A0A3Q0KSH5_SCHMA Loading...

Core 1 udp-galactose:n-acetylgalactosamine-alpha-r beta 1,3-galactosyltransferase, putative

AlphaFold DB , UniProt , Accession A0A3Q0KSH5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 319 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	51.8	Low	250 Å²	250	130.5 Å²	130.5	100%	1.232	65%	0.647	S	S	*	*				0	30.7	0	-79.5	-170.5	164.6	0	0	112.1
2	Q	43.6	Very low	51.9	Low	176 Å²	176	123.8 Å²	123.8	82%	0.822	64%	0.635	S	S	*	*			trans	-113.8	132.3	-179.2	-82.8	162.7	-37.9	0	0	107.7
3	N	51.7	Low	52.2	Low	125 Å²	125	117.4 Å²	117.4	67%	0.668	61%	0.605	S	S	*	*			trans	117.5	7.7	161.2	-52.6	-15	0	0	0	119.3	E5	N3-E5 VanDerWaalsContact C-N 3.29Å; N3-E5 PolarHBondContact O-N 3Å
4	D	54	Low	52.4	Low	78 Å²	78	109.9 Å²	109.9	42%	0.417	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-81.7	2.4	177.9	-82.8	0.2	0	0	0	114.8	S272	D4-S272 VanDerWaalsContact OD2-CB 3.23Å; D4-S272 WeakPolarHBondContact OD2-CB 3.07Å; D4-S272 PolarHBondContact OD2-OG 3.1Å
5	E	54	Low	52.8	Low	157 Å²	157	108.8 Å²	108.8	73%	0.734	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-82	-10.5	-177.7	-80.2	-175.1	153.3	0	0	115.1	N3 F7 K8	N3-E5 VanDerWaalsContact C-N 3.29Å; N3-E5 PolarHBondContact O-N 3Å; E5-F7 PolarHBondContact O-N 3.41Å; E5-K8 PolarHBondContact O-N 3.36Å
6	I	55.7	Low	53.2	Low	125 Å²	125	104.3 Å²	104.3	64%	0.641	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-63.5	-19	-170.7	-60.3	168.1	0	0	0	112.7
7	F	54.7	Low	53.5	Low	18 Å²	18	106.5 Å²	106.5	8%	0.079	54%	0.538	C	S	.	.	G	3₁₀ helix	trans	-96	-7.1	-178.9	-79	-111.9	0	0	0	113.8	E5 T9 G14 H16 Y267 Q269 P270	E5-F7 PolarHBondContact O-N 3.41Å; F7-T9 PolarHBondContact O-N 2.89Å; F7-G14 WeakPolarHBondContact O-CA 3.33Å; F7-G14 PolarHBondContact O-N 3.08Å; F7-H16 AromaticContact CE1-CE1 3.88Å; F7-H16 AromaticContact CE1-NE2 3.69Å; F7-Y267 VanDerWaalsContact CD1-OH 3.27Å; F7-Y267 WeakPolarHBondContact CD1-OH 3.41Å; F7-Y267 HydrophobicContact CE1-CE1 4.01Å; F7-Y267 AromaticContact CE1-CZ 3.56Å; F7-Y267 WeakPolarHBondContact CE1-OH 3.43Å; F7-Y267 HydrophobicContact CE2-CE1 4.31Å; F7-Y267 AromaticContact CE2-CE2 3.89Å; F7-Y267 HydrophobicContact CE2-CE2 3.89Å; F7-Y267 AromaticContact CE2-CZ 3.54Å; F7-Y267 VanDerWaalsContact CE2-OH 3.28Å; F7-Y267 WeakPolarHBondContact CE2-OH 3.05Å; F7-Y267 AromaticContact CZ-CE1 3.52Å; F7-Y267 HydrophobicContact CZ-CE1 3.52Å; F7-Y267 AromaticContact CZ-CE2 3.91Å; F7-Y267 HydrophobicContact CZ-CE2 3.91Å; F7-Y267 AromaticContact CZ-CZ 3.08Å; F7-Y267 WeakPolarHBondContact CZ-OH 3.34Å; F7-Q269 HydrophobicContact CE1-CG 4.07Å; F7-Q269 HydrophobicContact CZ-CB 4.49Å; F7-Q269 HydrophobicContact CZ-CG 3.65Å; F7-P270 HydrophobicContact CD2-CG 3.74Å; F7-P270 HydrophobicContact CE2-CG 3.37Å; F7-P270 HydrophobicContact CZ-CG 4.07Å
8	K	53.5	Low	53.9	Low	134 Å²	134	108.8 Å²	108.8	58%	0.583	54%	0.539	S	S	*	.			trans	-91.5	110.2	-177.2	-69.9	179.7	-178.8	174.7	0	109.2	E5	E5-K8 PolarHBondContact O-N 3.36Å
9	T	57.2	Low	54.5	Low	52 Å²	52	111.8 Å²	111.8	32%	0.319	55%	0.548	S	S	.	.			trans	-62.1	169.7	158.6	58	0	0	0	0	109.6	F7 Y11 G12 V13	F7-T9 PolarHBondContact O-N 2.89Å; T9-Y11 PolarHBondContact O-N 3.14Å; T9-G12 PolarHBondContact O-N 3.28Å; T9-V13 WeakPolarHBondContact CB-O 3.32Å; T9-V13 WeakPolarHBondContact CG2-O 3.41Å; T9-V13 PolarHBondContact N-O 3.41Å; T9-V13 PolarHBondContact OG1-O 3.35Å
10	S	52.1	Low	55	Low	118 Å²	118	107.2 Å²	107.2	83%	0.825	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-16.4	176.2	48.7	0	0	0	0	114.6
11	Y	51.8	Low	55.6	Low	203 Å²	203	107.7 Å²	107.7	80%	0.796	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	6.7	175.2	-65.8	-80.2	0	0	0	114.7	T9 V13	T9-Y11 PolarHBondContact O-N 3.14Å; Y11-V13 PolarHBondContact O-N 3.39Å
12	G	52.9	Low	56.8	Low	49 Å²	49	101.7 Å²	101.7	51%	0.505	50%	0.495	S	S	.	.	S	Bend	trans	71.3	15.3	-178.8	0	0	0	0	0	114.6	T9	T9-G12 PolarHBondContact O-N 3.28Å
13	V	55.6	Low	57.8	Low	41 Å²	41	99.2 Å²	99.2	25%	0.248	48%	0.481	C	S	.	.			trans	-112.4	129.1	-178.4	179.9	0	0	0	0	109.6	T9 Y11 C281	T9-V13 WeakPolarHBondContact CB-O 3.32Å; T9-V13 WeakPolarHBondContact CG2-O 3.41Å; T9-V13 PolarHBondContact N-O 3.41Å; T9-V13 PolarHBondContact OG1-O 3.35Å; Y11-V13 PolarHBondContact O-N 3.39Å; V13-C281 HydrophobicContact CG1-CB 3.83Å
14	G	55.5	Low	58.6	Low	13 Å²	13	94 Å²	94	13%	0.134	46%	0.455	C	S	.	.			trans	-92.3	123.9	174.4	0	0	0	0	0	112.4	F7	F7-G14 WeakPolarHBondContact O-CA 3.33Å; F7-G14 PolarHBondContact O-N 3.08Å
15	H	58.1	Low	59.4	Low	93 Å²	93	93.8 Å²	93.8	43%	0.431	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120	172.7	-70.9	-72.6	0	0	0	109.8	T283	H15-T283 PolarHBondContact ND1-OG1 3.47Å
16	H	59.1	Low	60.1	Low	37 Å²	37	90.8 Å²	90.8	17%	0.171	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.6	176.4	-111.9	-58.9	0	0	0	110.2	F7 R18 Q269 L280	F7-H16 AromaticContact CE1-CE1 3.88Å; F7-H16 AromaticContact CE1-NE2 3.69Å; H16-R18 PolarHBondContact O-N 3.06Å; H16-Q269 PolarHBondContact CE1-NE2 3.43Å; H16-Q269 PolarHBondContact NE2-NE2 3.08Å; H16-Q269 VanDerWaalsContact NE2-NE2 3.18Å; H16-L280 HydrophobicContact CB-CD2 4.06Å; H16-L280 WeakPolarHBondContact CD2-CD2 3.4Å
