.87Å; C108-L110 VanDerWaalsContact C-N 3.27Å; C108-L110 PolarHBondContact O-N 3.2Å; L110-H113 PolarHBondContact O-N 3.32Å; L110-R114 WeakPolarHBondContact O-CA 3.21Å; L110-R114 VanDerWaalsContact O-CB 3.3Å; L110-R114 WeakPolarHBondContact O-CB 3.24Å; L110-R114 PolarHBondContact O-N 3.11Å; L110-L117 HydrophobicContact CD1-CD1 3.79Å; L110-L117 HydrophobicContact CD1-CD2 4.4Å; L110-L124 HydrophobicContact CD1-CD1 4.1Å; L110-L124 HydrophobicContact CD1-CD2 4.09Å; L110-L124 HydrophobicContact CD2-CD1 4.24Å; L110-L124 HydrophobicContact CD2-CD2 4.27Å; L110-L124 HydrophobicContact CG-CD2 4.37Å; L110-V129 HydrophobicContact CD2-CG1 4.41Å; L110-V129 HydrophobicContact CD2-CG2 4.29Å; L110-Y161 HydrophobicContact CD2-CE1 4.26Å; L110-L230 HydrophobicContact CD1-CD1 3.9Å; L110-Y378 HydrophobicContact CD2-CE2 4.37Å; L110-Y378 WeakPolarHBondContact CD2-OH 3.22Å
111	L	96.1	Very high	93.8	Very high	24 Å²	24	55.5 Å²	55.5	13%	0.126	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-48.7	172.8	-73.9	-175.1	0	0	0	111.5	L107 C108 W109 H113 R114 W377 Y378 A381 M382	L107-L111 PolarHBondContact O-N 3.36Å; C108-L111 PolarHBondContact O-N 3.18Å; W109-L111 PolarHBondContact O-N 3.15Å; L111-H113 PolarHBondContact O-N 3.49Å; L111-R114 WeakPolarHBondContact O-CG 3.38Å; L111-R114 PolarHBondContact O-NH1 2.78Å; L111-W377 HydrophobicContact CD1-CE3 3.6Å; L111-W377 HydrophobicContact CD1-CZ3 3.46Å; L111-W377 VanDerWaalsContact CD1-CZ3 3.46Å; L111-W377 HydrophobicContact CG-CZ3 4.23Å; L111-Y378 HydrophobicContact CD1-CD2 3.99Å; L111-Y378 HydrophobicContact CD2-CD2 3.64Å; L111-Y378 HydrophobicContact CD2-CE2 3.64Å; L111-Y378 HydrophobicContact CG-CD2 3.55Å; L111-Y378 HydrophobicContact CG-CE2 3.78Å; L111-A381 HydrophobicContact CD1-CB 3.95Å; L111-A381 HydrophobicContact CD2-CB 3.88Å; L111-M382 HydrophobicContact CD2-CG 3.75Å; L111-M382 HydrophobicContact CD2-SD 3.71Å
112	E	95.9	Very high	93.4	Very high	105 Å²	105	56.2 Å²	56.2	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-28.8	-179	-69.5	172.5	168.2	0	0	112.8	Y60 C108 W109	Y60-E112 WeakPolarHBondContact CE1-OE1 3.27Å; Y60-E112 WeakPolarHBondContact CE1-OE2 3.36Å; Y60-E112 PolarHBondContact OH-OE2 3.06Å; C108-E112 WeakPolarHBondContact O-CG 3.21Å; C108-E112 PolarHBondContact O-N 2.86Å; W109-E112 PolarHBondContact O-N 3.06Å
113	H	95.3	Very high	93.2	Very high	45 Å²	45	53.2 Å²	53.2	21%	0.208	31%	0.313	C	S	.	.	H	α-helix	trans	-113.4	-3.6	-171	-61.8	80.3	0	0	0	114.9	W109 L110 L111 G115 R116 L117	W109-H113 AromaticContact CD1-CE1 3.62Å; W109-H113 AromaticContact CD1-ND1 3.67Å; W109-H113 HydrophobicContact CD2-CB 4.42Å; W109-H113 AromaticContact CD2-ND1 3.7Å; W109-H113 AromaticContact CE2-CE1 3.86Å; W109-H113 AromaticContact CE2-CG 3.7Å; W109-H113 AromaticContact CE2-ND1 3.53Å; W109-H113 HydrophobicContact CE3-CB 4.32Å; W109-H113 AromaticContact CG-ND1 3.81Å; W109-H113 HydrophobicContact CH2-CB 3.91Å; W109-H113 HydrophobicContact CZ2-CB 4.02Å; W109-H113 AromaticContact CZ2-CD2 3.98Å; W109-H113 AromaticContact CZ2-CG 3.75Å; W109-H113 HydrophobicContact CZ3-CB 4.05Å; W109-H113 AromaticContact NE1-CE1 3.39Å; W109-H113 PolarHBondContact NE1-CE1 2.9Å; W109-H113 AromaticContact NE1-ND1 3.51Å; W109-H113 AromaticContact NE1-NE2 3.83Å; W109-H113 WeakPolarHBondContact O-CB 3.43Å; W109-H113 PolarHBondContact O-N 3Å; W109-H113 PolarHBondContact O-ND1 3.35Å; L110-H113 PolarHBondContact O-N 3.32Å; L111-H113 PolarHBondContact O-N 3.49Å; H113-G115 PolarHBondContact O-N 3.28Å; H113-G115 VanDerWaalsContact O-N 3.07Å; H113-R116 PolarHBondContact O-N 2.98Å; H113-L117 PolarHBondContact O-N 3.2Å
114	R	88.1	Confident	93.1	Very high	90 Å²	90	54.3 Å²	54.3	34%	0.34	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-52	-36.8	-173.5	65.7	-169.2	-175.6	-91.3	8	114.6	L110 L111 R116 D385	L110-R114 WeakPolarHBondContact O-CA 3.21Å; L110-R114 VanDerWaalsContact O-CB 3.3Å; L110-R114 WeakPolarHBondContact O-CB 3.24Å; L110-R114 PolarHBondContact O-N 3.11Å; L111-R114 WeakPolarHBondContact O-CG 3.38Å; L111-R114 PolarHBondContact O-NH1 2.78Å; R114-R116 VanDerWaalsContact C-N 3.28Å; R114-R116 PolarHBondContact O-N 2.56Å; R114-D385 IonicContact CZ-OD2 3.09Å; R114-D385 IonicContact NE-OD2 2.7Å; R114-D385 PolarHBondContact NE-OD2 3.01Å; R114-D385 IonicContact NH2-OD1 2.66Å; R114-D385 IonicContact NH2-OD2 3.42Å; R114-D385 PolarHBondContact NH2-OD2 2.77Å
115	G	86.2	Confident	92.9	Very high	79 Å²	79	53.9 Å²	53.9	81%	0.814	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-77.5	-5.9	178.5	0	0	0	0	0	115.2	H113	H113-G115 PolarHBondContact O-N 3.28Å; H113-G115 VanDerWaalsContact O-N 3.07Å
116	R	88.6	Confident	92.7	Very high	211 Å²	211	59 Å²	59	80%	0.796	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-122.2	5.5	-175.7	-59.1	179.9	-174.9	168.7	2.9	113.1	H113 R114 E118	H113-R116 PolarHBondContact O-N 2.98Å; R114-R116 VanDerWaalsContact C-N 3.28Å; R114-R116 PolarHBondContact O-N 2.56Å; R116-E118 PolarHBondContact O-N 3.37Å
117	L	91.6	Very high	92.7	Very high	34 Å²	34	59 Å²	59	18%	0.178	35%	0.347	C	S	.	.			trans	-63	132.2	179.9	-65.9	177	0	0	0	111	L49 W109 L110 H113 L124 L230	L49-L117 HydrophobicContact CD1-CD2 4.17Å; W109-L117 HydrophobicContact CH2-CD2 4Å; W109-L117 HydrophobicContact CZ3-CD2 3.93Å; L110-L117 HydrophobicContact CD1-CD1 3.79Å; L110-L117 HydrophobicContact CD1-CD2 4.4Å; H113-L117 PolarHBondContact O-N 3.2Å; L117-L124 HydrophobicContact CD1-CB 4.18Å; L117-L124 HydrophobicContact CD1-CD1 4.29Å; L117-L124 HydrophobicContact CD1-CD2 3.97Å; L117-L124 HydrophobicContact CD1-CG 4.38Å; L117-L230 HydrophobicContact CD2-CD1 4.17Å
118	E	87.9	Confident	92.7	Very high	106 Å²	106	59 Å²	59	50%	0.495	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	155.1	173	-58.5	-178.2	171.7	0	0	111.8	L49 R116 R221	L49-E118 HydrophobicContact CD2-CB 4.46Å; L49-E118 HydrophobicContact CD2-CG 4.3Å; R116-E118 PolarHBondContact O-N 3.37Å; E118-R221 IonicContact OE2-NH1 3.68Å
119	G	86.1	Confident	92.7	Very high	48 Å²	48	57.3 Å²	57.3	50%	0.495	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	116.2	-8.9	175	0	0	0	0	0	115.1
120	G	86.7	Confident	92.7	Very high	44 Å²	44	57.3 Å²	57.3	45%	0.454	34%	0.335	S	S	.	.			trans	93	172.8	177.4	0	0	0	0	0	113.1	G122 W123	G120-G122 PolarHBondContact O-N 2.88Å; G120-W123 WeakPolarHBondContact O-CB 3.44Å; G120-W123 PolarHBondContact O-N 3.22Å
121	P	83.8	Confident	92.8	Very high	143 Å²	143	59.4 Å²	59.4	93%	0.929	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	134.1	179.2	-23.8	34	0	0	0	111.5	W123	P121-W123 VanDerWaalsContact C-N 3.28Å; P121-W123 PolarHBondContact O-N 2.96Å
122	G	88.9	Confident	92.9	Very high	51 Å²	51	59 Å²	59	53%	0.526	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-2.5	177.6	0	0	0	0	0	115.6	G120 L124 A125	G120-G122 PolarHBondContact O-N 2.88Å; G122-L124 VanDerWaalsContact C-N 3.29Å; G122-L124 PolarHBondContact O-N 2.6Å; G122-A125 WeakPolarHBondContact O-CB 3.23Å; G122-A125 PolarHBondContact O-N 2.68Å
123	W	95.4	Very high	93.1	Very high	25 Å²	25	55.6 Å²	55.6	10%	0.095	33%	0.333	C	S	.	.	H	α-helix	trans	-55.9	-42.1	-179.7	177.5	75.7	0	0	0	113.1	G120 P121 A125 E126 A127 R221 P228 L230	G120-W123 WeakPolarHBondContact O-CB 3.44Å; G120-W123 PolarHBondContact O-N 3.22Å; P121-W123 VanDerWaalsContact C-N 3.28Å; P121-W123 PolarHBondContact O-N 2.96Å; W123-A125 VanDerWaalsContact C-N 3.31Å; W123-A125 PolarHBondContact O-N 3.17Å; W123-E126 PolarHBondContact O-N 2.86Å; W123-A127 HydrophobicContact CH2-CB 4.31Å; W123-A127 HydrophobicContact CZ2-CB 4.34Å; W123-A127 HydrophobicContact CZ3-CB 4.49Å; W123-A127 PolarHBondContact O-N 3.16Å; W123-R221 HydrophobicContact CH2-CG 3.85Å; W123-R221 HydrophobicContact CZ2-CG 3.6Å; W123-R221 VanDerWaalsContact CZ2-NE 3.34Å; W123-P228 HydrophobicContact CZ2-CB 4.17Å; W123-L230 HydrophobicContact CH2-CB 3.97Å; W123-L230 HydrophobicContact CH2-CD1 4.23Å; W123-L230 HydrophobicContact CZ3-CB 4.39Å; W123-L230 HydrophobicContact CZ3-CD1 3.95Å
124	L	95.8	Very high	93.2	Very high	22 Å²	22	54.3 Å²	54.3	12%	0.115	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-38.2	177.9	-176.7	61.8	0	0	0	111.7	L110 L117 G122 E126 A127 V129 T159 M382	L110-L124 HydrophobicContact CD1-CD1 4.1Å; L110-L124 HydrophobicContact CD1-CD2 4.09Å; L110-L124 HydrophobicContact CD2-CD1 4.24Å; L110-L124 HydrophobicContact CD2-CD2 4.27Å; L110-L124 HydrophobicContact CG-CD2 4.37Å; L117-L124 HydrophobicContact CD1-CB 4.18Å; L117-L124 HydrophobicContact CD1-CD1 4.29Å; L117-L124 HydrophobicContact CD1-CD2 3.97Å; L117-L124 HydrophobicContact CD1-CG 4.38Å; G122-L124 VanDerWaalsContact C-N 3.29Å; G122-L124 PolarHBondContact O-N 2.6Å; L124-E126 PolarHBondContact O-N 2.9Å; L124-E126 VanDerWaalsContact O-N 3.12Å; L124-A127 HydrophobicContact CD1-CB 4.49Å; L124-A127 WeakPolarHBondContact O-CB 3.28Å; L124-A127 PolarHBondContact O-N 3.16Å; L124-V129 HydrophobicContact CD1-CG2 3.93Å; L124-T159 HydrophobicContact CD1-CG2 4.07Å; L124-T159 HydrophobicContact CG-CG2 4.32Å; L124-T159 WeakPolarHBondContact O-CG2 3.15Å; L124-T159 PolarHBondContact O-OG1 3.43Å; L124-M382 HydrophobicContact CD2-CE 4.14Å
125	A	95.1	Very high	93.8	Very high	41 Å²	41	50.1 Å²	50.1	34%	0.339	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-14.9	-179.9	0	0	0	0	0	113.6	G122 W123 Q157 G158 T159	G122-A125 WeakPolarHBondContact O-CB 3.23Å; G122-A125 PolarHBondContact O-N 2.68Å; W123-A125 VanDerWaalsContact C-N 3.31Å; W123-A125 PolarHBondContact O-N 3.17Å; A125-Q157 WeakPolarHBondContact CA-O 3.22Å; A125-Q157 WeakPolarHBondContact CB-O 3.32Å; A125-G158 CarbonylContact O-C 2.89Å; A125-G158 VanDerWaalsContact O-CA 3.26Å; A125-G158 WeakPolarHBondContact O-CA 3.09Å; A125-T159 PolarHBondContact O-N 2.87Å
126	E	94.5	Very high	94.4	Very high	135 Å²	135	47.2 Å²	47.2	63%	0.631	28%	0.278	S	S	*	.	H	α-helix	trans	-102.5	-10.8	172.2	-61.6	-173	163.6	0	0	112.8	W123 L124 P228	W123-E126 PolarHBondContact O-N 2.86Å; L124-E126 PolarHBondContact O-N 2.9Å; L124-E126 VanDerWaalsContact O-N 3.12Å; E126-P228 HydrophobicContact CB-CG 4.36Å; E126-P228 WeakPolarHBondContact O-CD 3.45Å
127	A	97.9	Very high	94.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	26%	0.256	C	S	.	.			trans	-81.7	160.6	-172.9	0	0	0	0	0	112.7	W123 L124 L160 P228	W123-A127 HydrophobicContact CH2-CB 4.31Å; W123-A127 HydrophobicContact CZ2-CB 4.34Å; W123-A127 HydrophobicContact CZ3-CB 4.49Å; W123-A127 PolarHBondContact O-N 3.16Å; L124-A127 HydrophobicContact CD1-CB 4.49Å; L124-A127 WeakPolarHBondContact O-CB 3.28Å; L124-A127 PolarHBondContact O-N 3.16Å; A127-L160 PolarHBondContact O-N 2.89Å; A127-L160 VanDerWaalsContact O-N 3.09Å; A127-P228 WeakPolarHBondContact CA-O 3.3Å; A127-P228 HydrophobicContact CB-CB 4.21Å
128	I	98.8	Very high	95.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123	169.1	-52.8	178.2	0	0	0	107.9	L160 L162 H227 P228 L229 L230 L335 Q339	I128-L160 CarbonylContact C-O 3.55Å; I128-L160 VanDerWaalsContact CA-O 3.22Å; I128-L160 WeakPolarHBondContact CA-O 3.26Å; I128-L160 HydrophobicContact CD1-CD2 4.29Å; I128-L160 HydrophobicContact CG1-CB 4.26Å; I128-L160 HydrophobicContact CG1-CD2 4.31Å; I128-L160 HydrophobicContact CG2-CD2 4.49Å; I128-L162 HydrophobicContact CG2-CD1 3.74Å; I128-L162 HydrophobicContact CG2-CG 3.94Å; I128-H227 HydrophobicContact CD1-CB 4.06Å; I128-P228 PolarHBondContact N-O 2.78Å; I128-L229 HydrophobicContact CB-CD2 3.95Å; I128-L229 HydrophobicContact CD1-CD2 4.44Å; I128-L230 PolarHBondContact O-N 3.24Å; I128-L335 HydrophobicContact CD1-CB 3.84Å; I128-L335 HydrophobicContact CD1-CD1 4.2Å; I128-L335 HydrophobicContact CD1-CD2 3.67Å; I128-L335 HydrophobicContact CD1-CG 4.07Å; I128-L335 HydrophobicContact CG2-CD2 4.36Å; I128-Q339 HydrophobicContact CD1-CG 4.23Å
129	V	98.8	Very high	95.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.2	-178.1	178	0	0	0	0	110.1	L106 L110 L124 T159 L160 Y161 L162 L230	L106-V129 HydrophobicContact CD2-CG1 3.93Å; L106-V129 HydrophobicContact CG-CG1 4.35Å; L110-V129 HydrophobicContact CD2-CG1 4.41Å; L110-V129 HydrophobicContact CD2-CG2 4.29Å; L124-V129 HydrophobicContact CD1-CG2 3.93Å; V129-T159 HydrophobicContact CB-CG2 4.33Å; V129-T159 HydrophobicContact CG2-CG2 3.51Å; V129-L160 PolarHBondContact N-O 2.59Å; V129-Y161 HydrophobicContact CB-CD1 3.6Å; V129-Y161 HydrophobicContact CB-CE1 3.82Å; V129-Y161 HydrophobicContact CB-CG 4.37Å; V129-Y161 HydrophobicContact CG1-CD1 3.78Å; V129-Y161 HydrophobicContact CG1-CE1 3.94Å; V129-Y161 HydrophobicContact CG2-CD1 4.28Å; V129-Y161 HydrophobicContact CG2-CE1 4.01Å; V129-Y161 WeakPolarHBondContact O-CA 3.39Å; V129-L162 PolarHBondContact O-N 3.41Å; V129-L230 VanDerWaalsContact CA-O 3.28Å; V129-L230 WeakPolarHBondContact CA-O 3.5Å; V129-L230 HydrophobicContact CG1-CD2 4.13Å; V129-L230 HydrophobicContact CG2-CB 4.24Å; V129-L230 HydrophobicContact CG2-CD2 4.35Å
130	T	98.9	Very high	96.3	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	179.4	-178.9	-165.6	0	0	0	0	113	L106 H134 L135 L162 L230 F231 S232	L106-T130 VanDerWaalsContact CD2-O 3.26Å; L106-T130 WeakPolarHBondContact CD2-O 3.46Å; T130-H134 PolarHBondContact OG1-CD2 2.7Å; T130-H134 VanDerWaalsContact OG1-CD2 3.25Å; T130-L135 HydrophobicContact CG2-CD1 3.96Å; T130-L135 HydrophobicContact CG2-CD2 3.84Å; T130-L135 HydrophobicContact CG2-CG 3.63Å; T130-L162 WeakPolarHBondContact CB-O 3.38Å; T130-L162 PolarHBondContact OG1-O 2.68Å; T130-L230 PolarHBondContact N-O 2.78Å; T130-F231 HydrophobicContact CG2-CB 4.31Å; T130-F231 WeakPolarHBondContact O-CA 3.28Å; T130-F231 WeakPolarHBondContact O-CB 3.12Å; T130-S232 PolarHBondContact O-N 2.91Å
131	W	98.9	Very high	96.9	Very high	44 Å²	44	30.4 Å²	30.4	17%	0.167	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	146	167	-71	111.8	0	0	0	112	F52 R102 L103 H105 L106 G133 H134 L135 S232	F52-W131 HydrophobicContact CE2-CH2 4.26Å; F52-W131 AromaticContact CZ-CH2 3.63Å; F52-W131 HydrophobicContact CZ-CH2 3.63Å; F52-W131 HydrophobicContact CZ-CZ3 4.05Å; R102-W131 PolarHBondContact O-NE1 3.32Å; L103-W131 HydrophobicContact CD2-CG 4.23Å; H105-W131 HydrophobicContact CB-CH2 4.48Å; H105-W131 HydrophobicContact CB-CZ2 4.44Å; L106-W131 HydrophobicContact CB-CH2 4.37Å; L106-W131 HydrophobicContact CB-CZ2 4.11Å; W131-G133 PolarHBondContact O-N 3.1Å; W131-H134 AromaticContact CD1-CE1 3.76Å; W131-H134 AromaticContact CD1-NE2 3.62Å; W131-H134 WeakPolarHBondContact O-CB 3.31Å; W131-H134 PolarHBondContact O-N 3.45Å; W131-L135 PolarHBondContact O-N 2.74Å; W131-S232 VanDerWaalsContact CE3-O 3.29Å; W131-S232 VanDerWaalsContact CZ3-CB 3.46Å; W131-S232 VanDerWaalsContact CZ3-OG 3.32Å; W131-S232 WeakPolarHBondContact CZ3-OG 3.03Å
132	R	98.8	Very high	97.6	Very high	16 Å²	16	24.3 Å²	24.3	6%	0.06	14%	0.142	C	C	.	.	H	α-helix	trans	-49.6	-42.1	170.3	-177.9	-83.5	-53.2	-76	-8.4	111.6	H134 L135 T136 F231 S232 E234 Q280 L283 P284	R132-H134 VanDerWaalsContact C-N 3.27Å; R132-H134 PolarHBondContact O-N 3.31Å; R132-L135 PolarHBondContact O-N 3.34Å; R132-T136 WeakPolarHBondContact CD-OG1 3.28Å; R132-T136 PolarHBondContact O-N 3.22Å; R132-T136 PolarHBondContact O-OG1 3.14Å; R132-T136 VanDerWaalsContact O-OG1 3.1Å; R132-F231 HydrophobicContact CB-CD2 3.86Å; R132-F231 HydrophobicContact CB-CE2 4.31Å; R132-F231 HydrophobicContact CG-CD2 4.36Å; R132-F231 HydrophobicContact CG-CE2 4.32Å; R132-S232 VanDerWaalsContact CB-O 3.25Å; R132-S232 WeakPolarHBondContact CB-O 3.39Å; R132-S232 PolarHBondContact N-O 3.5Å; R132-E234 PolarHBondContact NH2-O 2.87Å; R132-Q280 WeakPolarHBondContact CD-O 3.38Å; R132-Q280 PolarHBondContact NH1-O 2.94Å; R132-L283 HydrophobicContact CG-CB 4.27Å; R132-L283 HydrophobicContact CG-CD1 4.45Å; R132-P284 HydrophobicContact CG-CG 4.48Å
133	G	98.5	Very high	98.1	Very high	33 Å²	33	24.5 Å²	24.5	34%	0.34	13%	0.127	S	C	.	.	H	α-helix	trans	-60	-33.6	179.6	0	0	0	0	0	113.9	W131 T136 K137	W131-G133 PolarHBondContact O-N 3.1Å; G133-T136 WeakPolarHBondContact O-CB 3.28Å; G133-T136 PolarHBondContact O-N 3.12Å; G133-K137 PolarHBondContact O-N 2.83Å; G133-K137 VanDerWaalsContact O-N 3.11Å
134	H	98.8	Very high	98.2	Very high	18 Å²	18	24.6 Å²	24.6	8%	0.083	13%	0.129	C	C	.	.	H	α-helix	trans	-71.5	-43.1	178	-55.9	4.6	0	0	0	110.5	T130 W131 R132 T136 K137 L138 L151 L162 E164	T130-H134 PolarHBondContact OG1-CD2 2.7Å; T130-H134 VanDerWaalsContact OG1-CD2 3.25Å; W131-H134 AromaticContact CD1-CE1 3.76Å; W131-H134 AromaticContact CD1-NE2 3.62Å; W131-H134 WeakPolarHBondContact O-CB 3.31Å; W131-H134 PolarHBondContact O-N 3.45Å; R132-H134 VanDerWaalsContact C-N 3.27Å; R132-H134 PolarHBondContact O-N 3.31Å; H134-T136 VanDerWaalsContact C-N 3.32Å; H134-T136 PolarHBondContact O-N 3.23Å; H134-K137 PolarHBondContact O-N 2.9Å; H134-L138 PolarHBondContact O-N 3.49Å; H134-L138 VanDerWaalsContact O-N 3.14Å; H134-L151 HydrophobicContact CB-CD2 3.97Å; H134-L162 PolarHBondContact CD2-O 3.43Å; H134-E164 PolarHBondContact CD2-N 3.5Å; H134-E164 VanDerWaalsContact CD2-N 3.28Å; H134-E164 WeakPolarHBondContact CE1-CB 3.42Å; H134-E164 IonicContact ND1-OE2 3.29Å; H134-E164 PolarHBondContact NE2-N 3.47Å
135	L	98.9	Very high	98.3	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-39.2	172.5	-63.3	177.8	0	0	0	111.7	T130 W131 R132 K137 L138 L139 L229 F231 L283	T130-L135 HydrophobicContact CG2-CD1 3.96Å; T130-L135 HydrophobicContact CG2-CD2 3.84Å; T130-L135 HydrophobicContact CG2-CG 3.63Å; W131-L135 PolarHBondContact O-N 2.74Å; R132-L135 PolarHBondContact O-N 3.34Å; L135-K137 VanDerWaalsContact C-N 3.34Å; L135-K137 PolarHBondContact O-N 2.85Å; L135-L138 HydrophobicContact CD2-CD1 4.24Å; L135-L138 WeakPolarHBondContact O-CB 3.45Å; L135-L138 PolarHBondContact O-N 3.23Å; L135-L139 WeakPolarHBondContact O-CD1 3.4Å; L135-L139 PolarHBondContact O-N 2.98Å; L135-L229 HydrophobicContact CD1-CD1 4.32Å; L135-F231 HydrophobicContact CD1-CB 4.19Å; L135-F231 HydrophobicContact CD1-CD1 3.98Å; L135-F231 HydrophobicContact CD1-CD2 4.47Å; L135-F231 HydrophobicContact CD1-CG 3.95Å; L135-L283 HydrophobicContact CB-CD1 3.59Å; L135-L283 HydrophobicContact CB-CD2 4.28Å; L135-L283 HydrophobicContact CD1-CD2 4.48Å
136	T	98.9	Very high	98.4	Very high	19 Å²	19	38.7 Å²	38.7	12%	0.117	18%	0.179	C	C	.	.	H	α-helix	trans	-58.1	-45.9	174.5	-61.2	0	0	0	0	111.2	R132 G133 H134 L138 L139 T140 A279 Q280	R132-T136 WeakPolarHBondContact CD-OG1 3.28Å; R132-T136 PolarHBondContact O-N 3.22Å; R132-T136 PolarHBondContact O-OG1 3.14Å; R132-T136 VanDerWaalsContact O-OG1 3.1Å; G133-T136 WeakPolarHBondContact O-CB 3.28Å; G133-T136 PolarHBondContact O-N 3.12Å; H134-T136 VanDerWaalsContact C-N 3.32Å; H134-T136 PolarHBondContact O-N 3.23Å; T136-L138 VanDerWaalsContact C-N 3.32Å; T136-L138 PolarHBondContact O-N 3.12Å; T136-L139 WeakPolarHBondContact O-CB 3.38Å; T136-L139 PolarHBondContact O-N 3.43Å; T136-T140 WeakPolarHBondContact O-CG2 3.37Å; T136-T140 PolarHBondContact O-N 3.46Å; T136-T140 PolarHBondContact O-OG1 2.67Å; T136-A279 HydrophobicContact CG2-CB 3.9Å; T136-Q280 HydrophobicContact CG2-CB 4.29Å
137	K	98.8	Very high	98.5	Very high	78 Å²	78	37.2 Å²	37.2	34%	0.339	17%	0.172	S	C	.	.	H	α-helix	trans	-57.3	-47.3	176.5	-74.6	-176.9	172.7	174.3	0	110.9	G133 H134 L135 L139 T140 T141 W149 E164	G133-K137 PolarHBondContact O-N 2.83Å; G133-K137 VanDerWaalsContact O-N 3.11Å; H134-K137 PolarHBondContact O-N 2.9Å; L135-K137 VanDerWaalsContact C-N 3.34Å; L135-K137 PolarHBondContact O-N 2.85Å; K137-L139 PolarHBondContact O-N 3.1Å; K137-T140 PolarHBondContact O-N 3.03Å; K137-T140 VanDerWaalsContact O-N 3.15Å; K137-T140 PolarHBondContact O-OG1 3.32Å; K137-T141 PolarHBondContact O-N 3.08Å; K137-T141 PolarHBondContact O-OG1 3.36Å; K137-W149 HydrophobicContact CD-CB 4.3Å; K137-E164 VanDerWaalsContact CD-OE1 3.27Å; K137-E164 WeakPolarHBondContact CD-OE1 3.48Å; K137-E164 WeakPolarHBondContact CE-OE1 3.38Å; K137-E164 IonicContact NZ-OE1 3.4Å; K137-E164 PolarHBondContact NZ-OE1 3.21Å; K137-E164 IonicContact NZ-OE2 3.73Å; K137-E164 PolarHBondContact NZ-OE2 2.87Å
138	L	98.9	Very high	98.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.6	-50.5	174.1	-65.3	176.5	0	0	0	112.2	H134 L135 T136 T140 T141 W149 L151 F330 C331 F334	H134-L138 PolarHBondContact O-N 3.49Å; H134-L138 VanDerWaalsContact O-N 3.14Å; L135-L138 HydrophobicContact CD2-CD1 4.24Å; L135-L138 WeakPolarHBondContact O-CB 3.45Å; L135-L138 PolarHBondContact O-N 3.23Å; T136-L138 VanDerWaalsContact C-N 3.32Å; T136-L138 PolarHBondContact O-N 3.12Å; L138-T140 PolarHBondContact O-N 3.31Å; L138-T141 WeakPolarHBondContact O-CB 3.45Å; L138-T141 PolarHBondContact O-N 3.32Å; L138-T141 PolarHBondContact O-OG1 2.78Å; L138-W149 HydrophobicContact CD2-CH2 3.73Å; L138-W149 HydrophobicContact CD2-CZ2 3.69Å; L138-W149 HydrophobicContact CD2-CZ3 4.42Å; L138-L151 HydrophobicContact CD1-CD1 4.24Å; L138-L151 HydrophobicContact CD2-CD1 3.78Å; L138-L151 HydrophobicContact CG-CD1 4.04Å; L138-F330 HydrophobicContact CB-CE1 4.41Å; L138-F330 HydrophobicContact CD2-CE1 4.29Å; L138-F330 WeakPolarHBondContact O-CD1 3.44Å; L138-F330 WeakPolarHBondContact O-CE1 3.44Å; L138-C331 HydrophobicContact CB-CB 4.44Å; L138-F334 HydrophobicContact CD1-CD1 3.37Å; L138-F334 HydrophobicContact CD1-CE1 3.65Å; L138-F334 HydrophobicContact CD1-CG 4.12Å; L138-F334 HydrophobicContact CD2-CB 4.36Å; L138-F334 HydrophobicContact CD2-CD1 3.66Å; L138-F334 HydrophobicContact CD2-CD2 3.83Å; L138-F334 HydrophobicContact CD2-CE1 3.85Å; L138-F334 HydrophobicContact CD2-CE2 4Å; L138-F334 HydrophobicContact CD2-CG 3.65Å; L138-F334 HydrophobicContact CD2-CZ 4.02Å; L138-F334 HydrophobicContact CG-CD1 4.16Å; L138-F334 HydrophobicContact CG-CE1 4.39Å
139	L	98.9	Very high	98.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-55.9	-36.9	179	-95.7	65.3	0	0	0	112.1	L135 T136 K137 W278 A279 L283 C327 M328 C331	L135-L139 WeakPolarHBondContact O-CD1 3.4Å; L135-L139 PolarHBondContact O-N 2.98Å; T136-L139 WeakPolarHBondContact O-CB 3.38Å; T136-L139 PolarHBondContact O-N 3.43Å; K137-L139 PolarHBondContact O-N 3.1Å; L139-W278 HydrophobicContact CD2-CH2 4.19Å; L139-W278 HydrophobicContact CD2-CZ3 4.04Å; L139-A279 HydrophobicContact CB-CB 3.93Å; L139-A279 HydrophobicContact CD2-CB 3.81Å; L139-L283 HydrophobicContact CD1-CD1 4.36Å; L139-L283 HydrophobicContact CD1-CD2 4.05Å; L139-L283 HydrophobicContact CD2-CD1 4.05Å; L139-L283 HydrophobicContact CD2-CD2 4.02Å; L139-L283 HydrophobicContact CD2-CG 3.86Å; L139-C327 HydrophobicContact CB-CB 4.16Å; L139-C327 HydrophobicContact CG-CB 4.2Å; L139-C327 VanDerWaalsContact O-CA 3.31Å; L139-C327 WeakPolarHBondContact O-CA 3.31Å; L139-C327 WeakPolarHBondContact O-CB 3.43Å; L139-C327 PolarHBondContact O-SG 3.08Å; L139-M328 HydrophobicContact CD1-SD 4.06Å; L139-M328 HydrophobicContact CD2-SD 3.6Å; L139-M328 HydrophobicContact CG-SD 3.82Å; L139-C331 HydrophobicContact CD1-CB 3.63Å
140	T	98.8	Very high	98.5	Very high	10 Å²	10	40 Å²	40	6%	0.061	19%	0.188	C	C	.	.	H	α-helix	trans	-87.6	-16.9	-176.8	58.5	0	0	0	0	114.5	T136 K137 L138 P142 Y143 E144 L275 K276 A279	T136-T140 WeakPolarHBondContact O-CG2 3.37Å; T136-T140 PolarHBondContact O-N 3.46Å; T136-T140 PolarHBondContact O-OG1 2.67Å; K137-T140 PolarHBondContact O-N 3.03Å; K137-T140 VanDerWaalsContact O-N 3.15Å; K137-T140 PolarHBondContact O-OG1 3.32Å; L138-T140 PolarHBondContact O-N 3.31Å; T140-P142 VanDerWaalsContact C-CD 3.43Å; T140-Y143 CarbonylContact O-C 3.41Å; T140-Y143 PolarHBondContact O-N 3.05Å; T140-E144 PolarHBondContact O-N 3.49Å; T140-L275 HydrophobicContact CG2-CD1 4.3Å; T140-L275 HydrophobicContact CG2-CD2 4.33Å; T140-L275 HydrophobicContact CG2-CG 3.98Å; T140-K276 HydrophobicContact CG2-CG 4.42Å; T140-A279 HydrophobicContact CG2-CB 4.01Å
141	T	98.9	Very high	98.5	Very high	2 Å²	2	40 Å²	40	1%	0.012	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-45.7	-46.3	-177	-65.4	0	0	0	0	114.5	T31 K137 L138 Y143 E144 W149 F330 W355	T31-T141 HydrophobicContact CG2-CG2 3.79Å; K137-T141 PolarHBondContact O-N 3.08Å; K137-T141 PolarHBondContact O-OG1 3.36Å; L138-T141 WeakPolarHBondContact O-CB 3.45Å; L138-T141 PolarHBondContact O-N 3.32Å; L138-T141 PolarHBondContact O-OG1 2.78Å; T141-Y143 PolarHBondContact O-N 2.66Å; T141-E144 PolarHBondContact O-N 3.49Å; T141-W149 HydrophobicContact CG2-CZ2 4.23Å; T141-W149 PolarHBondContact OG1-NE1 3.08Å; T141-F330 VanDerWaalsContact CB-CE1 3.44Å; T141-F330 HydrophobicContact CG2-CE1 3.72Å; T141-F330 HydrophobicContact CG2-CE2 4.3Å; T141-F330 HydrophobicContact CG2-CZ 3.57Å; T141-W355 HydrophobicContact CG2-CD2 3.65Å; T141-W355 VanDerWaalsContact CG2-CE2 3.46Å; T141-W355 HydrophobicContact CG2-CE3 4.04Å; T141-W355 HydrophobicContact CG2-CG 4.19Å; T141-W355 HydrophobicContact CG2-CH2 4Å; T141-W355 HydrophobicContact CG2-CZ2 3.64Å; T141-W355 HydrophobicContact CG2-CZ3 4.2Å; T141-W355 WeakPolarHBondContact O-CH2 3.16Å; T141-W355 WeakPolarHBondContact O-CZ2 3.28Å
142	P	98.7	Very high	98.5	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.091	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-60.9	-22.7	-178.9	-24.8	36.4	0	0	0	114.2	T31 P33 T140 V326 F330	T31-P142 WeakPolarHBondContact O-CA 3.33Å; T31-P142 WeakPolarHBondContact O-CB 3.2Å; P33-P142 HydrophobicContact CB-CB 4.47Å; P33-P142 WeakPolarHBondContact CD-O 3.38Å; P33-P142 HydrophobicContact CG-CB 3.84Å; P33-P142 WeakPolarHBondContact CG-O 3.39Å; T140-P142 VanDerWaalsContact C-CD 3.43Å; P142-V326 HydrophobicContact CB-CG1 3.75Å; P142-V326 HydrophobicContact CG-CG1 4.04Å; P142-F330 HydrophobicContact CG-CB 3.56Å; P142-F330 HydrophobicContact CG-CD1 3.94Å; P142-F330 HydrophobicContact CG-CD2 4.28Å; P142-F330 HydrophobicContact CG-CG 3.63Å