17	W	58.7	Low	60.8	Low	141 Å²	141	89.9 Å²	89.9	53%	0.534	45%	0.446	S	S	.	.			trans	-65.2	129.3	169.1	-178.1	85.7	0	0	0	109.7	K19 Y263	W17-K19 HydrophobicContact CH2-CB 4.01Å; W17-K19 HydrophobicContact CH2-CG 4.26Å; W17-K19 HydrophobicContact CZ3-CB 4.33Å; W17-Y263 HydrophobicContact CB-CE1 4.45Å
18	R	59.7	Low	61.6	Low	149 Å²	149	91.4 Å²	91.4	56%	0.562	46%	0.457	S	S	*	.			trans	-111.5	146.7	168.1	-72	-176.2	173.6	168.3	-0.6	108.4	H16 G20 T285	H16-R18 PolarHBondContact O-N 3.06Å; R18-G20 PolarHBondContact O-N 2.92Å; R18-T285 HydrophobicContact CB-CG2 4.42Å; R18-T285 WeakPolarHBondContact O-CG2 3.37Å
19	K	65.2	Low	62.2	Low	165 Å²	165	87 Å²	87	72%	0.717	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-58.7	140	170.1	-167.2	171.9	-178.3	174.2	0	108.7	W17	W17-K19 HydrophobicContact CH2-CB 4.01Å; W17-K19 HydrophobicContact CH2-CG 4.26Å; W17-K19 HydrophobicContact CZ3-CB 4.33Å
20	G	65.5	Low	62.6	Low	19 Å²	19	86.7 Å²	86.7	20%	0.196	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-53	140.2	173.1	0	0	0	0	0	110.6	R18	R18-G20 PolarHBondContact O-N 2.92Å
21	F	66.8	Low	63.3	Low	119 Å²	119	87.9 Å²	87.9	52%	0.522	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-98.9	141.6	177.4	60.5	-85.9	0	0	0	109.7	T288	F21-T288 PolarHBondContact O-OG1 3.06Å
22	Y	66.8	Low	63.9	Low	123 Å²	123	80.5 Å²	80.5	48%	0.482	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-75.7	139.1	170.7	-60.4	-72.9	0	0	0	109.5	P24 D25 P290	Y22-P24 CarbonylContact O-C 3.46Å; Y22-D25 WeakPolarHBondContact O-CA 3.31Å; Y22-D25 PolarHBondContact O-N 3.03Å; Y22-P290 HydrophobicContact CD1-CB 4.35Å; Y22-P290 HydrophobicContact CE1-CB 4.37Å
23	F	65	Low	64.2	Low	124 Å²	124	81.6 Å²	81.6	54%	0.544	41%	0.406	S	S	.	.	S	Bend	trans	-113.2	131.9	167.3	-179.1	-91.6	0	0	0	108.9	F287	F23-F287 HydrophobicContact CB-CD2 3.41Å; F23-F287 VanDerWaalsContact CB-CD2 3.41Å; F23-F287 HydrophobicContact CB-CE2 3.37Å; F23-F287 HydrophobicContact CB-CG 4.34Å; F23-F287 HydrophobicContact CB-CZ 4.21Å; F23-F287 WeakPolarHBondContact O-CE2 3.43Å
24	P	68	Low	64.4	Low	17 Å²	17	86.5 Å²	86.5	11%	0.11	42%	0.424	C	S	.	.	S	Bend	cis	-67.6	153.9	-10.8	30	-36.3	0	0	0	111.4	Y22 T28 M29 L32 H298	Y22-P24 CarbonylContact O-C 3.46Å; P24-T28 VanDerWaalsContact CB-OG1 3.3Å; P24-T28 WeakPolarHBondContact CB-OG1 3.34Å; P24-M29 HydrophobicContact CG-CE 3.7Å; P24-M29 HydrophobicContact CG-CG 4.04Å; P24-M29 HydrophobicContact CG-SD 3.83Å; P24-L32 HydrophobicContact CG-CD1 4.3Å; P24-H298 WeakPolarHBondContact CD-CD2 3.42Å; P24-H298 WeakPolarHBondContact CD-NE2 2.74Å
25	D	72.3	Confident	64.3	Low	73 Å²	73	96.3 Å²	96.3	39%	0.39	46%	0.457	S	S	.	.			trans	-60.4	159.1	-175.3	76.2	-18.9	0	0	0	111.9	Y22 N27 T28 M29	Y22-D25 WeakPolarHBondContact O-CA 3.31Å; Y22-D25 PolarHBondContact O-N 3.03Å; D25-N27 PolarHBondContact O-N 3.37Å; D25-N27 VanDerWaalsContact O-N 3.09Å; D25-T28 PolarHBondContact N-OG1 3.04Å; D25-T28 VanDerWaalsContact N-OG1 3.1Å; D25-T28 PolarHBondContact O-N 2.82Å; D25-T28 VanDerWaalsContact O-N 3.14Å; D25-T28 PolarHBondContact O-OG1 3.14Å; D25-T28 WeakPolarHBondContact OD1-CA 3.29Å; D25-T28 WeakPolarHBondContact OD1-CB 3.27Å; D25-T28 WeakPolarHBondContact OD1-CG2 3.42Å; D25-T28 PolarHBondContact OD1-N 2.85Å; D25-T28 PolarHBondContact OD1-OG1 2.74Å; D25-M29 PolarHBondContact O-N 2.97Å
26	S	68.6	Low	64.2	Low	93 Å²	93	98.6 Å²	98.6	65%	0.65	47%	0.468	S	S	*	.	H	α-helix	trans	-57.5	-31	-176.8	55.2	0	0	0	0	113	A30	S26-A30 WeakPolarHBondContact O-CB 3.47Å; S26-A30 PolarHBondContact O-N 2.93Å
27	N	70.6	Confident	64	Low	107 Å²	107	98.6 Å²	98.6	57%	0.572	47%	0.47	S	S	*	.	H	α-helix	trans	-72.1	-44.3	177.4	-70.9	-30.9	0	0	0	112.6	D25 M29 A30 K31	D25-N27 PolarHBondContact O-N 3.37Å; D25-N27 VanDerWaalsContact O-N 3.09Å; N27-M29 VanDerWaalsContact C-N 3.33Å; N27-A30 PolarHBondContact O-N 3.49Å; N27-K31 WeakPolarHBondContact O-CG 3.42Å; N27-K31 PolarHBondContact O-N 2.89Å
28	T	70.8	Confident	63.8	Low	50 Å²	50	101.7 Å²	101.7	31%	0.307	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-37.8	173	52.9	0	0	0	0	110.5	P24 D25 A30 K31 L32	P24-T28 VanDerWaalsContact CB-OG1 3.3Å; P24-T28 WeakPolarHBondContact CB-OG1 3.34Å; D25-T28 PolarHBondContact N-OG1 3.04Å; D25-T28 VanDerWaalsContact N-OG1 3.1Å; D25-T28 PolarHBondContact O-N 2.82Å; D25-T28 VanDerWaalsContact O-N 3.14Å; D25-T28 PolarHBondContact O-OG1 3.14Å; D25-T28 WeakPolarHBondContact OD1-CA 3.29Å; D25-T28 WeakPolarHBondContact OD1-CB 3.27Å; D25-T28 WeakPolarHBondContact OD1-CG2 3.42Å; D25-T28 PolarHBondContact OD1-N 2.85Å; D25-T28 PolarHBondContact OD1-OG1 2.74Å; T28-A30 VanDerWaalsContact C-N 3.32Å; T28-A30 PolarHBondContact O-N 3.01Å; T28-K31 CarbonylContact O-C 3.53Å; T28-K31 WeakPolarHBondContact O-CB 3.5Å; T28-K31 PolarHBondContact O-N 3.23Å; T28-K31 VanDerWaalsContact O-N 3.08Å; T28-L32 WeakPolarHBondContact O-CB 3.43Å; T28-L32 VanDerWaalsContact O-CG 3.24Å; T28-L32 WeakPolarHBondContact O-CG 3.23Å; T28-L32 PolarHBondContact O-N 2.83Å
29	M	66.4	Low	63.8	Low	42 Å²	42	95.9 Å²	95.9	21%	0.207	46%	0.464	C	S	.	.	H	α-helix	trans	-58.1	-42.6	171.2	-79.6	-66	-156.2	0	0	112.6	P24 D25 N27 K31 L32 S33 L296	P24-M29 HydrophobicContact CG-CE 3.7Å; P24-M29 HydrophobicContact CG-CG 4.04Å; P24-M29 HydrophobicContact CG-SD 3.83Å; D25-M29 PolarHBondContact O-N 2.97Å; N27-M29 VanDerWaalsContact C-N 3.33Å; M29-K31 VanDerWaalsContact C-N 3.32Å; M29-K31 PolarHBondContact O-N 3.16Å; M29-L32 PolarHBondContact O-N 2.83Å; M29-L32 HydrophobicContact SD-CD1 4.39Å; M29-S33 WeakPolarHBondContact O-CB 3.38Å; M29-S33 PolarHBondContact O-N 2.85Å; M29-S33 PolarHBondContact O-OG 2.82Å; M29-L296 HydrophobicContact CE-CB 4.44Å; M29-L296 HydrophobicContact CE-CD1 4.27Å; M29-L296 HydrophobicContact CE-CD2 3.67Å; M29-L296 HydrophobicContact CE-CG 4.34Å; M29-L296 HydrophobicContact SD-CD2 4.44Å