143	Y	98.6	Very high	98.5	Very high	55 Å²	55	37.1 Å²	37.1	22%	0.216	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-112.2	-8.2	-177.5	-60.7	-70.8	0	0	0	113.6	P33 T140 T141 L275 W322 N323 V326	P33-Y143 HydrophobicContact CB-CE1 4.19Å; P33-Y143 HydrophobicContact CG-CD1 4.25Å; P33-Y143 HydrophobicContact CG-CE1 4.01Å; T140-Y143 CarbonylContact O-C 3.41Å; T140-Y143 PolarHBondContact O-N 3.05Å; T141-Y143 PolarHBondContact O-N 2.66Å; Y143-L275 HydrophobicContact CD2-CD2 4.02Å; Y143-L275 HydrophobicContact CG-CD2 4.1Å; Y143-W322 HydrophobicContact CD1-CB 4.2Å; Y143-W322 HydrophobicContact CD2-CB 3.83Å; Y143-W322 HydrophobicContact CE1-CB 4.12Å; Y143-W322 HydrophobicContact CE2-CB 3.73Å; Y143-W322 HydrophobicContact CG-CB 4.06Å; Y143-N323 PolarHBondContact OH-N 2.69Å; Y143-V326 HydrophobicContact CE2-CB 4.08Å; Y143-V326 HydrophobicContact CE2-CG1 3.74Å; Y143-V326 WeakPolarHBondContact OH-CB 3.45Å
144	E	98.3	Very high	98.5	Very high	27 Å²	27	35.5 Å²	35.5	13%	0.126	16%	0.161	C	C	.	.			trans	-76.1	135.2	-179.9	-177.3	54.2	-97.7	0	0	110	T140 T141 Q146 E147 K276 W355	T140-E144 PolarHBondContact O-N 3.49Å; T141-E144 PolarHBondContact O-N 3.49Å; E144-Q146 WeakPolarHBondContact OE1-CB 3.35Å; E144-Q146 PolarHBondContact OE1-N 3.02Å; E144-E147 WeakPolarHBondContact CG-O 3.43Å; E144-E147 PolarHBondContact OE1-N 2.91Å; E144-K276 VanDerWaalsContact OE2-CE 3.26Å; E144-K276 WeakPolarHBondContact OE2-CE 3.35Å; E144-K276 IonicContact OE2-NZ 3.52Å; E144-K276 PolarHBondContact OE2-NZ 2.87Å; E144-W355 HydrophobicContact CB-CH2 3.81Å; E144-W355 HydrophobicContact CB-CZ3 4.14Å; E144-W355 HydrophobicContact CG-CH2 4.12Å; E144-W355 HydrophobicContact CG-CZ3 4.08Å
145	R	97.7	Very high	98.5	Very high	205 Å²	205	36.2 Å²	36.2	77%	0.774	16%	0.163	S	C	*	.			trans	-131.6	-2.3	-172.6	-65	-173.5	-177	-179.4	1	113.5
146	Q	96.6	Very high	98.5	Very high	155 Å²	155	36.6 Å²	36.6	72%	0.724	16%	0.164	S	C	*	.	S	Bend	trans	-117.4	-50.3	-172.6	-60	-64.5	-31.2	0	0	111.9	E144	E144-Q146 WeakPolarHBondContact OE1-CB 3.35Å; E144-Q146 PolarHBondContact OE1-N 3.02Å
147	E	97.1	Very high	98.4	Very high	104 Å²	104	38 Å²	38	49%	0.486	17%	0.17	S	C	.	.			trans	-116.6	113	-167.7	-64.5	173.9	153.2	0	0	110.7	E144 W355	E144-E147 WeakPolarHBondContact CG-O 3.43Å; E144-E147 PolarHBondContact OE1-N 2.91Å; E147-W355 WeakPolarHBondContact O-CZ3 3.37Å
148	G	98.3	Very high	98.3	Very high	14 Å²	14	35.2 Å²	35.2	14%	0.144	16%	0.163	C	C	.	.			trans	-72.3	174.2	166.3	0	0	0	0	0	112.9	W355	G148-W355 CarbonylContact C-O 3.6Å; G148-W355 WeakPolarHBondContact CA-O 3.33Å
149	W	98.8	Very high	98.3	Very high	6 Å²	6	35.3 Å²	35.3	2%	0.023	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	161.1	-179.7	52.7	-103.1	0	0	0	112.5	K137 L138 T141 L151 F334 F353 W355 V361	K137-W149 HydrophobicContact CD-CB 4.3Å; L138-W149 HydrophobicContact CD2-CH2 3.73Å; L138-W149 HydrophobicContact CD2-CZ2 3.69Å; L138-W149 HydrophobicContact CD2-CZ3 4.42Å; T141-W149 HydrophobicContact CG2-CZ2 4.23Å; T141-W149 PolarHBondContact OG1-NE1 3.08Å; W149-L151 HydrophobicContact CE3-CB 4.36Å; W149-L151 HydrophobicContact CE3-CD1 4.07Å; W149-L151 HydrophobicContact CE3-CG 3.75Å; W149-L151 HydrophobicContact CH2-CD1 4.47Å; W149-L151 HydrophobicContact CZ3-CB 4.24Å; W149-L151 HydrophobicContact CZ3-CD1 3.89Å; W149-L151 HydrophobicContact CZ3-CG 3.91Å; W149-F334 HydrophobicContact CH2-CD2 4.12Å; W149-F334 AromaticContact CH2-CE2 3.67Å; W149-F334 HydrophobicContact CH2-CE2 3.67Å; W149-F334 HydrophobicContact CH2-CZ 4.37Å; W149-F334 HydrophobicContact CZ3-CE2 4.11Å; W149-F334 HydrophobicContact CZ3-CZ 4.49Å; W149-F353 HydrophobicContact CZ3-CB 4.18Å; W149-W355 AromaticContact CD1-CE3 3.43Å; W149-W355 VanDerWaalsContact CD1-CE3 3.43Å; W149-W355 AromaticContact CD1-CZ3 3.94Å; W149-W355 HydrophobicContact CD2-CB 4.03Å; W149-W355 HydrophobicContact CD2-CE3 4.49Å; W149-W355 AromaticContact CE2-CE3 3.88Å; W149-W355 HydrophobicContact CE3-CB 4.27Å; W149-W355 HydrophobicContact CG-CE3 4.23Å; W149-W355 HydrophobicContact CH2-CB 3.89Å; W149-W355 HydrophobicContact CZ2-CB 3.62Å; W149-W355 HydrophobicContact CZ2-CD2 4.42Å; W149-W355 HydrophobicContact CZ2-CG 4.04Å; W149-W355 HydrophobicContact CZ3-CB 4.21Å; W149-W355 PolarHBondContact N-O 3.07Å; W149-W355 AromaticContact NE1-CD2 3.84Å; W149-W355 AromaticContact NE1-CE3 3.18Å; W149-W355 AromaticContact NE1-CZ3 3.83Å; W149-W355 PolarHBondContact O-N 3.26Å; W149-V361 HydrophobicContact CH2-CG1 3.91Å; W149-V361 HydrophobicContact CH2-CG2 3.91Å; W149-V361 HydrophobicContact CZ2-CG2 4.17Å; W149-V361 HydrophobicContact CZ3-CG1 4.35Å
150	Q	98.8	Very high	98.3	Very high	37 Å²	37	35.3 Å²	35.3	17%	0.173	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.4	170.2	-73	-175.2	-38.1	0	0	110.5	E164 V165 T167 L352 F353 S354	Q150-E164 WeakPolarHBondContact O-CA 3.37Å; Q150-V165 HydrophobicContact CB-CB 3.98Å; Q150-V165 PolarHBondContact O-N 3.15Å; Q150-T167 HydrophobicContact CB-CG2 4.31Å; Q150-T167 HydrophobicContact CG-CG2 3.94Å; Q150-L352 HydrophobicContact CB-CD1 4.12Å; Q150-F353 CarbonylContact C-O 3.59Å; Q150-F353 VanDerWaalsContact CA-O 3.29Å; Q150-F353 WeakPolarHBondContact CA-O 3.43Å; Q150-S354 PolarHBondContact NE2-OG 2.95Å
151	L	98.9	Very high	98.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	114.3	175.1	-67.4	177.1	0	0	0	109.2	H134 L138 W149 E164 F334 F353	H134-L151 HydrophobicContact CB-CD2 3.97Å; L138-L151 HydrophobicContact CD1-CD1 4.24Å; L138-L151 HydrophobicContact CD2-CD1 3.78Å; L138-L151 HydrophobicContact CG-CD1 4.04Å; W149-L151 HydrophobicContact CE3-CB 4.36Å; W149-L151 HydrophobicContact CE3-CD1 4.07Å; W149-L151 HydrophobicContact CE3-CG 3.75Å; W149-L151 HydrophobicContact CH2-CD1 4.47Å; W149-L151 HydrophobicContact CZ3-CB 4.24Å; W149-L151 HydrophobicContact CZ3-CD1 3.89Å; W149-L151 HydrophobicContact CZ3-CG 3.91Å; L151-E164 HydrophobicContact CD2-CB 4.01Å; L151-F334 HydrophobicContact CD1-CE1 4.1Å; L151-F334 HydrophobicContact CD1-CZ 3.83Å; L151-F353 HydrophobicContact CB-CB 4.46Å; L151-F353 PolarHBondContact N-O 3.47Å; L151-F353 PolarHBondContact O-N 3.48Å
152	A	98.8	Very high	98.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	130.9	168	0	0	0	0	0	109.4	L162 S163 V165 V350 L352 F373	A152-L162 WeakPolarHBondContact O-CA 3.14Å; A152-S163 WeakPolarHBondContact CB-O 3.39Å; A152-S163 PolarHBondContact N-O 3.01Å; A152-S163 PolarHBondContact O-N 3.34Å; A152-V165 HydrophobicContact CB-CG2 3.72Å; A152-V350 HydrophobicContact CB-CG1 3.56Å; A152-L352 HydrophobicContact CB-CD1 4.24Å; A152-F373 HydrophobicContact CB-CD1 3.77Å; A152-F373 HydrophobicContact CB-CE1 3.81Å
153	A	98.9	Very high	98.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.3	176.3	0	0	0	0	0	111.6	L160 Y161 L162 V342 V350 H351 F353	A153-L160 HydrophobicContact CB-CD1 4.23Å; A153-Y161 VanDerWaalsContact CA-O 3.27Å; A153-Y161 WeakPolarHBondContact CA-O 3.33Å; A153-L162 HydrophobicContact CB-CD2 3.51Å; A153-V342 HydrophobicContact CB-CG2 3.9Å; A153-V350 WeakPolarHBondContact O-CA 3.39Å; A153-H351 PolarHBondContact N-O 3.31Å; A153-H351 PolarHBondContact O-N 3.27Å; A153-F353 HydrophobicContact CB-CD2 4Å; A153-F353 HydrophobicContact CB-CE2 3.58Å
154	S	98.8	Very high	98.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.6	173.9	-63.9	0	0	0	0	108.9	Y161 L349	S154-Y161 PolarHBondContact N-O 3.36Å; S154-Y161 PolarHBondContact O-N 2.98Å; S154-L349 WeakPolarHBondContact CB-O 3.41Å; S154-L349 PolarHBondContact OG-O 3.05Å
155	R	98.8	Very high	98.3	Very high	32 Å²	32	34.2 Å²	34.2	12%	0.121	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	131.8	170.7	-175.8	-177.3	-56.3	-77.1	0	108.6	G158 T159 Q339 V342 D345 D346	R155-G158 WeakPolarHBondContact CG-O 3.4Å; R155-G158 PolarHBondContact NH1-O 3.42Å; R155-T159 VanDerWaalsContact CA-O 3.31Å; R155-T159 WeakPolarHBondContact CA-O 3.42Å; R155-Q339 VanDerWaalsContact CZ-OE1 3.27Å; R155-Q339 PolarHBondContact NH2-O 3.25Å; R155-V342 HydrophobicContact CB-CG1 3.79Å; R155-V342 VanDerWaalsContact CZ-O 3.28Å; R155-V342 PolarHBondContact NE-O 3.42Å; R155-V342 PolarHBondContact NH2-O 2.91Å; R155-D345 HydrophobicContact CG-CB 4.47Å; R155-D346 CarbonylContact O-C 3.58Å; R155-D346 PolarHBondContact O-N 2.95Å
156	F	98.3	Very high	98.3	Very high	9 Å²	9	26.9 Å²	26.9	4%	0.039	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	121.2	176.8	173	-123.7	0	0	0	110.3	G158 T159 Y161 D345 P347 L374 Y378 V379 M382	F156-G158 VanDerWaalsContact C-N 3.33Å; F156-G158 PolarHBondContact O-N 3.24Å; F156-T159 PolarHBondContact N-O 3.36Å; F156-T159 WeakPolarHBondContact O-CB 3.47Å; F156-T159 PolarHBondContact O-N 2.93Å; F156-Y161 HydrophobicContact CB-CD2 4.35Å; F156-Y161 HydrophobicContact CB-CE2 3.91Å; F156-Y161 HydrophobicContact CD1-CE2 4.32Å; F156-D345 VanDerWaalsContact CA-OD1 3.28Å; F156-D345 WeakPolarHBondContact CA-OD1 3.23Å; F156-P347 HydrophobicContact CB-CB 4.12Å; F156-P347 HydrophobicContact CD2-CB 3.95Å; F156-P347 HydrophobicContact CD2-CG 3.84Å; F156-P347 HydrophobicContact CE2-CG 4.2Å; F156-P347 HydrophobicContact CG-CB 4.02Å; F156-P347 HydrophobicContact CG-CG 4.43Å; F156-L374 HydrophobicContact CB-CD1 3.65Å; F156-L374 HydrophobicContact CD1-CD1 4.23Å; F156-L374 HydrophobicContact CG-CD1 4.19Å; F156-Y378 HydrophobicContact CD1-CD1 4.38Å; F156-Y378 AromaticContact CD1-CE1 3.95Å; F156-Y378 HydrophobicContact CD1-CE1 3.95Å; F156-Y378 HydrophobicContact CE1-CD1 4.18Å; F156-Y378 AromaticContact CE1-CE1 3.95Å; F156-Y378 HydrophobicContact CE1-CE1 3.95Å; F156-V379 HydrophobicContact CE1-CG2 4.39Å; F156-V379 HydrophobicContact CE2-CG1 4.04Å; F156-V379 HydrophobicContact CZ-CB 4.27Å; F156-V379 HydrophobicContact CZ-CG1 3.92Å; F156-V379 HydrophobicContact CZ-CG2 4.45Å; F156-M382 HydrophobicContact CE1-CB 3.63Å; F156-M382 HydrophobicContact CE1-CG 4.07Å; F156-M382 HydrophobicContact CZ-CB 3.82Å
157	Q	96.3	Very high	98.4	Very high	49 Å²	49	20 Å²	20	23%	0.229	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	49.9	-173.7	-61.3	-174.4	-15.9	0	0	112.3	A125 T159 D345 M382	A125-Q157 WeakPolarHBondContact CA-O 3.22Å; A125-Q157 WeakPolarHBondContact CB-O 3.32Å; Q157-T159 PolarHBondContact O-N 3.46Å; Q157-D345 PolarHBondContact N-OD1 3.03Å; Q157-D345 PolarHBondContact N-OD2 3.44Å; Q157-D345 VanDerWaalsContact N-OD2 3.14Å; Q157-M382 PolarHBondContact NE2-O 2.83Å
158	G	97	Very high	98.4	Very high	19 Å²	19	20 Å²	20	20%	0.196	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	-35.8	-176.6	0	0	0	0	0	114	A125 R155 F156 D345	A125-G158 CarbonylContact O-C 2.89Å; A125-G158 VanDerWaalsContact O-CA 3.26Å; A125-G158 WeakPolarHBondContact O-CA 3.09Å; R155-G158 WeakPolarHBondContact CG-O 3.4Å; R155-G158 PolarHBondContact NH1-O 3.42Å; F156-G158 VanDerWaalsContact C-N 3.33Å; F156-G158 PolarHBondContact O-N 3.24Å; G158-D345 PolarHBondContact N-OD2 3.45Å
159	T	98.4	Very high	98.3	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.012	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	132.3	-175.2	-45.4	0	0	0	0	111	L124 A125 V129 R155 F156 Q157 Y161	L124-T159 HydrophobicContact CD1-CG2 4.07Å; L124-T159 HydrophobicContact CG-CG2 4.32Å; L124-T159 WeakPolarHBondContact O-CG2 3.15Å; L124-T159 PolarHBondContact O-OG1 3.43Å; A125-T159 PolarHBondContact O-N 2.87Å; V129-T159 HydrophobicContact CB-CG2 4.33Å; V129-T159 HydrophobicContact CG2-CG2 3.51Å; R155-T159 VanDerWaalsContact CA-O 3.31Å; R155-T159 WeakPolarHBondContact CA-O 3.42Å; F156-T159 PolarHBondContact N-O 3.36Å; F156-T159 WeakPolarHBondContact O-CB 3.47Å; F156-T159 PolarHBondContact O-N 2.93Å; Q157-T159 PolarHBondContact O-N 3.46Å; T159-Y161 HydrophobicContact CG2-CD2 4.23Å; T159-Y161 HydrophobicContact CG2-CE1 4.16Å; T159-Y161 HydrophobicContact CG2-CE2 3.65Å; T159-Y161 WeakPolarHBondContact O-CD2 3.48Å
160	L	98.8	Very high	98.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.6	173.6	-178	67.2	0	0	0	109.8	A127 I128 V129 A153 L162 A338 Q339 V342	A127-L160 PolarHBondContact O-N 2.89Å; A127-L160 VanDerWaalsContact O-N 3.09Å; I128-L160 CarbonylContact C-O 3.55Å; I128-L160 VanDerWaalsContact CA-O 3.22Å; I128-L160 WeakPolarHBondContact CA-O 3.26Å; I128-L160 HydrophobicContact CD1-CD2 4.29Å; I128-L160 HydrophobicContact CG1-CB 4.26Å; I128-L160 HydrophobicContact CG1-CD2 4.31Å; I128-L160 HydrophobicContact CG2-CD2 4.49Å; V129-L160 PolarHBondContact N-O 2.59Å; A153-L160 HydrophobicContact CB-CD1 4.23Å; L160-L162 HydrophobicContact CD2-CD2 4.33Å; L160-L162 HydrophobicContact CG-CD2 4.25Å; L160-A338 HydrophobicContact CD2-CB 4.04Å; L160-Q339 HydrophobicContact CD2-CG 3.94Å; L160-V342 HydrophobicContact CD1-CB 3.93Å; L160-V342 HydrophobicContact CD1-CG1 4.05Å; L160-V342 HydrophobicContact CD1-CG2 4.02Å
161	Y	98.9	Very high	98.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.5	176	-59.2	-99.1	0	0	0	109.7	L103 L107 L110 V129 A153 S154 F156 T159 L374 Y378	L103-Y161 HydrophobicContact CD1-CD1 4.37Å; L107-Y161 HydrophobicContact CD2-CD1 3.9Å; L107-Y161 HydrophobicContact CD2-CE1 3.65Å; L110-Y161 HydrophobicContact CD2-CE1 4.26Å; V129-Y161 HydrophobicContact CB-CD1 3.6Å; V129-Y161 HydrophobicContact CB-CE1 3.82Å; V129-Y161 HydrophobicContact CB-CG 4.37Å; V129-Y161 HydrophobicContact CG1-CD1 3.78Å; V129-Y161 HydrophobicContact CG1-CE1 3.94Å; V129-Y161 HydrophobicContact CG2-CD1 4.28Å; V129-Y161 HydrophobicContact CG2-CE1 4.01Å; V129-Y161 WeakPolarHBondContact O-CA 3.39Å; A153-Y161 VanDerWaalsContact CA-O 3.27Å; A153-Y161 WeakPolarHBondContact CA-O 3.33Å; S154-Y161 PolarHBondContact N-O 3.36Å; S154-Y161 PolarHBondContact O-N 2.98Å; F156-Y161 HydrophobicContact CB-CD2 4.35Å; F156-Y161 HydrophobicContact CB-CE2 3.91Å; F156-Y161 HydrophobicContact CD1-CE2 4.32Å; T159-Y161 HydrophobicContact CG2-CD2 4.23Å; T159-Y161 HydrophobicContact CG2-CE1 4.16Å; T159-Y161 HydrophobicContact CG2-CE2 3.65Å; T159-Y161 WeakPolarHBondContact O-CD2 3.48Å; Y161-L374 HydrophobicContact CD1-CD2 3.91Å; Y161-L374 HydrophobicContact CD2-CD1 3.93Å; Y161-L374 HydrophobicContact CD2-CD2 4.17Å; Y161-L374 HydrophobicContact CE1-CD2 4.35Å; Y161-L374 HydrophobicContact CE2-CD1 4.27Å; Y161-L374 HydrophobicContact CG-CD1 4.37Å; Y161-L374 HydrophobicContact CG-CD2 3.83Å; Y161-Y378 HydrophobicContact CE1-CE1 4.11Å; Y161-Y378 AromaticContact CZ-CE1 3.9Å; Y161-Y378 PolarHBondContact OH-OH 2.91Å
162	L	98.9	Very high	98.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.1	174.5	-55.3	176.4	0	0	0	109.4	I128 V129 T130 H134 A152 A153 L160 F334 L335	I128-L162 HydrophobicContact CG2-CD1 3.74Å; I128-L162 HydrophobicContact CG2-CG 3.94Å; V129-L162 PolarHBondContact O-N 3.41Å; T130-L162 WeakPolarHBondContact CB-O 3.38Å; T130-L162 PolarHBondContact OG1-O 2.68Å; H134-L162 PolarHBondContact CD2-O 3.43Å; A152-L162 WeakPolarHBondContact O-CA 3.14Å; A153-L162 HydrophobicContact CB-CD2 3.51Å; L160-L162 HydrophobicContact CD2-CD2 4.33Å; L160-L162 HydrophobicContact CG-CD2 4.25Å; L162-F334 HydrophobicContact CD1-CE1 4.11Å; L162-L335 HydrophobicContact CD1-CD2 4.09Å
163	S	98.9	Very high	98	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.014	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.5	176.9	-174.7	0	0	0	0	110	A152	A152-S163 WeakPolarHBondContact CB-O 3.39Å; A152-S163 PolarHBondContact N-O 3.01Å; A152-S163 PolarHBondContact O-N 3.34Å
164	E	98.7	Very high	97.9	Very high	49 Å²	49	35.6 Å²	35.6	23%	0.229	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	144.7	174.2	177.4	156.8	-132.7	0	0	112	H134 K137 Q150 L151	H134-E164 PolarHBondContact CD2-N 3.5Å; H134-E164 VanDerWaalsContact CD2-N 3.28Å; H134-E164 WeakPolarHBondContact CE1-CB 3.42Å; H134-E164 IonicContact ND1-OE2 3.29Å; H134-E164 PolarHBondContact NE2-N 3.47Å; K137-E164 VanDerWaalsContact CD-OE1 3.27Å; K137-E164 WeakPolarHBondContact CD-OE1 3.48Å; K137-E164 WeakPolarHBondContact CE-OE1 3.38Å; K137-E164 IonicContact NZ-OE1 3.4Å; K137-E164 PolarHBondContact NZ-OE1 3.21Å; K137-E164 IonicContact NZ-OE2 3.73Å; K137-E164 PolarHBondContact NZ-OE2 2.87Å; Q150-E164 WeakPolarHBondContact O-CA 3.37Å; L151-E164 HydrophobicContact CD2-CB 4.01Å
165	V	98.6	Very high	97.8	Very high	33 Å²	33	40.3 Å²	40.3	20%	0.2	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.4	170.5	-179.8	0	0	0	0	107.8	Q150 A152 T167 L352 Y371	Q150-V165 HydrophobicContact CB-CB 3.98Å; Q150-V165 PolarHBondContact O-N 3.15Å; A152-V165 HydrophobicContact CB-CG2 3.72Å; V165-T167 PolarHBondContact O-N 2.83Å; V165-L352 HydrophobicContact CB-CD1 4.26Å; V165-L352 HydrophobicContact CG2-CD1 3.81Å; V165-Y371 HydrophobicContact CG1-CD1 4.45Å; V165-Y371 HydrophobicContact CG1-CE1 4.32Å; V165-Y371 HydrophobicContact CG2-CD1 4.45Å
166	E	98.3	Very high	97.7	Very high	51 Å²	51	42.4 Å²	42.4	24%	0.238	24%	0.244	C	C	.	.			trans	-63	121.2	174.7	-177.5	175.6	-124.8	0	0	110.1	A170 R171 R174	E166-A170 HydrophobicContact CG-CB 4.03Å; E166-R171 VanDerWaalsContact CD-CA 3.49Å; E166-R171 HydrophobicContact CG-CB 3.93Å; E166-R171 WeakPolarHBondContact OE2-CB 3.3Å; E166-R171 WeakPolarHBondContact OE2-CG 3.37Å; E166-R171 IonicContact OE2-NH1 3.76Å; E166-R174 IonicContact OE1-CZ 3.22Å; E166-R174 IonicContact OE1-NE 3.11Å; E166-R174 PolarHBondContact OE1-NE 3.26Å; E166-R174 IonicContact OE1-NH2 2.77Å; E166-R174 PolarHBondContact OE1-NH2 3.1Å; E166-R174 IonicContact OE2-CZ 3.42Å; E166-R174 IonicContact OE2-NE 3.62Å; E166-R174 IonicContact OE2-NH2 2.91Å; E166-R174 PolarHBondContact OE2-NH2 3.19Å
167	T	98	Very high	97.7	Very high	10 Å²	10	43.6 Å²	43.6	6%	0.061	25%	0.248	C	C	.	.			trans	-70.2	154.5	178.2	74.6	0	0	0	0	110.7	Q150 V165 N169 A170 R171	Q150-T167 HydrophobicContact CB-CG2 4.31Å; Q150-T167 HydrophobicContact CG-CG2 3.94Å; V165-T167 PolarHBondContact O-N 2.83Å; T167-N169 PolarHBondContact O-N 2.71Å; T167-A170 PolarHBondContact O-N 2.91Å; T167-A170 VanDerWaalsContact O-N 3.09Å; T167-A170 WeakPolarHBondContact OG1-CB 3.44Å; T167-A170 PolarHBondContact OG1-N 3.45Å; T167-A170 VanDerWaalsContact OG1-N 3.07Å; T167-R171 PolarHBondContact O-N 3.19Å
168	P	97.1	Very high	97.7	Very high	105 Å²	105	44.8 Å²	44.8	68%	0.682	26%	0.26	S	S	*	.	H	α-helix	trans	-54.3	-37.4	175.9	-27.9	35.5	0	0	0	113.5	A172	P168-A172 WeakPolarHBondContact O-CB 3.2Å; P168-A172 PolarHBondContact O-N 3.3Å
169	N	96.6	Very high	97.7	Very high	80 Å²	80	48.8 Å²	48.8	43%	0.428	28%	0.282	S	S	.	.	H	α-helix	trans	-68.7	-45.2	176.4	-174.6	37.4	0	0	0	111.8	T167 R171 A172 Q173	T167-N169 PolarHBondContact O-N 2.71Å; N169-R171 VanDerWaalsContact C-N 3.34Å; N169-R171 PolarHBondContact O-N 2.84Å; N169-A172 PolarHBondContact O-N 3.06Å; N169-Q173 PolarHBondContact ND2-NE2 3.48Å; N169-Q173 WeakPolarHBondContact O-CG 3.38Å; N169-Q173 PolarHBondContact O-N 2.78Å; N169-Q173 PolarHBondContact OD1-NE2 3.25Å
170	A	97.4	Very high	97.6	Very high	36 Å²	36	53.8 Å²	53.8	30%	0.298	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-42.8	176.6	0	0	0	0	0	111.7	E166 T167 Q173 R174	E166-A170 HydrophobicContact CG-CB 4.03Å; T167-A170 PolarHBondContact O-N 2.91Å; T167-A170 VanDerWaalsContact O-N 3.09Å; T167-A170 WeakPolarHBondContact OG1-CB 3.44Å; T167-A170 PolarHBondContact OG1-N 3.45Å; T167-A170 VanDerWaalsContact OG1-N 3.07Å; A170-Q173 PolarHBondContact O-N 3.23Å; A170-R174 WeakPolarHBondContact O-CB 3.31Å; A170-R174 PolarHBondContact O-N 2.9Å
171	R	97.3	Very high	97.4	Very high	100 Å²	100	57.8 Å²	57.8	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-59.4	-48.5	173.9	-174.7	169.8	177.1	79.8	4.8	111.6	E98 E166 T167 N169 Q173 R174 L175	E98-R171 IonicContact OE1-CZ 2.74Å; E98-R171 IonicContact OE1-NH1 2.54Å; E98-R171 PolarHBondContact OE1-NH1 3.23Å; E98-R171 IonicContact OE1-NH2 2.8Å; E98-R171 IonicContact OE2-CZ 2.6Å; E98-R171 IonicContact OE2-NH1 2.73Å; E98-R171 PolarHBondContact OE2-NH1 3.38Å; E98-R171 VanDerWaalsContact OE2-NH1 3.11Å; E98-R171 IonicContact OE2-NH2 3.99Å; E98-R171 PolarHBondContact OE2-NH2 3.31Å; E166-R171 VanDerWaalsContact CD-CA 3.49Å; E166-R171 HydrophobicContact CG-CB 3.93Å; E166-R171 WeakPolarHBondContact OE2-CB 3.3Å; E166-R171 WeakPolarHBondContact OE2-CG 3.37Å; E166-R171 IonicContact OE2-NH1 3.76Å; T167-R171 PolarHBondContact O-N 3.19Å; N169-R171 VanDerWaalsContact C-N 3.34Å; N169-R171 PolarHBondContact O-N 2.84Å; R171-Q173 VanDerWaalsContact C-N 3.34Å; R171-Q173 PolarHBondContact O-N 3Å; R171-R174 PolarHBondContact O-N 2.7Å; R171-L175 HydrophobicContact CG-CD1 4.06Å; R171-L175 HydrophobicContact CG-CG 4.42Å; R171-L175 WeakPolarHBondContact O-CG 3.44Å; R171-L175 PolarHBondContact O-N 2.88Å
172	A	97.6	Very high	97.3	Very high	54 Å²	54	62.6 Å²	62.6	45%	0.446	35%	0.348	S	S	.	.	H	α-helix	trans	-59.8	-44	178.2	0	0	0	0	0	111.9	P168 N169 L175 A176	P168-A172 WeakPolarHBondContact O-CB 3.2Å; P168-A172 PolarHBondContact O-N 3.3Å; N169-A172 PolarHBondContact O-N 3.06Å; A172-L175 PolarHBondContact O-N 2.92Å; A172-A176 VanDerWaalsContact O-CB 3.26Å; A172-A176 WeakPolarHBondContact O-CB 3Å; A172-A176 PolarHBondContact O-N 3.1Å
173	Q	96.4	Very high	97.3	Very high	93 Å²	93	64.3 Å²	64.3	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-38.5	176.8	-71.4	178.4	5.3	0	0	112.8	N169 A170 R171 A176 R177	N169-Q173 PolarHBondContact ND2-NE2 3.48Å; N169-Q173 WeakPolarHBondContact O-CG 3.38Å; N169-Q173 PolarHBondContact O-N 2.78Å; N169-Q173 PolarHBondContact OD1-NE2 3.25Å; A170-Q173 PolarHBondContact O-N 3.23Å; R171-Q173 VanDerWaalsContact C-N 3.34Å; R171-Q173 PolarHBondContact O-N 3Å; Q173-A176 CarbonylContact O-C 3.54Å; Q173-R177 WeakPolarHBondContact O-CA 3.47Å; Q173-R177 PolarHBondContact O-N 3.18Å
174	R	96.9	Very high	97.2	Very high	23 Å²	23	66.5 Å²	66.5	9%	0.087	37%	0.367	C	S	.	.	H	α-helix	trans	-65.7	-47.2	175.9	177.8	167.8	63.3	69.2	7.3	111.9	E98 E166 A170 R171 A176 R177	E98-R174 IonicContact OE1-CZ 3.59Å; E98-R174 VanDerWaalsContact OE1-CZ 3.24Å; E98-R174 IonicContact OE1-NH1 3.64Å; E98-R174 PolarHBondContact OE1-NH1 2.88Å; E98-R174 IonicContact OE1-NH2 3.65Å; E98-R174 PolarHBondContact OE1-NH2 2.8Å; E166-R174 IonicContact OE1-CZ 3.22Å; E166-R174 IonicContact OE1-NE 3.11Å; E166-R174 PolarHBondContact OE1-NE 3.26Å; E166-R174 IonicContact OE1-NH2 2.77Å; E166-R174 PolarHBondContact OE1-NH2 3.1Å; E166-R174 IonicContact OE2-CZ 3.42Å; E166-R174 IonicContact OE2-NE 3.62Å; E166-R174 IonicContact OE2-NH2 2.91Å; E166-R174 PolarHBondContact OE2-NH2 3.19Å; A170-R174 WeakPolarHBondContact O-CB 3.31Å; A170-R174 PolarHBondContact O-N 2.9Å; R171-R174 PolarHBondContact O-N 2.7Å; R174-A176 VanDerWaalsContact C-N 3.32Å; R174-A176 PolarHBondContact O-N 2.87Å; R174-R177 WeakPolarHBondContact O-CB 3.33Å; R174-R177 PolarHBondContact O-N 3.05Å
175	L	96.9	Very high	97.2	Very high	98 Å²	98	67 Å²	67	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-39.1	177.9	-65.8	176.2	0	0	0	111.5	R171 A172 R177	R171-L175 HydrophobicContact CG-CD1 4.06Å; R171-L175 HydrophobicContact CG-CG 4.42Å; R171-L175 WeakPolarHBondContact O-CG 3.44Å; R171-L175 PolarHBondContact O-N 2.88Å; A172-L175 PolarHBondContact O-N 2.92Å; L175-R177 VanDerWaalsContact C-N 3.29Å; L175-R177 PolarHBondContact O-N 2.83Å
176	A	97.1	Very high	97.2	Very high	76 Å²	76	65.4 Å²	65.4	63%	0.628	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	14.5	177.9	0	0	0	0	0	114.2	A172 Q173 R174 P178	A172-A176 VanDerWaalsContact O-CB 3.26Å; A172-A176 WeakPolarHBondContact O-CB 3Å; A172-A176 PolarHBondContact O-N 3.1Å; Q173-A176 CarbonylContact O-C 3.54Å; R174-A176 VanDerWaalsContact C-N 3.32Å; R174-A176 PolarHBondContact O-N 2.87Å; A176-P178 VanDerWaalsContact O-CD 3.29Å; A176-P178 WeakPolarHBondContact O-CD 3.21Å; A176-P178 VanDerWaalsContact O-N 3.15Å
177	R	96.7	Very high	97.2	Very high	34 Å²	34	63.1 Å²	63.1	13%	0.128	35%	0.35	C	S	.	.			trans	-57.8	118.2	-171.9	-171.6	-178.3	-64.7	140.5	-6.1	111.7	E97 Q173 R174 L175 L181 R182 M185	E97-R177 IonicContact OE1-CZ 3.85Å; E97-R177 IonicContact OE1-NH1 2.81Å; E97-R177 IonicContact OE1-NH2 3.4Å; E97-R177 PolarHBondContact OE1-NH2 2.8Å; E97-R177 IonicContact OE2-CZ 3.72Å; E97-R177 IonicContact OE2-NH1 2.7Å; E97-R177 PolarHBondContact OE2-NH1 2.89Å; E97-R177 IonicContact OE2-NH2 2.76Å; E97-R177 PolarHBondContact OE2-NH2 3.37Å; Q173-R177 WeakPolarHBondContact O-CA 3.47Å; Q173-R177 PolarHBondContact O-N 3.18Å; R174-R177 WeakPolarHBondContact O-CB 3.33Å; R174-R177 PolarHBondContact O-N 3.05Å; L175-R177 VanDerWaalsContact C-N 3.29Å; L175-R177 PolarHBondContact O-N 2.83Å; R177-L181 HydrophobicContact CG-CB 3.95Å; R177-L181 HydrophobicContact CG-CD2 3.91Å; R177-L181 HydrophobicContact CG-CG 3.95Å; R177-R182 HydrophobicContact CB-CG 4.44Å; R177-R182 HydrophobicContact CG-CG 3.94Å; R177-R182 PolarHBondContact O-NE 2.96Å; R177-M185 VanDerWaalsContact CD-SD 3.51Å; R177-M185 VanDerWaalsContact CZ-SD 3.52Å; R177-M185 PolarHBondContact NE-SD 3.4Å
178	P	97.2	Very high	97.3	Very high	74 Å²	74	63.5 Å²	63.5	48%	0.481	36%	0.356	S	S	.	.			trans	-60.7	150.1	-178.9	-24.9	34.3	0	0	0	112.7	A176 L180 L181 R182	A176-P178 VanDerWaalsContact O-CD 3.29Å; A176-P178 WeakPolarHBondContact O-CD 3.21Å; A176-P178 VanDerWaalsContact O-N 3.15Å; P178-L180 VanDerWaalsContact C-N 3.28Å; P178-L180 PolarHBondContact O-N 2.97Å; P178-L181 PolarHBondContact O-N 2.97Å; P178-R182 PolarHBondContact O-N 3.47Å; P178-R182 VanDerWaalsContact O-N 3.16Å
179	P	96.8	Very high	97.3	Very high	103 Å²	103	62 Å²	62	67%	0.669	34%	0.337	S	S	*	.	H	α-helix	trans	-52.6	-42.3	178.1	-28.6	35.4	0	0	0	113.8	L181 R182 E183	P179-L181 VanDerWaalsContact C-N 3.29Å; P179-L181 PolarHBondContact O-N 2.77Å; P179-R182 WeakPolarHBondContact O-CB 3.41Å; P179-R182 PolarHBondContact O-N 2.86Å; P179-R182 VanDerWaalsContact O-N 3.16Å; P179-E183 PolarHBondContact O-N 3.13Å
180	L	96	Very high	97.4	Very high	108 Å²	108	58.2 Å²	58.2	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-59.1	-38.6	176.7	178.3	63.8	0	0	0	112.3	P178 L184	P178-L180 VanDerWaalsContact C-N 3.28Å; P178-L180 PolarHBondContact O-N 2.97Å; L180-L184 HydrophobicContact CG-CD1 4.29Å; L180-L184 WeakPolarHBondContact O-CB 3.48Å; L180-L184 WeakPolarHBondContact O-CG 3.44Å; L180-L184 PolarHBondContact O-N 2.97Å
181	L	96.1	Very high	97.5	Very high	83 Å²	83	56.6 Å²	56.6	44%	0.435	30%	0.303	S	S	.	.	H	α-helix	trans	-73.2	-33.1	179.7	-174.3	56.1	0	0	0	111.5	R177 P178 P179 L184 M185	R177-L181 HydrophobicContact CG-CB 3.95Å; R177-L181 HydrophobicContact CG-CD2 3.91Å; R177-L181 HydrophobicContact CG-CG 3.95Å; P178-L181 PolarHBondContact O-N 2.97Å; P179-L181 VanDerWaalsContact C-N 3.29Å; P179-L181 PolarHBondContact O-N 2.77Å; L181-L184 HydrophobicContact CD1-CD1 4.47Å; L181-L184 PolarHBondContact O-N 2.94Å; L181-M185 WeakPolarHBondContact O-CG 2.97Å; L181-M185 PolarHBondContact O-N 3.05Å