30	A	65.7	Low	63.5	Low	45 Å²	45	92.8 Å²	92.8	37%	0.372	46%	0.455	S	S	.	.	H	α-helix	trans	-66.8	-31.6	175	0	0	0	0	0	112.9	S26 N27 T28 S33 K34	S26-A30 WeakPolarHBondContact O-CB 3.47Å; S26-A30 PolarHBondContact O-N 2.93Å; N27-A30 PolarHBondContact O-N 3.49Å; T28-A30 VanDerWaalsContact C-N 3.32Å; T28-A30 PolarHBondContact O-N 3.01Å; A30-S33 WeakPolarHBondContact CA-OG 3.19Å; A30-S33 PolarHBondContact O-OG 2.66Å; A30-K34 WeakPolarHBondContact O-CG 3.08Å; A30-K34 PolarHBondContact O-N 3.45Å
31	K	67.2	Low	63.5	Low	143 Å²	143	98.3 Å²	98.3	62%	0.622	48%	0.476	S	S	*	.	H	α-helix	trans	-71.4	-38.8	172.4	-71.4	174.9	-178.8	-179.8	0	111.8	N27 T28 M29	N27-K31 WeakPolarHBondContact O-CG 3.42Å; N27-K31 PolarHBondContact O-N 2.89Å; T28-K31 CarbonylContact O-C 3.53Å; T28-K31 WeakPolarHBondContact O-CB 3.5Å; T28-K31 PolarHBondContact O-N 3.23Å; T28-K31 VanDerWaalsContact O-N 3.08Å; M29-K31 VanDerWaalsContact C-N 3.32Å; M29-K31 PolarHBondContact O-N 3.16Å
32	L	63.2	Low	63.4	Low	47 Å²	47	97.5 Å²	97.5	25%	0.246	48%	0.482	C	S	.	.	H	α-helix	trans	-70.1	-31.7	175.9	-67.6	171.1	0	0	0	111.9	P24 T28 M29 I86 R90	P24-L32 HydrophobicContact CG-CD1 4.3Å; T28-L32 WeakPolarHBondContact O-CB 3.43Å; T28-L32 VanDerWaalsContact O-CG 3.24Å; T28-L32 WeakPolarHBondContact O-CG 3.23Å; T28-L32 PolarHBondContact O-N 2.83Å; M29-L32 PolarHBondContact O-N 2.83Å; M29-L32 HydrophobicContact SD-CD1 4.39Å; L32-I86 HydrophobicContact CD2-CD1 3.55Å; L32-I86 HydrophobicContact CD2-CG1 4.27Å; L32-I86 HydrophobicContact CD2-CG2 4.41Å; L32-R90 PolarHBondContact O-NH1 3.07Å; L32-R90 PolarHBondContact O-NH2 2.85Å
33	S	59.3	Low	63.3	Low	73 Å²	73	100 Å²	100	51%	0.51	50%	0.499	S	S	.	.	H	α-helix	trans	-74	-31.5	177.9	70.8	0	0	0	0	113.1	M29 A30	M29-S33 WeakPolarHBondContact O-CB 3.38Å; M29-S33 PolarHBondContact O-N 2.85Å; M29-S33 PolarHBondContact O-OG 2.82Å; A30-S33 WeakPolarHBondContact CA-OG 3.19Å; A30-S33 PolarHBondContact O-OG 2.66Å
34	K	59.5	Low	63.3	Low	143 Å²	143	96.7 Å²	96.7	62%	0.622	49%	0.49	S	S	*	.	S	Bend	trans	-65.3	136.4	166.9	-70.6	177.1	-178.4	-176.3	0	108.1	A30 H36	A30-K34 WeakPolarHBondContact O-CG 3.08Å; A30-K34 PolarHBondContact O-N 3.45Å; K34-H36 PolarHBondContact O-N 2.95Å
35	R	54.9	Low	63.1	Low	219 Å²	219	97.1 Å²	97.1	83%	0.826	50%	0.495	S	S	*	.	S	Bend	trans	-61.7	24.5	178.4	-66.5	-176.7	177.9	-177.6	-0.9	114.3	T37	R35-T37 PolarHBondContact O-N 3.38Å
36	H	55.1	Low	62.7	Low	142 Å²	142	97.6 Å²	97.6	66%	0.657	50%	0.501	S	S	*	.			trans	-70.5	83.7	167.2	-84.4	59.5	0	0	0	107.6	K34 W38	K34-H36 PolarHBondContact O-N 2.95Å; H36-W38 PolarHBondContact O-N 3.49Å
37	T	53.9	Low	62.4	Low	37 Å²	37	102 Å²	102	23%	0.227	50%	0.503	C	S	.	.			trans	-64	116.3	167.2	49.9	0	0	0	0	106.3	R35 S39 H84 N87	R35-T37 PolarHBondContact O-N 3.38Å; T37-S39 PolarHBondContact O-N 3.21Å; T37-S39 PolarHBondContact O-OG 3.44Å; T37-S39 PolarHBondContact OG1-OG 3.31Å; T37-H84 VanDerWaalsContact CB-ND1 3.28Å; T37-H84 WeakPolarHBondContact CB-ND1 3.47Å; T37-H84 HydrophobicContact CG2-CB 3.64Å; T37-H84 WeakPolarHBondContact CG2-ND1 3.4Å; T37-H84 PolarHBondContact OG1-ND1 2.64Å; T37-N87 WeakPolarHBondContact CG2-ND2 3.42Å
38	W	55.7	Low	61.8	Low	206 Å²	206	103.4 Å²	103.4	78%	0.78	50%	0.504	S	S	*	.			trans	-72.4	41	169.1	-67.3	21.8	0	0	0	110.4	H36 L40 I86	H36-W38 PolarHBondContact O-N 3.49Å; W38-L40 PolarHBondContact O-N 3.4Å; W38-I86 HydrophobicContact CG-CD1 4.43Å
39	S	58.5	Low	61.5	Low	27 Å²	27	107.8 Å²	107.8	19%	0.189	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-68.9	125	162.3	44.3	0	0	0	0	106	T37 E41 W81	T37-S39 PolarHBondContact O-N 3.21Å; T37-S39 PolarHBondContact O-OG 3.44Å; T37-S39 PolarHBondContact OG1-OG 3.31Å; S39-E41 PolarHBondContact O-N 3.43Å; S39-W81 WeakPolarHBondContact CB-O 3.41Å
40	L	60.7	Low	61.4	Low	99 Å²	99	109.9 Å²	109.9	52%	0.518	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-50.4	131.2	168.8	-91.3	159.3	0	0	0	108.6	W38 S44 H80 W81	W38-L40 PolarHBondContact O-N 3.4Å; L40-S44 WeakPolarHBondContact CB-OG 3.32Å; L40-S44 WeakPolarHBondContact CD2-OG 3.26Å; L40-H80 WeakPolarHBondContact CB-NE2 3.44Å; L40-H80 VanDerWaalsContact CD1-CD2 3.41Å; L40-H80 WeakPolarHBondContact CD1-CD2 3.19Å; L40-H80 WeakPolarHBondContact CD1-NE2 3.41Å; L40-W81 VanDerWaalsContact O-CB 3.27Å; L40-W81 WeakPolarHBondContact O-CB 3.34Å
41	E	65.3	Low	61	Low	136 Å²	136	111.4 Å²	111.4	64%	0.636	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-57.6	145.6	-179.7	-70.7	-171.7	166.9	0	0	109.6	S39 E43 S44	S39-E41 PolarHBondContact O-N 3.43Å; E41-E43 PolarHBondContact O-N 3.45Å; E41-S44 WeakPolarHBondContact O-CB 3.23Å; E41-S44 PolarHBondContact O-N 3.28Å; E41-S44 PolarHBondContact O-OG 3.33Å
42	P	64.6	Low	60.4	Low	102 Å²	102	112.3 Å²	112.3	66%	0.662	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-55.9	-22.4	-179.1	20.4	-31.4	0	0	0	113.1	S44 A45	P42-S44 VanDerWaalsContact C-N 3.28Å; P42-S44 PolarHBondContact O-N 2.99Å; P42-A45 WeakPolarHBondContact O-CB 3.15Å; P42-A45 PolarHBondContact O-N 2.86Å; P42-A45 VanDerWaalsContact O-N 3.14Å