182	R	96.7	Very high	97.6	Very high	102 Å²	102	52.9 Å²	52.9	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-44.7	172.9	-65.9	174.8	-176.9	-96.8	-0.7	111.5	R177 P178 P179 M185 Y186	R177-R182 HydrophobicContact CB-CG 4.44Å; R177-R182 HydrophobicContact CG-CG 3.94Å; R177-R182 PolarHBondContact O-NE 2.96Å; P178-R182 PolarHBondContact O-N 3.47Å; P178-R182 VanDerWaalsContact O-N 3.16Å; P179-R182 WeakPolarHBondContact O-CB 3.41Å; P179-R182 PolarHBondContact O-N 2.86Å; P179-R182 VanDerWaalsContact O-N 3.16Å; R182-M185 WeakPolarHBondContact O-CB 3.32Å; R182-M185 PolarHBondContact O-N 2.91Å; R182-Y186 PolarHBondContact O-N 2.94Å; R182-Y186 VanDerWaalsContact O-N 3.11Å
183	E	98.2	Very high	97.6	Very high	36 Å²	36	51.3 Å²	51.3	17%	0.168	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-42.8	174.1	-171.8	-173.1	-167.7	0	0	111.2	R85 Y88 P179 M185 Y186 M187	R85-E183 VanDerWaalsContact CD-OE1 3.24Å; R85-E183 WeakPolarHBondContact CD-OE1 3.49Å; R85-E183 WeakPolarHBondContact CG-OE1 3.37Å; R85-E183 IonicContact CZ-OE1 2.73Å; R85-E183 IonicContact NE-OE1 3.11Å; R85-E183 PolarHBondContact NE-OE1 3.45Å; Y88-E183 HydrophobicContact CD1-CB 4.39Å; Y88-E183 HydrophobicContact CD1-CG 4.02Å; Y88-E183 HydrophobicContact CE1-CB 3.96Å; Y88-E183 HydrophobicContact CE1-CG 4.08Å; Y88-E183 HydrophobicContact CG-CG 4.5Å; P179-E183 PolarHBondContact O-N 3.13Å; E183-M185 VanDerWaalsContact C-N 3.28Å; E183-M185 PolarHBondContact O-N 2.75Å; E183-Y186 WeakPolarHBondContact O-CB 3.25Å; E183-Y186 PolarHBondContact O-N 2.79Å; E183-Y186 VanDerWaalsContact O-N 3.16Å; E183-M187 HydrophobicContact CG-SD 4.28Å; E183-M187 WeakPolarHBondContact O-CG 3.37Å; E183-M187 PolarHBondContact O-N 3.18Å
184	L	97.8	Very high	97.7	Very high	49 Å²	49	48.3 Å²	48.3	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-33.1	176.1	-73.8	173.6	0	0	0	113.7	L180 L181 M187 G188	L180-L184 HydrophobicContact CG-CD1 4.29Å; L180-L184 WeakPolarHBondContact O-CB 3.48Å; L180-L184 WeakPolarHBondContact O-CG 3.44Å; L180-L184 PolarHBondContact O-N 2.97Å; L181-L184 HydrophobicContact CD1-CD1 4.47Å; L181-L184 PolarHBondContact O-N 2.94Å; L184-M187 HydrophobicContact CD2-SD 3.88Å; L184-G188 PolarHBondContact O-N 3.16Å
185	M	98	Very high	97.8	Very high	58 Å²	58	47.2 Å²	47.2	29%	0.286	25%	0.254	S	S	.	.	H	α-helix	trans	-67.1	-47.6	172.8	-69.3	168.7	67	0	0	110.7	R177 L181 R182 E183 M187 G188 Y189	R177-M185 VanDerWaalsContact CD-SD 3.51Å; R177-M185 VanDerWaalsContact CZ-SD 3.52Å; R177-M185 PolarHBondContact NE-SD 3.4Å; L181-M185 WeakPolarHBondContact O-CG 2.97Å; L181-M185 PolarHBondContact O-N 3.05Å; R182-M185 WeakPolarHBondContact O-CB 3.32Å; R182-M185 PolarHBondContact O-N 2.91Å; E183-M185 VanDerWaalsContact C-N 3.28Å; E183-M185 PolarHBondContact O-N 2.75Å; M185-M187 VanDerWaalsContact C-N 3.31Å; M185-M187 PolarHBondContact O-N 2.91Å; M185-G188 PolarHBondContact O-N 2.78Å; M185-G188 VanDerWaalsContact O-N 3.1Å; M185-Y189 VanDerWaalsContact O-CD2 3.31Å; M185-Y189 WeakPolarHBondContact O-CD2 3.39Å; M185-Y189 PolarHBondContact O-N 3.02Å
186	Y	98.6	Very high	97.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-53.6	-48.7	174	173.3	-94	0	0	0	111.7	L84 D86 G87 Y88 Y92 R182 E183 G188 Y189 K190 V210	L84-Y186 WeakPolarHBondContact O-CD1 3.36Å; L84-Y186 VanDerWaalsContact O-CE1 3.28Å; L84-Y186 WeakPolarHBondContact O-CE1 3.25Å; D86-Y186 PolarHBondContact O-OH 3.43Å; G87-Y186 WeakPolarHBondContact CA-OH 3.42Å; Y88-Y186 HydrophobicContact CD2-CD1 4.05Å; Y88-Y186 AromaticContact CD2-CD2 3.9Å; Y88-Y186 HydrophobicContact CD2-CD2 3.9Å; Y88-Y186 AromaticContact CD2-CG 3.61Å; Y88-Y186 HydrophobicContact CD2-CG 3.61Å; Y88-Y186 HydrophobicContact CE2-CG 4.46Å; Y88-Y186 HydrophobicContact CG-CD1 4.2Å; Y88-Y186 HydrophobicContact CG-CG 4.23Å; Y92-Y186 AromaticContact CD1-CD2 3.97Å; Y92-Y186 HydrophobicContact CD1-CD2 3.97Å; Y92-Y186 AromaticContact CD2-CD2 3.46Å; Y92-Y186 HydrophobicContact CD2-CD2 3.46Å; Y92-Y186 VanDerWaalsContact CD2-CD2 3.46Å; Y92-Y186 AromaticContact CD2-CE2 3.97Å; Y92-Y186 HydrophobicContact CD2-CE2 3.97Å; Y92-Y186 HydrophobicContact CE1-CD2 4.42Å; Y92-Y186 AromaticContact CE2-CD2 3.95Å; Y92-Y186 HydrophobicContact CE2-CD2 3.95Å; Y92-Y186 AromaticContact CG-CD2 3.46Å; Y92-Y186 HydrophobicContact CG-CD2 3.46Å; Y92-Y186 VanDerWaalsContact CG-CD2 3.46Å; Y92-Y186 AromaticContact CG-CE2 3.95Å; Y92-Y186 HydrophobicContact CG-CE2 3.95Å; Y92-Y186 HydrophobicContact CG-CG 4.49Å; R182-Y186 PolarHBondContact O-N 2.94Å; R182-Y186 VanDerWaalsContact O-N 3.11Å; E183-Y186 WeakPolarHBondContact O-CB 3.25Å; E183-Y186 PolarHBondContact O-N 2.79Å; E183-Y186 VanDerWaalsContact O-N 3.16Å; Y186-G188 PolarHBondContact O-N 2.72Å; Y186-G188 VanDerWaalsContact O-N 3.12Å; Y186-Y189 PolarHBondContact O-N 3.26Å; Y186-Y189 VanDerWaalsContact O-N 3.08Å; Y186-K190 HydrophobicContact CD1-CB 4.15Å; Y186-K190 HydrophobicContact CE1-CB 3.78Å; Y186-K190 HydrophobicContact CE1-CD 4.27Å; Y186-K190 HydrophobicContact CE1-CG 3.94Å; Y186-K190 WeakPolarHBondContact O-CB 3.44Å; Y186-K190 PolarHBondContact O-N 3.3Å; Y186-V210 HydrophobicContact CD2-CB 4.19Å; Y186-V210 HydrophobicContact CD2-CG1 4.23Å; Y186-V210 HydrophobicContact CD2-CG2 4.39Å; Y186-V210 HydrophobicContact CE2-CB 3.62Å; Y186-V210 HydrophobicContact CE2-CG1 4.14Å; Y186-V210 HydrophobicContact CE2-CG2 3.56Å
187	M	98.7	Very high	97.9	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	20%	0.203	C	C	.	.	H	α-helix	trans	-57.7	-28.9	-179.7	-70.2	170.7	81.2	0	0	113	L84 E183 L184 M185 F191 G298	L84-M187 HydrophobicContact CB-CB 3.75Å; L84-M187 HydrophobicContact CB-CE 3.8Å; L84-M187 HydrophobicContact CB-CG 3.71Å; L84-M187 HydrophobicContact CD1-CB 4.05Å; L84-M187 HydrophobicContact CD1-CE 4.08Å; L84-M187 HydrophobicContact CG-CE 4.5Å; L84-M187 WeakPolarHBondContact O-CG 3.3Å; E183-M187 HydrophobicContact CG-SD 4.28Å; E183-M187 WeakPolarHBondContact O-CG 3.37Å; E183-M187 PolarHBondContact O-N 3.18Å; L184-M187 HydrophobicContact CD2-SD 3.88Å; M185-M187 VanDerWaalsContact C-N 3.31Å; M185-M187 PolarHBondContact O-N 2.91Å; M187-F191 WeakPolarHBondContact O-CB 3.44Å; M187-F191 PolarHBondContact O-N 3.14Å; M187-F191 VanDerWaalsContact O-N 3.1Å; M187-G298 VanDerWaalsContact CE-CA 3.42Å
188	G	98.5	Very high	98	Very high	19 Å²	19	44.1 Å²	44.1	20%	0.196	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-56.3	172.4	0	0	0	0	0	111.9	L184 M185 Y186 K190 F191 E192	L184-G188 PolarHBondContact O-N 3.16Å; M185-G188 PolarHBondContact O-N 2.78Å; M185-G188 VanDerWaalsContact O-N 3.1Å; Y186-G188 PolarHBondContact O-N 2.72Å; Y186-G188 VanDerWaalsContact O-N 3.12Å; G188-K190 VanDerWaalsContact C-N 3.32Å; G188-K190 PolarHBondContact O-N 3Å; G188-F191 WeakPolarHBondContact O-CB 3.44Å; G188-F191 PolarHBondContact O-N 2.81Å; G188-E192 PolarHBondContact O-N 2.86Å
189	Y	98.6	Very high	97.9	Very high	74 Å²	74	47.6 Å²	47.6	29%	0.29	24%	0.239	S	C	.	.	H	α-helix	trans	-65.4	-35.2	178.2	-65.5	-73.5	0	0	0	112.8	M185 Y186 F191 E192 Q193 V210 T212	M185-Y189 VanDerWaalsContact O-CD2 3.31Å; M185-Y189 WeakPolarHBondContact O-CD2 3.39Å; M185-Y189 PolarHBondContact O-N 3.02Å; Y186-Y189 PolarHBondContact O-N 3.26Å; Y186-Y189 VanDerWaalsContact O-N 3.08Å; Y189-F191 VanDerWaalsContact C-N 3.29Å; Y189-F191 PolarHBondContact O-N 2.82Å; Y189-E192 WeakPolarHBondContact O-CB 3.4Å; Y189-E192 PolarHBondContact O-N 3.04Å; Y189-E192 VanDerWaalsContact O-N 3.15Å; Y189-Q193 PolarHBondContact O-N 3.36Å; Y189-Q193 VanDerWaalsContact O-N 3.13Å; Y189-V210 VanDerWaalsContact CB-CG1 3.43Å; Y189-V210 HydrophobicContact CG-CG1 4.34Å; Y189-T212 HydrophobicContact CD1-CG2 3.85Å; Y189-T212 HydrophobicContact CD2-CG2 3.39Å; Y189-T212 HydrophobicContact CE1-CG2 3.86Å; Y189-T212 HydrophobicContact CE2-CG2 3.4Å; Y189-T212 VanDerWaalsContact CE2-CG2 3.4Å; Y189-T212 HydrophobicContact CG-CG2 3.61Å
190	K	98.7	Very high	97.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-37	175.1	-175.1	61.2	177.1	-157.8	0	111.6	D86 Y186 G188 E192 Q193 Y194 P206 V210	D86-K190 WeakPolarHBondContact O-CE 3.48Å; D86-K190 PolarHBondContact O-NZ 3.13Å; D86-K190 IonicContact OD2-NZ 2.88Å; D86-K190 PolarHBondContact OD2-NZ 2.84Å; Y186-K190 HydrophobicContact CD1-CB 4.15Å; Y186-K190 HydrophobicContact CE1-CB 3.78Å; Y186-K190 HydrophobicContact CE1-CD 4.27Å; Y186-K190 HydrophobicContact CE1-CG 3.94Å; Y186-K190 WeakPolarHBondContact O-CB 3.44Å; Y186-K190 PolarHBondContact O-N 3.3Å; G188-K190 VanDerWaalsContact C-N 3.32Å; G188-K190 PolarHBondContact O-N 3Å; K190-E192 VanDerWaalsContact C-N 3.29Å; K190-E192 PolarHBondContact O-N 3.2Å; K190-Q193 HydrophobicContact CD-CB 4.48Å; K190-Q193 VanDerWaalsContact CD-OE1 3.25Å; K190-Q193 WeakPolarHBondContact O-CB 3.42Å; K190-Q193 PolarHBondContact O-N 3.21Å; K190-Q193 VanDerWaalsContact O-N 3.15Å; K190-Y194 HydrophobicContact CD-CD2 4.49Å; K190-Y194 HydrophobicContact CD-CE2 4.05Å; K190-Y194 VanDerWaalsContact CE-CE2 3.47Å; K190-Y194 HydrophobicContact CG-CD2 4.17Å; K190-Y194 HydrophobicContact CG-CE2 3.79Å; K190-Y194 WeakPolarHBondContact O-CD2 3.26Å; K190-Y194 PolarHBondContact O-N 2.77Å; K190-P206 PolarHBondContact NZ-O 3.06Å; K190-V210 HydrophobicContact CB-CG2 4.4Å; K190-V210 HydrophobicContact CD-CG2 3.96Å
191	F	98.8	Very high	97.6	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-39.1	173.9	174.3	-114.1	0	0	0	111.9	F82 L84 M187 G188 Y189 Q193 Y194 M195 L254 K255 T256 G292 V300 L303	F82-F191 HydrophobicContact CD2-CD2 4.27Å; F82-F191 HydrophobicContact CD2-CE2 4.18Å; F82-F191 HydrophobicContact CE2-CE2 4.27Å; L84-F191 HydrophobicContact CD1-CB 4.5Å; L84-F191 HydrophobicContact CD2-CB 3.74Å; L84-F191 HydrophobicContact CD2-CD2 4.34Å; M187-F191 WeakPolarHBondContact O-CB 3.44Å; M187-F191 PolarHBondContact O-N 3.14Å; M187-F191 VanDerWaalsContact O-N 3.1Å; G188-F191 WeakPolarHBondContact O-CB 3.44Å; G188-F191 PolarHBondContact O-N 2.81Å; Y189-F191 VanDerWaalsContact C-N 3.29Å; Y189-F191 PolarHBondContact O-N 2.82Å; F191-Q193 VanDerWaalsContact C-N 3.31Å; F191-Q193 PolarHBondContact O-N 2.92Å; F191-Y194 PolarHBondContact O-N 2.97Å; F191-M195 HydrophobicContact CD2-CG 4.01Å; F191-M195 HydrophobicContact CE1-CG 4.13Å; F191-M195 HydrophobicContact CE2-CG 3.48Å; F191-M195 VanDerWaalsContact CE2-CG 3.48Å; F191-M195 HydrophobicContact CE2-SD 4.04Å; F191-M195 HydrophobicContact CZ-CG 3.56Å; F191-M195 HydrophobicContact CZ-SD 4.23Å; F191-M195 WeakPolarHBondContact O-CG 3.48Å; F191-M195 PolarHBondContact O-N 3.06Å; F191-L254 HydrophobicContact CD1-CB 4.25Å; F191-L254 HydrophobicContact CE1-CB 4.04Å; F191-K255 VanDerWaalsContact CE1-O 3.24Å; F191-K255 WeakPolarHBondContact CE1-O 3.21Å; F191-T256 HydrophobicContact CB-CG2 3.35Å; F191-T256 HydrophobicContact CD1-CG2 3.62Å; F191-T256 HydrophobicContact CD2-CG2 4.25Å; F191-T256 HydrophobicContact CE1-CG2 4.48Å; F191-T256 HydrophobicContact CG-CG2 3.47Å; F191-T256 VanDerWaalsContact CG-CG2 3.47Å; F191-G292 VanDerWaalsContact CZ-N 3.34Å; F191-V300 HydrophobicContact CD2-CG2 4.15Å; F191-V300 HydrophobicContact CE2-CG1 4.16Å; F191-V300 HydrophobicContact CE2-CG2 4.49Å; F191-L303 HydrophobicContact CE2-CD2 3.71Å; F191-L303 HydrophobicContact CZ-CD2 3.6Å
192	E	98.7	Very high	97.6	Very high	22 Å²	22	43.1 Å²	43.1	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-41.2	174	-56.7	163.2	-151.9	0	0	111.3	R68 G188 Y189 K190 Y194 M195 C196 L254	R68-E192 IonicContact CZ-OE2 2.69Å; R68-E192 IonicContact NH2-OE2 2.97Å; R68-E192 PolarHBondContact NH2-OE2 3.2Å; G188-E192 PolarHBondContact O-N 2.86Å; Y189-E192 WeakPolarHBondContact O-CB 3.4Å; Y189-E192 PolarHBondContact O-N 3.04Å; Y189-E192 VanDerWaalsContact O-N 3.15Å; K190-E192 VanDerWaalsContact C-N 3.29Å; K190-E192 PolarHBondContact O-N 3.2Å; E192-Y194 PolarHBondContact O-N 2.87Å; E192-M195 CarbonylContact O-C 3.55Å; E192-M195 PolarHBondContact O-N 3.11Å; E192-C196 WeakPolarHBondContact O-CB 3.42Å; E192-C196 PolarHBondContact O-N 2.94Å; E192-C196 PolarHBondContact O-SG 2.85Å; E192-C196 VanDerWaalsContact O-SG 3.4Å; E192-L254 HydrophobicContact CB-CD1 4.09Å; E192-L254 HydrophobicContact CG-CB 4.16Å; E192-L254 HydrophobicContact CG-CD1 4.09Å
193	Q	98.5	Very high	97.5	Very high	21 Å²	21	43.2 Å²	43.2	10%	0.098	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-31.2	175.7	-164.1	-175.9	14.1	0	0	112.9	Y189 K190 F191 P204 D205 G208	Y189-Q193 PolarHBondContact O-N 3.36Å; Y189-Q193 VanDerWaalsContact O-N 3.13Å; K190-Q193 HydrophobicContact CD-CB 4.48Å; K190-Q193 VanDerWaalsContact CD-OE1 3.25Å; K190-Q193 WeakPolarHBondContact O-CB 3.42Å; K190-Q193 PolarHBondContact O-N 3.21Å; K190-Q193 VanDerWaalsContact O-N 3.15Å; F191-Q193 VanDerWaalsContact C-N 3.31Å; F191-Q193 PolarHBondContact O-N 2.92Å; Q193-P204 WeakPolarHBondContact O-CB 3.32Å; Q193-D205 WeakPolarHBondContact CG-O 3.41Å; Q193-D205 PolarHBondContact NE2-O 3Å; Q193-G208 PolarHBondContact NE2-O 3.2Å
194	Y	98.6	Very high	97.5	Very high	31 Å²	31	43.2 Å²	43.2	12%	0.122	26%	0.256	C	S	.	.	H	α-helix	trans	-79.7	-18.7	174.9	-78.1	-71.9	0	0	0	114.5	F82 D83 L84 K190 F191 E192 P204 P206	F82-Y194 HydrophobicContact CB-CD1 4.02Å; F82-Y194 HydrophobicContact CB-CD2 3.66Å; F82-Y194 HydrophobicContact CB-CE1 4.24Å; F82-Y194 HydrophobicContact CB-CE2 3.89Å; F82-Y194 HydrophobicContact CB-CG 3.72Å; F82-Y194 AromaticContact CD1-CD1 3.56Å; F82-Y194 HydrophobicContact CD1-CD1 3.56Å; F82-Y194 HydrophobicContact CD1-CE1 4.19Å; F82-Y194 AromaticContact CD1-CG 3.79Å; F82-Y194 HydrophobicContact CD1-CG 3.79Å; F82-Y194 HydrophobicContact CD2-CG 4.44Å; F82-Y194 HydrophobicContact CE1-CD1 4.23Å; F82-Y194 HydrophobicContact CE1-CG 4.46Å; F82-Y194 AromaticContact CG-CD1 3.99Å; F82-Y194 HydrophobicContact CG-CD1 3.99Å; F82-Y194 HydrophobicContact CG-CD2 4.19Å; F82-Y194 AromaticContact CG-CG 3.75Å; F82-Y194 HydrophobicContact CG-CG 3.75Å; D83-Y194 PolarHBondContact N-OH 3.23Å; D83-Y194 WeakPolarHBondContact O-CE2 3.44Å; D83-Y194 PolarHBondContact O-OH 3.06Å; L84-Y194 HydrophobicContact CD2-CD2 4.09Å; L84-Y194 HydrophobicContact CD2-CE2 4.29Å; K190-Y194 HydrophobicContact CD-CD2 4.49Å; K190-Y194 HydrophobicContact CD-CE2 4.05Å; K190-Y194 VanDerWaalsContact CE-CE2 3.47Å; K190-Y194 HydrophobicContact CG-CD2 4.17Å; K190-Y194 HydrophobicContact CG-CE2 3.79Å; K190-Y194 WeakPolarHBondContact O-CD2 3.26Å; K190-Y194 PolarHBondContact O-N 2.77Å; F191-Y194 PolarHBondContact O-N 2.97Å; E192-Y194 PolarHBondContact O-N 2.87Å; Y194-P204 VanDerWaalsContact O-CG 3.28Å; Y194-P204 WeakPolarHBondContact O-CG 3.49Å; Y194-P206 HydrophobicContact CD1-CB 3.83Å; Y194-P206 HydrophobicContact CD1-CG 4.18Å; Y194-P206 HydrophobicContact CE1-CB 3.43Å; Y194-P206 VanDerWaalsContact CE1-CB 3.43Å; Y194-P206 HydrophobicContact CE1-CG 3.78Å
195	M	98.6	Very high	97.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-111	-3.4	-173.3	-67.7	-63.4	-60.4	0	0	113	Y70 S71 P72 F82 F191 E192 L254 V290 L303	Y70-M195 HydrophobicContact CD2-CE 4.45Å; Y70-M195 HydrophobicContact CE2-CE 3.48Å; Y70-M195 VanDerWaalsContact CE2-CE 3.48Å; S71-M195 PolarHBondContact N-O 2.96Å; P72-M195 HydrophobicContact CB-CE 3.88Å; F82-M195 HydrophobicContact CE2-CG 4.37Å; F82-M195 HydrophobicContact CE2-SD 3.53Å; F82-M195 VanDerWaalsContact CE2-SD 3.53Å; F82-M195 HydrophobicContact CZ-SD 3.84Å; F191-M195 HydrophobicContact CD2-CG 4.01Å; F191-M195 HydrophobicContact CE1-CG 4.13Å; F191-M195 HydrophobicContact CE2-CG 3.48Å; F191-M195 VanDerWaalsContact CE2-CG 3.48Å; F191-M195 HydrophobicContact CE2-SD 4.04Å; F191-M195 HydrophobicContact CZ-CG 3.56Å; F191-M195 HydrophobicContact CZ-SD 4.23Å; F191-M195 WeakPolarHBondContact O-CG 3.48Å; F191-M195 PolarHBondContact O-N 3.06Å; E192-M195 CarbonylContact O-C 3.55Å; E192-M195 PolarHBondContact O-N 3.11Å; M195-L254 HydrophobicContact CB-CD1 3.78Å; M195-L254 HydrophobicContact CB-CD2 4.31Å; M195-V290 HydrophobicContact CE-CG1 4.16Å; M195-L303 HydrophobicContact CE-CD1 3.94Å; M195-L303 HydrophobicContact CE-CD2 4.09Å; M195-L303 HydrophobicContact SD-CD1 3.94Å; M195-L303 HydrophobicContact SD-CD2 3.98Å
196	C	98.6	Very high	97.5	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.034	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146.1	-174.8	-68.1	0	0	0	0	111.4	R68 Y69 E192 P204 C237 L254	R68-C196 HydrophobicContact CB-CB 3.83Å; Y69-C196 CarbonylContact O-C 3.58Å; Y69-C196 VanDerWaalsContact O-CA 3.29Å; Y69-C196 WeakPolarHBondContact O-CA 3.13Å; E192-C196 WeakPolarHBondContact O-CB 3.42Å; E192-C196 PolarHBondContact O-N 2.94Å; E192-C196 PolarHBondContact O-SG 2.85Å; E192-C196 VanDerWaalsContact O-SG 3.4Å; C196-P204 WeakPolarHBondContact O-CA 3.32Å; C196-P204 VanDerWaalsContact O-CB 3.29Å; C196-P204 WeakPolarHBondContact O-CB 3.5Å; C196-C237 VanDerWaalsContact SG-CB 3.57Å; C196-L254 WeakPolarHBondContact SG-CD1 3.3Å
197	A	98.3	Very high	97.4	Very high	4 Å²	4	48.2 Å²	48.2	3%	0.033	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	158.3	169.9	0	0	0	0	0	111.2	Y69 K199 S202	Y69-A197 PolarHBondContact N-O 3.07Å; Y69-A197 PolarHBondContact O-N 3.14Å; A197-K199 VanDerWaalsContact C-N 3.29Å; A197-K199 PolarHBondContact O-N 3.23Å; A197-S202 WeakPolarHBondContact CB-O 3.34Å; A197-S202 VanDerWaalsContact CB-OG 3.26Å; A197-S202 WeakPolarHBondContact CB-OG 3.36Å
198	D	97.2	Very high	97.3	Very high	133 Å²	133	49.4 Å²	49.4	71%	0.711	31%	0.306	S	S	*	.	S	Bend	trans	-75.3	-18.1	-177.2	-62.8	-23.6	0	0	0	113.4	Y69	Y69-D198 WeakPolarHBondContact CE2-O 3.33Å
199	K	96.5	Very high	97.3	Very high	148 Å²	148	53.7 Å²	53.7	64%	0.643	32%	0.321	S	S	*	.	S	Bend	trans	-128.5	152	178.4	-64.2	178.9	-175.8	175.7	0	111.2	Y69 A197 G201 S202	Y69-K199 VanDerWaalsContact CD2-C 3.4Å; A197-K199 VanDerWaalsContact C-N 3.29Å; A197-K199 PolarHBondContact O-N 3.23Å; K199-G201 PolarHBondContact O-N 3.41Å; K199-S202 PolarHBondContact N-OG 3.23Å; K199-S202 PolarHBondContact O-N 3.3Å; K199-S202 PolarHBondContact O-OG 3.1Å
200	P	94.9	Very high	97.3	Very high	80 Å²	80	50.7 Å²	50.7	52%	0.519	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	127.5	173.6	-19.1	28.4	0	0	0	111.1	Y69 S202 P240	Y69-P200 HydrophobicContact CD1-CB 4.19Å; Y69-P200 HydrophobicContact CD1-CG 3.79Å; Y69-P200 HydrophobicContact CD2-CG 4.29Å; Y69-P200 HydrophobicContact CE1-CB 4.42Å; Y69-P200 HydrophobicContact CE1-CG 3.57Å; Y69-P200 HydrophobicContact CE2-CG 4.11Å; Y69-P200 HydrophobicContact CG-CB 4.44Å; Y69-P200 HydrophobicContact CG-CG 4.14Å; P200-S202 VanDerWaalsContact C-N 3.25Å; P200-S202 PolarHBondContact O-N 3.11Å; P200-P240 HydrophobicContact CB-CB 4.47Å; P200-P240 HydrophobicContact CB-CG 4.08Å
201	G	91.8	Very high	97.3	Very high	79 Å²	79	51.9 Å²	51.9	81%	0.814	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	2.1	175.7	0	0	0	0	0	115.9	K199	K199-G201 PolarHBondContact O-N 3.41Å
202	S	94.9	Very high	97.2	Very high	41 Å²	41	52.4 Å²	52.4	29%	0.287	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-82.3	165.4	170.4	58.4	0	0	0	0	112.2	S71 A197 K199 P200	S71-S202 PolarHBondContact OG-O 3.3Å; A197-S202 WeakPolarHBondContact CB-O 3.34Å; A197-S202 VanDerWaalsContact CB-OG 3.26Å; A197-S202 WeakPolarHBondContact CB-OG 3.36Å; K199-S202 PolarHBondContact N-OG 3.23Å; K199-S202 PolarHBondContact O-N 3.3Å; K199-S202 PolarHBondContact O-OG 3.1Å; P200-S202 VanDerWaalsContact C-N 3.25Å; P200-S202 PolarHBondContact O-N 3.11Å
203	S	95.6	Very high	97.2	Very high	104 Å²	104	52.7 Å²	52.7	73%	0.727	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-81	147	176.1	-56.7	0	0	0	0	112
204	P	97.7	Very high	97.2	Very high	35 Å²	35	54.6 Å²	54.6	23%	0.227	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-58	145.1	167.5	-23.9	34.9	0	0	0	112.5	S71 Q193 Y194 C196	S71-P204 WeakPolarHBondContact O-CG 3.47Å; Q193-P204 WeakPolarHBondContact O-CB 3.32Å; Y194-P204 VanDerWaalsContact O-CG 3.28Å; Y194-P204 WeakPolarHBondContact O-CG 3.49Å; C196-P204 WeakPolarHBondContact O-CA 3.32Å; C196-P204 VanDerWaalsContact O-CB 3.29Å; C196-P204 WeakPolarHBondContact O-CB 3.5Å
205	D	97.7	Very high	97.3	Very high	94 Å²	94	53.3 Å²	53.3	50%	0.503	33%	0.331	S	S	.	.			trans	-116.7	96.4	173.5	-178.2	4.7	0	0	0	110.7	Q193 S207	Q193-D205 WeakPolarHBondContact CG-O 3.41Å; Q193-D205 PolarHBondContact NE2-O 3Å; D205-S207 PolarHBondContact O-N 2.79Å; D205-S207 VanDerWaalsContact OD1-CB 3.24Å; D205-S207 WeakPolarHBondContact OD1-CB 3.17Å; D205-S207 PolarHBondContact OD1-N 3.4Å; D205-S207 PolarHBondContact OD1-OG 3.12Å; D205-S207 PolarHBondContact OD2-OG 3.22Å
206	P	97.5	Very high	97.3	Very high	39 Å²	39	53.6 Å²	53.6	25%	0.253	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-3.6	178.3	32.5	-35.3	0	0	0	113.8	R91 K190 Y194	R91-P206 PolarHBondContact NH1-O 2.95Å; K190-P206 PolarHBondContact NZ-O 3.06Å; Y194-P206 HydrophobicContact CD1-CB 3.83Å; Y194-P206 HydrophobicContact CD1-CG 4.18Å; Y194-P206 HydrophobicContact CE1-CB 3.43Å; Y194-P206 VanDerWaalsContact CE1-CB 3.43Å; Y194-P206 HydrophobicContact CE1-CG 3.78Å
207	S	97.6	Very high	97.3	Very high	79 Å²	79	53.6 Å²	53.6	55%	0.552	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.9	-177.5	76.7	0	0	0	0	113.8	R91 D205	R91-S207 PolarHBondContact NH1-O 3.33Å; D205-S207 PolarHBondContact O-N 2.79Å; D205-S207 VanDerWaalsContact OD1-CB 3.24Å; D205-S207 WeakPolarHBondContact OD1-CB 3.17Å; D205-S207 PolarHBondContact OD1-N 3.4Å; D205-S207 PolarHBondContact OD1-OG 3.12Å; D205-S207 PolarHBondContact OD2-OG 3.22Å
208	G	96.4	Very high	97.3	Very high	29 Å²	29	53.5 Å²	53.5	30%	0.299	33%	0.331	S	S	.	.	S	Bend	trans	-68.8	179.9	175.4	0	0	0	0	0	114.3	R91 Q193	R91-G208 PolarHBondContact NH1-O 2.97Å; Q193-G208 PolarHBondContact NE2-O 3.2Å
209	E	97.7	Very high	97.4	Very high	109 Å²	109	47.1 Å²	47.1	51%	0.509	30%	0.297	S	S	.	.			trans	-82	149.2	175.1	-61.9	-178.2	124.2	0	0	112.1	R91 Q93	R91-E209 HydrophobicContact CB-CG 4.33Å; R91-E209 WeakPolarHBondContact O-CA 3.24Å; Q93-E209 PolarHBondContact NE2-OE1 3.15Å; Q93-E209 PolarHBondContact NE2-OE2 3.05Å
210	V	98.6	Very high	97.5	Very high	10 Å²	10	40.1 Å²	40.1	6%	0.061	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	99.6	166.9	178.5	0	0	0	0	107.6	R91 Y92 Q93 Y186 Y189 K190 T212	R91-V210 PolarHBondContact O-N 3.4Å; Y92-V210 HydrophobicContact CD2-CB 4.26Å; Y92-V210 HydrophobicContact CD2-CG1 4.15Å; Y92-V210 WeakPolarHBondContact CD2-O 3.42Å; Y92-V210 HydrophobicContact CE2-CG1 4.29Å; Q93-V210 PolarHBondContact N-O 2.87Å; Y186-V210 HydrophobicContact CD2-CB 4.19Å; Y186-V210 HydrophobicContact CD2-CG1 4.23Å; Y186-V210 HydrophobicContact CD2-CG2 4.39Å; Y186-V210 HydrophobicContact CE2-CB 3.62Å; Y186-V210 HydrophobicContact CE2-CG1 4.14Å; Y186-V210 HydrophobicContact CE2-CG2 3.56Å; Y189-V210 VanDerWaalsContact CB-CG1 3.43Å; Y189-V210 HydrophobicContact CG-CG1 4.34Å; K190-V210 HydrophobicContact CB-CG2 4.4Å; K190-V210 HydrophobicContact CD-CG2 3.96Å; V210-T212 HydrophobicContact CG1-CG2 4.38Å
211	N	98.5	Very high	97.6	Very high	25 Å²	25	37.9 Å²	37.9	13%	0.134	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.1	176.7	-175.8	-23.8	0	0	0	110.6	A56 Q93 N213 V214	A56-N211 WeakPolarHBondContact CB-ND2 3.3Å; A56-N211 PolarHBondContact O-ND2 2.94Å; Q93-N211 HydrophobicContact CB-CB 3.99Å; Q93-N211 WeakPolarHBondContact O-CA 3.46Å; Q93-N211 PolarHBondContact OE1-ND2 3.3Å; N211-N213 VanDerWaalsContact C-N 3.29Å; N211-N213 PolarHBondContact O-N 3Å; N211-N213 WeakPolarHBondContact OD1-CB 3.4Å; N211-N213 PolarHBondContact OD1-N 3.34Å; N211-N213 PolarHBondContact OD1-ND2 2.89Å; N211-V214 HydrophobicContact CB-CG2 4.31Å; N211-V214 PolarHBondContact O-N 3.35Å
212	T	98.3	Very high	97.9	Very high	13 Å²	13	34.2 Å²	34.2	8%	0.08	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	6.4	-175.7	60.7	0	0	0	0	113.6	Y92 Q93 P94 R95 Y189 V210	Y92-T212 HydrophobicContact CE2-CG2 3.84Å; Q93-T212 PolarHBondContact O-N 2.77Å; Q93-T212 PolarHBondContact O-OG1 3.48Å; P94-T212 VanDerWaalsContact CA-OG1 3.28Å; P94-T212 WeakPolarHBondContact CA-OG1 3.33Å; R95-T212 PolarHBondContact N-OG1 3.27Å; Y189-T212 HydrophobicContact CD1-CG2 3.85Å; Y189-T212 HydrophobicContact CD2-CG2 3.39Å; Y189-T212 HydrophobicContact CE1-CG2 3.86Å; Y189-T212 HydrophobicContact CE2-CG2 3.4Å; Y189-T212 VanDerWaalsContact CE2-CG2 3.4Å; Y189-T212 HydrophobicContact CG-CG2 3.61Å; V210-T212 HydrophobicContact CG1-CG2 4.38Å
213	N	98.6	Very high	98.1	Very high	28 Å²	28	36.8 Å²	36.8	15%	0.15	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-33.6	164.1	-61.2	-77.2	0	0	0	110.9	L54 D55 R58 R95 N211 A215	L54-N213 WeakPolarHBondContact CB-O 3.29Å; D55-N213 CarbonylContact O-C 3.49Å; R58-N213 HydrophobicContact CB-CB 4.07Å; R58-N213 VanDerWaalsContact CD-O 3.26Å; R58-N213 WeakPolarHBondContact CD-O 3.34Å; R58-N213 PolarHBondContact NH1-O 3.36Å; R95-N213 WeakPolarHBondContact CA-OD1 3.32Å; R95-N213 WeakPolarHBondContact CG-OD1 3.46Å; N211-N213 VanDerWaalsContact C-N 3.29Å; N211-N213 PolarHBondContact O-N 3Å; N211-N213 WeakPolarHBondContact OD1-CB 3.4Å; N211-N213 PolarHBondContact OD1-N 3.34Å; N211-N213 PolarHBondContact OD1-ND2 2.89Å; N213-A215 PolarHBondContact O-N 3.05Å
214	V	98.7	Very high	98.3	Very high	60 Å²	60	31.9 Å²	31.9	36%	0.364	18%	0.178	S	C	.	.			trans	-67	126.4	178.7	-176.4	0	0	0	0	109.3	L54 A56 A66 N211	L54-V214 VanDerWaalsContact O-CA 3.27Å; L54-V214 WeakPolarHBondContact O-CA 3.22Å; A56-V214 HydrophobicContact CB-CG2 4.16Å; A66-V214 HydrophobicContact CB-CG1 3.95Å; N211-V214 HydrophobicContact CB-CG2 4.31Å; N211-V214 PolarHBondContact O-N 3.35Å
215	A	98.8	Very high	98.3	Very high	5 Å²	5	31.4 Å²	31.4	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	145.2	176.9	0	0	0	0	0	111.1	S53 L54 A66 N213 E234	S53-A215 CarbonylContact C-O 3.6Å; S53-A215 WeakPolarHBondContact CA-O 3.42Å; L54-A215 HydrophobicContact CB-CB 4.33Å; L54-A215 HydrophobicContact CD1-CB 4.37Å; L54-A215 PolarHBondContact N-O 3.39Å; L54-A215 PolarHBondContact O-N 3.39Å; A66-A215 VanDerWaalsContact CB-O 3.31Å; A66-A215 WeakPolarHBondContact CB-O 3.41Å; N213-A215 PolarHBondContact O-N 3.05Å; A215-E234 HydrophobicContact CB-CG 4.34Å