43	E	64.9	Low	59.7	Low	176 Å²	176	117.9 Å²	117.9	82%	0.822	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-67.5	-25.4	174.7	-59.9	-170.3	173.6	0	0	113.9	E41 A45	E41-E43 PolarHBondContact O-N 3.45Å; E43-A45 PolarHBondContact O-N 3Å
44	S	65	Low	59.4	Low	53 Å²	53	118.1 Å²	118.1	37%	0.371	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-82.1	0.1	173.5	67.7	0	0	0	0	113.4	L40 E41 P42 V46	L40-S44 WeakPolarHBondContact CB-OG 3.32Å; L40-S44 WeakPolarHBondContact CD2-OG 3.26Å; E41-S44 WeakPolarHBondContact O-CB 3.23Å; E41-S44 PolarHBondContact O-N 3.28Å; E41-S44 PolarHBondContact O-OG 3.33Å; P42-S44 VanDerWaalsContact C-N 3.28Å; P42-S44 PolarHBondContact O-N 2.99Å; S44-V46 PolarHBondContact O-N 3.45Å
45	A	63.8	Low	59.3	Low	26 Å²	26	117.3 Å²	117.3	22%	0.215	57%	0.574	C	S	.	*	S	Bend	trans	-62.8	117.8	171.7	0	0	0	0	0	109.7	P42 E43 R47 W81	P42-A45 WeakPolarHBondContact O-CB 3.15Å; P42-A45 PolarHBondContact O-N 2.86Å; P42-A45 VanDerWaalsContact O-N 3.14Å; E43-A45 PolarHBondContact O-N 3Å; A45-R47 PolarHBondContact O-N 3.14Å; A45-W81 HydrophobicContact CB-CD2 4.12Å; A45-W81 HydrophobicContact CB-CE3 3.68Å; A45-W81 HydrophobicContact CB-CH2 3.74Å; A45-W81 HydrophobicContact CB-CZ2 4.12Å; A45-W81 HydrophobicContact CB-CZ3 3.51Å
46	V	62.2	Low	59.3	Low	84 Å²	84	111.6 Å²	111.6	51%	0.509	56%	0.56	S	S	.	*			trans	-59.4	112.4	172.9	-175.9	0	0	0	0	107.9	S44 D50 Q51	S44-V46 PolarHBondContact O-N 3.45Å; V46-D50 HydrophobicContact CG1-CB 4.04Å; V46-Q51 HydrophobicContact CB-CG 4.33Å; V46-Q51 HydrophobicContact CG1-CB 4.34Å; V46-Q51 HydrophobicContact CG1-CG 3.59Å
47	R	63.2	Low	59.1	Low	186 Å²	186	116.1 Å²	116.1	70%	0.702	57%	0.571	S	S	*	*			trans	-59.7	148.3	177.8	-66.6	-176.2	170.2	-168.1	-1.6	109	A45 D49 D50 Q51	A45-R47 PolarHBondContact O-N 3.14Å; R47-D49 PolarHBondContact O-N 3.19Å; R47-D50 HydrophobicContact CB-CB 4.48Å; R47-D50 PolarHBondContact O-N 3.49Å; R47-Q51 PolarHBondContact O-N 2.94Å
48	F	58	Low	59.1	Low	135 Å²	135	123 Å²	123	59%	0.592	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-31	-179.5	-123.9	-63.2	0	0	0	112.7
49	D	64	Low	59.1	Low	142 Å²	142	121 Å²	121	76%	0.759	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-22.9	177.9	-62.9	-36.3	0	0	0	113.8	R47	R47-D49 PolarHBondContact O-N 3.19Å
50	D	64.2	Low	58.7	Low	86 Å²	86	127.4 Å²	127.4	46%	0.46	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.9	-14.5	-176.2	-65.9	-28	0	0	0	112.9	V46 R47 Y52	V46-D50 HydrophobicContact CG1-CB 4.04Å; R47-D50 HydrophobicContact CB-CB 4.48Å; R47-D50 PolarHBondContact O-N 3.49Å; D50-Y52 PolarHBondContact O-N 3.09Å
51	Q	57.9	Low	58.2	Low	77 Å²	77	130 Å²	130	36%	0.36	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.9	-21.9	-172.8	-77.8	-175	-18.3	0	0	114.2	V46 R47	V46-Q51 HydrophobicContact CB-CG 4.33Å; V46-Q51 HydrophobicContact CG1-CB 4.34Å; V46-Q51 HydrophobicContact CG1-CG 3.59Å; R47-Q51 PolarHBondContact O-N 2.94Å
52	Y	53.7	Low	57.7	Low	162 Å²	162	130.2 Å²	130.2	64%	0.635	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.5	50.5	-174.5	-58.5	-75.3	0	0	0	114.1	D50 T54	D50-Y52 PolarHBondContact O-N 3.09Å; Y52-T54 PolarHBondContact O-N 2.84Å
53	Q	49.9	Very low	57.3	Low	164 Å²	164	134.1 Å²	134.1	77%	0.766	64%	0.644	S	S	*	*			trans	-74.2	60	161.8	-66.5	-165.5	16.2	0	0	110.7
54	T	53	Low	57	Low	79 Å²	79	129.8 Å²	129.8	49%	0.485	63%	0.625	S	S	.	*			trans	-84.5	146.7	163.3	57.4	0	0	0	0	108.6	Y52 N56	Y52-T54 PolarHBondContact O-N 2.84Å; T54-N56 PolarHBondContact O-N 3.14Å
55	S	56.5	Low	56.4	Low	125 Å²	125	130.6 Å²	130.6	87%	0.874	63%	0.629	S	S	*	*	S	Bend	trans	-58	-4.9	-171.9	42.6	0	0	0	0	116
56	N	55.9	Low	56.2	Low	100 Å²	100	136.1 Å²	136.1	54%	0.535	65%	0.649	S	S	.	*			trans	-117.1	65.5	174.7	-79.5	-17.4	0	0	0	111.2	T54 L58 M59 Y60	T54-N56 PolarHBondContact O-N 3.14Å; N56-L58 PolarHBondContact O-N 3.45Å; N56-M59 PolarHBondContact O-N 3.45Å; N56-Y60 HydrophobicContact CB-CE2 4.31Å
57	R	50.6	Low	56.2	Low	236 Å²	236	138.2 Å²	138.2	89%	0.891	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-17.3	-179.2	-171.7	174.6	-179	172.6	3.1	114.8
58	L	54.2	Low	55.7	Low	181 Å²	181	136.5 Å²	136.5	95%	0.948	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-9.9	-174	-70.4	169.8	0	0	0	115	N56	N56-L58 PolarHBondContact O-N 3.45Å
59	M	54.1	Low	55.6	Low	164 Å²	164	134.8 Å²	134.8	81%	0.808	65%	0.651	S	S	*	*	S	Bend	trans	-120.7	-0.6	-165.9	-135	-171.8	176.6	0	0	116.1	N56	N56-M59 PolarHBondContact O-N 3.45Å
60	Y	51.2	Low	55.3	Low	163 Å²	163	135.6 Å²	135.6	64%	0.639	65%	0.648	S	S	*	*			trans	-113.1	95.8	177.1	-69.5	-76.4	0	0	0	110.7	N56	N56-Y60 HydrophobicContact CB-CE2 4.31Å
61	D	51	Low	55	Low	154 Å²	154	137.2 Å²	137.2	82%	0.824	65%	0.651	S	S	*	*			trans	-54.2	141.3	162.2	-103.6	-26.4	0	0	0	109.9	K63	D61-K63 PolarHBondContact O-N 3.22Å
62	R	53.9	Low	55.4	Low	139 Å²	139	139.5 Å²	139.5	53%	0.525	67%	0.673	S	S	.	*			trans	-59.7	99.1	179.2	-160.3	170.2	171.2	180	-6.3	108.3	I64	R62-I64 PolarHBondContact O-N 2.83Å
63	K	56.6	Low	56.2	Low	184 Å²	184	140 Å²	140	80%	0.8	68%	0.681	S	S	*	*	S	Bend	trans	-63.4	1.8	-177.9	-70.6	-168.8	178.4	-175.6	0	115	D61 P65	D61-K63 PolarHBondContact O-N 3.22Å; K63-P65 WeakPolarHBondContact O-CD 3.4Å