216	F	98.8	Very high	98.3	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.4	168.1	171	-101.4	0	0	0	109.5	C51 A64 A66 L67 E234 V235 Y251	C51-F216 HydrophobicContact CB-CE2 3.49Å; C51-F216 VanDerWaalsContact CB-CE2 3.49Å; C51-F216 HydrophobicContact CB-CZ 3.66Å; A64-F216 HydrophobicContact CB-CD2 4.22Å; A64-F216 HydrophobicContact CB-CE2 3.6Å; A64-F216 HydrophobicContact CB-CZ 4.45Å; A66-F216 HydrophobicContact CB-CB 4.05Å; L67-F216 HydrophobicContact CB-CB 4.44Å; L67-F216 HydrophobicContact CB-CD1 4.15Å; L67-F216 HydrophobicContact CB-CD2 3.8Å; L67-F216 HydrophobicContact CB-CE1 4.4Å; L67-F216 HydrophobicContact CB-CE2 4.03Å; L67-F216 HydrophobicContact CB-CG 3.85Å; L67-F216 HydrophobicContact CB-CZ 4.33Å; L67-F216 HydrophobicContact CD1-CD1 3.59Å; L67-F216 HydrophobicContact CD1-CE1 3.68Å; L67-F216 HydrophobicContact CD1-CG 4.16Å; L67-F216 HydrophobicContact CD1-CZ 4.27Å; L67-F216 HydrophobicContact CD2-CE1 4.45Å; L67-F216 HydrophobicContact CD2-CZ 4.27Å; L67-F216 HydrophobicContact CG-CD1 4.39Å; L67-F216 HydrophobicContact CG-CE1 4.39Å; F216-E234 WeakPolarHBondContact O-CA 3.31Å; F216-V235 HydrophobicContact CD1-CB 3.88Å; F216-V235 HydrophobicContact CD1-CG1 4.27Å; F216-V235 HydrophobicContact CE1-CB 4.11Å; F216-V235 HydrophobicContact CE1-CG1 4.32Å; F216-V235 PolarHBondContact O-N 3.38Å; F216-Y251 HydrophobicContact CE1-CE1 4.07Å; F216-Y251 AromaticContact CE1-CZ 3.93Å
217	C	98.9	Very high	98.3	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.034	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.9	-175.1	-72	0	0	0	0	111.1	C51 F52 G233	C51-C217 CarbonylContact C-O 3.55Å; C51-C217 WeakPolarHBondContact CA-O 3.33Å; C51-C217 VanDerWaalsContact CB-O 3.24Å; C51-C217 WeakPolarHBondContact CB-O 3.33Å; F52-C217 HydrophobicContact CD1-CB 4.19Å; F52-C217 HydrophobicContact CD2-CB 3.93Å; F52-C217 HydrophobicContact CE1-CB 3.79Å; F52-C217 HydrophobicContact CE2-CB 3.49Å; F52-C217 VanDerWaalsContact CE2-CB 3.49Å; F52-C217 HydrophobicContact CG-CB 4.26Å; F52-C217 HydrophobicContact CZ-CB 3.41Å; F52-C217 VanDerWaalsContact CZ-CB 3.41Å; F52-C217 PolarHBondContact N-O 3.07Å; F52-C217 PolarHBondContact O-N 3.5Å; C217-G233 WeakPolarHBondContact CA-O 3.4Å
218	S	98.8	Very high	98.3	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.3	170.2	176.7	0	0	0	0	109.7	E48 L220 S232 G233	E48-S218 VanDerWaalsContact OE2-CB 3.28Å; E48-S218 WeakPolarHBondContact OE2-CB 3.41Å; E48-S218 PolarHBondContact OE2-OG 3.45Å; S218-L220 WeakPolarHBondContact O-CD1 3.47Å; S218-S232 CarbonylContact O-C 3.4Å; S218-S232 VanDerWaalsContact O-CA 3.23Å; S218-S232 WeakPolarHBondContact O-CA 3.21Å; S218-S232 PolarHBondContact O-OG 2.94Å; S218-G233 PolarHBondContact N-O 2.7Å; S218-G233 PolarHBondContact O-N 3.47Å
219	V	98.7	Very high	98.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.2	174.7	-172.8	0	0	0	0	109.1	E48 L49 G50 F52 L106 W109 L230	E48-V219 CarbonylContact C-O 3.5Å; E48-V219 WeakPolarHBondContact CA-O 3.28Å; L49-V219 PolarHBondContact N-O 3.18Å; G50-V219 PolarHBondContact O-N 3.19Å; F52-V219 HydrophobicContact CD1-CG2 3.83Å; F52-V219 HydrophobicContact CE1-CG2 3.68Å; L106-V219 HydrophobicContact CD1-CG1 4.1Å; L106-V219 HydrophobicContact CD1-CG2 4.32Å; W109-V219 HydrophobicContact CD2-CB 4.11Å; W109-V219 HydrophobicContact CD2-CG1 4.02Å; W109-V219 HydrophobicContact CD2-CG2 3.7Å; W109-V219 HydrophobicContact CE3-CB 4.32Å; W109-V219 HydrophobicContact CE3-CG1 3.71Å; W109-V219 HydrophobicContact CE3-CG2 4.22Å; W109-V219 HydrophobicContact CG-CG2 3.87Å; W109-V219 HydrophobicContact CH2-CB 4.23Å; W109-V219 HydrophobicContact CH2-CG1 3.79Å; W109-V219 HydrophobicContact CZ2-CB 3.98Å; W109-V219 HydrophobicContact CZ2-CG1 4.07Å; W109-V219 HydrophobicContact CZ2-CG2 4.36Å; W109-V219 HydrophobicContact CZ3-CB 4.39Å; W109-V219 HydrophobicContact CZ3-CG1 3.61Å; V219-L230 HydrophobicContact CG1-CD2 4.12Å; V219-L230 HydrophobicContact CG1-CG 4.39Å
220	L	98.6	Very high	98.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.9	-169.6	-56	106.7	0	0	0	112.6	P46 S47 S218 L230 F231 P248 P284	P46-L220 HydrophobicContact CB-CD2 3.86Å; S47-L220 WeakPolarHBondContact O-CA 3.47Å; S218-L220 WeakPolarHBondContact O-CD1 3.47Å; L220-L230 WeakPolarHBondContact O-CA 3.48Å; L220-F231 HydrophobicContact CB-CE1 4.33Å; L220-F231 HydrophobicContact CB-CE2 4.1Å; L220-F231 HydrophobicContact CB-CZ 3.95Å; L220-F231 HydrophobicContact CD1-CD2 4.31Å; L220-F231 HydrophobicContact CD1-CE2 3.87Å; L220-F231 HydrophobicContact CD1-CZ 4.49Å; L220-F231 PolarHBondContact N-O 2.99Å; L220-F231 PolarHBondContact O-N 3.11Å; L220-P248 HydrophobicContact CD2-CB 4.01Å; L220-P248 HydrophobicContact CD2-CG 3.93Å; L220-P284 HydrophobicContact CD1-CB 3.9Å; L220-P284 HydrophobicContact CD2-CB 4.06Å; L220-P284 WeakPolarHBondContact CD2-O 3.46Å
221	R	98.1	Very high	98.5	Very high	34 Å²	34	20.1 Å²	20.1	13%	0.128	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.5	168.5	-178.2	173.3	-179.1	-149.2	2	110.5	P46 S47 L49 E118 W123 L229	P46-R221 WeakPolarHBondContact CA-O 3.26Å; S47-R221 PolarHBondContact N-O 3.19Å; S47-R221 PolarHBondContact O-N 3.24Å; L49-R221 HydrophobicContact CD1-CB 3.9Å; L49-R221 HydrophobicContact CD2-CB 3.79Å; L49-R221 HydrophobicContact CG-CB 3.77Å; E118-R221 IonicContact OE2-NH1 3.68Å; W123-R221 HydrophobicContact CH2-CG 3.85Å; W123-R221 HydrophobicContact CZ2-CG 3.6Å; W123-R221 VanDerWaalsContact CZ2-NE 3.34Å; R221-L229 WeakPolarHBondContact CA-O 3.41Å
222	S	98.4	Very high	98.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.007	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	-170.9	170.4	-168.3	0	0	0	0	111	Y43 R44 L229	Y43-S222 WeakPolarHBondContact CE2-OG 3.41Å; Y43-S222 VanDerWaalsContact CZ-OG 3.3Å; R44-S222 PolarHBondContact O-OG 3.42Å; S222-L229 PolarHBondContact N-O 3.18Å; S222-L229 PolarHBondContact O-N 2.75Å
223	R	98.6	Very high	98.5	Very high	96 Å²	96	18.4 Å²	18.4	36%	0.362	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	127.5	171.8	173.6	165.4	66.7	87.3	-5.6	109.3	F42 Y43 R44 G225 H227	F42-R223 HydrophobicContact CE1-CB 4.38Å; F42-R223 HydrophobicContact CE1-CG 4.32Å; F42-R223 VanDerWaalsContact CE1-NH2 3.25Å; Y43-R223 CarbonylContact C-O 3.59Å; Y43-R223 WeakPolarHBondContact CA-O 3.33Å; R44-R223 HydrophobicContact CB-CB 4.02Å; R44-R223 PolarHBondContact N-O 3.41Å; R223-G225 VanDerWaalsContact CG-O 3.28Å; R223-G225 WeakPolarHBondContact CG-O 3.37Å; R223-G225 PolarHBondContact NH1-O 2.89Å; R223-H227 CarbonylContact C-O 3.58Å; R223-H227 VanDerWaalsContact CA-O 3.26Å; R223-H227 WeakPolarHBondContact CA-O 3.28Å; R223-H227 WeakPolarHBondContact CG-O 3.36Å
224	L	98.8	Very high	98.5	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.6	173.4	175.1	53.6	0	0	0	109.5	P41 Y43 S226 H227 L229 M328 C331 A332 L335	P41-L224 HydrophobicContact CB-CD1 4.27Å; P41-L224 HydrophobicContact CG-CD1 3.86Å; Y43-L224 HydrophobicContact CD2-CB 3.96Å; Y43-L224 HydrophobicContact CD2-CD1 4.14Å; Y43-L224 HydrophobicContact CE2-CB 4.27Å; L224-S226 PolarHBondContact O-N 2.86Å; L224-H227 PolarHBondContact N-O 2.89Å; L224-H227 WeakPolarHBondContact O-CB 3.5Å; L224-H227 PolarHBondContact O-CD2 3.14Å; L224-H227 PolarHBondContact O-N 3.46Å; L224-L229 HydrophobicContact CB-CD1 4.08Å; L224-M328 HydrophobicContact CD1-CB 4.44Å; L224-M328 HydrophobicContact CD1-CE 3.64Å; L224-M328 HydrophobicContact CD2-CE 4.01Å; L224-M328 HydrophobicContact CG-CE 4.37Å; L224-C331 HydrophobicContact CD2-CB 3.81Å; L224-A332 HydrophobicContact CD1-CB 4.29Å; L224-A332 HydrophobicContact CD2-CB 4.09Å; L224-A332 HydrophobicContact CG-CB 3.92Å; L224-L335 HydrophobicContact CB-CD1 4.41Å; L224-L335 HydrophobicContact CD2-CD1 4.11Å
225	G	98.1	Very high	98.5	Very high	24 Å²	24	17.7 Å²	17.7	25%	0.247	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	-123.2	-171.5	0	0	0	0	0	110.5	F42 R223	F42-G225 PolarHBondContact O-N 2.66Å; R223-G225 VanDerWaalsContact CG-O 3.28Å; R223-G225 WeakPolarHBondContact CG-O 3.37Å; R223-G225 PolarHBondContact NH1-O 2.89Å
226	S	97.2	Very high	98.5	Very high	91 Å²	91	18.1 Å²	18.1	64%	0.636	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-5	174.9	53.9	0	0	0	0	114.3	L224 P228	L224-S226 PolarHBondContact O-N 2.86Å; S226-P228 VanDerWaalsContact O-CD 3.28Å; S226-P228 WeakPolarHBondContact O-CD 3.32Å
227	H	98.6	Very high	98.5	Very high	17 Å²	17	17.9 Å²	17.9	8%	0.079	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	107.2	-167.6	-53.5	-61.7	0	0	0	111.8	I128 R223 L224 A332 L335 S336	I128-H227 HydrophobicContact CD1-CB 4.06Å; R223-H227 CarbonylContact C-O 3.58Å; R223-H227 VanDerWaalsContact CA-O 3.26Å; R223-H227 WeakPolarHBondContact CA-O 3.28Å; R223-H227 WeakPolarHBondContact CG-O 3.36Å; L224-H227 PolarHBondContact N-O 2.89Å; L224-H227 WeakPolarHBondContact O-CB 3.5Å; L224-H227 PolarHBondContact O-CD2 3.14Å; L224-H227 PolarHBondContact O-N 3.46Å; H227-A332 PolarHBondContact NE2-O 3.09Å; H227-L335 HydrophobicContact CB-CB 4.36Å; H227-L335 HydrophobicContact CB-CD1 3.98Å; H227-S336 PolarHBondContact CE1-OG 2.87Å; H227-S336 VanDerWaalsContact CE1-OG 3.27Å; H227-S336 PolarHBondContact NE2-N 2.92Å; H227-S336 PolarHBondContact NE2-OG 3.04Å
228	P	98.4	Very high	98.5	Very high	14 Å²	14	18.3 Å²	18.3	9%	0.091	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	139.1	172.7	-12.3	28.8	0	0	0	110.1	W123 E126 A127 I128 S226	W123-P228 HydrophobicContact CZ2-CB 4.17Å; E126-P228 HydrophobicContact CB-CG 4.36Å; E126-P228 WeakPolarHBondContact O-CD 3.45Å; A127-P228 WeakPolarHBondContact CA-O 3.3Å; A127-P228 HydrophobicContact CB-CB 4.21Å; I128-P228 PolarHBondContact N-O 2.78Å; S226-P228 VanDerWaalsContact O-CD 3.28Å; S226-P228 WeakPolarHBondContact O-CD 3.32Å
229	L	98.8	Very high	98.5	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.2	-177.6	-56.8	176.8	0	0	0	109.9	Y43 I128 L135 R221 S222 L224 F231 L335	Y43-L229 HydrophobicContact CE2-CD1 4.16Å; I128-L229 HydrophobicContact CB-CD2 3.95Å; I128-L229 HydrophobicContact CD1-CD2 4.44Å; L135-L229 HydrophobicContact CD1-CD1 4.32Å; R221-L229 WeakPolarHBondContact CA-O 3.41Å; S222-L229 PolarHBondContact N-O 3.18Å; S222-L229 PolarHBondContact O-N 2.75Å; L224-L229 HydrophobicContact CB-CD1 4.08Å; L229-F231 HydrophobicContact CB-CD1 3.93Å; L229-F231 HydrophobicContact CB-CE1 4.26Å; L229-L335 HydrophobicContact CD2-CD1 3.9Å
230	L	98.7	Very high	98.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.1	160.3	-174.9	149.5	0	0	0	106.9	L49 L106 W109 L110 L117 W123 I128 V129 T130 V219 L220	L49-L230 HydrophobicContact CD1-CD1 3.98Å; L49-L230 HydrophobicContact CD1-CG 4.47Å; L106-L230 HydrophobicContact CD1-CD2 3.96Å; L106-L230 HydrophobicContact CG-CD2 4.5Å; W109-L230 HydrophobicContact CZ3-CD1 4.26Å; L110-L230 HydrophobicContact CD1-CD1 3.9Å; L117-L230 HydrophobicContact CD2-CD1 4.17Å; W123-L230 HydrophobicContact CH2-CB 3.97Å; W123-L230 HydrophobicContact CH2-CD1 4.23Å; W123-L230 HydrophobicContact CZ3-CB 4.39Å; W123-L230 HydrophobicContact CZ3-CD1 3.95Å; I128-L230 PolarHBondContact O-N 3.24Å; V129-L230 VanDerWaalsContact CA-O 3.28Å; V129-L230 WeakPolarHBondContact CA-O 3.5Å; V129-L230 HydrophobicContact CG1-CD2 4.13Å; V129-L230 HydrophobicContact CG2-CB 4.24Å; V129-L230 HydrophobicContact CG2-CD2 4.35Å; T130-L230 PolarHBondContact N-O 2.78Å; V219-L230 HydrophobicContact CG1-CD2 4.12Å; V219-L230 HydrophobicContact CG1-CG 4.39Å; L220-L230 WeakPolarHBondContact O-CA 3.48Å
231	F	98.9	Very high	98.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.3	179.4	62	-85.1	0	0	0	110.9	T130 R132 L135 L220 L229 L283 P284	T130-F231 HydrophobicContact CG2-CB 4.31Å; T130-F231 WeakPolarHBondContact O-CA 3.28Å; T130-F231 WeakPolarHBondContact O-CB 3.12Å; R132-F231 HydrophobicContact CB-CD2 3.86Å; R132-F231 HydrophobicContact CB-CE2 4.31Å; R132-F231 HydrophobicContact CG-CD2 4.36Å; R132-F231 HydrophobicContact CG-CE2 4.32Å; L135-F231 HydrophobicContact CD1-CB 4.19Å; L135-F231 HydrophobicContact CD1-CD1 3.98Å; L135-F231 HydrophobicContact CD1-CD2 4.47Å; L135-F231 HydrophobicContact CD1-CG 3.95Å; L220-F231 HydrophobicContact CB-CE1 4.33Å; L220-F231 HydrophobicContact CB-CE2 4.1Å; L220-F231 HydrophobicContact CB-CZ 3.95Å; L220-F231 HydrophobicContact CD1-CD2 4.31Å; L220-F231 HydrophobicContact CD1-CE2 3.87Å; L220-F231 HydrophobicContact CD1-CZ 4.49Å; L220-F231 PolarHBondContact N-O 2.99Å; L220-F231 PolarHBondContact O-N 3.11Å; L229-F231 HydrophobicContact CB-CD1 3.93Å; L229-F231 HydrophobicContact CB-CE1 4.26Å; F231-L283 HydrophobicContact CE2-CB 4.49Å; F231-L283 WeakPolarHBondContact CZ-O 3.36Å; F231-P284 HydrophobicContact CE2-CB 4.43Å
232	S	98.8	Very high	97.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	151.6	173.4	-178.9	0	0	0	0	110.9	F52 T130 W131 R132 S218	F52-S232 WeakPolarHBondContact CE1-OG 3.18Å; T130-S232 PolarHBondContact O-N 2.91Å; W131-S232 VanDerWaalsContact CE3-O 3.29Å; W131-S232 VanDerWaalsContact CZ3-CB 3.46Å; W131-S232 VanDerWaalsContact CZ3-OG 3.32Å; W131-S232 WeakPolarHBondContact CZ3-OG 3.03Å; R132-S232 VanDerWaalsContact CB-O 3.25Å; R132-S232 WeakPolarHBondContact CB-O 3.39Å; R132-S232 PolarHBondContact N-O 3.5Å; S218-S232 CarbonylContact O-C 3.4Å; S218-S232 VanDerWaalsContact O-CA 3.23Å; S218-S232 WeakPolarHBondContact O-CA 3.21Å; S218-S232 PolarHBondContact O-OG 2.94Å
233	G	98.4	Very high	97.7	Very high	3 Å²	3	36.9 Å²	36.9	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	137.4	173.7	0	0	0	0	0	110.8	C217 S218	C217-G233 WeakPolarHBondContact CA-O 3.4Å; S218-G233 PolarHBondContact N-O 2.7Å; S218-G233 PolarHBondContact O-N 3.47Å
234	E	98.5	Very high	97.4	Very high	65 Å²	65	34.3 Å²	34.3	30%	0.304	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	138.4	167.3	-172.6	173.1	-174.2	0	0	110.4	R132 A215 F216	R132-E234 PolarHBondContact NH2-O 2.87Å; A215-E234 HydrophobicContact CB-CG 4.34Å; F216-E234 WeakPolarHBondContact O-CA 3.31Å
235	V	98.7	Very high	97	Very high	8 Å²	8	39.6 Å²	39.6	5%	0.048	24%	0.239	C	C	.	.			trans	-126.7	125.3	-179.4	168.8	0	0	0	0	108.5	F216 Y251	F216-V235 HydrophobicContact CD1-CB 3.88Å; F216-V235 HydrophobicContact CD1-CG1 4.27Å; F216-V235 HydrophobicContact CE1-CB 4.11Å; F216-V235 HydrophobicContact CE1-CG1 4.32Å; F216-V235 PolarHBondContact O-N 3.38Å; V235-Y251 HydrophobicContact CG1-CD1 3.55Å; V235-Y251 HydrophobicContact CG1-CD2 3.92Å; V235-Y251 HydrophobicContact CG1-CE1 4.05Å; V235-Y251 HydrophobicContact CG1-CE2 4.38Å; V235-Y251 HydrophobicContact CG1-CG 3.49Å; V235-Y251 VanDerWaalsContact CG1-CG 3.49Å; V235-Y251 HydrophobicContact CG2-CD2 3.95Å; V235-Y251 HydrophobicContact CG2-CE2 4.17Å; V235-Y251 HydrophobicContact CG2-CG 4.37Å
236	D	98.7	Very high	96.8	Very high	14 Å²	14	45 Å²	45	8%	0.075	26%	0.258	C	S	.	.			trans	-71.6	-42.3	-171.2	-52	-28	0	0	0	112.5	E253 L254	D236-E253 WeakPolarHBondContact OD2-CA 3.29Å; D236-L254 HydrophobicContact CB-CB 4.28Å; D236-L254 HydrophobicContact CB-CD1 4.33Å; D236-L254 HydrophobicContact CB-CG 4.1Å; D236-L254 PolarHBondContact OD2-N 2.97Å
237	C	98.6	Very high	96.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	169.1	177.1	60.2	0	0	0	0	113.9	R68 C196 Y251 V252	R68-C237 CarbonylContact O-C 3.55Å; R68-C237 WeakPolarHBondContact O-CA 3.47Å; R68-C237 VanDerWaalsContact O-CB 3.3Å; R68-C237 WeakPolarHBondContact O-CB 3.46Å; C196-C237 VanDerWaalsContact SG-CB 3.57Å; C237-Y251 WeakPolarHBondContact O-CA 3.38Å; C237-V252 PolarHBondContact N-O 3.36Å; C237-V252 PolarHBondContact O-N 2.83Å
238	T	98.6	Very high	96.8	Very high	14 Å²	14	42.8 Å²	42.8	9%	0.086	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.9	166.8	-171.6	0	0	0	0	110.6	L67 R68 Y69 Y70 P240 C250	L67-T238 HydrophobicContact CD1-CG2 4.06Å; L67-T238 HydrophobicContact CD2-CG2 3.87Å; L67-T238 HydrophobicContact CG-CG2 4.04Å; R68-T238 PolarHBondContact O-N 3.28Å; Y69-T238 CarbonylContact C-O 3.57Å; Y69-T238 WeakPolarHBondContact CA-O 3.46Å; Y69-T238 HydrophobicContact CD1-CG2 3.41Å; Y69-T238 VanDerWaalsContact CD1-CG2 3.41Å; Y69-T238 HydrophobicContact CE1-CG2 3.59Å; Y69-T238 HydrophobicContact CG-CG2 4.34Å; Y70-T238 PolarHBondContact N-O 3.48Å; T238-P240 WeakPolarHBondContact O-CD 3.33Å; T238-C250 CarbonylContact C-O 3.23Å; T238-C250 WeakPolarHBondContact CA-O 3.33Å; T238-C250 PolarHBondContact OG1-O 2.83Å; T238-C250 PolarHBondContact OG1-SG 3.42Å
239	D	97.9	Very high	96.8	Very high	30 Å²	30	44.6 Å²	44.6	16%	0.16	25%	0.254	C	S	.	.			trans	-96.9	108.5	175.4	177.4	8.4	0	0	0	110.3	Y70 Q241 A242 C250 V252	Y70-D239 HydrophobicContact CD1-CB 4.18Å; D239-Q241 PolarHBondContact O-N 3.16Å; D239-Q241 VanDerWaalsContact O-N 3.13Å; D239-Q241 WeakPolarHBondContact OD1-CA 3.47Å; D239-Q241 WeakPolarHBondContact OD1-CB 3.5Å; D239-Q241 PolarHBondContact OD1-N 3.23Å; D239-A242 HydrophobicContact CB-CB 4.1Å; D239-A242 VanDerWaalsContact O-CB 3.26Å; D239-A242 WeakPolarHBondContact O-CB 3.29Å; D239-A242 PolarHBondContact O-N 3.24Å; D239-C250 PolarHBondContact N-O 2.87Å; D239-V252 HydrophobicContact CB-CG2 3.74Å
240	P	95.2	Very high	96.7	Very high	59 Å²	59	44.7 Å²	44.7	38%	0.383	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.5	176.1	-21.7	33.6	0	0	0	114	Y69 P200 T238	Y69-P240 HydrophobicContact CD1-CG 3.9Å; Y69-P240 HydrophobicContact CG-CG 4.47Å; P200-P240 HydrophobicContact CB-CB 4.47Å; P200-P240 HydrophobicContact CB-CG 4.08Å; T238-P240 WeakPolarHBondContact O-CD 3.33Å
241	Q	93.9	Very high	96.7	Very high	177 Å²	177	45 Å²	45	83%	0.827	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	4.1	179.3	-55.6	-175.5	6.3	0	0	112.6	D239	D239-Q241 PolarHBondContact O-N 3.16Å; D239-Q241 VanDerWaalsContact O-N 3.13Å; D239-Q241 WeakPolarHBondContact OD1-CA 3.47Å; D239-Q241 WeakPolarHBondContact OD1-CB 3.5Å; D239-Q241 PolarHBondContact OD1-N 3.23Å
242	A	95.2	Very high	96.7	Very high	14 Å²	14	45.2 Å²	45.2	12%	0.116	26%	0.257	C	S	.	.	S	Bend	trans	-58.1	143.8	176.2	0	0	0	0	0	110.8	D239 S244 C250	D239-A242 HydrophobicContact CB-CB 4.1Å; D239-A242 VanDerWaalsContact O-CB 3.26Å; D239-A242 WeakPolarHBondContact O-CB 3.29Å; D239-A242 PolarHBondContact O-N 3.24Å; A242-S244 PolarHBondContact O-N 2.82Å; A242-C250 HydrophobicContact CB-CB 4.2Å
243	P	93.4	Very high	96.7	Very high	146 Å²	146	45.3 Å²	45.3	95%	0.948	26%	0.257	S	S	*	.	S	Bend	trans	-56.5	-24.2	179.3	-27.1	34.7	0	0	0	114.6
244	S	91.8	Very high	96.7	Very high	43 Å²	43	45.4 Å²	45.4	30%	0.301	26%	0.257	S	S	.	.			trans	-128.7	128.9	174.2	167.4	0	0	0	0	108.2	A242 Q246 T249 C250	A242-S244 PolarHBondContact O-N 2.82Å; S244-Q246 VanDerWaalsContact C-N 3.26Å; S244-Q246 PolarHBondContact OG-N 2.88Å; S244-T249 WeakPolarHBondContact CB-OG1 3.45Å; S244-T249 PolarHBondContact OG-OG1 2.82Å; S244-C250 WeakPolarHBondContact O-CB 3.27Å
245	T	91	Very high	96.8	Very high	111 Å²	111	44.3 Å²	44.3	68%	0.681	25%	0.251	S	S	*	.			trans	-82	-4.8	174.8	54.9	0	0	0	0	112.7	P247 C250	T245-P247 WeakPolarHBondContact O-CD 3.35Å; T245-C250 PolarHBondContact O-SG 3.35Å
246	Q	94.6	Very high	96.7	Very high	139 Å²	139	45.3 Å²	45.3	65%	0.65	26%	0.257	S	S	*	.	S	Bend	trans	-76.8	124.6	-178	-66.5	-171.1	-18.5	0	0	111.5	S244 T249 C250	S244-Q246 VanDerWaalsContact C-N 3.26Å; S244-Q246 PolarHBondContact OG-N 2.88Å; Q246-T249 WeakPolarHBondContact O-CA 3.39Å; Q246-T249 WeakPolarHBondContact O-CB 3.46Å; Q246-T249 PolarHBondContact O-N 2.87Å; Q246-T249 PolarHBondContact O-OG1 3.4Å; Q246-C250 PolarHBondContact O-N 2.74Å
247	P	97.5	Very high	96.7	Very high	54 Å²	54	44.9 Å²	44.9	35%	0.351	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	146.1	167.6	-25.8	36.6	0	0	0	112	E48 T245 T249 Y251	E48-P247 HydrophobicContact CB-CB 4.07Å; E48-P247 VanDerWaalsContact CD-CB 3.47Å; E48-P247 HydrophobicContact CG-CB 4.41Å; E48-P247 WeakPolarHBondContact OE1-CB 3.48Å; E48-P247 WeakPolarHBondContact OE1-CG 3.27Å; T245-P247 WeakPolarHBondContact O-CD 3.35Å; P247-T249 VanDerWaalsContact C-N 3.33Å; P247-Y251 HydrophobicContact CB-CE2 3.85Å
248	P	97.6	Very high	96.7	Very high	7 Å²	7	51.2 Å²	51.2	5%	0.045	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	cis	-86	6	-3.9	34.7	-35	0	0	0	113.8	L220 C250 Y251 P284	L220-P248 HydrophobicContact CD2-CB 4.01Å; L220-P248 HydrophobicContact CD2-CG 3.93Å; P248-C250 PolarHBondContact O-N 3.29Å; P248-Y251 VanDerWaalsContact CA-CD2 3.44Å; P248-Y251 HydrophobicContact CB-CD2 3.66Å; P248-Y251 HydrophobicContact CB-CE2 4.01Å; P248-Y251 WeakPolarHBondContact O-CB 3.28Å; P248-Y251 PolarHBondContact O-N 3.32Å; P248-Y251 VanDerWaalsContact O-N 3.11Å; P248-P284 WeakPolarHBondContact CB-O 3.49Å; P248-P284 WeakPolarHBondContact CG-O 3.26Å
249	T	97.5	Very high	96.6	Very high	51 Å²	51	52.7 Å²	52.7	31%	0.313	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-14.8	-172.7	64	0	0	0	0	114.6	S244 Q246 P247 P287	S244-T249 WeakPolarHBondContact CB-OG1 3.45Å; S244-T249 PolarHBondContact OG-OG1 2.82Å; Q246-T249 WeakPolarHBondContact O-CA 3.39Å; Q246-T249 WeakPolarHBondContact O-CB 3.46Å; Q246-T249 PolarHBondContact O-N 2.87Å; Q246-T249 PolarHBondContact O-OG1 3.4Å; P247-T249 VanDerWaalsContact C-N 3.33Å; T249-P287 WeakPolarHBondContact O-CG 3.47Å
250	C	97.9	Very high	96.7	Very high	4 Å²	4	52.4 Å²	52.4	3%	0.027	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.8	172.3	58.8	0	0	0	0	113.5	T238 D239 A242 S244 T245 Q246 P248	T238-C250 CarbonylContact C-O 3.23Å; T238-C250 WeakPolarHBondContact CA-O 3.33Å; T238-C250 PolarHBondContact OG1-O 2.83Å; T238-C250 PolarHBondContact OG1-SG 3.42Å; D239-C250 PolarHBondContact N-O 2.87Å; A242-C250 HydrophobicContact CB-CB 4.2Å; S244-C250 WeakPolarHBondContact O-CB 3.27Å; T245-C250 PolarHBondContact O-SG 3.35Å; Q246-C250 PolarHBondContact O-N 2.74Å; P248-C250 PolarHBondContact O-N 3.29Å
251	Y	98.7	Very high	96.7	Very high	6 Å²	6	56.9 Å²	56.9	2%	0.024	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	153.4	-176.2	-63.8	-36.8	0	0	0	113	E48 L67 F216 V235 C237 P247 P248 P287	E48-Y251 PolarHBondContact OE1-OH 3.43Å; E48-Y251 VanDerWaalsContact OE2-CE2 3.24Å; E48-Y251 WeakPolarHBondContact OE2-CE2 3.49Å; E48-Y251 PolarHBondContact OE2-OH 3.05Å; L67-Y251 HydrophobicContact CD1-CE1 4.35Å; F216-Y251 HydrophobicContact CE1-CE1 4.07Å; F216-Y251 AromaticContact CE1-CZ 3.93Å; V235-Y251 HydrophobicContact CG1-CD1 3.55Å; V235-Y251 HydrophobicContact CG1-CD2 3.92Å; V235-Y251 HydrophobicContact CG1-CE1 4.05Å; V235-Y251 HydrophobicContact CG1-CE2 4.38Å; V235-Y251 HydrophobicContact CG1-CG 3.49Å; V235-Y251 VanDerWaalsContact CG1-CG 3.49Å; V235-Y251 HydrophobicContact CG2-CD2 3.95Å; V235-Y251 HydrophobicContact CG2-CE2 4.17Å; V235-Y251 HydrophobicContact CG2-CG 4.37Å; C237-Y251 WeakPolarHBondContact O-CA 3.38Å; P247-Y251 HydrophobicContact CB-CE2 3.85Å; P248-Y251 VanDerWaalsContact CA-CD2 3.44Å; P248-Y251 HydrophobicContact CB-CD2 3.66Å; P248-Y251 HydrophobicContact CB-CE2 4.01Å; P248-Y251 WeakPolarHBondContact O-CB 3.28Å; P248-Y251 PolarHBondContact O-N 3.32Å; P248-Y251 VanDerWaalsContact O-N 3.11Å; Y251-P287 WeakPolarHBondContact O-CD 3.45Å
252	V	98.7	Very high	96.9	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.024	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.4	177	179.8	0	0	0	0	108.9	Y70 C237 D239 L254 V290	Y70-V252 HydrophobicContact CD2-CG1 4.33Å; Y70-V252 HydrophobicContact CE2-CG1 4.44Å; C237-V252 PolarHBondContact N-O 3.36Å; C237-V252 PolarHBondContact O-N 2.83Å; D239-V252 HydrophobicContact CB-CG2 3.74Å; V252-L254 HydrophobicContact CG1-CD2 4.09Å; V252-V290 HydrophobicContact CG1-CB 4.27Å; V252-V290 HydrophobicContact CG1-CG2 3.62Å
253	E	98.9	Very high	97	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	137	170.3	-176.6	86.9	-166.9	0	0	109.2	D236 K255 Q280 V286 N288 V289 V290	D236-E253 WeakPolarHBondContact OD2-CA 3.29Å; E253-K255 HydrophobicContact CG-CD 4.46Å; E253-K255 HydrophobicContact CG-CG 4.27Å; E253-K255 WeakPolarHBondContact OE1-CE 3.27Å; E253-K255 IonicContact OE1-NZ 3.48Å; E253-K255 PolarHBondContact OE1-NZ 3.4Å; E253-Q280 PolarHBondContact OE1-NE2 3.2Å; E253-Q280 PolarHBondContact OE1-OE1 3.04Å; E253-V286 HydrophobicContact CB-CG1 4.19Å; E253-N288 PolarHBondContact N-O 3.42Å; E253-V289 HydrophobicContact CB-CB 4.4Å; E253-V289 HydrophobicContact CB-CG1 4.28Å; E253-V289 HydrophobicContact CB-CG2 3.98Å; E253-V289 HydrophobicContact CG-CG1 4.2Å; E253-V289 HydrophobicContact CG-CG2 4.34Å; E253-V289 CarbonylContact O-C 3.52Å; E253-V289 VanDerWaalsContact O-CA 3.28Å; E253-V289 WeakPolarHBondContact O-CA 3.27Å; E253-V290 PolarHBondContact O-N 2.76Å
254	L	98.9	Very high	97.2	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.3	179.7	-60.6	-177.3	0	0	0	109.7	Y70 F191 E192 M195 C196 D236 V252 V290	Y70-L254 HydrophobicContact CD2-CD2 4.18Å; Y70-L254 HydrophobicContact CE2-CD2 4.06Å; F191-L254 HydrophobicContact CD1-CB 4.25Å; F191-L254 HydrophobicContact CE1-CB 4.04Å; E192-L254 HydrophobicContact CB-CD1 4.09Å; E192-L254 HydrophobicContact CG-CB 4.16Å; E192-L254 HydrophobicContact CG-CD1 4.09Å; M195-L254 HydrophobicContact CB-CD1 3.78Å; M195-L254 HydrophobicContact CB-CD2 4.31Å; C196-L254 WeakPolarHBondContact SG-CD1 3.3Å; D236-L254 HydrophobicContact CB-CB 4.28Å; D236-L254 HydrophobicContact CB-CD1 4.33Å; D236-L254 HydrophobicContact CB-CG 4.1Å; D236-L254 PolarHBondContact OD2-N 2.97Å; V252-L254 HydrophobicContact CG1-CD2 4.09Å; L254-V290 WeakPolarHBondContact CA-O 3.41Å; L254-V290 HydrophobicContact CD2-CB 3.94Å
255	K	98.8	Very high	97.5	Very high	42 Å²	42	52.4 Å²	52.4	18%	0.183	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153	-179.6	-66	-64.3	-176.3	-150	0	111.9	F191 E253 W277 V289 V290 A291 G292	F191-K255 VanDerWaalsContact CE1-O 3.24Å; F191-K255 WeakPolarHBondContact CE1-O 3.21Å; E253-K255 HydrophobicContact CG-CD 4.46Å; E253-K255 HydrophobicContact CG-CG 4.27Å; E253-K255 WeakPolarHBondContact OE1-CE 3.27Å; E253-K255 IonicContact OE1-NZ 3.48Å; E253-K255 PolarHBondContact OE1-NZ 3.4Å; K255-W277 HydrophobicContact CB-CD2 4.27Å; K255-W277 HydrophobicContact CB-CH2 3.72Å; K255-W277 HydrophobicContact CB-CZ2 3.35Å; K255-W277 HydrophobicContact CB-CZ3 4.3Å; K255-W277 HydrophobicContact CG-CD2 3.95Å; K255-W277 HydrophobicContact CG-CG 4.27Å; K255-W277 HydrophobicContact CG-CH2 4.45Å; K255-W277 HydrophobicContact CG-CZ2 3.88Å; K255-V289 HydrophobicContact CB-CG1 4.14Å; K255-V289 HydrophobicContact CG-CG1 3.54Å; K255-V290 PolarHBondContact N-O 3.44Å; K255-A291 CarbonylContact O-C 3.49Å; K255-A291 VanDerWaalsContact O-CA 3.22Å; K255-A291 WeakPolarHBondContact O-CA 3.45Å; K255-G292 PolarHBondContact O-N 2.87Å
256	T	98.5	Very high	97.9	Very high	29 Å²	29	50 Å²	50	18%	0.178	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	149.3	165.9	64.5	0	0	0	0	111.5	L84 F191 G292	L84-T256 HydrophobicContact CD1-CG2 4.02Å; F191-T256 HydrophobicContact CB-CG2 3.35Å; F191-T256 HydrophobicContact CD1-CG2 3.62Å; F191-T256 HydrophobicContact CD2-CG2 4.25Å; F191-T256 HydrophobicContact CE1-CG2 4.48Å; F191-T256 HydrophobicContact CG-CG2 3.47Å; F191-T256 VanDerWaalsContact CG-CG2 3.47Å; T256-G292 VanDerWaalsContact CA-O 3.31Å; T256-G292 WeakPolarHBondContact CA-O 3.17Å
257	S	98.4	Very high	98	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.042	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.3	168.8	-167.8	0	0	0	0	110.4	K273 G292 F293 R294	S257-K273 PolarHBondContact OG-NZ 2.74Å; S257-G292 PolarHBondContact N-O 3.43Å; S257-F293 CarbonylContact O-C 3.32Å; S257-F293 VanDerWaalsContact O-CA 3.26Å; S257-F293 WeakPolarHBondContact O-CA 3.35Å; S257-R294 WeakPolarHBondContact O-CG 3.33Å; S257-R294 PolarHBondContact O-N 2.84Å
258	K	97.9	Very high	98.1	Very high	132 Å²	132	50.1 Å²	50.1	57%	0.574	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.6	145.1	169.6	-65.5	-179.5	179.7	-178	0	109.6
259	E	97.5	Very high	98.1	Very high	45 Å²	45	50.3 Å²	50.3	21%	0.21	26%	0.262	C	S	.	.			trans	-55.8	148.5	165.4	-75.4	179.8	166.5	0	0	111.3	H261 F293 R294	E259-H261 IonicContact OE2-CE1 3.31Å; E259-H261 IonicContact OE2-NE2 3.83Å; E259-F293 HydrophobicContact CG-CB 3.71Å; E259-R294 PolarHBondContact N-O 3.24Å
260	M	98	Very high	98.2	Very high	24 Å²	24	49.8 Å²	49.8	12%	0.118	26%	0.255	C	S	.	.			trans	-133.8	120.8	-176.4	-65.4	173.9	-78.4	0	0	109	Q265 W266 F269 F293	M260-Q265 HydrophobicContact CB-CB 3.9Å; M260-Q265 HydrophobicContact CG-CB 3.94Å; M260-W266 HydrophobicContact CB-CD2 4.15Å; M260-W266 HydrophobicContact CB-CG 4.18Å; M260-W266 HydrophobicContact CB-CZ2 4.4Å; M260-W266 HydrophobicContact CE-CD2 3.9Å; M260-W266 HydrophobicContact CE-CE3 3.55Å; M260-W266 HydrophobicContact CE-CH2 3.72Å; M260-W266 HydrophobicContact CE-CZ2 4.02Å; M260-W266 HydrophobicContact CE-CZ3 3.46Å; M260-W266 VanDerWaalsContact CE-CZ3 3.46Å; M260-W266 PolarHBondContact O-NE1 3Å; M260-W266 HydrophobicContact SD-CD2 4.13Å; M260-W266 HydrophobicContact SD-CE3 4.13Å; M260-W266 HydrophobicContact SD-CG 4.43Å; M260-F269 HydrophobicContact CE-CB 3.98Å; M260-F269 HydrophobicContact CE-CD1 3.97Å; M260-F269 HydrophobicContact CE-CD2 3.77Å; M260-F269 HydrophobicContact CE-CE1 4.43Å; M260-F269 HydrophobicContact CE-CE2 4.23Å; M260-F269 HydrophobicContact CE-CG 3.64Å; M260-F269 HydrophobicContact SD-CB 3.27Å; M260-F269 WeakPolarHBondContact SD-CB 3.31Å; M260-F269 HydrophobicContact SD-CD1 4.33Å; M260-F269 HydrophobicContact SD-CD2 4.08Å; M260-F269 HydrophobicContact SD-CG 3.66Å; M260-F293 HydrophobicContact CE-CD1 4.04Å; M260-F293 HydrophobicContact CE-CE1 3.45Å; M260-F293 VanDerWaalsContact CE-CE1 3.45Å; M260-F293 HydrophobicContact CE-CZ 4.2Å
261	H	96.4	Very high	98.2	Very high	154 Å²	154	51.6 Å²	51.6	71%	0.713	26%	0.261	S	S	*	.			trans	-111.5	-16.4	-173.8	-51.6	-71.4	0	0	0	112.7	E259	E259-H261 IonicContact OE2-CE1 3.31Å; E259-H261 IonicContact OE2-NE2 3.83Å
262	S	97.8	Very high	98.1	Very high	50 Å²	50	56.9 Å²	56.9	35%	0.35	29%	0.286	S	S	.	.	S	Bend	trans	-112.4	149.7	177.5	79.3	0	0	0	0	112.8	G264 Q265 W266	S262-G264 PolarHBondContact O-N 3.33Å; S262-Q265 VanDerWaalsContact N-OE1 3.13Å; S262-Q265 PolarHBondContact O-N 3.14Å; S262-Q265 VanDerWaalsContact O-N 3.09Å; S262-Q265 WeakPolarHBondContact OG-CG 3.19Å; S262-Q265 PolarHBondContact OG-N 3.24Å; S262-W266 PolarHBondContact O-N 2.94Å
263	P	97.4	Very high	98.1	Very high	114 Å²	114	60.2 Å²	60.2	74%	0.74	30%	0.3	S	S	*	.	H	α-helix	trans	-55.7	-32	172.9	-26.9	35.1	0	0	0	113.3	W266 R267	P263-W266 PolarHBondContact O-N 3.12Å; P263-R267 WeakPolarHBondContact O-CB 3.26Å; P263-R267 PolarHBondContact O-N 2.89Å
264	G	97.8	Very high	98.1	Very high	35 Å²	35	60.1 Å²	60.1	36%	0.361	30%	0.3	S	S	.	.	H	α-helix	trans	-65.3	-40.5	176.6	0	0	0	0	0	113.1	S262 R267 S268	S262-G264 PolarHBondContact O-N 3.33Å; G264-R267 PolarHBondContact O-N 2.99Å; G264-S268 PolarHBondContact O-N 2.99Å
265	Q	98.1	Very high	98.1	Very high	86 Å²	86	60.3 Å²	60.3	40%	0.402	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-45.8	174.9	-73	170.8	-29.6	0	0	111.2	M260 S262 R267 S268 F269	M260-Q265 HydrophobicContact CB-CB 3.9Å; M260-Q265 HydrophobicContact CG-CB 3.94Å; S262-Q265 VanDerWaalsContact N-OE1 3.13Å; S262-Q265 PolarHBondContact O-N 3.14Å; S262-Q265 VanDerWaalsContact O-N 3.09Å; S262-Q265 WeakPolarHBondContact OG-CG 3.19Å; S262-Q265 PolarHBondContact OG-N 3.24Å; Q265-R267 PolarHBondContact O-N 3.29Å; Q265-S268 PolarHBondContact O-N 2.92Å; Q265-F269 PolarHBondContact O-N 2.91Å
266	W	98.4	Very high	98.1	Very high	60 Å²	60	62.4 Å²	62.4	23%	0.227	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-45	175.5	-81.8	103.5	0	0	0	112.5	M260 S262 P263 S268 F269 Y270 F293 K304 F306	M260-W266 HydrophobicContact CB-CD2 4.15Å; M260-W266 HydrophobicContact CB-CG 4.18Å; M260-W266 HydrophobicContact CB-CZ2 4.4Å; M260-W266 HydrophobicContact CE-CD2 3.9Å; M260-W266 HydrophobicContact CE-CE3 3.55Å; M260-W266 HydrophobicContact CE-CH2 3.72Å; M260-W266 HydrophobicContact CE-CZ2 4.02Å; M260-W266 HydrophobicContact CE-CZ3 3.46Å; M260-W266 VanDerWaalsContact CE-CZ3 3.46Å; M260-W266 PolarHBondContact O-NE1 3Å; M260-W266 HydrophobicContact SD-CD2 4.13Å; M260-W266 HydrophobicContact SD-CE3 4.13Å; M260-W266 HydrophobicContact SD-CG 4.43Å; S262-W266 PolarHBondContact O-N 2.94Å; P263-W266 PolarHBondContact O-N 3.12Å; W266-S268 PolarHBondContact O-N 3.05Å; W266-F269 HydrophobicContact CE3-CD1 4.08Å; W266-F269 HydrophobicContact CE3-CE1 4.48Å; W266-F269 HydrophobicContact CZ3-CD1 4.21Å; W266-F269 HydrophobicContact CZ3-CE1 4.19Å; W266-F269 WeakPolarHBondContact O-CB 3.27Å; W266-F269 PolarHBondContact O-N 2.87Å; W266-Y270 HydrophobicContact CB-CE2 4.02Å; W266-Y270 AromaticContact CE3-CE1 3.64Å; W266-Y270 HydrophobicContact CE3-CE1 3.64Å; W266-Y270 HydrophobicContact CE3-CE2 4.31Å; W266-Y270 AromaticContact CE3-CZ 3.46Å; W266-Y270 VanDerWaalsContact CE3-CZ 3.46Å; W266-Y270 HydrophobicContact CZ3-CE1 4.03Å; W266-Y270 WeakPolarHBondContact O-CD2 3.48Å; W266-Y270 PolarHBondContact O-N 3.14Å; W266-F293 HydrophobicContact CH2-CE1 4.14Å; W266-F293 HydrophobicContact CH2-CE2 4.03Å; W266-F293 AromaticContact CH2-CZ 3.58Å; W266-F293 HydrophobicContact CH2-CZ 3.58Å; W266-F293 HydrophobicContact CZ3-CZ 4.1Å; W266-K304 HydrophobicContact CH2-CD 4.15Å; W266-F306 HydrophobicContact CZ3-CZ 4.08Å
267	R	98.1	Very high	98.1	Very high	136 Å²	136	61.7 Å²	61.7	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-59.7	-44.1	176	-177.1	172.4	60.6	-177	-1.7	112.3	P263 G264 Q265 Y270 R271	P263-R267 WeakPolarHBondContact O-CB 3.26Å; P263-R267 PolarHBondContact O-N 2.89Å; G264-R267 PolarHBondContact O-N 2.99Å; Q265-R267 PolarHBondContact O-N 3.29Å; R267-Y270 PolarHBondContact O-N 2.94Å; R267-R271 VanDerWaalsContact O-CG 3.31Å; R267-R271 WeakPolarHBondContact O-CG 3.26Å; R267-R271 PolarHBondContact O-N 3.05Å
268	S	98.1	Very high	98.1	Very high	61 Å²	61	61.8 Å²	61.8	43%	0.427	30%	0.303	S	S	.	.	H	α-helix	trans	-61.6	-43.9	175.3	-179.6	0	0	0	0	111.9	G264 Q265 W266 Y270 R271 H272	G264-S268 PolarHBondContact O-N 2.99Å; Q265-S268 PolarHBondContact O-N 2.92Å; W266-S268 PolarHBondContact O-N 3.05Å; S268-Y270 PolarHBondContact O-N 3.45Å; S268-R271 PolarHBondContact O-N 3.46Å; S268-H272 PolarHBondContact O-CD2 2.85Å; S268-H272 PolarHBondContact O-N 2.84Å
269	F	98.6	Very high	98.2	Very high	11 Å²	11	55.5 Å²	55.5	5%	0.048	28%	0.276	C	S	.	.	I	π-helix	trans	-59.7	-45.4	174.7	165.3	-89.8	0	0	0	112.5	M260 Q265 W266 R271 H272 K273 L274 W277 F306	M260-F269 HydrophobicContact CE-CB 3.98Å; M260-F269 HydrophobicContact CE-CD1 3.97Å; M260-F269 HydrophobicContact CE-CD2 3.77Å; M260-F269 HydrophobicContact CE-CE1 4.43Å; M260-F269 HydrophobicContact CE-CE2 4.23Å; M260-F269 HydrophobicContact CE-CG 3.64Å; M260-F269 HydrophobicContact SD-CB 3.27Å; M260-F269 WeakPolarHBondContact SD-CB 3.31Å; M260-F269 HydrophobicContact SD-CD1 4.33Å; M260-F269 HydrophobicContact SD-CD2 4.08Å; M260-F269 HydrophobicContact SD-CG 3.66Å; Q265-F269 PolarHBondContact O-N 2.91Å; W266-F269 HydrophobicContact CE3-CD1 4.08Å; W266-F269 HydrophobicContact CE3-CE1 4.48Å; W266-F269 HydrophobicContact CZ3-CD1 4.21Å; W266-F269 HydrophobicContact CZ3-CE1 4.19Å; W266-F269 WeakPolarHBondContact O-CB 3.27Å; W266-F269 PolarHBondContact O-N 2.87Å; F269-R271 PolarHBondContact O-N 2.85Å; F269-H272 PolarHBondContact O-N 2.98Å; F269-K273 HydrophobicContact CD2-CB 3.81Å; F269-K273 HydrophobicContact CD2-CD 3.81Å; F269-K273 HydrophobicContact CD2-CG 4.15Å; F269-K273 HydrophobicContact CE2-CB 4.12Å; F269-K273 HydrophobicContact CE2-CD 3.69Å; F269-K273 HydrophobicContact CE2-CG 4.03Å; F269-K273 HydrophobicContact CG-CB 4.49Å; F269-K273 PolarHBondContact O-N 2.96Å; F269-L274 HydrophobicContact CE1-CB 4.49Å; F269-L274 HydrophobicContact CE1-CD1 3.83Å; F269-L274 HydrophobicContact CZ-CD1 3.97Å; F269-L274 PolarHBondContact O-N 3.13Å; F269-W277 HydrophobicContact CE2-CE3 4.45Å; F269-W277 AromaticContact CE2-CH2 3.58Å; F269-W277 HydrophobicContact CE2-CH2 3.58Å; F269-W277 HydrophobicContact CE2-CZ2 4.09Å; F269-W277 AromaticContact CE2-CZ3 3.79Å; F269-W277 HydrophobicContact CE2-CZ3 3.79Å; F269-W277 HydrophobicContact CZ-CE3 4.05Å; F269-W277 AromaticContact CZ-CH2 3.73Å; F269-W277 HydrophobicContact CZ-CH2 3.73Å; F269-W277 AromaticContact CZ-CZ3 3.44Å; F269-W277 HydrophobicContact CZ-CZ3 3.44Å; F269-W277 VanDerWaalsContact CZ-CZ3 3.44Å; F269-F306 AromaticContact CE1-CE1 3.92Å; F269-F306 HydrophobicContact CE1-CE1 3.92Å; F269-F306 AromaticContact CE1-CZ 3.76Å; F269-F306 HydrophobicContact CE1-CZ 3.76Å; F269-F306 HydrophobicContact CZ-CE1 4.36Å; F269-F306 HydrophobicContact CZ-CE2 4.26Å; F269-F306 AromaticContact CZ-CZ 3.89Å; F269-F306 HydrophobicContact CZ-CZ 3.89Å
270	Y	98.6	Very high	98.2	Very high	40 Å²	40	55 Å²	55	16%	0.157	27%	0.274	C	S	.	.	I	π-helix	trans	-63.1	-39.9	177.6	-60.6	-36.2	0	0	0	112.5	W266 R267 S268 L274 F306 Y314 W322	W266-Y270 HydrophobicContact CB-CE2 4.02Å; W266-Y270 AromaticContact CE3-CE1 3.64Å; W266-Y270 HydrophobicContact CE3-CE1 3.64Å; W266-Y270 HydrophobicContact CE3-CE2 4.31Å; W266-Y270 AromaticContact CE3-CZ 3.46Å; W266-Y270 VanDerWaalsContact CE3-CZ 3.46Å; W266-Y270 HydrophobicContact CZ3-CE1 4.03Å; W266-Y270 WeakPolarHBondContact O-CD2 3.48Å; W266-Y270 PolarHBondContact O-N 3.14Å; R267-Y270 PolarHBondContact O-N 2.94Å; S268-Y270 PolarHBondContact O-N 3.45Å; Y270-L274 HydrophobicContact CD1-CD2 4Å; Y270-L274 WeakPolarHBondContact O-CB 3.43Å; Y270-F306 HydrophobicContact CE1-CE1 4.26Å; Y270-Y314 HydrophobicContact CD1-CD1 4.1Å; Y270-Y314 HydrophobicContact CD1-CD2 4.45Å; Y270-Y314 AromaticContact CD1-CG 3.89Å; Y270-Y314 HydrophobicContact CD1-CG 3.89Å; Y270-Y314 HydrophobicContact CD2-CD1 4.14Å; Y270-Y314 HydrophobicContact CD2-CG 4.33Å; Y270-Y314 AromaticContact CE1-CD1 3.63Å; Y270-Y314 HydrophobicContact CE1-CD1 3.63Å; Y270-Y314 HydrophobicContact CE1-CD2 4.39Å; Y270-Y314 AromaticContact CE1-CE1 3.97Å; Y270-Y314 HydrophobicContact CE1-CE1 3.97Å; Y270-Y314 AromaticContact CE1-CG 3.85Å; Y270-Y314 HydrophobicContact CE1-CG 3.85Å; Y270-Y314 AromaticContact CE2-CD1 3.67Å; Y270-Y314 HydrophobicContact CE2-CD1 3.67Å; Y270-Y314 HydrophobicContact CE2-CE1 4.39Å; Y270-Y314 HydrophobicContact CE2-CG 4.29Å; Y270-Y314 HydrophobicContact CG-CD1 4.35Å; Y270-Y314 HydrophobicContact CG-CG 4.16Å; Y270-Y314 AromaticContact CZ-CD1 3.39Å; Y270-Y314 AromaticContact CZ-CE1 3.73Å; Y270-W322 PolarHBondContact O-NE1 3.29Å
271	R	98.4	Very high	98.3	Very high	42 Å²	42	53.9 Å²	53.9	16%	0.158	27%	0.268	C	S	.	.	I	π-helix	trans	-70.5	-36.2	179.6	-72.3	173.2	-178.4	-164.8	-10.9	113.6	R267 S268 F269 V315 D318 D320	R267-R271 VanDerWaalsContact O-CG 3.31Å; R267-R271 WeakPolarHBondContact O-CG 3.26Å; R267-R271 PolarHBondContact O-N 3.05Å; S268-R271 PolarHBondContact O-N 3.46Å; F269-R271 PolarHBondContact O-N 2.85Å; R271-V315 HydrophobicContact CG-CG1 4.45Å; R271-D318 IonicContact CZ-OD1 3.57Å; R271-D318 IonicContact CZ-OD2 3.45Å; R271-D318 VanDerWaalsContact CZ-OD2 3.31Å; R271-D318 IonicContact NE-OD1 2.66Å; R271-D318 PolarHBondContact NE-OD1 3.1Å; R271-D318 IonicContact NE-OD2 3.65Å; R271-D318 PolarHBondContact NE-OD2 2.8Å; R271-D318 VanDerWaalsContact NH2-CG 3.29Å; R271-D318 IonicContact NH2-OD1 3.24Å; R271-D318 PolarHBondContact NH2-OD1 3.3Å; R271-D318 IonicContact NH2-OD2 2.68Å; R271-D318 PolarHBondContact NH2-OD2 2.89Å; R271-D318 VanDerWaalsContact NH2-OD2 3.11Å; R271-D320 VanDerWaalsContact CZ-CB 3.5Å; R271-D320 IonicContact CZ-OD2 3.06Å; R271-D320 IonicContact NH1-OD2 3.36Å; R271-D320 PolarHBondContact NH1-OD2 3.35Å; R271-D320 IonicContact NH2-OD2 3.97Å; R271-D320 PolarHBondContact NH2-OD2 3.47Å
272	H	98	Very high	98.4	Very high	116 Å²	116	47.8 Å²	47.8	54%	0.537	24%	0.239	S	C	.	.	I	π-helix	trans	-113.8	-53	-168.2	-56.9	-56.5	0	0	0	113.4	S268 F269	S268-H272 PolarHBondContact O-CD2 2.85Å; S268-H272 PolarHBondContact O-N 2.84Å; F269-H272 PolarHBondContact O-N 2.98Å
273	K	98.3	Very high	98.4	Very high	75 Å²	75	45.5 Å²	45.5	33%	0.326	22%	0.223	S	C	.	.	I	π-helix	trans	-78.5	-41.7	-174.8	-172.7	170.9	-67.6	-166.3	0	111.7	S257 F269 L275 K276 W277	S257-K273 PolarHBondContact OG-NZ 2.74Å; F269-K273 HydrophobicContact CD2-CB 3.81Å; F269-K273 HydrophobicContact CD2-CD 3.81Å; F269-K273 HydrophobicContact CD2-CG 4.15Å; F269-K273 HydrophobicContact CE2-CB 4.12Å; F269-K273 HydrophobicContact CE2-CD 3.69Å; F269-K273 HydrophobicContact CE2-CG 4.03Å; F269-K273 HydrophobicContact CG-CB 4.49Å; F269-K273 PolarHBondContact O-N 2.96Å; K273-L275 VanDerWaalsContact C-N 3.27Å; K273-L275 PolarHBondContact O-N 2.98Å; K273-K276 PolarHBondContact O-N 3.25Å; K273-K276 VanDerWaalsContact O-N 3.12Å; K273-W277 HydrophobicContact CD-CH2 4.27Å; K273-W277 HydrophobicContact CD-CZ2 3.47Å; K273-W277 VanDerWaalsContact CD-CZ2 3.47Å; K273-W277 HydrophobicContact CG-CD2 4.28Å; K273-W277 HydrophobicContact CG-CZ2 3.88Å; K273-W277 PolarHBondContact O-N 2.93Å; K273-W277 VanDerWaalsContact O-N 3.13Å
274	L	98.6	Very high	98.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-28.6	-178.1	-155.2	75.8	0	0	0	112.6	F269 Y270 W277 W278 F306 M311 Y314	F269-L274 HydrophobicContact CE1-CB 4.49Å; F269-L274 HydrophobicContact CE1-CD1 3.83Å; F269-L274 HydrophobicContact CZ-CD1 3.97Å; F269-L274 PolarHBondContact O-N 3.13Å; Y270-L274 HydrophobicContact CD1-CD2 4Å; Y270-L274 WeakPolarHBondContact O-CB 3.43Å; L274-W277 HydrophobicContact CD1-CE3 3.93Å; L274-W277 PolarHBondContact O-N 3.12Å; L274-W278 VanDerWaalsContact O-CB 3.28Å; L274-W278 WeakPolarHBondContact O-CB 3.47Å; L274-W278 PolarHBondContact O-N 2.94Å; L274-F306 HydrophobicContact CD1-CD1 3.76Å; L274-F306 HydrophobicContact CD1-CE1 4.13Å; L274-F306 HydrophobicContact CD1-CG 4.16Å; L274-M311 HydrophobicContact CD1-CE 4.33Å; L274-M311 HydrophobicContact CD1-CG 4.13Å; L274-M311 HydrophobicContact CD1-SD 4.14Å; L274-M311 HydrophobicContact CD2-CB 3.77Å; L274-M311 HydrophobicContact CD2-CG 4.09Å; L274-M311 VanDerWaalsContact CD2-O 3.32Å; L274-M311 WeakPolarHBondContact CD2-O 3.48Å; L274-M311 HydrophobicContact CG-CB 3.97Å; L274-M311 HydrophobicContact CG-CG 3.98Å; L274-M311 HydrophobicContact CG-SD 4.09Å; L274-Y314 HydrophobicContact CD2-CD2 3.74Å; L274-Y314 HydrophobicContact CD2-CE2 4.48Å; L274-Y314 HydrophobicContact CD2-CG 4.33Å
275	L	98.8	Very high	98.5	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-56.9	-50.9	169.2	169.4	59.1	0	0	0	111.5	T140 Y143 K273 W277 W278 A279 W322	T140-L275 HydrophobicContact CG2-CD1 4.3Å; T140-L275 HydrophobicContact CG2-CD2 4.33Å; T140-L275 HydrophobicContact CG2-CG 3.98Å; Y143-L275 HydrophobicContact CD2-CD2 4.02Å; Y143-L275 HydrophobicContact CG-CD2 4.1Å; K273-L275 VanDerWaalsContact C-N 3.27Å; K273-L275 PolarHBondContact O-N 2.98Å; L275-W277 VanDerWaalsContact C-N 3.34Å; L275-W277 PolarHBondContact O-N 3.04Å; L275-W278 HydrophobicContact CD1-CE3 4.22Å; L275-W278 PolarHBondContact O-N 2.54Å; L275-A279 WeakPolarHBondContact O-CB 3.37Å; L275-A279 PolarHBondContact O-N 3.46Å; L275-W322 HydrophobicContact CB-CD2 3.84Å; L275-W322 HydrophobicContact CB-CG 3.79Å; L275-W322 HydrophobicContact CB-CZ2 4.48Å; L275-W322 HydrophobicContact CD1-CB 4.07Å; L275-W322 HydrophobicContact CD1-CD2 3.64Å; L275-W322 HydrophobicContact CD1-CE3 3.58Å; L275-W322 HydrophobicContact CD1-CG 3.85Å; L275-W322 HydrophobicContact CD1-CZ3 4.24Å; L275-W322 HydrophobicContact CD2-CB 4.12Å; L275-W322 HydrophobicContact CD2-CG 4.26Å; L275-W322 HydrophobicContact CG-CB 4.46Å; L275-W322 HydrophobicContact CG-CD2 4.26Å; L275-W322 HydrophobicContact CG-CG 4.15Å
276	K	98.7	Very high	98.5	Very high	86 Å²	86	35.7 Å²	35.7	37%	0.374	17%	0.165	S	C	.	.	H	α-helix	trans	-63.8	-41.6	-178.3	-62.9	-167.8	176.4	-163.2	0	111	T140 E144 K273 Q280	T140-K276 HydrophobicContact CG2-CG 4.42Å; E144-K276 VanDerWaalsContact OE2-CE 3.26Å; E144-K276 WeakPolarHBondContact OE2-CE 3.35Å; E144-K276 IonicContact OE2-NZ 3.52Å; E144-K276 PolarHBondContact OE2-NZ 2.87Å; K273-K276 PolarHBondContact O-N 3.25Å; K273-K276 VanDerWaalsContact O-N 3.12Å; K276-Q280 WeakPolarHBondContact O-CB 3.12Å; K276-Q280 PolarHBondContact O-N 2.92Å; K276-Q280 VanDerWaalsContact O-N 3.07Å
277	W	98.8	Very high	98.5	Very high	14 Å²	14	34.8 Å²	34.8	5%	0.053	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-45.3	176	-64.6	-1.2	0	0	0	112.1	K255 F269 K273 L274 L275 A279 Q280 S281 V289 A291 F306 M311	K255-W277 HydrophobicContact CB-CD2 4.27Å; K255-W277 HydrophobicContact CB-CH2 3.72Å; K255-W277 HydrophobicContact CB-CZ2 3.35Å; K255-W277 HydrophobicContact CB-CZ3 4.3Å; K255-W277 HydrophobicContact CG-CD2 3.95Å; K255-W277 HydrophobicContact CG-CG 4.27Å; K255-W277 HydrophobicContact CG-CH2 4.45Å; K255-W277 HydrophobicContact CG-CZ2 3.88Å; F269-W277 HydrophobicContact CE2-CE3 4.45Å; F269-W277 AromaticContact CE2-CH2 3.58Å; F269-W277 HydrophobicContact CE2-CH2 3.58Å; F269-W277 HydrophobicContact CE2-CZ2 4.09Å; F269-W277 AromaticContact CE2-CZ3 3.79Å; F269-W277 HydrophobicContact CE2-CZ3 3.79Å; F269-W277 HydrophobicContact CZ-CE3 4.05Å; F269-W277 AromaticContact CZ-CH2 3.73Å; F269-W277 HydrophobicContact CZ-CH2 3.73Å; F269-W277 AromaticContact CZ-CZ3 3.44Å; F269-W277 HydrophobicContact CZ-CZ3 3.44Å; F269-W277 VanDerWaalsContact CZ-CZ3 3.44Å; K273-W277 HydrophobicContact CD-CH2 4.27Å; K273-W277 HydrophobicContact CD-CZ2 3.47Å; K273-W277 VanDerWaalsContact CD-CZ2 3.47Å; K273-W277 HydrophobicContact CG-CD2 4.28Å; K273-W277 HydrophobicContact CG-CZ2 3.88Å; K273-W277 PolarHBondContact O-N 2.93Å; K273-W277 VanDerWaalsContact O-N 3.13Å; L274-W277 HydrophobicContact CD1-CE3 3.93Å; L274-W277 PolarHBondContact O-N 3.12Å; L275-W277 VanDerWaalsContact C-N 3.34Å; L275-W277 PolarHBondContact O-N 3.04Å; W277-A279 PolarHBondContact O-N 2.94Å; W277-Q280 PolarHBondContact O-N 2.6Å; W277-S281 PolarHBondContact O-N 3.25Å; W277-S281 PolarHBondContact O-OG 2.8Å; W277-V289 HydrophobicContact CD2-CG1 4.24Å; W277-V289 HydrophobicContact CE3-CG1 3.91Å; W277-V289 HydrophobicContact CZ3-CG1 4.39Å; W277-A291 HydrophobicContact CH2-CB 3.62Å; W277-A291 HydrophobicContact CZ3-CB 3.71Å; W277-F306 HydrophobicContact CZ3-CD2 4.07Å; W277-F306 HydrophobicContact CZ3-CE2 4.12Å; W277-M311 HydrophobicContact CB-CE 4.15Å; W277-M311 HydrophobicContact CB-SD 4.33Å
278	W	98.9	Very high	98.5	Very high	7 Å²	7	30.7 Å²	30.7	3%	0.027	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-52.2	176.2	169.7	78.4	0	0	0	110.8	L139 L274 L275 Q280 S281 F282 M311 W322 P324 C327 M328	L139-W278 HydrophobicContact CD2-CH2 4.19Å; L139-W278 HydrophobicContact CD2-CZ3 4.04Å; L274-W278 VanDerWaalsContact O-CB 3.28Å; L274-W278 WeakPolarHBondContact O-CB 3.47Å; L274-W278 PolarHBondContact O-N 2.94Å; L275-W278 HydrophobicContact CD1-CE3 4.22Å; L275-W278 PolarHBondContact O-N 2.54Å; W278-Q280 VanDerWaalsContact C-N 3.32Å; W278-Q280 PolarHBondContact O-N 3.25Å; W278-S281 PolarHBondContact O-N 3.07Å; W278-F282 HydrophobicContact CD2-CB 4.4Å; W278-F282 AromaticContact CE2-CG 3.91Å; W278-F282 HydrophobicContact CH2-CD1 4.41Å; W278-F282 HydrophobicContact CZ2-CB 4.24Å; W278-F282 AromaticContact CZ2-CD1 3.86Å; W278-F282 HydrophobicContact CZ2-CD1 3.86Å; W278-F282 HydrophobicContact CZ2-CD2 4.23Å; W278-F282 HydrophobicContact CZ2-CE1 4.33Å; W278-F282 AromaticContact CZ2-CG 3.82Å; W278-F282 HydrophobicContact CZ2-CG 3.82Å; W278-F282 AromaticContact NE1-CD2 3.82Å; W278-F282 AromaticContact NE1-CG 3.88Å; W278-F282 WeakPolarHBondContact O-CA 3.08Å; W278-F282 WeakPolarHBondContact O-CB 3.48Å; W278-F282 PolarHBondContact O-N 3.4Å; W278-M311 WeakPolarHBondContact CA-SD 3.24Å; W278-M311 HydrophobicContact CB-CB 4.19Å; W278-M311 HydrophobicContact CB-SD 3.6Å; W278-M311 PolarHBondContact N-SD 2.96Å; W278-W322 HydrophobicContact CB-CH2 3.49Å; W278-W322 VanDerWaalsContact CB-CH2 3.49Å; W278-W322 HydrophobicContact CB-CZ2 4.21Å; W278-W322 HydrophobicContact CB-CZ3 4.08Å; W278-W322 AromaticContact CD2-CH2 3.81Å; W278-W322 HydrophobicContact CD2-CH2 3.81Å; W278-W322 AromaticContact CD2-CZ3 3.49Å; W278-W322 HydrophobicContact CD2-CZ3 3.49Å; W278-W322 VanDerWaalsContact CD2-CZ3 3.49Å; W278-W322 HydrophobicContact CE3-CE3 4.21Å; W278-W322 HydrophobicContact CE3-CH2 4.17Å; W278-W322 AromaticContact CE3-CZ3 3.52Å; W278-W322 HydrophobicContact CE3-CZ3 3.52Å; W278-W322 AromaticContact CG-CH2 3.47Å; W278-W322 HydrophobicContact CG-CH2 3.47Å; W278-W322 VanDerWaalsContact CG-CH2 3.47Å; W278-W322 AromaticContact CG-CZ3 3.71Å; W278-W322 HydrophobicContact CG-CZ3 3.71Å; W278-W322 HydrophobicContact CZ3-CZ3 4.25Å; W278-P324 HydrophobicContact CH2-CB 3.79Å; W278-P324 HydrophobicContact CZ2-CB 3.53Å; W278-P324 HydrophobicContact CZ2-CG 4.1Å; W278-C327 HydrophobicContact CH2-CB 3.94Å; W278-C327 HydrophobicContact CZ3-CB 3.64Å; W278-M328 HydrophobicContact CH2-CG 4.15Å; W278-M328 HydrophobicContact CH2-SD 4.19Å
279	A	98.8	Very high	98.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.1	-42.7	-178	0	0	0	0	0	111.8	T136 L139 T140 L275 W277 L283	T136-A279 HydrophobicContact CG2-CB 3.9Å; L139-A279 HydrophobicContact CB-CB 3.93Å; L139-A279 HydrophobicContact CD2-CB 3.81Å; T140-A279 HydrophobicContact CG2-CB 4.01Å; L275-A279 WeakPolarHBondContact O-CB 3.37Å; L275-A279 PolarHBondContact O-N 3.46Å; W277-A279 PolarHBondContact O-N 2.94Å; A279-L283 WeakPolarHBondContact O-CD1 3.43Å; A279-L283 WeakPolarHBondContact O-CG 3.5Å; A279-L283 PolarHBondContact O-N 3.15Å
280	Q	98.7	Very high	98.6	Very high	36 Å²	36	27.4 Å²	27.4	17%	0.168	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-39.3	-179.6	-172.1	-170.7	0.9	0	0	113.5	R132 T136 E253 K276 W277 W278 P284	R132-Q280 WeakPolarHBondContact CD-O 3.38Å; R132-Q280 PolarHBondContact NH1-O 2.94Å; T136-Q280 HydrophobicContact CG2-CB 4.29Å; E253-Q280 PolarHBondContact OE1-NE2 3.2Å; E253-Q280 PolarHBondContact OE1-OE1 3.04Å; K276-Q280 WeakPolarHBondContact O-CB 3.12Å; K276-Q280 PolarHBondContact O-N 2.92Å; K276-Q280 VanDerWaalsContact O-N 3.07Å; W277-Q280 PolarHBondContact O-N 2.6Å; W278-Q280 VanDerWaalsContact C-N 3.32Å; W278-Q280 PolarHBondContact O-N 3.25Å; Q280-P284 WeakPolarHBondContact O-CD 3.22Å; Q280-P284 WeakPolarHBondContact O-CG 3.15Å
281	S	98.8	Very high	98.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-93	-27.2	-176.6	-57.5	0	0	0	0	113	W277 W278 P284 G285 V286 V289	W277-S281 PolarHBondContact O-N 3.25Å; W277-S281 PolarHBondContact O-OG 2.8Å; W278-S281 PolarHBondContact O-N 3.07Å; S281-P284 WeakPolarHBondContact O-CD 3.36Å; S281-G285 PolarHBondContact O-N 3.13Å; S281-V286 PolarHBondContact O-N 2.73Å; S281-V289 VanDerWaalsContact OG-CG2 3.27Å; S281-V289 WeakPolarHBondContact OG-CG2 3.39Å
282	F	98.8	Very high	98.6	Very high	26 Å²	26	23.5 Å²	23.5	11%	0.114	12%	0.119	C	C	.	.	H	α-helix	trans	-65.3	-45.7	177.6	177.8	-98.1	0	0	0	111.9	F40 Y43 W278 G285 T308 M309 M328	F40-F282 HydrophobicContact CE1-CZ 4.21Å; F40-F282 AromaticContact CZ-CE1 3.93Å; F40-F282 HydrophobicContact CZ-CE1 3.93Å; F40-F282 HydrophobicContact CZ-CE2 4.43Å; F40-F282 AromaticContact CZ-CZ 3.55Å; F40-F282 HydrophobicContact CZ-CZ 3.55Å; Y43-F282 HydrophobicContact CD1-CD1 4.46Å; Y43-F282 AromaticContact CD1-CE1 3.54Å; Y43-F282 HydrophobicContact CD1-CE1 3.54Å; Y43-F282 AromaticContact CD1-CZ 3.78Å; Y43-F282 HydrophobicContact CD1-CZ 3.78Å; Y43-F282 HydrophobicContact CE1-CD1 4.39Å; Y43-F282 AromaticContact CE1-CE1 3.88Å; Y43-F282 HydrophobicContact CE1-CE1 3.88Å; Y43-F282 HydrophobicContact CE1-CZ 4.41Å; Y43-F282 HydrophobicContact CG-CE1 4.18Å; Y43-F282 HydrophobicContact CG-CZ 4.5Å; W278-F282 HydrophobicContact CD2-CB 4.4Å; W278-F282 AromaticContact CE2-CG 3.91Å; W278-F282 HydrophobicContact CH2-CD1 4.41Å; W278-F282 HydrophobicContact CZ2-CB 4.24Å; W278-F282 AromaticContact CZ2-CD1 3.86Å; W278-F282 HydrophobicContact CZ2-CD1 3.86Å; W278-F282 HydrophobicContact CZ2-CD2 4.23Å; W278-F282 HydrophobicContact CZ2-CE1 4.33Å; W278-F282 AromaticContact CZ2-CG 3.82Å; W278-F282 HydrophobicContact CZ2-CG 3.82Å; W278-F282 AromaticContact NE1-CD2 3.82Å; W278-F282 AromaticContact NE1-CG 3.88Å; W278-F282 WeakPolarHBondContact O-CA 3.08Å; W278-F282 WeakPolarHBondContact O-CB 3.48Å; W278-F282 PolarHBondContact O-N 3.4Å; F282-G285 PolarHBondContact O-N 3.47Å; F282-T308 HydrophobicContact CB-CG2 3.95Å; F282-M309 HydrophobicContact CD2-SD 4.07Å; F282-M309 HydrophobicContact CE2-CE 4.46Å; F282-M309 HydrophobicContact CE2-SD 4.05Å; F282-M328 HydrophobicContact CD1-SD 4.1Å; F282-M328 HydrophobicContact CE1-CE 3.91Å; F282-M328 HydrophobicContact CE1-CG 4.46Å; F282-M328 HydrophobicContact CE1-SD 3.84Å