64	I	57.6	Low	56.9	Low	85 Å²	85	138 Å²	138	44%	0.436	68%	0.676	S	S	.	*	S	Bend	trans	-96.6	98.1	174.4	-52.4	175.8	0	0	0	106.6	R62 K66 L69	R62-I64 PolarHBondContact O-N 2.83Å; I64-K66 PolarHBondContact O-N 3.06Å; I64-K66 VanDerWaalsContact O-N 3.1Å; I64-L69 HydrophobicContact CG2-CD1 4.09Å
65	P	53.9	Low	57.8	Low	70 Å²	70	139.4 Å²	139.4	46%	0.455	69%	0.686	S	S	.	*			trans	-57.4	120.6	169.1	24.2	-32.6	0	0	0	108.1	K63 D67 F68	K63-P65 WeakPolarHBondContact O-CD 3.4Å; P65-D67 PolarHBondContact O-N 3.07Å; P65-F68 HydrophobicContact CB-CB 4.49Å; P65-F68 HydrophobicContact CB-CD2 3.91Å; P65-F68 HydrophobicContact CG-CB 4.09Å; P65-F68 HydrophobicContact CG-CD2 4.15Å; P65-F68 HydrophobicContact CG-CG 4.49Å
66	K	59.9	Low	58.4	Low	143 Å²	143	138.9 Å²	138.9	62%	0.622	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-19.4	-172.3	-74.6	-179.1	178.7	175.4	0	113.7	I64	I64-K66 PolarHBondContact O-N 3.06Å; I64-K66 VanDerWaalsContact O-N 3.1Å
67	D	60.7	Low	59.3	Low	127 Å²	127	139.1 Å²	139.1	68%	0.679	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	-25.8	-167.2	-58.6	-28	0	0	0	113.8	P65 L69 K70	P65-D67 PolarHBondContact O-N 3.07Å; D67-L69 PolarHBondContact O-N 2.78Å; D67-K70 PolarHBondContact O-N 3.18Å
68	F	53.6	Low	60.5	Low	150 Å²	150	132 Å²	132	66%	0.658	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-16.3	-172.5	-85.1	-88.1	0	0	0	115	P65 F71	P65-F68 HydrophobicContact CB-CB 4.49Å; P65-F68 HydrophobicContact CB-CD2 3.91Å; P65-F68 HydrophobicContact CG-CB 4.09Å; P65-F68 HydrophobicContact CG-CD2 4.15Å; P65-F68 HydrophobicContact CG-CG 4.49Å; F68-F71 VanDerWaalsContact O-CD2 3.32Å; F68-F71 WeakPolarHBondContact O-CD2 3.25Å
69	L	55.5	Low	61.5	Low	100 Å²	100	128.3 Å²	128.3	52%	0.524	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.7	0.5	177.9	-66.2	174.3	0	0	0	113.3	I64 D67 F71 L76	I64-L69 HydrophobicContact CG2-CD1 4.09Å; D67-L69 PolarHBondContact O-N 2.78Å; L69-F71 VanDerWaalsContact C-N 3.33Å; L69-F71 PolarHBondContact O-N 2.99Å; L69-L76 HydrophobicContact CB-CD2 4.38Å; L69-L76 HydrophobicContact CD1-CD2 4.49Å
70	K	56.7	Low	62.4	Low	158 Å²	158	123.6 Å²	123.6	69%	0.687	62%	0.618	S	S	*	*			trans	-96.3	37.1	176.5	-68	-174.9	179.3	179.4	0	112.3	D67	D67-K70 PolarHBondContact O-N 3.18Å
71	F	59.2	Low	63.6	Low	120 Å²	120	118.9 Å²	118.9	53%	0.526	60%	0.599	S	S	.	*			trans	-71.1	127.1	168.8	-86.1	-83.4	0	0	0	109.1	F68 L69 Q73 N74	F68-F71 VanDerWaalsContact O-CD2 3.32Å; F68-F71 WeakPolarHBondContact O-CD2 3.25Å; L69-F71 VanDerWaalsContact C-N 3.33Å; L69-F71 PolarHBondContact O-N 2.99Å; F71-Q73 PolarHBondContact O-N 2.93Å; F71-N74 CarbonylContact O-C 3.57Å; F71-N74 PolarHBondContact O-N 2.84Å
72	P	67	Low	64.6	Low	126 Å²	126	116 Å²	116	82%	0.818	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-22.1	-178.8	21.5	-31.3	0	0	0	113.1
73	Q	68.5	Low	65.6	Low	173 Å²	173	110.4 Å²	110.4	81%	0.808	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-21.4	175.8	-67.7	-180	-4.9	0	0	113.5	F71	F71-Q73 PolarHBondContact O-N 2.93Å
74	N	66.5	Low	66.5	Low	121 Å²	121	105.3 Å²	105.3	65%	0.647	54%	0.543	S	S	*	.	S	Bend	trans	-130.1	77.7	-177.2	-70.5	-23.5	0	0	0	109.7	F71	F71-N74 CarbonylContact O-C 3.57Å; F71-N74 PolarHBondContact O-N 2.84Å
75	P	71.4	Confident	67.3	Low	109 Å²	109	107.9 Å²	107.9	71%	0.708	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-57.9	145.9	174.1	26.3	-33.9	0	0	0	110.1
76	L	69.4	Low	68.2	Low	113 Å²	113	106.6 Å²	106.6	59%	0.592	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-53.8	138.5	171	-77.5	145.8	0	0	0	109	L69	L69-L76 HydrophobicContact CB-CD2 4.38Å; L69-L76 HydrophobicContact CD1-CD2 4.49Å
77	P	74.1	Confident	68.7	Low	106 Å²	106	102.2 Å²	102.2	69%	0.688	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-58.1	143.4	174.5	25.9	-33.3	0	0	0	109.2
78	P	76.6	Confident	69.2	Low	85 Å²	85	98.5 Å²	98.5	55%	0.552	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-54.6	145.4	173.9	23	-32.8	0	0	0	109.9	D82 V83	P78-D82 HydrophobicContact CB-CB 4.38Å; P78-V83 HydrophobicContact CB-CG2 3.86Å; P78-V83 HydrophobicContact CG-CG2 3.53Å
79	H	73.2	Confident	70	Confident	105 Å²	105	94.7 Å²	94.7	49%	0.486	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-61.7	147	176.5	-60.5	89.4	0	0	0	109.4	W81 D82 V83	H79-W81 HydrophobicContact CB-CD2 3.69Å; H79-W81 HydrophobicContact CB-CE3 4.26Å; H79-W81 HydrophobicContact CB-CG 4.17Å; H79-W81 HydrophobicContact CB-CH2 3.96Å; H79-W81 HydrophobicContact CB-CZ2 3.37Å; H79-W81 HydrophobicContact CB-CZ3 4.37Å; H79-W81 AromaticContact CD2-CH2 3.47Å; H79-W81 VanDerWaalsContact CD2-CH2 3.47Å; H79-W81 WeakPolarHBondContact CD2-CH2 3.32Å; H79-W81 AromaticContact CD2-CZ2 3.19Å; H79-W81 WeakPolarHBondContact CD2-CZ2 3.42Å; H79-W81 AromaticContact CG-CE2 3.6Å; H79-W81 AromaticContact CG-CH2 3.91Å; H79-W81 AromaticContact CG-CZ2 3.26Å; H79-W81 AromaticContact CG-NE1 3.89Å; H79-W81 AromaticContact NE2-CZ2 3.97Å; H79-W81 PolarHBondContact O-N 3.33Å; H79-D82 IonicContact ND1-OD2 3.68Å; H79-D82 WeakPolarHBondContact O-CA 3.18Å; H79-D82 WeakPolarHBondContact O-CB 3.32Å; H79-D82 PolarHBondContact O-N 2.64Å; H79-V83 PolarHBondContact O-N 3.46Å