283	L	98.8	Very high	98.6	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-55.2	179.7	-74.2	167.6	0	0	0	112.9	Y43 P46 R132 L135 L139 F231 A279 G285	Y43-L283 HydrophobicContact CE2-CD2 4.46Å; Y43-L283 WeakPolarHBondContact OH-CA 3.32Å; Y43-L283 PolarHBondContact OH-O 3.03Å; P46-L283 WeakPolarHBondContact CG-O 3.28Å; R132-L283 HydrophobicContact CG-CB 4.27Å; R132-L283 HydrophobicContact CG-CD1 4.45Å; L135-L283 HydrophobicContact CB-CD1 3.59Å; L135-L283 HydrophobicContact CB-CD2 4.28Å; L135-L283 HydrophobicContact CD1-CD2 4.48Å; L139-L283 HydrophobicContact CD1-CD1 4.36Å; L139-L283 HydrophobicContact CD1-CD2 4.05Å; L139-L283 HydrophobicContact CD2-CD1 4.05Å; L139-L283 HydrophobicContact CD2-CD2 4.02Å; L139-L283 HydrophobicContact CD2-CG 3.86Å; F231-L283 HydrophobicContact CE2-CB 4.49Å; F231-L283 WeakPolarHBondContact CZ-O 3.36Å; A279-L283 WeakPolarHBondContact O-CD1 3.43Å; A279-L283 WeakPolarHBondContact O-CG 3.5Å; A279-L283 PolarHBondContact O-N 3.15Å; L283-G285 PolarHBondContact O-N 3.26Å
284	P	98.5	Very high	98.6	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.013	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-4.6	177.2	32.8	-38.2	0	0	0	113.5	R132 L220 F231 P248 Q280 S281 V286	R132-P284 HydrophobicContact CG-CG 4.48Å; L220-P284 HydrophobicContact CD1-CB 3.9Å; L220-P284 HydrophobicContact CD2-CB 4.06Å; L220-P284 WeakPolarHBondContact CD2-O 3.46Å; F231-P284 HydrophobicContact CE2-CB 4.43Å; P248-P284 WeakPolarHBondContact CB-O 3.49Å; P248-P284 WeakPolarHBondContact CG-O 3.26Å; Q280-P284 WeakPolarHBondContact O-CD 3.22Å; Q280-P284 WeakPolarHBondContact O-CG 3.15Å; S281-P284 WeakPolarHBondContact O-CD 3.36Å; P284-V286 HydrophobicContact CB-CG2 4.16Å; P284-V286 HydrophobicContact CG-CB 4.38Å; P284-V286 HydrophobicContact CG-CG2 3.72Å
285	G	98.3	Very high	98.6	Very high	24 Å²	24	17.6 Å²	17.6	25%	0.247	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	26.2	-177.1	0	0	0	0	0	114.1	S281 F282 L283 P287	S281-G285 PolarHBondContact O-N 3.13Å; F282-G285 PolarHBondContact O-N 3.47Å; L283-G285 PolarHBondContact O-N 3.26Å; G285-P287 WeakPolarHBondContact O-CD 3.49Å
286	V	98.5	Very high	98.5	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.018	12%	0.123	C	C	.	.			trans	-73.7	115.7	174	174.8	0	0	0	0	108.4	E253 S281 P284 T308	E253-V286 HydrophobicContact CB-CG1 4.19Å; S281-V286 PolarHBondContact O-N 2.73Å; P284-V286 HydrophobicContact CB-CG2 4.16Å; P284-V286 HydrophobicContact CG-CB 4.38Å; P284-V286 HydrophobicContact CG-CG2 3.72Å; V286-T308 WeakPolarHBondContact O-CB 3.46Å; V286-T308 PolarHBondContact O-OG1 2.89Å
287	P	98.2	Very high	98.4	Very high	42 Å²	42	23 Å²	23	27%	0.273	13%	0.131	S	C	.	.			trans	-78.3	-23.7	-166.7	29.1	-36.4	0	0	0	114.4	T249 Y251 G285 P307 T308	T249-P287 WeakPolarHBondContact O-CG 3.47Å; Y251-P287 WeakPolarHBondContact O-CD 3.45Å; G285-P287 WeakPolarHBondContact O-CD 3.49Å; P287-P307 CarbonylContact O-C 3.57Å; P287-P307 WeakPolarHBondContact O-CA 3.14Å; P287-T308 PolarHBondContact O-N 3.27Å; P287-T308 PolarHBondContact O-OG1 3.22Å
288	N	98.5	Very high	98.3	Very high	49 Å²	49	22.3 Å²	22.3	26%	0.262	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.3	-171.7	-66.5	-52	0	0	0	111.7	E253 T305	E253-N288 PolarHBondContact N-O 3.42Å; N288-T305 HydrophobicContact CB-CG2 4.01Å
289	V	98.9	Very high	98.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118	165.8	-174.9	0	0	0	0	108.8	E253 K255 W277 S281 F306 M311	E253-V289 HydrophobicContact CB-CB 4.4Å; E253-V289 HydrophobicContact CB-CG1 4.28Å; E253-V289 HydrophobicContact CB-CG2 3.98Å; E253-V289 HydrophobicContact CG-CG1 4.2Å; E253-V289 HydrophobicContact CG-CG2 4.34Å; E253-V289 CarbonylContact O-C 3.52Å; E253-V289 VanDerWaalsContact O-CA 3.28Å; E253-V289 WeakPolarHBondContact O-CA 3.27Å; K255-V289 HydrophobicContact CB-CG1 4.14Å; K255-V289 HydrophobicContact CG-CG1 3.54Å; W277-V289 HydrophobicContact CD2-CG1 4.24Å; W277-V289 HydrophobicContact CE3-CG1 3.91Å; W277-V289 HydrophobicContact CZ3-CG1 4.39Å; S281-V289 VanDerWaalsContact OG-CG2 3.27Å; S281-V289 WeakPolarHBondContact OG-CG2 3.39Å; V289-F306 PolarHBondContact N-O 3.45Å; V289-F306 PolarHBondContact O-N 3.27Å; V289-M311 HydrophobicContact CB-CE 3.66Å; V289-M311 HydrophobicContact CG2-CE 3.33Å
290	V	98.8	Very high	98.3	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.024	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	116.9	177.2	179.5	0	0	0	0	109	Y70 M195 V252 E253 L254 K255 L303 T305	Y70-V290 HydrophobicContact CE2-CB 4.41Å; Y70-V290 HydrophobicContact CE2-CG1 4.32Å; Y70-V290 HydrophobicContact CE2-CG2 4.1Å; M195-V290 HydrophobicContact CE-CG1 4.16Å; V252-V290 HydrophobicContact CG1-CB 4.27Å; V252-V290 HydrophobicContact CG1-CG2 3.62Å; E253-V290 PolarHBondContact O-N 2.76Å; L254-V290 WeakPolarHBondContact CA-O 3.41Å; L254-V290 HydrophobicContact CD2-CB 3.94Å; K255-V290 PolarHBondContact N-O 3.44Å; V290-L303 HydrophobicContact CG1-CD2 4.26Å; V290-T305 HydrophobicContact CG2-CG2 4.29Å
291	A	98.8	Very high	98.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.8	-177.8	0	0	0	0	0	111.9	K255 W277 F293 L303 K304 F306	K255-A291 CarbonylContact O-C 3.49Å; K255-A291 VanDerWaalsContact O-CA 3.22Å; K255-A291 WeakPolarHBondContact O-CA 3.45Å; W277-A291 HydrophobicContact CH2-CB 3.62Å; W277-A291 HydrophobicContact CZ3-CB 3.71Å; A291-F293 HydrophobicContact CB-CE2 4.48Å; A291-F293 HydrophobicContact CB-CZ 4.16Å; A291-L303 CarbonylContact O-C 3.53Å; A291-L303 VanDerWaalsContact O-CA 3.3Å; A291-L303 WeakPolarHBondContact O-CA 3.46Å; A291-K304 PolarHBondContact N-O 3.06Å; A291-K304 PolarHBondContact O-N 3.32Å; A291-F306 HydrophobicContact CB-CD2 4.08Å; A291-F306 HydrophobicContact CB-CE2 3.79Å
292	G	98.7	Very high	98	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.1	162.1	0	0	0	0	0	111.2	F191 K255 T256 S257	F191-G292 VanDerWaalsContact CZ-N 3.34Å; K255-G292 PolarHBondContact O-N 2.87Å; T256-G292 VanDerWaalsContact CA-O 3.31Å; T256-G292 WeakPolarHBondContact CA-O 3.17Å; S257-G292 PolarHBondContact N-O 3.43Å
293	F	98.6	Very high	98	Very high	8 Å²	8	29.2 Å²	29.2	4%	0.035	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.9	174.7	-60.3	-73.4	0	0	0	110.5	S257 E259 M260 W266 A291 V300 S301 S302 K304 F306	S257-F293 CarbonylContact O-C 3.32Å; S257-F293 VanDerWaalsContact O-CA 3.26Å; S257-F293 WeakPolarHBondContact O-CA 3.35Å; E259-F293 HydrophobicContact CG-CB 3.71Å; M260-F293 HydrophobicContact CE-CD1 4.04Å; M260-F293 HydrophobicContact CE-CE1 3.45Å; M260-F293 VanDerWaalsContact CE-CE1 3.45Å; M260-F293 HydrophobicContact CE-CZ 4.2Å; W266-F293 HydrophobicContact CH2-CE1 4.14Å; W266-F293 HydrophobicContact CH2-CE2 4.03Å; W266-F293 AromaticContact CH2-CZ 3.58Å; W266-F293 HydrophobicContact CH2-CZ 3.58Å; W266-F293 HydrophobicContact CZ3-CZ 4.1Å; A291-F293 HydrophobicContact CB-CE2 4.48Å; A291-F293 HydrophobicContact CB-CZ 4.16Å; F293-V300 WeakPolarHBondContact O-CA 3.29Å; F293-S301 PolarHBondContact O-N 3.22Å; F293-S302 PolarHBondContact N-O 3.48Å; F293-K304 HydrophobicContact CE2-CB 3.59Å; F293-K304 HydrophobicContact CE2-CD 4.21Å; F293-K304 HydrophobicContact CZ-CB 4.29Å; F293-K304 HydrophobicContact CZ-CD 4.42Å; F293-F306 AromaticContact CZ-CE2 3.92Å; F293-F306 HydrophobicContact CZ-CE2 3.92Å; F293-F306 HydrophobicContact CZ-CZ 4.02Å
294	R	98.1	Very high	97.9	Very high	30 Å²	30	32.9 Å²	32.9	11%	0.113	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.8	-178.5	60.2	168.5	-166.3	79.3	-5.1	112.4	L84 S257 E259 F299 V300	L84-R294 HydrophobicContact CD1-CB 4.19Å; S257-R294 WeakPolarHBondContact O-CG 3.33Å; S257-R294 PolarHBondContact O-N 2.84Å; E259-R294 PolarHBondContact N-O 3.24Å; R294-F299 CarbonylContact C-O 3.53Å; R294-F299 WeakPolarHBondContact CA-O 3.36Å; R294-V300 HydrophobicContact CB-CG2 4.07Å
295	N	97.3	Very high	97.9	Very high	28 Å²	28	36 Å²	36	15%	0.15	21%	0.208	C	C	.	.			trans	-75	176.3	170.3	75.2	7	0	0	0	111	D297 G298 F299	N295-D297 VanDerWaalsContact C-N 3.26Å; N295-D297 PolarHBondContact O-N 2.8Å; N295-D297 WeakPolarHBondContact OD1-CA 3.4Å; N295-D297 PolarHBondContact OD1-N 2.73Å; N295-G298 PolarHBondContact O-N 3.11Å; N295-G298 PolarHBondContact OD1-N 2.67Å; N295-F299 PolarHBondContact N-O 3.02Å; N295-F299 PolarHBondContact OD1-N 3.48Å; N295-F299 PolarHBondContact OD1-O 2.92Å
296	P	96.2	Very high	98	Very high	108 Å²	108	34.9 Å²	34.9	70%	0.701	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.6	176.9	-25.9	37	0	0	0	114.7	G298	P296-G298 VanDerWaalsContact C-N 3.25Å; P296-G298 PolarHBondContact O-N 2.8Å
297	D	97.1	Very high	98	Very high	101 Å²	101	36.8 Å²	36.8	54%	0.54	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.5	-179.2	-57.1	-47.5	0	0	0	113.1	R85 N295 F299	R85-D297 PolarHBondContact NH1-O 3.48Å; N295-D297 VanDerWaalsContact C-N 3.26Å; N295-D297 PolarHBondContact O-N 2.8Å; N295-D297 WeakPolarHBondContact OD1-CA 3.4Å; N295-D297 PolarHBondContact OD1-N 2.73Å; D297-F299 HydrophobicContact CB-CD2 3.97Å; D297-F299 HydrophobicContact CB-CE2 4.29Å
298	G	97.6	Very high	98	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	99.4	8.4	175.4	0	0	0	0	0	114.9	L84 M187 N295 P296	L84-G298 VanDerWaalsContact CB-O 3.23Å; L84-G298 WeakPolarHBondContact CB-O 3.17Å; L84-G298 WeakPolarHBondContact CG-O 3.48Å; L84-G298 PolarHBondContact N-O 2.79Å; L84-G298 VanDerWaalsContact N-O 3.11Å; M187-G298 VanDerWaalsContact CE-CA 3.42Å; N295-G298 PolarHBondContact O-N 3.11Å; N295-G298 PolarHBondContact OD1-N 2.67Å; P296-G298 VanDerWaalsContact C-N 3.25Å; P296-G298 PolarHBondContact O-N 2.8Å
299	F	98.6	Very high	98	Very high	60 Å²	60	39.3 Å²	39.3	26%	0.263	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	138.2	178.8	-67.8	-99	0	0	0	111.8	F82 D83 R294 N295 D297	F82-F299 CarbonylContact O-C 3.36Å; F82-F299 WeakPolarHBondContact O-CA 3.17Å; D83-F299 HydrophobicContact CB-CD1 3.98Å; D83-F299 HydrophobicContact CB-CE1 3.49Å; D83-F299 VanDerWaalsContact CB-CE1 3.49Å; D83-F299 HydrophobicContact CB-CZ 3.98Å; R294-F299 CarbonylContact C-O 3.53Å; R294-F299 WeakPolarHBondContact CA-O 3.36Å; N295-F299 PolarHBondContact N-O 3.02Å; N295-F299 PolarHBondContact OD1-N 3.48Å; N295-F299 PolarHBondContact OD1-O 2.92Å; D297-F299 HydrophobicContact CB-CD2 3.97Å; D297-F299 HydrophobicContact CB-CE2 4.29Å
300	V	98.5	Very high	98	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.9	166.5	172.3	0	0	0	0	109.6	P80 N81 F82 L84 F191 F293 R294 S302 L303	P80-V300 CarbonylContact C-O 3.51Å; N81-V300 WeakPolarHBondContact CA-O 3.3Å; N81-V300 PolarHBondContact N-O 3.18Å; F82-V300 HydrophobicContact CB-CB 4.2Å; F82-V300 HydrophobicContact CD2-CB 3.95Å; F82-V300 HydrophobicContact CD2-CG1 3.98Å; F82-V300 PolarHBondContact N-O 3Å; F82-V300 VanDerWaalsContact N-O 3.13Å; F82-V300 PolarHBondContact O-N 3.47Å; L84-V300 HydrophobicContact CD1-CG2 3.54Å; L84-V300 HydrophobicContact CD2-CG2 4.07Å; L84-V300 HydrophobicContact CG-CG2 3.9Å; F191-V300 HydrophobicContact CD2-CG2 4.15Å; F191-V300 HydrophobicContact CE2-CG1 4.16Å; F191-V300 HydrophobicContact CE2-CG2 4.49Å; F293-V300 WeakPolarHBondContact O-CA 3.29Å; R294-V300 HydrophobicContact CB-CG2 4.07Å; V300-S302 WeakPolarHBondContact CG1-O 3.31Å; V300-L303 HydrophobicContact CG1-CD2 4.43Å
301	S	94.5	Very high	98	Very high	52 Å²	52	45.4 Å²	45.4	36%	0.364	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-5.5	-177.3	-54.7	0	0	0	0	113.3	P80 F293	P80-S301 WeakPolarHBondContact O-CA 3.39Å; F293-S301 PolarHBondContact O-N 3.22Å
302	S	96.9	Very high	98	Very high	47 Å²	47	47 Å²	47	33%	0.329	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	148.7	175.2	62	0	0	0	0	112.6	F293 V300	F293-S302 PolarHBondContact N-O 3.48Å; V300-S302 WeakPolarHBondContact CG1-O 3.31Å
303	L	98.2	Very high	97.9	Very high	55 Å²	55	51.8 Å²	51.8	29%	0.288	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.8	177.8	-70.1	166.4	0	0	0	110	P73 P80 F82 F191 M195 V290 A291 V300	P73-L303 HydrophobicContact CG-CD1 4.04Å; P80-L303 HydrophobicContact CB-CD1 4.18Å; P80-L303 HydrophobicContact CB-CG 4.34Å; P80-L303 HydrophobicContact CG-CD1 4.11Å; P80-L303 HydrophobicContact CG-CG 4.02Å; F82-L303 HydrophobicContact CE2-CD1 4.39Å; F191-L303 HydrophobicContact CE2-CD2 3.71Å; F191-L303 HydrophobicContact CZ-CD2 3.6Å; M195-L303 HydrophobicContact CE-CD1 3.94Å; M195-L303 HydrophobicContact CE-CD2 4.09Å; M195-L303 HydrophobicContact SD-CD1 3.94Å; M195-L303 HydrophobicContact SD-CD2 3.98Å; V290-L303 HydrophobicContact CG1-CD2 4.26Å; A291-L303 CarbonylContact O-C 3.53Å; A291-L303 VanDerWaalsContact O-CA 3.3Å; A291-L303 WeakPolarHBondContact O-CA 3.46Å; V300-L303 HydrophobicContact CG1-CD2 4.43Å
304	K	98	Very high	97.9	Very high	77 Å²	77	55.7 Å²	55.7	34%	0.335	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	129.6	171.8	-175.9	176.6	173.2	79.2	0	111.1	W266 A291 F293 F306	W266-K304 HydrophobicContact CH2-CD 4.15Å; A291-K304 PolarHBondContact N-O 3.06Å; A291-K304 PolarHBondContact O-N 3.32Å; F293-K304 HydrophobicContact CE2-CB 3.59Å; F293-K304 HydrophobicContact CE2-CD 4.21Å; F293-K304 HydrophobicContact CZ-CB 4.29Å; F293-K304 HydrophobicContact CZ-CD 4.42Å; K304-F306 HydrophobicContact CB-CE2 3.99Å; K304-F306 HydrophobicContact CD-CE1 4.1Å; K304-F306 HydrophobicContact CD-CE2 3.8Å; K304-F306 HydrophobicContact CD-CZ 3.48Å; K304-F306 VanDerWaalsContact CD-CZ 3.48Å; K304-F306 HydrophobicContact CG-CD2 4.33Å; K304-F306 HydrophobicContact CG-CE2 3.82Å; K304-F306 HydrophobicContact CG-CZ 4.01Å; K304-F306 WeakPolarHBondContact O-CD2 3.27Å
305	T	98.5	Very high	97.9	Very high	68 Å²	68	54.4 Å²	54.4	42%	0.417	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.4	171.4	-52.2	0	0	0	0	110.7	N288 V290	N288-T305 HydrophobicContact CB-CG2 4.01Å; V290-T305 HydrophobicContact CG2-CG2 4.29Å
306	F	98.7	Very high	97.9	Very high	1 Å²	1	59 Å²	59	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	101.3	171.5	-66.6	-92.7	0	0	0	108.7	W266 F269 Y270 L274 W277 V289 A291 F293 K304 T308 M311 Y314	W266-F306 HydrophobicContact CZ3-CZ 4.08Å; F269-F306 AromaticContact CE1-CE1 3.92Å; F269-F306 HydrophobicContact CE1-CE1 3.92Å; F269-F306 AromaticContact CE1-CZ 3.76Å; F269-F306 HydrophobicContact CE1-CZ 3.76Å; F269-F306 HydrophobicContact CZ-CE1 4.36Å; F269-F306 HydrophobicContact CZ-CE2 4.26Å; F269-F306 AromaticContact CZ-CZ 3.89Å; F269-F306 HydrophobicContact CZ-CZ 3.89Å; Y270-F306 HydrophobicContact CE1-CE1 4.26Å; L274-F306 HydrophobicContact CD1-CD1 3.76Å; L274-F306 HydrophobicContact CD1-CE1 4.13Å; L274-F306 HydrophobicContact CD1-CG 4.16Å; W277-F306 HydrophobicContact CZ3-CD2 4.07Å; W277-F306 HydrophobicContact CZ3-CE2 4.12Å; V289-F306 PolarHBondContact N-O 3.45Å; V289-F306 PolarHBondContact O-N 3.27Å; A291-F306 HydrophobicContact CB-CD2 4.08Å; A291-F306 HydrophobicContact CB-CE2 3.79Å; F293-F306 AromaticContact CZ-CE2 3.92Å; F293-F306 HydrophobicContact CZ-CE2 3.92Å; F293-F306 HydrophobicContact CZ-CZ 4.02Å; K304-F306 HydrophobicContact CB-CE2 3.99Å; K304-F306 HydrophobicContact CD-CE1 4.1Å; K304-F306 HydrophobicContact CD-CE2 3.8Å; K304-F306 HydrophobicContact CD-CZ 3.48Å; K304-F306 VanDerWaalsContact CD-CZ 3.48Å; K304-F306 HydrophobicContact CG-CD2 4.33Å; K304-F306 HydrophobicContact CG-CE2 3.82Å; K304-F306 HydrophobicContact CG-CZ 4.01Å; K304-F306 WeakPolarHBondContact O-CD2 3.27Å; F306-T308 PolarHBondContact O-N 3.34Å; F306-M311 HydrophobicContact CB-CE 3.67Å; F306-M311 HydrophobicContact CB-CG 4.46Å; F306-Y314 HydrophobicContact CD1-CE2 4.19Å; F306-Y314 HydrophobicContact CE1-CE2 4.44Å
307	P	98.7	Very high	98	Very high	43 Å²	43	61.3 Å²	61.3	28%	0.279	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	125.1	171.9	-23.8	35	0	0	0	109.9	P287 M309 K310 M311	P287-P307 CarbonylContact O-C 3.57Å; P287-P307 WeakPolarHBondContact O-CA 3.14Å; P307-M309 PolarHBondContact O-N 2.95Å; P307-K310 HydrophobicContact CB-CB 4.26Å; P307-K310 HydrophobicContact CB-CD 4.26Å; P307-K310 HydrophobicContact CB-CG 4.19Å; P307-K310 HydrophobicContact CG-CD 4.26Å; P307-K310 WeakPolarHBondContact O-CA 3.3Å; P307-K310 PolarHBondContact O-N 3.48Å; P307-M311 PolarHBondContact O-N 3.48Å
308	T	98.7	Very high	97.9	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.018	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-52.9	-43.5	-174.2	-57.2	0	0	0	0	111.5	F282 V286 P287 F306 K310 M311	F282-T308 HydrophobicContact CB-CG2 3.95Å; V286-T308 WeakPolarHBondContact O-CB 3.46Å; V286-T308 PolarHBondContact O-OG1 2.89Å; P287-T308 PolarHBondContact O-N 3.27Å; P287-T308 PolarHBondContact O-OG1 3.22Å; F306-T308 PolarHBondContact O-N 3.34Å; T308-K310 PolarHBondContact O-N 3.03Å; T308-M311 PolarHBondContact O-N 3.36Å
309	M	98.2	Very high	97.8	Very high	140 Å²	140	70.1 Å²	70.1	69%	0.69	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-70	-12.7	179.8	-61.4	-54.2	-64.1	0	0	114.5	F282 P307	F282-M309 HydrophobicContact CD2-SD 4.07Å; F282-M309 HydrophobicContact CE2-CE 4.46Å; F282-M309 HydrophobicContact CE2-SD 4.05Å; P307-M309 PolarHBondContact O-N 2.95Å
310	K	98.5	Very high	97.6	Very high	133 Å²	133	72.4 Å²	72.4	58%	0.578	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-104.1	-3.3	177.7	-63.5	-173.5	179.7	179.6	0	113.1	P307 T308 F312 E313	P307-K310 HydrophobicContact CB-CB 4.26Å; P307-K310 HydrophobicContact CB-CD 4.26Å; P307-K310 HydrophobicContact CB-CG 4.19Å; P307-K310 HydrophobicContact CG-CD 4.26Å; P307-K310 WeakPolarHBondContact O-CA 3.3Å; P307-K310 PolarHBondContact O-N 3.48Å; T308-K310 PolarHBondContact O-N 3.03Å; K310-F312 VanDerWaalsContact C-N 3.33Å; K310-F312 PolarHBondContact O-N 3.18Å; K310-E313 WeakPolarHBondContact O-CB 3.34Å; K310-E313 PolarHBondContact O-N 2.84Å
311	M	98.8	Very high	97.6	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-63.5	-37.6	-176.3	-71.6	-175.3	176.3	0	0	112.9	L274 W277 W278 V289 F306 P307 T308 E313 Y314 W322	L274-M311 HydrophobicContact CD1-CE 4.33Å; L274-M311 HydrophobicContact CD1-CG 4.13Å; L274-M311 HydrophobicContact CD1-SD 4.14Å; L274-M311 HydrophobicContact CD2-CB 3.77Å; L274-M311 HydrophobicContact CD2-CG 4.09Å; L274-M311 VanDerWaalsContact CD2-O 3.32Å; L274-M311 WeakPolarHBondContact CD2-O 3.48Å; L274-M311 HydrophobicContact CG-CB 3.97Å; L274-M311 HydrophobicContact CG-CG 3.98Å; L274-M311 HydrophobicContact CG-SD 4.09Å; W277-M311 HydrophobicContact CB-CE 4.15Å; W277-M311 HydrophobicContact CB-SD 4.33Å; W278-M311 WeakPolarHBondContact CA-SD 3.24Å; W278-M311 HydrophobicContact CB-CB 4.19Å; W278-M311 HydrophobicContact CB-SD 3.6Å; W278-M311 PolarHBondContact N-SD 2.96Å; V289-M311 HydrophobicContact CB-CE 3.66Å; V289-M311 HydrophobicContact CG2-CE 3.33Å; F306-M311 HydrophobicContact CB-CE 3.67Å; F306-M311 HydrophobicContact CB-CG 4.46Å; P307-M311 PolarHBondContact O-N 3.48Å; T308-M311 PolarHBondContact O-N 3.36Å; M311-E313 PolarHBondContact O-N 2.9Å; M311-Y314 WeakPolarHBondContact O-CD2 3.31Å; M311-Y314 PolarHBondContact O-N 2.93Å; M311-W322 HydrophobicContact CB-CH2 4.31Å
312	F	98.5	Very high	97.8	Very high	34 Å²	34	70.9 Å²	70.9	15%	0.149	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-65.8	-25.4	179.1	176.4	-126.7	0	0	0	113.1	K310 Y314 V315 R316 W322 P324	K310-F312 VanDerWaalsContact C-N 3.33Å; K310-F312 PolarHBondContact O-N 3.18Å; F312-Y314 PolarHBondContact O-N 2.82Å; F312-Y314 VanDerWaalsContact O-N 3.11Å; F312-V315 HydrophobicContact CD2-CG2 3.76Å; F312-V315 HydrophobicContact CE2-CG2 4.17Å; F312-V315 CarbonylContact O-C 3.6Å; F312-V315 PolarHBondContact O-N 3.48Å; F312-R316 HydrophobicContact CE1-CB 4.19Å; F312-R316 HydrophobicContact CE1-CG 4.03Å; F312-R316 HydrophobicContact CE2-CB 4.47Å; F312-R316 HydrophobicContact CZ-CB 4.14Å; F312-R316 HydrophobicContact CZ-CG 4.15Å; F312-R316 PolarHBondContact O-N 3.03Å; F312-W322 HydrophobicContact CB-CH2 4.32Å; F312-W322 WeakPolarHBondContact CD2-O 3.35Å; F312-W322 WeakPolarHBondContact CE2-O 3.4Å; F312-P324 HydrophobicContact CB-CG 3.76Å; F312-P324 HydrophobicContact CD1-CG 4.05Å; F312-P324 HydrophobicContact CD2-CG 3.86Å; F312-P324 HydrophobicContact CG-CG 3.61Å
313	E	98.3	Very high	97.8	Very high	100 Å²	100	71 Å²	71	47%	0.467	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-58.9	-29.4	-179.7	-58.7	-52.8	143.7	0	0	112.9	K310 M311 V315 R316	K310-E313 WeakPolarHBondContact O-CB 3.34Å; K310-E313 PolarHBondContact O-N 2.84Å; M311-E313 PolarHBondContact O-N 2.9Å; E313-V315 PolarHBondContact O-N 2.77Å; E313-R316 IonicContact OE1-CZ 3.12Å; E313-R316 IonicContact OE1-NE 2.67Å; E313-R316 IonicContact OE1-NH2 3.54Å; E313-R316 PolarHBondContact OE1-NH2 3.09Å; E313-R316 IonicContact OE2-CZ 2.7Å; E313-R316 IonicContact OE2-NE 3.3Å; E313-R316 PolarHBondContact OE2-NE 3.07Å; E313-R316 IonicContact OE2-NH2 3.49Å; E313-R316 PolarHBondContact OE2-NH2 3.18Å
314	Y	98.1	Very high	97.9	Very high	90 Å²	90	69 Å²	69	35%	0.353	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-69.7	-17.5	178.9	-66.4	-78.5	0	0	0	113.8	Y270 L274 F306 M311 F312	Y270-Y314 HydrophobicContact CD1-CD1 4.1Å; Y270-Y314 HydrophobicContact CD1-CD2 4.45Å; Y270-Y314 AromaticContact CD1-CG 3.89Å; Y270-Y314 HydrophobicContact CD1-CG 3.89Å; Y270-Y314 HydrophobicContact CD2-CD1 4.14Å; Y270-Y314 HydrophobicContact CD2-CG 4.33Å; Y270-Y314 AromaticContact CE1-CD1 3.63Å; Y270-Y314 HydrophobicContact CE1-CD1 3.63Å; Y270-Y314 HydrophobicContact CE1-CD2 4.39Å; Y270-Y314 AromaticContact CE1-CE1 3.97Å; Y270-Y314 HydrophobicContact CE1-CE1 3.97Å; Y270-Y314 AromaticContact CE1-CG 3.85Å; Y270-Y314 HydrophobicContact CE1-CG 3.85Å; Y270-Y314 AromaticContact CE2-CD1 3.67Å; Y270-Y314 HydrophobicContact CE2-CD1 3.67Å; Y270-Y314 HydrophobicContact CE2-CE1 4.39Å; Y270-Y314 HydrophobicContact CE2-CG 4.29Å; Y270-Y314 HydrophobicContact CG-CD1 4.35Å; Y270-Y314 HydrophobicContact CG-CG 4.16Å; Y270-Y314 AromaticContact CZ-CD1 3.39Å; Y270-Y314 AromaticContact CZ-CE1 3.73Å; L274-Y314 HydrophobicContact CD2-CD2 3.74Å; L274-Y314 HydrophobicContact CD2-CE2 4.48Å; L274-Y314 HydrophobicContact CD2-CG 4.33Å; F306-Y314 HydrophobicContact CD1-CE2 4.19Å; F306-Y314 HydrophobicContact CE1-CE2 4.44Å; M311-Y314 WeakPolarHBondContact O-CD2 3.31Å; M311-Y314 PolarHBondContact O-N 2.93Å; F312-Y314 PolarHBondContact O-N 2.82Å; F312-Y314 VanDerWaalsContact O-N 3.11Å
315	V	98.3	Very high	97.9	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.018	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	1.5	-178.2	-60.4	0	0	0	0	113.7	R271 F312 E313 N317 D318 W322	R271-V315 HydrophobicContact CG-CG1 4.45Å; F312-V315 HydrophobicContact CD2-CG2 3.76Å; F312-V315 HydrophobicContact CE2-CG2 4.17Å; F312-V315 CarbonylContact O-C 3.6Å; F312-V315 PolarHBondContact O-N 3.48Å; E313-V315 PolarHBondContact O-N 2.77Å; V315-N317 PolarHBondContact O-N 2.91Å; V315-N317 VanDerWaalsContact O-N 3.11Å; V315-D318 HydrophobicContact CB-CB 4.25Å; V315-D318 WeakPolarHBondContact O-CB 3.47Å; V315-D318 PolarHBondContact O-N 3.38Å; V315-W322 HydrophobicContact CG2-CD2 4.12Å; V315-W322 HydrophobicContact CG2-CG 4.24Å; V315-W322 HydrophobicContact CG2-CZ2 4.27Å; V315-W322 WeakPolarHBondContact CG2-O 3.4Å
316	R	97.6	Very high	97.9	Very high	125 Å²	125	63.2 Å²	63.2	47%	0.472	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-39.8	-175.7	179.7	-175.2	-72.3	-87	1.1	113.6	F312 E313	F312-R316 HydrophobicContact CE1-CB 4.19Å; F312-R316 HydrophobicContact CE1-CG 4.03Å; F312-R316 HydrophobicContact CE2-CB 4.47Å; F312-R316 HydrophobicContact CZ-CB 4.14Å; F312-R316 HydrophobicContact CZ-CG 4.15Å; F312-R316 PolarHBondContact O-N 3.03Å; E313-R316 IonicContact OE1-CZ 3.12Å; E313-R316 IonicContact OE1-NE 2.67Å; E313-R316 IonicContact OE1-NH2 3.54Å; E313-R316 PolarHBondContact OE1-NH2 3.09Å; E313-R316 IonicContact OE2-CZ 2.7Å; E313-R316 IonicContact OE2-NE 3.3Å; E313-R316 PolarHBondContact OE2-NE 3.07Å; E313-R316 IonicContact OE2-NH2 3.49Å; E313-R316 PolarHBondContact OE2-NH2 3.18Å
317	N	96.5	Very high	97.9	Very high	156 Å²	156	63.1 Å²	63.1	83%	0.834	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	12.8	-179.1	-60.8	-36.7	0	0	0	112.7	V315	V315-N317 PolarHBondContact O-N 2.91Å; V315-N317 VanDerWaalsContact O-N 3.11Å
318	D	96.8	Very high	97.9	Very high	41 Å²	41	61.1 Å²	61.1	22%	0.219	29%	0.285	C	S	.	.			trans	-89.5	124.9	179.6	-167.7	-23.4	0	0	0	110.2	R271 V315 D320 G321	R271-D318 IonicContact CZ-OD1 3.57Å; R271-D318 IonicContact CZ-OD2 3.45Å; R271-D318 VanDerWaalsContact CZ-OD2 3.31Å; R271-D318 IonicContact NE-OD1 2.66Å; R271-D318 PolarHBondContact NE-OD1 3.1Å; R271-D318 IonicContact NE-OD2 3.65Å; R271-D318 PolarHBondContact NE-OD2 2.8Å; R271-D318 VanDerWaalsContact NH2-CG 3.29Å; R271-D318 IonicContact NH2-OD1 3.24Å; R271-D318 PolarHBondContact NH2-OD1 3.3Å; R271-D318 IonicContact NH2-OD2 2.68Å; R271-D318 PolarHBondContact NH2-OD2 2.89Å; R271-D318 VanDerWaalsContact NH2-OD2 3.11Å; V315-D318 HydrophobicContact CB-CB 4.25Å; V315-D318 WeakPolarHBondContact O-CB 3.47Å; V315-D318 PolarHBondContact O-N 3.38Å; D318-D320 PolarHBondContact O-N 3.12Å; D318-D320 PolarHBondContact OD1-N 3.33Å; D318-G321 PolarHBondContact O-N 2.78Å
319	R	94.4	Very high	97.9	Very high	244 Å²	244	62.5 Å²	62.5	92%	0.921	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-29.2	179	-67.2	-174.7	179.9	-162.4	-0.3	113.3
320	D	95	Very high	98	Very high	108 Å²	108	55.8 Å²	55.8	58%	0.578	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	16.4	175.5	-42.1	-57.3	0	0	0	111.5	R271 D318	R271-D320 VanDerWaalsContact CZ-CB 3.5Å; R271-D320 IonicContact CZ-OD2 3.06Å; R271-D320 IonicContact NH1-OD2 3.36Å; R271-D320 PolarHBondContact NH1-OD2 3.35Å; R271-D320 IonicContact NH2-OD2 3.97Å; R271-D320 PolarHBondContact NH2-OD2 3.47Å; D318-D320 PolarHBondContact O-N 3.12Å; D318-D320 PolarHBondContact OD1-N 3.33Å
321	G	97.5	Very high	98	Very high	16 Å²	16	49.5 Å²	49.5	17%	0.165	23%	0.232	C	C	.	.			trans	-73	157.9	176.7	0	0	0	0	0	112.7	D318	D318-G321 PolarHBondContact O-N 2.78Å