80	H	74	Confident	70.6	Confident	64 Å²	64	93.5 Å²	93.5	30%	0.296	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.3	-174.5	72.2	-84.6	0	0	0	113.9	L40 D82 V83 Y85	L40-H80 WeakPolarHBondContact CB-NE2 3.44Å; L40-H80 VanDerWaalsContact CD1-CD2 3.41Å; L40-H80 WeakPolarHBondContact CD1-CD2 3.19Å; L40-H80 WeakPolarHBondContact CD1-NE2 3.41Å; H80-D82 VanDerWaalsContact C-N 3.35Å; H80-V83 PolarHBondContact O-N 3.14Å; H80-Y85 HydrophobicContact CB-CE2 4.44Å; H80-Y85 WeakPolarHBondContact CB-OH 3.48Å
81	W	75.3	Confident	71.1	Confident	64 Å²	64	89 Å²	89	24%	0.242	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-23.6	173.3	54.1	75.1	0	0	0	113.2	S39 L40 A45 H79	S39-W81 WeakPolarHBondContact CB-O 3.41Å; L40-W81 VanDerWaalsContact O-CB 3.27Å; L40-W81 WeakPolarHBondContact O-CB 3.34Å; A45-W81 HydrophobicContact CB-CD2 4.12Å; A45-W81 HydrophobicContact CB-CE3 3.68Å; A45-W81 HydrophobicContact CB-CH2 3.74Å; A45-W81 HydrophobicContact CB-CZ2 4.12Å; A45-W81 HydrophobicContact CB-CZ3 3.51Å; H79-W81 HydrophobicContact CB-CD2 3.69Å; H79-W81 HydrophobicContact CB-CE3 4.26Å; H79-W81 HydrophobicContact CB-CG 4.17Å; H79-W81 HydrophobicContact CB-CH2 3.96Å; H79-W81 HydrophobicContact CB-CZ2 3.37Å; H79-W81 HydrophobicContact CB-CZ3 4.37Å; H79-W81 AromaticContact CD2-CH2 3.47Å; H79-W81 VanDerWaalsContact CD2-CH2 3.47Å; H79-W81 WeakPolarHBondContact CD2-CH2 3.32Å; H79-W81 AromaticContact CD2-CZ2 3.19Å; H79-W81 WeakPolarHBondContact CD2-CZ2 3.42Å; H79-W81 AromaticContact CG-CE2 3.6Å; H79-W81 AromaticContact CG-CH2 3.91Å; H79-W81 AromaticContact CG-CZ2 3.26Å; H79-W81 AromaticContact CG-NE1 3.89Å; H79-W81 AromaticContact NE2-CZ2 3.97Å; H79-W81 PolarHBondContact O-N 3.33Å
82	D	73.5	Confident	71.5	Confident	95 Å²	95	91.6 Å²	91.6	51%	0.508	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-16.3	171.8	-60.7	-33.5	0	0	0	111.6	P78 H79 H80	P78-D82 HydrophobicContact CB-CB 4.38Å; H79-D82 IonicContact ND1-OD2 3.68Å; H79-D82 WeakPolarHBondContact O-CA 3.18Å; H79-D82 WeakPolarHBondContact O-CB 3.32Å; H79-D82 PolarHBondContact O-N 2.64Å; H80-D82 VanDerWaalsContact C-N 3.35Å
83	V	73.6	Confident	71.3	Confident	21 Å²	21	92.8 Å²	92.8	13%	0.127	46%	0.46	C	S	.	.			trans	-90.7	112.4	-178.1	-178.9	0	0	0	0	110.9	P78 H79 H80 Y85	P78-V83 HydrophobicContact CB-CG2 3.86Å; P78-V83 HydrophobicContact CG-CG2 3.53Å; H79-V83 PolarHBondContact O-N 3.46Å; H80-V83 PolarHBondContact O-N 3.14Å; V83-Y85 VanDerWaalsContact C-N 3.3Å; V83-Y85 HydrophobicContact CB-CE1 4.38Å; V83-Y85 HydrophobicContact CB-CE2 4.24Å; V83-Y85 HydrophobicContact CG1-CD1 3.7Å; V83-Y85 HydrophobicContact CG1-CD2 4.21Å; V83-Y85 HydrophobicContact CG1-CE1 3.72Å; V83-Y85 HydrophobicContact CG1-CE2 4.22Å; V83-Y85 HydrophobicContact CG1-CG 3.96Å; V83-Y85 WeakPolarHBondContact O-CD2 3.27Å; V83-Y85 PolarHBondContact O-N 2.85Å
84	H	75.9	Confident	71.1	Confident	76 Å²	76	87 Å²	87	35%	0.352	43%	0.434	S	S	.	.			trans	-84.8	71	171.7	-60.4	-47.7	0	0	0	110.9	T37 I86 N87 D88	T37-H84 VanDerWaalsContact CB-ND1 3.28Å; T37-H84 WeakPolarHBondContact CB-ND1 3.47Å; T37-H84 HydrophobicContact CG2-CB 3.64Å; T37-H84 WeakPolarHBondContact CG2-ND1 3.4Å; T37-H84 PolarHBondContact OG1-ND1 2.64Å; H84-I86 VanDerWaalsContact C-N 3.28Å; H84-I86 PolarHBondContact O-N 3.1Å; H84-N87 HydrophobicContact CB-CB 3.91Å; H84-N87 CarbonylContact O-C 3.57Å; H84-N87 WeakPolarHBondContact O-CA 3.36Å; H84-N87 PolarHBondContact O-N 3.37Å; H84-D88 PolarHBondContact O-N 3.42Å
85	Y	74.3	Confident	70.9	Confident	139 Å²	139	85.2 Å²	85.2	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-41.1	-48.3	-170.7	-67.7	-78.7	0	0	0	115.2	H80 V83 F89	H80-Y85 HydrophobicContact CB-CE2 4.44Å; H80-Y85 WeakPolarHBondContact CB-OH 3.48Å; V83-Y85 VanDerWaalsContact C-N 3.3Å; V83-Y85 HydrophobicContact CB-CE1 4.38Å; V83-Y85 HydrophobicContact CB-CE2 4.24Å; V83-Y85 HydrophobicContact CG1-CD1 3.7Å; V83-Y85 HydrophobicContact CG1-CD2 4.21Å; V83-Y85 HydrophobicContact CG1-CE1 3.72Å; V83-Y85 HydrophobicContact CG1-CE2 4.22Å; V83-Y85 HydrophobicContact CG1-CG 3.96Å; V83-Y85 WeakPolarHBondContact O-CD2 3.27Å; V83-Y85 PolarHBondContact O-N 2.85Å; Y85-F89 WeakPolarHBondContact O-CB 3.36Å; Y85-F89 PolarHBondContact O-N 3.45Å
86	I	72.4	Confident	70.1	Confident	43 Å²	43	81.9 Å²	81.9	22%	0.221	42%	0.417	C	S	.	.	H	α-helix	trans	-69.6	-41.5	-179	-64.3	160	0	0	0	111.4	L32 W38 H84 F89 R90	L32-I86 HydrophobicContact CD2-CD1 3.55Å; L32-I86 HydrophobicContact CD2-CG1 4.27Å; L32-I86 HydrophobicContact CD2-CG2 4.41Å; W38-I86 HydrophobicContact CG-CD1 4.43Å; H84-I86 VanDerWaalsContact C-N 3.28Å; H84-I86 PolarHBondContact O-N 3.1Å; I86-F89 PolarHBondContact O-N 3.35Å; I86-R90 WeakPolarHBondContact O-CG 3.35Å; I86-R90 PolarHBondContact O-N 3.01Å
87	N	71.1	Confident	69.5	Low	51 Å²	51	78.8 Å²	78.8	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-70.6	-41.3	178.4	-75.1	-14.5	0	0	0	111.3	T37 H84 F89 R90 S91	T37-N87 WeakPolarHBondContact CG2-ND2 3.42Å; H84-N87 HydrophobicContact CB-CB 3.91Å; H84-N87 CarbonylContact O-C 3.57Å; H84-N87 WeakPolarHBondContact O-CA 3.36Å; H84-N87 PolarHBondContact O-N 3.37Å; N87-F89 VanDerWaalsContact C-N 3.32Å; N87-R90 PolarHBondContact O-N 2.96Å; N87-S91 WeakPolarHBondContact O-CB 3.28Å; N87-S91 PolarHBondContact O-N 2.96Å; N87-S91 PolarHBondContact O-OG 3.42Å; N87-S91 VanDerWaalsContact O-OG 3.04Å