322	W	98.7	Very high	98	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.015	24%	0.238	C	C	.	.			trans	-91.1	154.8	169.9	54.5	-86	0	0	0	110.4	Y143 Y270 L275 W278 M311 F312 V315 P324	Y143-W322 HydrophobicContact CD1-CB 4.2Å; Y143-W322 HydrophobicContact CD2-CB 3.83Å; Y143-W322 HydrophobicContact CE1-CB 4.12Å; Y143-W322 HydrophobicContact CE2-CB 3.73Å; Y143-W322 HydrophobicContact CG-CB 4.06Å; Y270-W322 PolarHBondContact O-NE1 3.29Å; L275-W322 HydrophobicContact CB-CD2 3.84Å; L275-W322 HydrophobicContact CB-CG 3.79Å; L275-W322 HydrophobicContact CB-CZ2 4.48Å; L275-W322 HydrophobicContact CD1-CB 4.07Å; L275-W322 HydrophobicContact CD1-CD2 3.64Å; L275-W322 HydrophobicContact CD1-CE3 3.58Å; L275-W322 HydrophobicContact CD1-CG 3.85Å; L275-W322 HydrophobicContact CD1-CZ3 4.24Å; L275-W322 HydrophobicContact CD2-CB 4.12Å; L275-W322 HydrophobicContact CD2-CG 4.26Å; L275-W322 HydrophobicContact CG-CB 4.46Å; L275-W322 HydrophobicContact CG-CD2 4.26Å; L275-W322 HydrophobicContact CG-CG 4.15Å; W278-W322 HydrophobicContact CB-CH2 3.49Å; W278-W322 VanDerWaalsContact CB-CH2 3.49Å; W278-W322 HydrophobicContact CB-CZ2 4.21Å; W278-W322 HydrophobicContact CB-CZ3 4.08Å; W278-W322 AromaticContact CD2-CH2 3.81Å; W278-W322 HydrophobicContact CD2-CH2 3.81Å; W278-W322 AromaticContact CD2-CZ3 3.49Å; W278-W322 HydrophobicContact CD2-CZ3 3.49Å; W278-W322 VanDerWaalsContact CD2-CZ3 3.49Å; W278-W322 HydrophobicContact CE3-CE3 4.21Å; W278-W322 HydrophobicContact CE3-CH2 4.17Å; W278-W322 AromaticContact CE3-CZ3 3.52Å; W278-W322 HydrophobicContact CE3-CZ3 3.52Å; W278-W322 AromaticContact CG-CH2 3.47Å; W278-W322 HydrophobicContact CG-CH2 3.47Å; W278-W322 VanDerWaalsContact CG-CH2 3.47Å; W278-W322 AromaticContact CG-CZ3 3.71Å; W278-W322 HydrophobicContact CG-CZ3 3.71Å; W278-W322 HydrophobicContact CZ3-CZ3 4.25Å; M311-W322 HydrophobicContact CB-CH2 4.31Å; F312-W322 HydrophobicContact CB-CH2 4.32Å; F312-W322 WeakPolarHBondContact CD2-O 3.35Å; F312-W322 WeakPolarHBondContact CE2-O 3.4Å; V315-W322 HydrophobicContact CG2-CD2 4.12Å; V315-W322 HydrophobicContact CG2-CG 4.24Å; V315-W322 HydrophobicContact CG2-CZ2 4.27Å; V315-W322 WeakPolarHBondContact CG2-O 3.4Å; W322-P324 HydrophobicContact CE3-CG 4.36Å; W322-P324 HydrophobicContact CZ3-CG 3.82Å
323	N	98.6	Very high	98	Very high	51 Å²	51	50 Å²	50	27%	0.273	24%	0.242	S	C	.	.			trans	-124	121.4	-178.4	-174	-28	0	0	0	110.5	Y143 S325 V326 C327	Y143-N323 PolarHBondContact OH-N 2.69Å; N323-S325 PolarHBondContact O-N 3.43Å; N323-S325 VanDerWaalsContact O-N 3.15Å; N323-S325 WeakPolarHBondContact OD1-CB 3.37Å; N323-S325 PolarHBondContact OD1-N 3.15Å; N323-V326 HydrophobicContact CB-CB 4.31Å; N323-V326 HydrophobicContact CB-CG2 4Å; N323-V326 WeakPolarHBondContact O-CB 3.33Å; N323-V326 PolarHBondContact O-N 3.42Å; N323-C327 PolarHBondContact O-N 3.43Å
324	P	98.7	Very high	98	Very high	13 Å²	13	45.2 Å²	45.2	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-48	-39.2	174.6	-30.9	34.3	0	0	0	114.6	F40 W278 F312 W322 V326 C327 M328	F40-P324 HydrophobicContact CD2-CB 4.09Å; F40-P324 HydrophobicContact CE2-CB 3.81Å; W278-P324 HydrophobicContact CH2-CB 3.79Å; W278-P324 HydrophobicContact CZ2-CB 3.53Å; W278-P324 HydrophobicContact CZ2-CG 4.1Å; F312-P324 HydrophobicContact CB-CG 3.76Å; F312-P324 HydrophobicContact CD1-CG 4.05Å; F312-P324 HydrophobicContact CD2-CG 3.86Å; F312-P324 HydrophobicContact CG-CG 3.61Å; W322-P324 HydrophobicContact CE3-CG 4.36Å; W322-P324 HydrophobicContact CZ3-CG 3.82Å; P324-V326 PolarHBondContact O-N 3.1Å; P324-C327 WeakPolarHBondContact O-CB 3.2Å; P324-C327 PolarHBondContact O-N 3.18Å; P324-M328 WeakPolarHBondContact O-CG 3.28Å; P324-M328 PolarHBondContact O-N 3.19Å
325	S	98.7	Very high	98.1	Very high	18 Å²	18	40.9 Å²	40.9	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-41.7	179.7	-59.1	0	0	0	0	111.6	G38 F40 N323 M328 N329	G38-S325 WeakPolarHBondContact O-CB 3.31Å; F40-S325 WeakPolarHBondContact CA-OG 3.36Å; F40-S325 WeakPolarHBondContact CB-OG 3.28Å; F40-S325 PolarHBondContact N-OG 2.7Å; N323-S325 PolarHBondContact O-N 3.43Å; N323-S325 VanDerWaalsContact O-N 3.15Å; N323-S325 WeakPolarHBondContact OD1-CB 3.37Å; N323-S325 PolarHBondContact OD1-N 3.15Å; S325-M328 PolarHBondContact O-N 3.38Å; S325-N329 WeakPolarHBondContact O-CB 3.4Å; S325-N329 PolarHBondContact O-N 2.68Å; S325-N329 PolarHBondContact O-ND2 3.22Å; S325-N329 VanDerWaalsContact O-ND2 3.09Å
326	V	98.8	Very high	98.1	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-48.3	176.2	168.4	0	0	0	0	110.3	P33 Y36 P142 Y143 N323 P324 M328 N329 F330	P33-V326 HydrophobicContact CB-CG1 3.91Å; Y36-V326 WeakPolarHBondContact O-CA 3.42Å; P142-V326 HydrophobicContact CB-CG1 3.75Å; P142-V326 HydrophobicContact CG-CG1 4.04Å; Y143-V326 HydrophobicContact CE2-CB 4.08Å; Y143-V326 HydrophobicContact CE2-CG1 3.74Å; Y143-V326 WeakPolarHBondContact OH-CB 3.45Å; N323-V326 HydrophobicContact CB-CB 4.31Å; N323-V326 HydrophobicContact CB-CG2 4Å; N323-V326 WeakPolarHBondContact O-CB 3.33Å; N323-V326 PolarHBondContact O-N 3.42Å; P324-V326 PolarHBondContact O-N 3.1Å; V326-M328 PolarHBondContact O-N 3.19Å; V326-N329 PolarHBondContact O-N 2.66Å; V326-F330 WeakPolarHBondContact O-CB 3.39Å; V326-F330 PolarHBondContact O-N 3.11Å
327	C	98.9	Very high	98.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-56.8	-49.9	178.9	-63.4	0	0	0	0	112.1	L139 W278 N323 P324 C331	L139-C327 HydrophobicContact CB-CB 4.16Å; L139-C327 HydrophobicContact CG-CB 4.2Å; L139-C327 VanDerWaalsContact O-CA 3.31Å; L139-C327 WeakPolarHBondContact O-CA 3.31Å; L139-C327 WeakPolarHBondContact O-CB 3.43Å; L139-C327 PolarHBondContact O-SG 3.08Å; W278-C327 HydrophobicContact CH2-CB 3.94Å; W278-C327 HydrophobicContact CZ3-CB 3.64Å; N323-C327 PolarHBondContact O-N 3.43Å; P324-C327 WeakPolarHBondContact O-CB 3.2Å; P324-C327 PolarHBondContact O-N 3.18Å; C327-C331 WeakPolarHBondContact O-CB 3.48Å; C327-C331 PolarHBondContact O-N 2.81Å; C327-C331 VanDerWaalsContact O-N 3.1Å
328	M	98.9	Very high	98.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-74.1	-36.7	-176.8	-62.3	-57.5	-64.8	0	0	112.6	F40 P41 Y43 L139 L224 W278 F282 P324 S325 V326 C331 A332	F40-M328 HydrophobicContact CD2-CG 4.45Å; F40-M328 HydrophobicContact CE2-CB 4.21Å; F40-M328 HydrophobicContact CE2-CG 3.52Å; F40-M328 HydrophobicContact CZ-CB 4.38Å; F40-M328 HydrophobicContact CZ-CG 3.6Å; P41-M328 HydrophobicContact CG-CB 3.48Å; P41-M328 VanDerWaalsContact CG-CB 3.48Å; Y43-M328 HydrophobicContact CD1-CE 4.37Å; Y43-M328 HydrophobicContact CD2-CE 3.55Å; Y43-M328 HydrophobicContact CE2-CE 3.97Å; Y43-M328 HydrophobicContact CG-CE 3.78Å; L139-M328 HydrophobicContact CD1-SD 4.06Å; L139-M328 HydrophobicContact CD2-SD 3.6Å; L139-M328 HydrophobicContact CG-SD 3.82Å; L224-M328 HydrophobicContact CD1-CB 4.44Å; L224-M328 HydrophobicContact CD1-CE 3.64Å; L224-M328 HydrophobicContact CD2-CE 4.01Å; L224-M328 HydrophobicContact CG-CE 4.37Å; W278-M328 HydrophobicContact CH2-CG 4.15Å; W278-M328 HydrophobicContact CH2-SD 4.19Å; F282-M328 HydrophobicContact CD1-SD 4.1Å; F282-M328 HydrophobicContact CE1-CE 3.91Å; F282-M328 HydrophobicContact CE1-CG 4.46Å; F282-M328 HydrophobicContact CE1-SD 3.84Å; P324-M328 WeakPolarHBondContact O-CG 3.28Å; P324-M328 PolarHBondContact O-N 3.19Å; S325-M328 PolarHBondContact O-N 3.38Å; V326-M328 PolarHBondContact O-N 3.19Å; M328-C331 PolarHBondContact O-N 3.46Å; M328-A332 WeakPolarHBondContact O-CB 3.24Å; M328-A332 PolarHBondContact O-N 3.39Å
329	N	98.9	Very high	98.3	Very high	32 Å²	32	31.3 Å²	31.3	17%	0.171	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-42.7	177.1	-77.7	-32.6	0	0	0	111.5	Y36 G38 P39 P41 S325 V326 A332 A333	Y36-N329 HydrophobicContact CD1-CB 4.24Å; Y36-N329 PolarHBondContact O-ND2 2.71Å; G38-N329 PolarHBondContact O-ND2 2.85Å; P39-N329 PolarHBondContact O-ND2 2.83Å; P39-N329 PolarHBondContact O-OD1 3.07Å; P41-N329 WeakPolarHBondContact CB-OD1 3.28Å; P41-N329 VanDerWaalsContact CD-OD1 3.3Å; P41-N329 WeakPolarHBondContact CD-OD1 3.36Å; P41-N329 WeakPolarHBondContact CG-OD1 3.44Å; S325-N329 WeakPolarHBondContact O-CB 3.4Å; S325-N329 PolarHBondContact O-N 2.68Å; S325-N329 PolarHBondContact O-ND2 3.22Å; S325-N329 VanDerWaalsContact O-ND2 3.09Å; V326-N329 PolarHBondContact O-N 2.66Å; N329-A332 PolarHBondContact O-N 2.91Å; N329-A333 WeakPolarHBondContact O-CB 3.45Å; N329-A333 PolarHBondContact O-N 2.77Å
330	F	98.9	Very high	98.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-46.3	172.7	169.6	-97	0	0	0	111	L29 T31 Y36 L138 T141 P142 V326 A332 A333 F334 V361	L29-F330 HydrophobicContact CD2-CE2 3.9Å; L29-F330 HydrophobicContact CD2-CZ 4.42Å; L29-F330 HydrophobicContact CG-CE2 4.4Å; T31-F330 HydrophobicContact CG2-CD2 4.44Å; T31-F330 HydrophobicContact CG2-CE2 3.52Å; T31-F330 HydrophobicContact CG2-CZ 3.92Å; Y36-F330 HydrophobicContact CD1-CB 4.19Å; Y36-F330 HydrophobicContact CD2-CB 3.91Å; Y36-F330 HydrophobicContact CD2-CD2 4.2Å; Y36-F330 HydrophobicContact CE1-CB 4.42Å; Y36-F330 HydrophobicContact CE1-CD2 4.4Å; Y36-F330 HydrophobicContact CE2-CB 4.17Å; Y36-F330 AromaticContact CE2-CD2 3.61Å; Y36-F330 HydrophobicContact CE2-CD2 3.61Å; Y36-F330 HydrophobicContact CE2-CG 4.35Å; Y36-F330 HydrophobicContact CG-CB 3.92Å; Y36-F330 AromaticContact CZ-CD2 3.72Å; L138-F330 HydrophobicContact CB-CE1 4.41Å; L138-F330 HydrophobicContact CD2-CE1 4.29Å; L138-F330 WeakPolarHBondContact O-CD1 3.44Å; L138-F330 WeakPolarHBondContact O-CE1 3.44Å; T141-F330 VanDerWaalsContact CB-CE1 3.44Å; T141-F330 HydrophobicContact CG2-CE1 3.72Å; T141-F330 HydrophobicContact CG2-CE2 4.3Å; T141-F330 HydrophobicContact CG2-CZ 3.57Å; P142-F330 HydrophobicContact CG-CB 3.56Å; P142-F330 HydrophobicContact CG-CD1 3.94Å; P142-F330 HydrophobicContact CG-CD2 4.28Å; P142-F330 HydrophobicContact CG-CG 3.63Å; V326-F330 WeakPolarHBondContact O-CB 3.39Å; V326-F330 PolarHBondContact O-N 3.11Å; F330-A332 VanDerWaalsContact C-N 3.34Å; F330-A332 PolarHBondContact O-N 2.88Å; F330-A333 PolarHBondContact O-N 2.78Å; F330-F334 HydrophobicContact CZ-CB 4.45Å; F330-F334 PolarHBondContact O-N 3.15Å; F330-V361 HydrophobicContact CE2-CG2 4.49Å; F330-V361 HydrophobicContact CZ-CG2 4.18Å
331	C	98.9	Very high	98.6	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.007	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-46.2	177.2	-173.6	0	0	0	0	111.3	L138 L139 L224 C327 M328 A333 F334 L335	L138-C331 HydrophobicContact CB-CB 4.44Å; L139-C331 HydrophobicContact CD1-CB 3.63Å; L224-C331 HydrophobicContact CD2-CB 3.81Å; C327-C331 WeakPolarHBondContact O-CB 3.48Å; C327-C331 PolarHBondContact O-N 2.81Å; C327-C331 VanDerWaalsContact O-N 3.1Å; M328-C331 PolarHBondContact O-N 3.46Å; C331-A333 VanDerWaalsContact C-N 3.32Å; C331-A333 PolarHBondContact O-N 3.02Å; C331-F334 PolarHBondContact O-N 2.89Å; C331-L335 VanDerWaalsContact O-CG 3.3Å; C331-L335 WeakPolarHBondContact O-CG 3.4Å; C331-L335 PolarHBondContact O-N 2.6Å
332	A	98.8	Very high	98.6	Very high	16 Å²	16	18.9 Å²	18.9	13%	0.132	12%	0.118	C	C	.	.	H	α-helix	trans	-59.8	-41.1	176.2	0	0	0	0	0	112.6	L224 H227 M328 N329 F330 L335 S336	L224-A332 HydrophobicContact CD1-CB 4.29Å; L224-A332 HydrophobicContact CD2-CB 4.09Å; L224-A332 HydrophobicContact CG-CB 3.92Å; H227-A332 PolarHBondContact NE2-O 3.09Å; M328-A332 WeakPolarHBondContact O-CB 3.24Å; M328-A332 PolarHBondContact O-N 3.39Å; N329-A332 PolarHBondContact O-N 2.91Å; F330-A332 VanDerWaalsContact C-N 3.34Å; F330-A332 PolarHBondContact O-N 2.88Å; A332-L335 PolarHBondContact O-N 2.9Å; A332-S336 PolarHBondContact O-N 3.44Å; A332-S336 PolarHBondContact O-OG 2.71Å
333	A	98.8	Very high	98.5	Very high	27 Å²	27	23.8 Å²	23.8	22%	0.223	15%	0.149	C	C	.	.	H	α-helix	trans	-65.8	-40.2	175.9	0	0	0	0	0	112.1	L29 Y36 N329 F330 C331 S336 F337	L29-A333 HydrophobicContact CD1-CB 4.3Å; Y36-A333 HydrophobicContact CD1-CB 4.38Å; Y36-A333 HydrophobicContact CE1-CB 3.57Å; N329-A333 WeakPolarHBondContact O-CB 3.45Å; N329-A333 PolarHBondContact O-N 2.77Å; F330-A333 PolarHBondContact O-N 2.78Å; C331-A333 VanDerWaalsContact C-N 3.32Å; C331-A333 PolarHBondContact O-N 3.02Å; A333-S336 PolarHBondContact O-N 3.36Å; A333-F337 VanDerWaalsContact O-CB 3.32Å; A333-F337 WeakPolarHBondContact O-CB 3.44Å; A333-F337 PolarHBondContact O-N 2.82Å
334	F	98.9	Very high	98.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-46	173.1	176	-87.4	0	0	0	111.8	L29 L138 W149 L151 L162 F330 C331 S336 F337 A338 F353 V361	L29-F334 HydrophobicContact CD2-CB 3.83Å; L29-F334 HydrophobicContact CD2-CD2 4.15Å; L29-F334 HydrophobicContact CD2-CG 4.48Å; L138-F334 HydrophobicContact CD1-CD1 3.37Å; L138-F334 HydrophobicContact CD1-CE1 3.65Å; L138-F334 HydrophobicContact CD1-CG 4.12Å; L138-F334 HydrophobicContact CD2-CB 4.36Å; L138-F334 HydrophobicContact CD2-CD1 3.66Å; L138-F334 HydrophobicContact CD2-CD2 3.83Å; L138-F334 HydrophobicContact CD2-CE1 3.85Å; L138-F334 HydrophobicContact CD2-CE2 4Å; L138-F334 HydrophobicContact CD2-CG 3.65Å; L138-F334 HydrophobicContact CD2-CZ 4.02Å; L138-F334 HydrophobicContact CG-CD1 4.16Å; L138-F334 HydrophobicContact CG-CE1 4.39Å; W149-F334 HydrophobicContact CH2-CD2 4.12Å; W149-F334 AromaticContact CH2-CE2 3.67Å; W149-F334 HydrophobicContact CH2-CE2 3.67Å; W149-F334 HydrophobicContact CH2-CZ 4.37Å; W149-F334 HydrophobicContact CZ3-CE2 4.11Å; W149-F334 HydrophobicContact CZ3-CZ 4.49Å; L151-F334 HydrophobicContact CD1-CE1 4.1Å; L151-F334 HydrophobicContact CD1-CZ 3.83Å; L162-F334 HydrophobicContact CD1-CE1 4.11Å; F330-F334 HydrophobicContact CZ-CB 4.45Å; F330-F334 PolarHBondContact O-N 3.15Å; C331-F334 PolarHBondContact O-N 2.89Å; F334-S336 VanDerWaalsContact C-N 3.32Å; F334-S336 PolarHBondContact O-N 2.89Å; F334-F337 WeakPolarHBondContact O-CB 3.26Å; F334-F337 PolarHBondContact O-N 3.19Å; F334-F337 VanDerWaalsContact O-N 3.16Å; F334-A338 HydrophobicContact CE1-CB 4.26Å; F334-A338 WeakPolarHBondContact O-CB 3.37Å; F334-A338 PolarHBondContact O-N 3.35Å; F334-F353 HydrophobicContact CE2-CB 3.95Å; F334-F353 AromaticContact CE2-CD1 3.9Å; F334-F353 HydrophobicContact CE2-CD1 3.9Å; F334-F353 AromaticContact CE2-CG 3.94Å; F334-F353 HydrophobicContact CE2-CG 3.94Å; F334-F353 HydrophobicContact CZ-CB 4.1Å; F334-F353 HydrophobicContact CZ-CD1 4.25Å; F334-F353 HydrophobicContact CZ-CD2 4.36Å; F334-F353 AromaticContact CZ-CG 3.96Å; F334-F353 HydrophobicContact CZ-CG 3.96Å; F334-V361 HydrophobicContact CD2-CG1 4.48Å; F334-V361 HydrophobicContact CD2-CG2 4.49Å; F334-V361 HydrophobicContact CE2-CG1 4.13Å
335	L	98.8	Very high	98.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-40.2	178.5	-62.5	176.4	0	0	0	111.3	I128 L162 L224 H227 L229 C331 A332 Q339	I128-L335 HydrophobicContact CD1-CB 3.84Å; I128-L335 HydrophobicContact CD1-CD1 4.2Å; I128-L335 HydrophobicContact CD1-CD2 3.67Å; I128-L335 HydrophobicContact CD1-CG 4.07Å; I128-L335 HydrophobicContact CG2-CD2 4.36Å; L162-L335 HydrophobicContact CD1-CD2 4.09Å; L224-L335 HydrophobicContact CB-CD1 4.41Å; L224-L335 HydrophobicContact CD2-CD1 4.11Å; H227-L335 HydrophobicContact CB-CB 4.36Å; H227-L335 HydrophobicContact CB-CD1 3.98Å; L229-L335 HydrophobicContact CD2-CD1 3.9Å; C331-L335 VanDerWaalsContact O-CG 3.3Å; C331-L335 WeakPolarHBondContact O-CG 3.4Å; C331-L335 PolarHBondContact O-N 2.6Å; A332-L335 PolarHBondContact O-N 2.9Å; L335-Q339 WeakPolarHBondContact O-CB 3.37Å; L335-Q339 VanDerWaalsContact O-CG 3.28Å; L335-Q339 WeakPolarHBondContact O-CG 3.43Å; L335-Q339 PolarHBondContact O-N 3.18Å
336	S	98.6	Very high	98.4	Very high	56 Å²	56	30.7 Å²	30.7	39%	0.392	18%	0.18	S	C	.	.	H	α-helix	trans	-62.4	-45.4	171.8	-64.2	0	0	0	0	112.1	H227 A332 A333 F334 Q339 S340	H227-S336 PolarHBondContact CE1-OG 2.87Å; H227-S336 VanDerWaalsContact CE1-OG 3.27Å; H227-S336 PolarHBondContact NE2-N 2.92Å; H227-S336 PolarHBondContact NE2-OG 3.04Å; A332-S336 PolarHBondContact O-N 3.44Å; A332-S336 PolarHBondContact O-OG 2.71Å; A333-S336 PolarHBondContact O-N 3.36Å; F334-S336 VanDerWaalsContact C-N 3.32Å; F334-S336 PolarHBondContact O-N 2.89Å; S336-Q339 PolarHBondContact O-N 3.23Å; S336-S340 WeakPolarHBondContact O-CB 3.15Å; S336-S340 PolarHBondContact O-N 2.85Å; S336-S340 PolarHBondContact O-OG 2.87Å
337	F	98.5	Very high	98.4	Very high	24 Å²	24	31.7 Å²	31.7	11%	0.105	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-48.5	178.4	178.8	-122.8	0	0	0	110.9	P27 L29 A333 F334 S340 T341 F353 V363	P27-F337 HydrophobicContact CB-CE2 3.88Å; P27-F337 HydrophobicContact CB-CZ 4.14Å; L29-F337 HydrophobicContact CB-CD1 3.79Å; L29-F337 HydrophobicContact CB-CE1 4.02Å; L29-F337 HydrophobicContact CB-CG 4.1Å; L29-F337 HydrophobicContact CD1-CB 4.45Å; L29-F337 HydrophobicContact CD2-CB 4.21Å; L29-F337 HydrophobicContact CD2-CD1 4.24Å; L29-F337 HydrophobicContact CD2-CG 4.46Å; A333-F337 VanDerWaalsContact O-CB 3.32Å; A333-F337 WeakPolarHBondContact O-CB 3.44Å; A333-F337 PolarHBondContact O-N 2.82Å; F334-F337 WeakPolarHBondContact O-CB 3.26Å; F334-F337 PolarHBondContact O-N 3.19Å; F334-F337 VanDerWaalsContact O-N 3.16Å; F337-S340 PolarHBondContact O-N 3.45Å; F337-S340 PolarHBondContact O-OG 2.95Å; F337-T341 VanDerWaalsContact O-CB 3.26Å; F337-T341 WeakPolarHBondContact O-CB 3.32Å; F337-T341 PolarHBondContact O-N 3.09Å; F337-T341 PolarHBondContact O-OG1 3.37Å; F337-F353 AromaticContact CD1-CD1 3.98Å; F337-F353 HydrophobicContact CD1-CD1 3.98Å; F337-F353 AromaticContact CD1-CE1 3.65Å; F337-F353 HydrophobicContact CD1-CE1 3.65Å; F337-F353 AromaticContact CE1-CD1 3.77Å; F337-F353 HydrophobicContact CE1-CD1 3.77Å; F337-F353 AromaticContact CE1-CE1 3.55Å; F337-F353 HydrophobicContact CE1-CE1 3.55Å; F337-F353 HydrophobicContact CZ-CE1 4.41Å; F337-V363 HydrophobicContact CE1-CG2 3.64Å; F337-V363 HydrophobicContact CZ-CG2 3.61Å
338	A	98.5	Very high	98.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-48.1	177.5	0	0	0	0	0	112.1	L160 F334 S340 T341 V342 F353	L160-A338 HydrophobicContact CD2-CB 4.04Å; F334-A338 HydrophobicContact CE1-CB 4.26Å; F334-A338 WeakPolarHBondContact O-CB 3.37Å; F334-A338 PolarHBondContact O-N 3.35Å; A338-S340 VanDerWaalsContact C-N 3.32Å; A338-S340 PolarHBondContact O-N 3.06Å; A338-T341 PolarHBondContact O-N 3.37Å; A338-T341 VanDerWaalsContact O-N 3.15Å; A338-V342 WeakPolarHBondContact O-CG2 3.43Å; A338-V342 PolarHBondContact O-N 2.83Å; A338-F353 HydrophobicContact CB-CE1 4.23Å; A338-F353 HydrophobicContact CB-CE2 4.12Å; A338-F353 HydrophobicContact CB-CZ 3.79Å
339	Q	97.9	Very high	98.4	Very high	43 Å²	43	39.1 Å²	39.1	20%	0.201	22%	0.216	C	C	.	.	H	α-helix	trans	-56.9	-43.5	175.9	-78.9	-76.5	5.7	0	0	112.4	I128 R155 L160 L335 S336 T341	I128-Q339 HydrophobicContact CD1-CG 4.23Å; R155-Q339 VanDerWaalsContact CZ-OE1 3.27Å; R155-Q339 PolarHBondContact NH2-O 3.25Å; L160-Q339 HydrophobicContact CD2-CG 3.94Å; L335-Q339 WeakPolarHBondContact O-CB 3.37Å; L335-Q339 VanDerWaalsContact O-CG 3.28Å; L335-Q339 WeakPolarHBondContact O-CG 3.43Å; L335-Q339 PolarHBondContact O-N 3.18Å; S336-Q339 PolarHBondContact O-N 3.23Å; Q339-T341 VanDerWaalsContact C-N 3.34Å
340	S	97.6	Very high	98.4	Very high	82 Å²	82	37.6 Å²	37.6	57%	0.573	21%	0.208	S	C	*	.	H	α-helix	trans	-73.2	-24.4	179	69.3	0	0	0	0	114.2	S336 F337 A338 V343	S336-S340 WeakPolarHBondContact O-CB 3.15Å; S336-S340 PolarHBondContact O-N 2.85Å; S336-S340 PolarHBondContact O-OG 2.87Å; F337-S340 PolarHBondContact O-N 3.45Å; F337-S340 PolarHBondContact O-OG 2.95Å; A338-S340 VanDerWaalsContact C-N 3.32Å; A338-S340 PolarHBondContact O-N 3.06Å; S340-V343 WeakPolarHBondContact O-CG2 3.35Å
341	T	98	Very high	98.4	Very high	25 Å²	25	38.2 Å²	38.2	15%	0.153	21%	0.211	C	C	.	.	H	α-helix	trans	-85.3	-43.7	-177.9	-61.4	0	0	0	0	111.3	F337 A338 Q339 V343 F353 V363	F337-T341 VanDerWaalsContact O-CB 3.26Å; F337-T341 WeakPolarHBondContact O-CB 3.32Å; F337-T341 PolarHBondContact O-N 3.09Å; F337-T341 PolarHBondContact O-OG1 3.37Å; A338-T341 PolarHBondContact O-N 3.37Å; A338-T341 VanDerWaalsContact O-N 3.15Å; Q339-T341 VanDerWaalsContact C-N 3.34Å; T341-V343 PolarHBondContact O-N 3.24Å; T341-F353 HydrophobicContact CG2-CE1 4.32Å; T341-F353 HydrophobicContact CG2-CZ 3.99Å; T341-V363 HydrophobicContact CG2-CG1 3.91Å; T341-V363 HydrophobicContact CG2-CG2 4.28Å
342	V	98	Very high	98.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	21%	0.211	C	C	.	.			trans	-85.6	78.6	-178.3	-169.6	0	0	0	0	109.7	A153 R155 L160 A338 H351 F353	A153-V342 HydrophobicContact CB-CG2 3.9Å; R155-V342 HydrophobicContact CB-CG1 3.79Å; R155-V342 VanDerWaalsContact CZ-O 3.28Å; R155-V342 PolarHBondContact NE-O 3.42Å; R155-V342 PolarHBondContact NH2-O 2.91Å; L160-V342 HydrophobicContact CD1-CB 3.93Å; L160-V342 HydrophobicContact CD1-CG1 4.05Å; L160-V342 HydrophobicContact CD1-CG2 4.02Å; A338-V342 WeakPolarHBondContact O-CG2 3.43Å; A338-V342 PolarHBondContact O-N 2.83Å; V342-H351 HydrophobicContact CG2-CB 3.78Å; V342-F353 HydrophobicContact CG2-CE2 4.16Å; V342-F353 HydrophobicContact CG2-CZ 4.25Å
343	V	97.4	Very high	98.3	Very high	107 Å²	107	37.6 Å²	37.6	65%	0.648	21%	0.205	S	C	*	.			trans	-82.5	-41	-176.3	-179.5	0	0	0	0	111.9	S340 T341	S340-V343 WeakPolarHBondContact O-CG2 3.35Å; T341-V343 PolarHBondContact O-N 3.24Å
344	Q	97.8	Very high	98.3	Very high	103 Å²	103	37.3 Å²	37.3	48%	0.481	20%	0.202	S	C	.	.	S	Bend	trans	-73.1	132.5	-178.2	-56.7	91.4	-10.1	0	0	111.3	D346 L349	Q344-D346 PolarHBondContact O-N 3.45Å; Q344-L349 HydrophobicContact CB-CD2 3.73Å; Q344-L349 HydrophobicContact CG-CD2 4.04Å; Q344-L349 VanDerWaalsContact OE1-CD2 3.3Å
345	D	98.1	Very high	98.3	Very high	81 Å²	81	37.6 Å²	37.6	43%	0.433	20%	0.203	S	C	.	.	B	Isolated β-bridge	trans	-86	93	168.5	-158.2	-61	0	0	0	108.6	R155 F156 Q157 G158	R155-D345 HydrophobicContact CG-CB 4.47Å; F156-D345 VanDerWaalsContact CA-OD1 3.28Å; F156-D345 WeakPolarHBondContact CA-OD1 3.23Å; Q157-D345 PolarHBondContact N-OD1 3.03Å; Q157-D345 PolarHBondContact N-OD2 3.44Å; Q157-D345 VanDerWaalsContact N-OD2 3.14Å; G158-D345 PolarHBondContact N-OD2 3.45Å
346	D	98.2	Very high	98.3	Very high	43 Å²	43	42.1 Å²	42.1	23%	0.23	22%	0.224	C	C	.	.			trans	-151.6	113.6	-179.2	-179.5	-2.6	0	0	0	109	R155 Q344 R348 L349	R155-D346 CarbonylContact O-C 3.58Å; R155-D346 PolarHBondContact O-N 2.95Å; Q344-D346 PolarHBondContact O-N 3.45Å; D346-R348 PolarHBondContact O-N 3.45Å; D346-R348 VanDerWaalsContact O-N 3.16Å; D346-R348 VanDerWaalsContact OD1-CB 3.31Å; D346-R348 WeakPolarHBondContact OD1-CB 3.2Å; D346-R348 PolarHBondContact OD1-N 3.13Å; D346-L349 HydrophobicContact CB-CB 3.81Å; D346-L349 PolarHBondContact O-N 3.11Å; D346-L349 VanDerWaalsContact O-N 3.17Å
347	P	98.1	Very high	98.3	Very high	24 Å²	24	41.7 Å²	41.7	16%	0.156	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-13.8	-180	28.3	-34.3	0	0	0	113.5	F156 L374 V379	F156-P347 HydrophobicContact CB-CB 4.12Å; F156-P347 HydrophobicContact CD2-CB 3.95Å; F156-P347 HydrophobicContact CD2-CG 3.84Å; F156-P347 HydrophobicContact CE2-CG 4.2Å; F156-P347 HydrophobicContact CG-CB 4.02Å; F156-P347 HydrophobicContact CG-CG 4.43Å; P347-L374 HydrophobicContact CB-CB 4.2Å; P347-L374 HydrophobicContact CB-CD1 3.75Å; P347-V379 HydrophobicContact CB-CG1 4.46Å; P347-V379 HydrophobicContact CB-CG2 3.74Å; P347-V379 HydrophobicContact CG-CG1 3.88Å; P347-V379 HydrophobicContact CG-CG2 4.07Å
348	R	98.4	Very high	98.2	Very high	134 Å²	134	44.6 Å²	44.6	51%	0.506	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-18.1	177.8	-59.9	173.1	61.5	-177	-3.1	112.8	D346 Q367 D368	D346-R348 PolarHBondContact O-N 3.45Å; D346-R348 VanDerWaalsContact O-N 3.16Å; D346-R348 VanDerWaalsContact OD1-CB 3.31Å; D346-R348 WeakPolarHBondContact OD1-CB 3.2Å; D346-R348 PolarHBondContact OD1-N 3.13Å; R348-Q367 HydrophobicContact CB-CG 4.49Å; R348-Q367 WeakPolarHBondContact O-CA 3.35Å; R348-D368 IonicContact CZ-OD1 3.68Å; R348-D368 VanDerWaalsContact CZ-OD1 3.27Å; R348-D368 IonicContact CZ-OD2 3.82Å; R348-D368 IonicContact NE-OD1 3.84Å; R348-D368 PolarHBondContact NE-OD1 3.45Å; R348-D368 IonicContact NE-OD2 3.27Å; R348-D368 IonicContact NH2-OD1 2.79Å; R348-D368 PolarHBondContact NH2-OD1 2.81Å; R348-D368 IonicContact NH2-OD2 2.8Å; R348-D368 PolarHBondContact NH2-OD2 2.94Å; R348-D368 PolarHBondContact O-N 2.92Å
349	L	98.6	Very high	98.1	Very high	23 Å²	23	45.7 Å²	45.7	12%	0.12	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	133.5	179.3	-171.8	72	0	0	0	110.3	S154 Q344 D346 V365	S154-L349 WeakPolarHBondContact CB-O 3.41Å; S154-L349 PolarHBondContact OG-O 3.05Å; Q344-L349 HydrophobicContact CB-CD2 3.73Å; Q344-L349 HydrophobicContact CG-CD2 4.04Å; Q344-L349 VanDerWaalsContact OE1-CD2 3.3Å; D346-L349 HydrophobicContact CB-CB 3.81Å; D346-L349 PolarHBondContact O-N 3.11Å; D346-L349 VanDerWaalsContact O-N 3.17Å; L349-V365 HydrophobicContact CD1-CG1 3.69Å; L349-V365 HydrophobicContact CG-CG1 4.38Å
350	V	98.8	Very high	98.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.8	-179.9	-178.6	0	0	0	0	110.4	A152 A153 V365 H366 A372	A152-V350 HydrophobicContact CB-CG1 3.56Å; A153-V350 WeakPolarHBondContact O-CA 3.39Å; V350-V365 WeakPolarHBondContact O-CA 3.35Å; V350-H366 PolarHBondContact N-O 2.7Å; V350-H366 PolarHBondContact O-N 3.11Å; V350-A372 HydrophobicContact CG2-CB 4.29Å
351	H	98.7	Very high	98.2	Very high	13 Å²	13	42.4 Å²	42.4	6%	0.06	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	114.4	160.5	-68.1	71.5	0	0	0	108.1	A153 V342 F353 V363 S364	A153-H351 PolarHBondContact N-O 3.31Å; A153-H351 PolarHBondContact O-N 3.27Å; V342-H351 HydrophobicContact CG2-CB 3.78Å; H351-F353 HydrophobicContact CB-CE2 3.9Å; H351-F353 HydrophobicContact CB-CZ 4.31Å; H351-F353 WeakPolarHBondContact O-CD2 3.26Å; H351-V363 HydrophobicContact CB-CG1 4.1Å; H351-S364 CarbonylContact C-O 3.47Å; H351-S364 WeakPolarHBondContact CA-O 3.47Å