88	D	72.2	Confident	68.7	Low	49 Å²	49	80 Å²	80	26%	0.262	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-39.5	174.4	-92.6	30.5	0	0	0	111.2	H84 S91 R92	H84-D88 PolarHBondContact O-N 3.42Å; D88-S91 WeakPolarHBondContact CA-OG 3.41Å; D88-S91 PolarHBondContact O-OG 2.96Å; D88-R92 WeakPolarHBondContact O-CB 3.4Å; D88-R92 VanDerWaalsContact O-CG 3.23Å; D88-R92 WeakPolarHBondContact O-CG 3.2Å; D88-R92 PolarHBondContact O-N 3.06Å; D88-R92 IonicContact OD2-CZ 3.68Å; D88-R92 IonicContact OD2-NE 2.83Å; D88-R92 IonicContact OD2-NH2 3.16Å; D88-R92 PolarHBondContact OD2-NH2 2.49Å
89	F	70	Confident	67.5	Low	70 Å²	70	86.3 Å²	86.3	31%	0.307	42%	0.417	S	S	.	.	H	α-helix	trans	-60.2	-52.4	171.7	-176.3	-87	0	0	0	110.4	Y85 I86 N87 S91 R92 F93 V297	Y85-F89 WeakPolarHBondContact O-CB 3.36Å; Y85-F89 PolarHBondContact O-N 3.45Å; I86-F89 PolarHBondContact O-N 3.35Å; N87-F89 VanDerWaalsContact C-N 3.32Å; F89-S91 PolarHBondContact O-N 2.77Å; F89-R92 PolarHBondContact O-N 3.41Å; F89-F93 HydrophobicContact CD1-CB 4.37Å; F89-F93 HydrophobicContact CD2-CB 4.26Å; F89-F93 AromaticContact CD2-CD2 3.84Å; F89-F93 HydrophobicContact CD2-CD2 3.84Å; F89-F93 HydrophobicContact CD2-CE2 4.5Å; F89-F93 HydrophobicContact CD2-CG 4.2Å; F89-F93 HydrophobicContact CE1-CB 3.97Å; F89-F93 HydrophobicContact CE2-CB 3.92Å; F89-F93 HydrophobicContact CE2-CD1 4.23Å; F89-F93 AromaticContact CE2-CD2 3.6Å; F89-F93 HydrophobicContact CE2-CD2 3.6Å; F89-F93 HydrophobicContact CE2-CE2 4.13Å; F89-F93 AromaticContact CE2-CG 3.66Å; F89-F93 HydrophobicContact CE2-CG 3.66Å; F89-F93 HydrophobicContact CG-CB 4.47Å; F89-F93 HydrophobicContact CZ-CB 3.74Å; F89-F93 HydrophobicContact CZ-CD1 4.23Å; F89-F93 HydrophobicContact CZ-CD2 4.27Å; F89-F93 AromaticContact CZ-CG 3.84Å; F89-F93 HydrophobicContact CZ-CG 3.84Å; F89-F93 WeakPolarHBondContact O-CA 3.46Å; F89-F93 WeakPolarHBondContact O-CB 3.49Å; F89-F93 PolarHBondContact O-N 3.14Å; F89-V297 HydrophobicContact CD1-CG1 4.49Å; F89-V297 HydrophobicContact CD1-CG2 4Å; F89-V297 HydrophobicContact CE1-CB 3.94Å; F89-V297 HydrophobicContact CE1-CG1 3.41Å; F89-V297 VanDerWaalsContact CE1-CG1 3.41Å; F89-V297 HydrophobicContact CE1-CG2 3.34Å; F89-V297 HydrophobicContact CE2-CG1 4.44Å; F89-V297 HydrophobicContact CZ-CB 4.35Å; F89-V297 HydrophobicContact CZ-CG1 3.37Å; F89-V297 HydrophobicContact CZ-CG2 4.22Å
90	R	67.4	Low	66.6	Low	76 Å²	76	90.4 Å²	90.4	29%	0.287	43%	0.428	S	S	.	.	I	π-helix	trans	-61.6	-44.2	178.4	-71.5	-163.7	172.7	136	-2.5	112.7	L32 I86 N87 R92 L94 S95	L32-R90 PolarHBondContact O-NH1 3.07Å; L32-R90 PolarHBondContact O-NH2 2.85Å; I86-R90 WeakPolarHBondContact O-CG 3.35Å; I86-R90 PolarHBondContact O-N 3.01Å; N87-R90 PolarHBondContact O-N 2.96Å; R90-R92 VanDerWaalsContact C-N 3.33Å; R90-R92 PolarHBondContact O-N 2.98Å; R90-L94 HydrophobicContact CB-CD1 4.15Å; R90-L94 HydrophobicContact CG-CD1 3.75Å; R90-L94 WeakPolarHBondContact O-CA 3.37Å; R90-L94 VanDerWaalsContact O-CB 3.27Å; R90-L94 WeakPolarHBondContact O-CB 3.23Å; R90-L94 PolarHBondContact O-N 2.98Å; R90-S95 PolarHBondContact O-N 3.5Å; R90-S95 VanDerWaalsContact O-N 3.11Å
91	S	67.3	Low	65.6	Low	63 Å²	63	89.8 Å²	89.8	44%	0.441	43%	0.43	S	S	.	.	I	π-helix	trans	-75.4	-19.1	-175.4	73	0	0	0	0	113.4	N87 D88 F89 S95	N87-S91 WeakPolarHBondContact O-CB 3.28Å; N87-S91 PolarHBondContact O-N 2.96Å; N87-S91 PolarHBondContact O-OG 3.42Å; N87-S91 VanDerWaalsContact O-OG 3.04Å; D88-S91 WeakPolarHBondContact CA-OG 3.41Å; D88-S91 PolarHBondContact O-OG 2.96Å; F89-S91 PolarHBondContact O-N 2.77Å; S91-S95 WeakPolarHBondContact O-CB 3.2Å; S91-S95 PolarHBondContact O-OG 3.24Å
92	R	68	Low	64.7	Low	175 Å²	175	93.6 Å²	93.6	66%	0.66	45%	0.454	S	S	*	.	I	π-helix	trans	-105.9	-44.3	176.6	-60.6	-179.2	-166.9	-165.6	8.5	112.9	D88 F89 R90	D88-R92 WeakPolarHBondContact O-CB 3.4Å; D88-R92 VanDerWaalsContact O-CG 3.23Å; D88-R92 WeakPolarHBondContact O-CG 3.2Å; D88-R92 PolarHBondContact O-N 3.06Å; D88-R92 IonicContact OD2-CZ 3.68Å; D88-R92 IonicContact OD2-NE 2.83Å; D88-R92 IonicContact OD2-NH2 3.16Å; D88-R92 PolarHBondContact OD2-NH2 2.49Å; F89-R92 PolarHBondContact O-N 3.41Å; R90-R92 VanDerWaalsContact C-N 3.33Å; R90-R92 PolarHBondContact O-N 2.98Å
93	F	63.5	Low	63.7	Low	150 Å²	150	90.7 Å²	90.7	66%	0.658	44%	0.441	S	S	*	.	I	π-helix	trans	-82.7	-44.1	-178.7	-99.9	-90	0	0	0	112.8	F89	F89-F93 HydrophobicContact CD1-CB 4.37Å; F89-F93 HydrophobicContact CD2-CB 4.26Å; F89-F93 AromaticContact CD2-CD2 3.84Å; F89-F93 HydrophobicContact CD2-CD2 3.84Å; F89-F93 HydrophobicContact CD2-CE2 4.5Å; F89-F93 HydrophobicContact CD2-CG 4.2Å; F89-F93 HydrophobicContact CE1-CB 3.97Å; F89-F93 HydrophobicContact CE2-CB 3.92Å; F89-F93 HydrophobicContact CE2-CD1 4.23Å; F89-F93 AromaticContact CE2-CD2 3.6Å; F89-F93 HydrophobicContact CE2-CD2 3.6Å; F89-F93 HydrophobicContact CE2-CE2 4.13Å; F89-F93 AromaticContact CE2-CG 3.66Å; F89-F93 HydrophobicContact CE2-CG 3.66Å; F89-F93 HydrophobicContact CG-CB 4.47Å; F89-F93 HydrophobicContact CZ-CB 3.74Å; F89-F93 HydrophobicContact CZ-CD1 4.23Å; F89-F93 HydrophobicContact CZ-CD2 4.27Å; F89-F93 AromaticContact CZ-CG 3.84Å; F89-F93 HydrophobicContact CZ-CG 3.84Å; F89-F93 WeakPolarHBondContact O-CA 3.46Å; F89-F93 WeakPolarHBondContact O-CB 3.49Å; F89-F93 PolarHBondContact O-N 3.14Å