352	L	98.7	Very high	98.2	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	107.1	179.8	-174	69.1	0	0	0	109.5	Q150 A152 V165 V363 S364 Y371	Q150-L352 HydrophobicContact CB-CD1 4.12Å; A152-L352 HydrophobicContact CB-CD1 4.24Å; V165-L352 HydrophobicContact CB-CD1 4.26Å; V165-L352 HydrophobicContact CG2-CD1 3.81Å; L352-V363 WeakPolarHBondContact O-CA 3.21Å; L352-S364 PolarHBondContact N-O 3.37Å; L352-S364 PolarHBondContact O-N 2.95Å; L352-S364 VanDerWaalsContact O-N 3.09Å; L352-Y371 HydrophobicContact CD1-CD1 4.32Å; L352-Y371 HydrophobicContact CD2-CD1 4.17Å; L352-Y371 HydrophobicContact CD2-CE1 3.69Å
353	F	98.8	Very high	98.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118	173.4	-63.3	-92.6	0	0	0	108.9	W149 Q150 L151 A153 F334 F337 A338 T341 V342 H351 V361 T362 V363	W149-F353 HydrophobicContact CZ3-CB 4.18Å; Q150-F353 CarbonylContact C-O 3.59Å; Q150-F353 VanDerWaalsContact CA-O 3.29Å; Q150-F353 WeakPolarHBondContact CA-O 3.43Å; L151-F353 HydrophobicContact CB-CB 4.46Å; L151-F353 PolarHBondContact N-O 3.47Å; L151-F353 PolarHBondContact O-N 3.48Å; A153-F353 HydrophobicContact CB-CD2 4Å; A153-F353 HydrophobicContact CB-CE2 3.58Å; F334-F353 HydrophobicContact CE2-CB 3.95Å; F334-F353 AromaticContact CE2-CD1 3.9Å; F334-F353 HydrophobicContact CE2-CD1 3.9Å; F334-F353 AromaticContact CE2-CG 3.94Å; F334-F353 HydrophobicContact CE2-CG 3.94Å; F334-F353 HydrophobicContact CZ-CB 4.1Å; F334-F353 HydrophobicContact CZ-CD1 4.25Å; F334-F353 HydrophobicContact CZ-CD2 4.36Å; F334-F353 AromaticContact CZ-CG 3.96Å; F334-F353 HydrophobicContact CZ-CG 3.96Å; F337-F353 AromaticContact CD1-CD1 3.98Å; F337-F353 HydrophobicContact CD1-CD1 3.98Å; F337-F353 AromaticContact CD1-CE1 3.65Å; F337-F353 HydrophobicContact CD1-CE1 3.65Å; F337-F353 AromaticContact CE1-CD1 3.77Å; F337-F353 HydrophobicContact CE1-CD1 3.77Å; F337-F353 AromaticContact CE1-CE1 3.55Å; F337-F353 HydrophobicContact CE1-CE1 3.55Å; F337-F353 HydrophobicContact CZ-CE1 4.41Å; A338-F353 HydrophobicContact CB-CE1 4.23Å; A338-F353 HydrophobicContact CB-CE2 4.12Å; A338-F353 HydrophobicContact CB-CZ 3.79Å; T341-F353 HydrophobicContact CG2-CE1 4.32Å; T341-F353 HydrophobicContact CG2-CZ 3.99Å; V342-F353 HydrophobicContact CG2-CE2 4.16Å; V342-F353 HydrophobicContact CG2-CZ 4.25Å; H351-F353 HydrophobicContact CB-CE2 3.9Å; H351-F353 HydrophobicContact CB-CZ 4.31Å; H351-F353 WeakPolarHBondContact O-CD2 3.26Å; F353-V361 HydrophobicContact CB-CG1 3.94Å; F353-V361 HydrophobicContact CD1-CG1 4.12Å; F353-T362 CarbonylContact C-O 3.53Å; F353-T362 WeakPolarHBondContact CA-O 3.21Å; F353-V363 HydrophobicContact CD1-CG2 3.69Å; F353-V363 HydrophobicContact CE1-CG2 3.58Å; F353-V363 HydrophobicContact CZ-CG2 4.37Å
354	S	98.7	Very high	98.3	Very high	22 Å²	22	43.5 Å²	43.5	15%	0.154	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.6	-178.9	-57.4	0	0	0	0	110.6	Q150 V361 T362	Q150-S354 PolarHBondContact NE2-OG 2.95Å; S354-V361 WeakPolarHBondContact O-CA 3.44Å; S354-T362 PolarHBondContact N-O 2.83Å; S354-T362 PolarHBondContact O-N 3.41Å; S354-T362 PolarHBondContact O-OG1 2.88Å
355	W	98.7	Very high	98.3	Very high	6 Å²	6	42.7 Å²	42.7	2%	0.023	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	138.3	178.7	177.7	72.7	0	0	0	111.8	T31 T141 E144 E147 G148 W149 P357 G359 V361	T31-W355 PolarHBondContact OG1-NE1 3.26Å; T141-W355 HydrophobicContact CG2-CD2 3.65Å; T141-W355 VanDerWaalsContact CG2-CE2 3.46Å; T141-W355 HydrophobicContact CG2-CE3 4.04Å; T141-W355 HydrophobicContact CG2-CG 4.19Å; T141-W355 HydrophobicContact CG2-CH2 4Å; T141-W355 HydrophobicContact CG2-CZ2 3.64Å; T141-W355 HydrophobicContact CG2-CZ3 4.2Å; T141-W355 WeakPolarHBondContact O-CH2 3.16Å; T141-W355 WeakPolarHBondContact O-CZ2 3.28Å; E144-W355 HydrophobicContact CB-CH2 3.81Å; E144-W355 HydrophobicContact CB-CZ3 4.14Å; E144-W355 HydrophobicContact CG-CH2 4.12Å; E144-W355 HydrophobicContact CG-CZ3 4.08Å; E147-W355 WeakPolarHBondContact O-CZ3 3.37Å; G148-W355 CarbonylContact C-O 3.6Å; G148-W355 WeakPolarHBondContact CA-O 3.33Å; W149-W355 AromaticContact CD1-CE3 3.43Å; W149-W355 VanDerWaalsContact CD1-CE3 3.43Å; W149-W355 AromaticContact CD1-CZ3 3.94Å; W149-W355 HydrophobicContact CD2-CB 4.03Å; W149-W355 HydrophobicContact CD2-CE3 4.49Å; W149-W355 AromaticContact CE2-CE3 3.88Å; W149-W355 HydrophobicContact CE3-CB 4.27Å; W149-W355 HydrophobicContact CG-CE3 4.23Å; W149-W355 HydrophobicContact CH2-CB 3.89Å; W149-W355 HydrophobicContact CZ2-CB 3.62Å; W149-W355 HydrophobicContact CZ2-CD2 4.42Å; W149-W355 HydrophobicContact CZ2-CG 4.04Å; W149-W355 HydrophobicContact CZ3-CB 4.21Å; W149-W355 PolarHBondContact N-O 3.07Å; W149-W355 AromaticContact NE1-CD2 3.84Å; W149-W355 AromaticContact NE1-CE3 3.18Å; W149-W355 AromaticContact NE1-CZ3 3.83Å; W149-W355 PolarHBondContact O-N 3.26Å; W355-P357 HydrophobicContact CH2-CB 4.44Å; W355-P357 HydrophobicContact CH2-CG 4.04Å; W355-P357 HydrophobicContact CZ3-CG 4.35Å; W355-G359 VanDerWaalsContact CD1-O 3.31Å; W355-G359 PolarHBondContact NE1-O 3.35Å; W355-V361 HydrophobicContact CB-CG2 4.19Å; W355-V361 HydrophobicContact CG-CG2 4.3Å
356	E	98.4	Very high	98.3	Very high	95 Å²	95	41.3 Å²	41.3	44%	0.444	25%	0.25	S	C	.	.			trans	-129.5	149.3	171.1	-71.1	-63.9	155.6	0	0	109.6	G358 G359	E356-G358 PolarHBondContact O-N 3.44Å; E356-G359 PolarHBondContact O-N 2.95Å
357	P	98.2	Very high	98.3	Very high	46 Å²	46	44.5 Å²	44.5	30%	0.299	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	131	179	-32	37.6	0	0	0	114.5	W355 G359	W355-P357 HydrophobicContact CH2-CB 4.44Å; W355-P357 HydrophobicContact CH2-CG 4.04Å; W355-P357 HydrophobicContact CZ3-CG 4.35Å; P357-G359 VanDerWaalsContact C-N 3.28Å; P357-G359 PolarHBondContact O-N 3.43Å
358	G	96.5	Very high	98.2	Very high	85 Å²	85	46 Å²	46	88%	0.876	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-9.5	-179.2	0	0	0	0	0	115.2	E356	E356-G358 PolarHBondContact O-N 3.44Å
359	G	97.1	Very high	98.1	Very high	23 Å²	23	44 Å²	44	24%	0.237	28%	0.282	C	S	.	.	S	Bend	trans	-103	166.6	175.3	0	0	0	0	0	114	T31 W355 E356 P357	T31-G359 PolarHBondContact OG1-O 3.2Å; W355-G359 VanDerWaalsContact CD1-O 3.31Å; W355-G359 PolarHBondContact NE1-O 3.35Å; E356-G359 PolarHBondContact O-N 2.95Å; P357-G359 VanDerWaalsContact C-N 3.28Å; P357-G359 PolarHBondContact O-N 3.43Å
360	P	98.3	Very high	98	Very high	57 Å²	57	47 Å²	47	37%	0.37	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-75.1	164	166.4	35.2	-35.6	0	0	0	110.7	L29 T362	L29-P360 CarbonylContact O-C 3.59Å; L29-P360 VanDerWaalsContact O-CA 3.28Å; L29-P360 WeakPolarHBondContact O-CA 3.37Å; L29-P360 WeakPolarHBondContact O-CB 3.49Å; P360-T362 HydrophobicContact CG-CG2 4.42Å
361	V	98.7	Very high	97.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	129.9	164.2	-170.9	0	0	0	0	108.4	S28 L29 T31 W149 F330 F334 F353 S354 W355	S28-V361 CarbonylContact C-O 3.59Å; S28-V361 WeakPolarHBondContact CA-O 3.43Å; S28-V361 VanDerWaalsContact CB-O 3.3Å; S28-V361 WeakPolarHBondContact CB-O 3.39Å; L29-V361 HydrophobicContact CB-CB 4.11Å; L29-V361 HydrophobicContact CB-CG2 4.35Å; L29-V361 HydrophobicContact CD2-CG2 4.39Å; L29-V361 PolarHBondContact N-O 3.31Å; L29-V361 PolarHBondContact O-N 3.44Å; T31-V361 HydrophobicContact CG2-CG2 3.86Å; W149-V361 HydrophobicContact CH2-CG1 3.91Å; W149-V361 HydrophobicContact CH2-CG2 3.91Å; W149-V361 HydrophobicContact CZ2-CG2 4.17Å; W149-V361 HydrophobicContact CZ3-CG1 4.35Å; F330-V361 HydrophobicContact CE2-CG2 4.49Å; F330-V361 HydrophobicContact CZ-CG2 4.18Å; F334-V361 HydrophobicContact CD2-CG1 4.48Å; F334-V361 HydrophobicContact CD2-CG2 4.49Å; F334-V361 HydrophobicContact CE2-CG1 4.13Å; F353-V361 HydrophobicContact CB-CG1 3.94Å; F353-V361 HydrophobicContact CD1-CG1 4.12Å; S354-V361 WeakPolarHBondContact O-CA 3.44Å; W355-V361 HydrophobicContact CB-CG2 4.19Å; W355-V361 HydrophobicContact CG-CG2 4.3Å
362	T	98.5	Very high	97.9	Very high	69 Å²	69	50.8 Å²	50.8	42%	0.423	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	161.2	178.3	59.3	0	0	0	0	110.6	F353 S354 P360	F353-T362 CarbonylContact C-O 3.53Å; F353-T362 WeakPolarHBondContact CA-O 3.21Å; S354-T362 PolarHBondContact N-O 2.83Å; S354-T362 PolarHBondContact O-N 3.41Å; S354-T362 PolarHBondContact O-OG1 2.88Å; P360-T362 HydrophobicContact CG-CG2 4.42Å
363	V	98.4	Very high	97.9	Very high	38 Å²	38	51 Å²	51	23%	0.23	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.3	-175.9	-171.9	0	0	0	0	110.5	F337 T341 H351 L352 F353	F337-V363 HydrophobicContact CE1-CG2 3.64Å; F337-V363 HydrophobicContact CZ-CG2 3.61Å; T341-V363 HydrophobicContact CG2-CG1 3.91Å; T341-V363 HydrophobicContact CG2-CG2 4.28Å; H351-V363 HydrophobicContact CB-CG1 4.1Å; L352-V363 WeakPolarHBondContact O-CA 3.21Å; F353-V363 HydrophobicContact CD1-CG2 3.69Å; F353-V363 HydrophobicContact CE1-CG2 3.58Å; F353-V363 HydrophobicContact CZ-CG2 4.37Å
364	S	97.9	Very high	97.9	Very high	48 Å²	48	51.8 Å²	51.8	34%	0.336	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.5	165.2	56.2	0	0	0	0	110	H351 L352 H366	H351-S364 CarbonylContact C-O 3.47Å; H351-S364 WeakPolarHBondContact CA-O 3.47Å; L352-S364 PolarHBondContact N-O 3.37Å; L352-S364 PolarHBondContact O-N 2.95Å; L352-S364 VanDerWaalsContact O-N 3.09Å; S364-H366 PolarHBondContact OG-NE2 3.16Å
365	V	98.2	Very high	97.9	Very high	86 Å²	86	52 Å²	52	52%	0.521	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.8	-176.5	-174.7	0	0	0	0	109.5	L349 V350	L349-V365 HydrophobicContact CD1-CG1 3.69Å; L349-V365 HydrophobicContact CG-CG1 4.38Å; V350-V365 WeakPolarHBondContact O-CA 3.35Å
366	H	98.4	Very high	97.8	Very high	53 Å²	53	57.6 Å²	57.6	25%	0.245	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.3	-178.4	-54.3	-92	0	0	0	109.9	V350 S364 Y371	V350-H366 PolarHBondContact N-O 2.7Å; V350-H366 PolarHBondContact O-N 3.11Å; S364-H366 PolarHBondContact OG-NE2 3.16Å; H366-Y371 HydrophobicContact CB-CD2 3.57Å; H366-Y371 HydrophobicContact CB-CE2 4.26Å; H366-Y371 HydrophobicContact CB-CG 4.22Å; H366-Y371 AromaticContact CE1-CE2 3.58Å; H366-Y371 AromaticContact CG-CD2 3.42Å; H366-Y371 VanDerWaalsContact CG-CD2 3.42Å; H366-Y371 AromaticContact CG-CE2 3.64Å; H366-Y371 AromaticContact ND1-CD2 3.54Å; H366-Y371 AromaticContact ND1-CE2 3.27Å; H366-Y371 VanDerWaalsContact ND1-CE2 3.27Å; H366-Y371 WeakPolarHBondContact ND1-CE2 3.48Å
367	Q	97.7	Very high	97.7	Very high	110 Å²	110	57.8 Å²	57.8	51%	0.514	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.2	174.7	-168.5	169.4	33.2	0	0	109.2	R348	R348-Q367 HydrophobicContact CB-CG 4.49Å; R348-Q367 WeakPolarHBondContact O-CA 3.35Å
368	D	97.3	Very high	97.7	Very high	56 Å²	56	55.6 Å²	55.6	30%	0.299	34%	0.34	S	S	.	.	S	Bend	trans	59	-151.7	179	-58	-44.9	0	0	0	113.8	R348 Y371 A372	R348-D368 IonicContact CZ-OD1 3.68Å; R348-D368 VanDerWaalsContact CZ-OD1 3.27Å; R348-D368 IonicContact CZ-OD2 3.82Å; R348-D368 IonicContact NE-OD1 3.84Å; R348-D368 PolarHBondContact NE-OD1 3.45Å; R348-D368 IonicContact NE-OD2 3.27Å; R348-D368 IonicContact NH2-OD1 2.79Å; R348-D368 PolarHBondContact NH2-OD1 2.81Å; R348-D368 IonicContact NH2-OD2 2.8Å; R348-D368 PolarHBondContact NH2-OD2 2.94Å; R348-D368 PolarHBondContact O-N 2.92Å; D368-Y371 PolarHBondContact O-N 2.83Å; D368-Y371 VanDerWaalsContact O-N 3.16Å; D368-A372 WeakPolarHBondContact O-CB 3.16Å; D368-A372 PolarHBondContact O-N 2.79Å
369	A	95	Very high	97.8	Very high	91 Å²	91	52.9 Å²	52.9	75%	0.752	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	143.4	-178.4	0	0	0	0	0	111.8
370	P	96.4	Very high	97.8	Very high	86 Å²	86	57 Å²	57	56%	0.558	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.5	-5.5	4.9	35.4	-36	0	0	0	114.6	R102	R102-P370 PolarHBondContact NH1-O 2.83Å; R102-P370 PolarHBondContact NH2-O 2.74Å
371	Y	98.1	Very high	97.6	Very high	65 Å²	65	55.5 Å²	55.5	26%	0.255	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-31.9	-165.7	-62	-72.8	0	0	0	114.5	R102 V165 L352 H366 D368 F373	R102-Y371 PolarHBondContact NH1-O 2.81Å; V165-Y371 HydrophobicContact CG1-CD1 4.45Å; V165-Y371 HydrophobicContact CG1-CE1 4.32Å; V165-Y371 HydrophobicContact CG2-CD1 4.45Å; L352-Y371 HydrophobicContact CD1-CD1 4.32Å; L352-Y371 HydrophobicContact CD2-CD1 4.17Å; L352-Y371 HydrophobicContact CD2-CE1 3.69Å; H366-Y371 HydrophobicContact CB-CD2 3.57Å; H366-Y371 HydrophobicContact CB-CE2 4.26Å; H366-Y371 HydrophobicContact CB-CG 4.22Å; H366-Y371 AromaticContact CE1-CE2 3.58Å; H366-Y371 AromaticContact CG-CD2 3.42Å; H366-Y371 VanDerWaalsContact CG-CD2 3.42Å; H366-Y371 AromaticContact CG-CE2 3.64Å; H366-Y371 AromaticContact ND1-CD2 3.54Å; H366-Y371 AromaticContact ND1-CE2 3.27Å; H366-Y371 VanDerWaalsContact ND1-CE2 3.27Å; H366-Y371 WeakPolarHBondContact ND1-CE2 3.48Å; D368-Y371 PolarHBondContact O-N 2.83Å; D368-Y371 VanDerWaalsContact O-N 3.16Å; Y371-F373 PolarHBondContact O-N 3.05Å
372	A	98.3	Very high	97.4	Very high	28 Å²	28	56.1 Å²	56.1	23%	0.231	32%	0.315	C	S	.	.			trans	-57.3	126.5	177.2	0	0	0	0	0	109.4	R102 V350 D368	R102-A372 PolarHBondContact NH1-O 3.18Å; V350-A372 HydrophobicContact CG2-CB 4.29Å; D368-A372 WeakPolarHBondContact O-CB 3.16Å; D368-A372 PolarHBondContact O-N 2.79Å
373	F	98.6	Very high	97.2	Very high	8 Å²	8	56 Å²	56	4%	0.035	31%	0.314	C	S	.	.			trans	-127.2	-7.1	-167.5	65.7	-92.5	0	0	0	114.3	R102 L103 A152 Y371 P375	R102-F373 VanDerWaalsContact CD-CB 3.48Å; R102-F373 VanDerWaalsContact NH1-CA 3.33Å; R102-F373 VanDerWaalsContact NH1-CB 3.3Å; L103-F373 HydrophobicContact CD1-CD2 4.18Å; L103-F373 HydrophobicContact CD1-CE2 3.71Å; L103-F373 HydrophobicContact CG-CD2 4.41Å; L103-F373 HydrophobicContact CG-CE2 4.4Å; A152-F373 HydrophobicContact CB-CD1 3.77Å; A152-F373 HydrophobicContact CB-CE1 3.81Å; Y371-F373 PolarHBondContact O-N 3.05Å; F373-P375 VanDerWaalsContact O-CD 3.3Å; F373-P375 WeakPolarHBondContact O-CD 3.5Å
374	L	98.6	Very high	96.5	Very high	16 Å²	16	61.6 Å²	61.6	8%	0.084	34%	0.338	C	S	.	.	S	Bend	trans	-80.5	112.9	170.9	-66.3	179.4	0	0	0	108.2	L107 F156 Y161 P347 Y378 V379	L107-L374 HydrophobicContact CD1-CD2 3.88Å; L107-L374 HydrophobicContact CD2-CD2 4.38Å; F156-L374 HydrophobicContact CB-CD1 3.65Å; F156-L374 HydrophobicContact CD1-CD1 4.23Å; F156-L374 HydrophobicContact CG-CD1 4.19Å; Y161-L374 HydrophobicContact CD1-CD2 3.91Å; Y161-L374 HydrophobicContact CD2-CD1 3.93Å; Y161-L374 HydrophobicContact CD2-CD2 4.17Å; Y161-L374 HydrophobicContact CE1-CD2 4.35Å; Y161-L374 HydrophobicContact CE2-CD1 4.27Å; Y161-L374 HydrophobicContact CG-CD1 4.37Å; Y161-L374 HydrophobicContact CG-CD2 3.83Å; P347-L374 HydrophobicContact CB-CB 4.2Å; P347-L374 HydrophobicContact CB-CD1 3.75Å; L374-Y378 HydrophobicContact CD2-CD1 4.39Å; L374-V379 HydrophobicContact CB-CG2 4Å
375	P	98	Very high	95	Very high	25 Å²	25	63.8 Å²	63.8	16%	0.162	35%	0.346	C	S	.	.			trans	-73.8	152.3	-173.9	30.3	-34.5	0	0	0	111.4	L107 F373 W377 Y378 V379	L107-P375 HydrophobicContact CD1-CG 4.21Å; F373-P375 VanDerWaalsContact O-CD 3.3Å; F373-P375 WeakPolarHBondContact O-CD 3.5Å; P375-W377 VanDerWaalsContact C-N 3.27Å; P375-W377 HydrophobicContact CB-CD2 4.34Å; P375-W377 HydrophobicContact CB-CG 4.28Å; P375-W377 HydrophobicContact CB-CZ2 4.28Å; P375-W377 VanDerWaalsContact CB-NE1 3.3Å; P375-W377 HydrophobicContact CG-CD2 3.9Å; P375-W377 HydrophobicContact CG-CG 4.36Å; P375-W377 HydrophobicContact CG-CH2 4.09Å; P375-W377 HydrophobicContact CG-CZ2 3.32Å; P375-W377 VanDerWaalsContact CG-NE1 3.35Å; P375-W377 PolarHBondContact O-N 3.11Å; P375-Y378 WeakPolarHBondContact O-CB 3.21Å; P375-Y378 PolarHBondContact O-N 2.86Å; P375-V379 PolarHBondContact O-N 2.96Å; P375-V379 VanDerWaalsContact O-N 3.12Å
376	I	97.2	Very high	93.2	Very high	125 Å²	125	64.6 Å²	64.6	64%	0.641	35%	0.347	S	S	*	.	H	α-helix	trans	-54.7	-42.7	-176.5	-66.1	172.8	0	0	0	111.4	Y378 V379 E380	I376-Y378 PolarHBondContact O-N 3.32Å; I376-V379 PolarHBondContact O-N 3.04Å; I376-E380 HydrophobicContact CG2-CG 3.87Å; I376-E380 VanDerWaalsContact CG2-OE1 3.22Å; I376-E380 WeakPolarHBondContact CG2-OE1 3.41Å; I376-E380 WeakPolarHBondContact O-CB 3.22Å; I376-E380 WeakPolarHBondContact O-CG 3.39Å; I376-E380 PolarHBondContact O-N 3.43Å
377	W	97.5	Very high	91.1	Very high	98 Å²	98	67.7 Å²	67.7	37%	0.371	37%	0.371	S	S	.	.	H	α-helix	trans	-59	-34.2	179	59.9	-105.6	0	0	0	113	D104 L107 C108 L111 P375 A381	D104-W377 HydrophobicContact CB-CZ2 4.24Å; L107-W377 HydrophobicContact CB-CH2 3.58Å; L107-W377 HydrophobicContact CB-CZ2 4.45Å; L107-W377 HydrophobicContact CB-CZ3 4.22Å; C108-W377 VanDerWaalsContact SG-CH2 3.55Å; L111-W377 HydrophobicContact CD1-CE3 3.6Å; L111-W377 HydrophobicContact CD1-CZ3 3.46Å; L111-W377 VanDerWaalsContact CD1-CZ3 3.46Å; L111-W377 HydrophobicContact CG-CZ3 4.23Å; P375-W377 VanDerWaalsContact C-N 3.27Å; P375-W377 HydrophobicContact CB-CD2 4.34Å; P375-W377 HydrophobicContact CB-CG 4.28Å; P375-W377 HydrophobicContact CB-CZ2 4.28Å; P375-W377 VanDerWaalsContact CB-NE1 3.3Å; P375-W377 HydrophobicContact CG-CD2 3.9Å; P375-W377 HydrophobicContact CG-CG 4.36Å; P375-W377 HydrophobicContact CG-CH2 4.09Å; P375-W377 HydrophobicContact CG-CZ2 3.32Å; P375-W377 VanDerWaalsContact CG-NE1 3.35Å; P375-W377 PolarHBondContact O-N 3.11Å; W377-A381 VanDerWaalsContact O-CB 3.25Å; W377-A381 WeakPolarHBondContact O-CB 3.29Å; W377-A381 PolarHBondContact O-N 2.96Å
378	Y	98.1	Very high	88.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-74.6	-47.9	177.9	-178.8	-102.2	0	0	0	110.7	L107 L110 L111 F156 Y161 L374 P375 I376 A381 M382	L107-Y378 HydrophobicContact CB-CD2 3.74Å; L107-Y378 HydrophobicContact CB-CE2 4.08Å; L107-Y378 HydrophobicContact CB-CG 4.21Å; L107-Y378 HydrophobicContact CD1-CD1 4.33Å; L107-Y378 HydrophobicContact CD1-CG 4.18Å; L107-Y378 HydrophobicContact CD2-CD1 4.31Å; L107-Y378 HydrophobicContact CD2-CD2 4.23Å; L107-Y378 HydrophobicContact CD2-CE1 4.01Å; L107-Y378 HydrophobicContact CD2-CE2 3.96Å; L107-Y378 HydrophobicContact CD2-CG 4.42Å; L107-Y378 HydrophobicContact CG-CD2 4.37Å; L110-Y378 HydrophobicContact CD2-CE2 4.37Å; L110-Y378 WeakPolarHBondContact CD2-OH 3.22Å; L111-Y378 HydrophobicContact CD1-CD2 3.99Å; L111-Y378 HydrophobicContact CD2-CD2 3.64Å; L111-Y378 HydrophobicContact CD2-CE2 3.64Å; L111-Y378 HydrophobicContact CG-CD2 3.55Å; L111-Y378 HydrophobicContact CG-CE2 3.78Å; F156-Y378 HydrophobicContact CD1-CD1 4.38Å; F156-Y378 AromaticContact CD1-CE1 3.95Å; F156-Y378 HydrophobicContact CD1-CE1 3.95Å; F156-Y378 HydrophobicContact CE1-CD1 4.18Å; F156-Y378 AromaticContact CE1-CE1 3.95Å; F156-Y378 HydrophobicContact CE1-CE1 3.95Å; Y161-Y378 HydrophobicContact CE1-CE1 4.11Å; Y161-Y378 AromaticContact CZ-CE1 3.9Å; Y161-Y378 PolarHBondContact OH-OH 2.91Å; L374-Y378 HydrophobicContact CD2-CD1 4.39Å; P375-Y378 WeakPolarHBondContact O-CB 3.21Å; P375-Y378 PolarHBondContact O-N 2.86Å; I376-Y378 PolarHBondContact O-N 3.32Å; Y378-A381 PolarHBondContact O-N 3.38Å; Y378-M382 HydrophobicContact CD1-CG 4.33Å; Y378-M382 HydrophobicContact CD2-CG 4.34Å; Y378-M382 HydrophobicContact CE1-CG 3.92Å; Y378-M382 HydrophobicContact CE2-CG 3.91Å; Y378-M382 HydrophobicContact CE2-SD 4.29Å; Y378-M382 WeakPolarHBondContact O-CB 3.24Å; Y378-M382 VanDerWaalsContact O-CG 3.3Å; Y378-M382 WeakPolarHBondContact O-CG 3.37Å; Y378-M382 PolarHBondContact O-N 3.16Å
379	V	97.7	Very high	86.1	Confident	28 Å²	28	70.1 Å²	70.1	17%	0.17	40%	0.403	C	S	.	.	H	α-helix	trans	-62.3	-45.7	-178.5	175.6	0	0	0	0	111	F156 P347 L374 P375 I376 T383	F156-V379 HydrophobicContact CE1-CG2 4.39Å; F156-V379 HydrophobicContact CE2-CG1 4.04Å; F156-V379 HydrophobicContact CZ-CB 4.27Å; F156-V379 HydrophobicContact CZ-CG1 3.92Å; F156-V379 HydrophobicContact CZ-CG2 4.45Å; P347-V379 HydrophobicContact CB-CG1 4.46Å; P347-V379 HydrophobicContact CB-CG2 3.74Å; P347-V379 HydrophobicContact CG-CG1 3.88Å; P347-V379 HydrophobicContact CG-CG2 4.07Å; L374-V379 HydrophobicContact CB-CG2 4Å; P375-V379 PolarHBondContact O-N 2.96Å; P375-V379 VanDerWaalsContact O-N 3.12Å; I376-V379 PolarHBondContact O-N 3.04Å; V379-T383 VanDerWaalsContact O-CB 3.31Å; V379-T383 WeakPolarHBondContact O-CB 3.4Å; V379-T383 PolarHBondContact O-N 2.96Å; V379-T383 PolarHBondContact O-OG1 3.41Å
380	E	96.6	Very high	83.6	Confident	110 Å²	110	71.5 Å²	71.5	51%	0.514	40%	0.404	S	S	.	.	H	α-helix	trans	-63.2	-48	178.2	-72.8	178.9	168.5	0	0	111.6	I376 M382 T383 Q384	I376-E380 HydrophobicContact CG2-CG 3.87Å; I376-E380 VanDerWaalsContact CG2-OE1 3.22Å; I376-E380 WeakPolarHBondContact CG2-OE1 3.41Å; I376-E380 WeakPolarHBondContact O-CB 3.22Å; I376-E380 WeakPolarHBondContact O-CG 3.39Å; I376-E380 PolarHBondContact O-N 3.43Å; E380-M382 PolarHBondContact O-N 3.32Å; E380-T383 PolarHBondContact O-N 3.23Å; E380-Q384 WeakPolarHBondContact O-CG 3.47Å; E380-Q384 PolarHBondContact O-N 3.24Å
381	A	95.6	Very high	81.3	Confident	25 Å²	25	77.1 Å²	77.1	21%	0.207	42%	0.419	C	S	.	.	H	α-helix	trans	-61	-43.7	179.8	0	0	0	0	0	112.4	L111 W377 Y378 T383	L111-A381 HydrophobicContact CD1-CB 3.95Å; L111-A381 HydrophobicContact CD2-CB 3.88Å; W377-A381 VanDerWaalsContact O-CB 3.25Å; W377-A381 WeakPolarHBondContact O-CB 3.29Å; W377-A381 PolarHBondContact O-N 2.96Å; Y378-A381 PolarHBondContact O-N 3.38Å; A381-T383 VanDerWaalsContact C-N 3.32Å; A381-T383 PolarHBondContact O-N 3.16Å
382	M	94	Very high	79	Confident	14 Å²	14	80.1 Å²	80.1	7%	0.069	44%	0.444	C	S	.	.	H	α-helix	trans	-69.8	-28.1	177.5	-69.4	-67.6	-73.9	0	0	112.9	L111 L124 F156 Q157 Y378 E380	L111-M382 HydrophobicContact CD2-CG 3.75Å; L111-M382 HydrophobicContact CD2-SD 3.71Å; L124-M382 HydrophobicContact CD2-CE 4.14Å; F156-M382 HydrophobicContact CE1-CB 3.63Å; F156-M382 HydrophobicContact CE1-CG 4.07Å; F156-M382 HydrophobicContact CZ-CB 3.82Å; Q157-M382 PolarHBondContact NE2-O 2.83Å; Y378-M382 HydrophobicContact CD1-CG 4.33Å; Y378-M382 HydrophobicContact CD2-CG 4.34Å; Y378-M382 HydrophobicContact CE1-CG 3.92Å; Y378-M382 HydrophobicContact CE2-CG 3.91Å; Y378-M382 HydrophobicContact CE2-SD 4.29Å; Y378-M382 WeakPolarHBondContact O-CB 3.24Å; Y378-M382 VanDerWaalsContact O-CG 3.3Å; Y378-M382 WeakPolarHBondContact O-CG 3.37Å; Y378-M382 PolarHBondContact O-N 3.16Å; E380-M382 PolarHBondContact O-N 3.32Å
383	T	92.8	Very high	76.6	Confident	65 Å²	65	84.2 Å²	84.2	40%	0.399	47%	0.469	S	S	.	.	H	α-helix	trans	-78.8	-36.5	-179.8	-57.8	0	0	0	0	112.1	V379 E380 A381 D385 L386	V379-T383 VanDerWaalsContact O-CB 3.31Å; V379-T383 WeakPolarHBondContact O-CB 3.4Å; V379-T383 PolarHBondContact O-N 2.96Å; V379-T383 PolarHBondContact O-OG1 3.41Å; E380-T383 PolarHBondContact O-N 3.23Å; A381-T383 VanDerWaalsContact C-N 3.32Å; A381-T383 PolarHBondContact O-N 3.16Å; T383-D385 PolarHBondContact O-N 3.47Å; T383-L386 HydrophobicContact CG2-CD1 4.42Å; T383-L386 PolarHBondContact O-N 2.87Å
384	Q	84.8	Confident	74.5	Confident	156 Å²	156	89 Å²	89	73%	0.729	50%	0.503	S	S	*	.	H	α-helix	trans	-63.2	-27	179.1	-73.4	175.2	16.4	0	0	113.2	E380 L386	E380-Q384 WeakPolarHBondContact O-CG 3.47Å; E380-Q384 PolarHBondContact O-N 3.24Å; Q384-L386 VanDerWaalsContact C-N 3.3Å; Q384-L386 PolarHBondContact O-N 3.26Å
385	D	66.8	Low	72.9	Confident	95 Å²	95	94.3 Å²	94.3	51%	0.508	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-0.7	-178.7	-77.2	-15	0	0	0	114.6	R114 T383 P387	R114-D385 IonicContact CZ-OD2 3.09Å; R114-D385 IonicContact NE-OD2 2.7Å; R114-D385 PolarHBondContact NE-OD2 3.01Å; R114-D385 IonicContact NH2-OD1 2.66Å; R114-D385 IonicContact NH2-OD2 3.42Å; R114-D385 PolarHBondContact NH2-OD2 2.77Å; T383-D385 PolarHBondContact O-N 3.47Å; D385-P387 WeakPolarHBondContact O-CD 3.47Å
386	L	60.5	Low	70.8	Confident	103 Å²	103	106.6 Å²	106.6	54%	0.539	59%	0.59	S	S	.	*	S	Bend	trans	-67.8	125.2	174.8	-75.9	163	0	0	0	109.7	T383 Q384 S388	T383-L386 HydrophobicContact CG2-CD1 4.42Å; T383-L386 PolarHBondContact O-N 2.87Å; Q384-L386 VanDerWaalsContact C-N 3.3Å; Q384-L386 PolarHBondContact O-N 3.26Å; L386-S388 PolarHBondContact O-N 2.99Å; L386-S388 VanDerWaalsContact O-N 3.16Å
387	P	53.6	Low	69.5	Low	117 Å²	117	105.7 Å²	105.7	76%	0.76	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-56.2	127.7	169.6	22.2	-30	0	0	0	108	D385	D385-P387 WeakPolarHBondContact O-CD 3.47Å
388	S	41.7	Very low	68	Low	107 Å²	107	106.1 Å²	106.1	75%	0.748	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-49.5	136.3	177	-45.1	0	0	0	0	108.8	L386	L386-S388 PolarHBondContact O-N 2.99Å; L386-S388 VanDerWaalsContact O-N 3.16Å
389	P	48.2	Very low	66.3	Low	111 Å²	111	111.9 Å²	111.9	72%	0.721	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-53.3	138.9	176.2	21.7	-31.2	0	0	0	108.3	K391	P389-K391 PolarHBondContact O-N 2.88Å
390	P	43.2	Very low	64.5	Low	120 Å²	120	116.9 Å²	116.9	78%	0.779	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-53.9	121.2	179.8	20.2	-29.6	0	0	0	107.8	T392	P390-T392 PolarHBondContact O-N 3.06Å
391	K	46.5	Very low	62.5	Low	204 Å²	204	117.3 Å²	117.3	89%	0.887	67%	0.668	S	S	*	*			trans	-55.7	108.2	173.8	-76.2	-176.9	178.7	178.6	0	106.7	P389 P393	P389-K391 PolarHBondContact O-N 2.88Å; K391-P393 WeakPolarHBondContact O-CD 3.45Å; K391-P393 VanDerWaalsContact O-N 3.16Å
392	T	50.3	Low	60.3	Low	127 Å²	127	123.5 Å²	123.5	78%	0.779	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-55.4	121.9	169.4	-26.7	0	0	0	0	106.3	P390 S394	P390-T392 PolarHBondContact O-N 3.06Å; T392-S394 PolarHBondContact O-N 3.12Å; T392-S394 VanDerWaalsContact O-N 3.13Å
393	P	49	Very low	57.9	Low	114 Å²	114	131.3 Å²	131.3	74%	0.74	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-63	121.9	173.8	24.6	-29.2	0	0	0	106.9	K391	K391-P393 WeakPolarHBondContact O-CD 3.45Å; K391-P393 VanDerWaalsContact O-N 3.16Å
394	S	54.4	Low	55.2	Low	109 Å²	109	136.4 Å²	136.4	76%	0.762	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-53.4	129.2	171.3	-53.3	0	0	0	0	108.3	T392 K396	T392-S394 PolarHBondContact O-N 3.12Å; T392-S394 VanDerWaalsContact O-N 3.13Å; S394-K396 PolarHBondContact O-N 3Å
395	P	63.7	Low	52.7	Low	128 Å²	128	134.8 Å²	134.8	83%	0.831	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.7	134.5	174.1	21.8	-23.6	0	0	0	108.6
396	K	54.7	Low	51.4	Low	282 Å²	282	138.4 Å²	138.4	100%	1.226	80%	0.798	S	S	*	*			trans	-64.6	0	169.9	-82.9	-174.2	175.5	-179	0	111.4	S394	S394-K396 PolarHBondContact O-N 3Å

Retrieved 396 of 396 residues in 660 ms (Link to these results)

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