94	L	64	Low	62.9	Low	51 Å²	51	95 Å²	95	27%	0.267	47%	0.47	S	S	.	.	I	π-helix	trans	-86.9	-29.8	-177.1	-56.6	176.1	0	0	0	112.9	R90 G96 V295 V297	R90-L94 HydrophobicContact CB-CD1 4.15Å; R90-L94 HydrophobicContact CG-CD1 3.75Å; R90-L94 WeakPolarHBondContact O-CA 3.37Å; R90-L94 VanDerWaalsContact O-CB 3.27Å; R90-L94 WeakPolarHBondContact O-CB 3.23Å; R90-L94 PolarHBondContact O-N 2.98Å; L94-G96 VanDerWaalsContact C-N 3.31Å; L94-V295 HydrophobicContact CB-CG1 4.15Å; L94-V295 HydrophobicContact CD1-CG1 4.29Å; L94-V295 HydrophobicContact CD2-CG1 4.39Å; L94-V297 HydrophobicContact CD1-CG2 4.46Å
95	S	61.9	Low	61.8	Low	85 Å²	85	95.9 Å²	95.9	59%	0.594	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-27.5	177	80.4	0	0	0	0	113.1	R90 S91 G97	R90-S95 PolarHBondContact O-N 3.5Å; R90-S95 VanDerWaalsContact O-N 3.11Å; S91-S95 WeakPolarHBondContact O-CB 3.2Å; S91-S95 PolarHBondContact O-OG 3.24Å; S95-G97 PolarHBondContact O-N 3.24Å
96	G	54.6	Low	61	Low	38 Å²	38	94.2 Å²	94.2	39%	0.392	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	3	-168.9	0	0	0	0	0	115.3	L94	L94-G96 VanDerWaalsContact C-N 3.31Å
97	G	56.4	Low	60.6	Low	48 Å²	48	97 Å²	97	50%	0.495	49%	0.493	S	S	.	.			trans	60.3	164.6	-167.3	0	0	0	0	0	111.5	S95 R99	S95-G97 PolarHBondContact O-N 3.24Å; G97-R99 VanDerWaalsContact C-N 3.34Å; G97-R99 PolarHBondContact O-N 3.24Å
98	Y	56.7	Low	60.2	Low	131 Å²	131	99 Å²	99	51%	0.514	51%	0.507	S	S	.	.			trans	-64.4	100.6	166.3	-65.2	-78.5	0	0	0	107.8	R100 T294 P301	Y98-R100 PolarHBondContact O-N 3.1Å; Y98-T294 PolarHBondContact OH-O 3.25Å; Y98-P301 HydrophobicContact CD1-CB 4.44Å; Y98-P301 HydrophobicContact CE1-CB 4.31Å
99	R	52.6	Low	60	Low	218 Å²	218	99.8 Å²	99.8	82%	0.823	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-59.9	129.8	166.7	-69.6	-172.6	177.6	172.4	-0.6	106.6	G97	G97-R99 VanDerWaalsContact C-N 3.34Å; G97-R99 PolarHBondContact O-N 3.24Å
100	R	53.6	Low	60	Low	191 Å²	191	104.3 Å²	104.3	72%	0.721	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-52.8	130.2	173.1	-72.1	-176.3	-178.6	-180	4.2	106.9	Y98 L102 H106	Y98-R100 PolarHBondContact O-N 3.1Å; R100-L102 PolarHBondContact O-N 2.88Å; R100-H106 PolarHBondContact NH1-NE2 3.14Å; R100-H106 VanDerWaalsContact NH1-NE2 3.11Å
101	P	53.3	Low	60.1	Low	52 Å²	52	103.4 Å²	103.4	34%	0.338	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-53	148.5	173.9	23.3	-32	0	0	0	107.9	S103 M303	P101-S103 PolarHBondContact O-N 3.45Å; P101-M303 HydrophobicContact CG-CB 4.49Å; P101-M303 WeakPolarHBondContact CG-O 3.49Å
102	L	56.5	Low	60.2	Low	144 Å²	144	103.3 Å²	103.3	75%	0.754	53%	0.531	S	S	*	.			trans	-64	69.3	168.4	-75.3	164	0	0	0	108.4	R100 Q107	R100-L102 PolarHBondContact O-N 2.88Å; L102-Q107 HydrophobicContact CD2-CG 4.28Å
103	S	52.7	Low	60.5	Low	33 Å²	33	102.2 Å²	102.2	23%	0.231	53%	0.533	C	S	.	.			trans	-71	144.9	171.4	67.1	0	0	0	0	107.2	P101 S105 H106 Q107	P101-S103 PolarHBondContact O-N 3.45Å; S103-S105 PolarHBondContact O-N 3.44Å; S103-S105 PolarHBondContact OG-OG 2.66Å; S103-H106 PolarHBondContact O-N 3.07Å; S103-H106 PolarHBondContact OG-ND1 3.47Å; S103-Q107 PolarHBondContact O-N 3.29Å
104	P	56.1	Low	60.9	Low	112 Å²	112	99.1 Å²	99.1	73%	0.727	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-26.4	175.2	-28.2	34.9	0	0	0	113.1	H106 Q107	P104-H106 VanDerWaalsContact C-N 3.3Å; P104-H106 PolarHBondContact O-N 2.97Å; P104-Q107 PolarHBondContact O-N 2.88Å
105	S	54.1	Low	61.1	Low	94 Å²	94	101.3 Å²	101.3	66%	0.657	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.4	176.7	70.8	0	0	0	0	115.1	S103	S103-S105 PolarHBondContact O-N 3.44Å; S103-S105 PolarHBondContact OG-OG 2.66Å
106	H	57.2	Low	61.3	Low	104 Å²	104	99 Å²	99	48%	0.481	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-3.8	178.8	-62.8	97.4	0	0	0	112.7	R100 S103 P104	R100-H106 PolarHBondContact NH1-NE2 3.14Å; R100-H106 VanDerWaalsContact NH1-NE2 3.11Å; S103-H106 PolarHBondContact O-N 3.07Å; S103-H106 PolarHBondContact OG-ND1 3.47Å; P104-H106 VanDerWaalsContact C-N 3.3Å; P104-H106 PolarHBondContact O-N 2.97Å
107	Q	62.7	Low	61.7	Low	103 Å²	103	98.6 Å²	98.6	48%	0.481	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-83.8	119.3	171	-70.1	-178.6	-11.8	0	0	108.7	L102 S103 P104	L102-Q107 HydrophobicContact CD2-CG 4.28Å; S103-Q107 PolarHBondContact O-N 3.29Å; P104-Q107 PolarHBondContact O-N 2.88Å
108	T	62.8	Low	62	Low	91 Å²	91	103 Å²	103	56%	0.558	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-77.1	121.8	167.4	47.8	0	0	0	0	107.8	K112	T108-K112 HydrophobicContact CG2-CD 4.29Å
109	T	67.9	Low	62.3	Low	67 Å²	67	104.1 Å²	104.1	41%	0.411	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-65.4	149.6	171.1	54.4	0	0	0	0	109.4	T111 K112 E113 H183	T109-T111 PolarHBondContact O-N 3.16Å; T109-T111 VanDerWaalsContact O-N 3.09Å; T109-T111 PolarHBondContact OG1-OG1 3.35Å; T109-K112 WeakPolarHBondContact O-CA 3.26Å; T109-K112 WeakPolarHBondContact O-CB 3.18Å; T109-K112 PolarHBondContact O-N 3.22Å; T109-K112 VanDerWaalsContact OG1-CB 3.23Å; T109-K112 WeakPolarHBondContact OG1-CB 3.49Å; T109-K112 PolarHBondContact OG1-N 2.82Å; T109-K112 VanDerWaalsContact OG1-N 3.14Å; T109-E113 PolarHBondContact O-N 2.86Å; T109-H183 PolarHBondContact OG1-CE1 2.94Å
110	E	71.5	Confident	62.5	Low	165 Å²	165	94.9 Å²	94.9	77%	0.771	53%	0.526	S	S	*	.	H	α-helix	trans	-52.3	-34.4	175	-65.7	178.5	172.7	0	0	111.4	E113 S114	E110-E113 PolarHBondContact O-N 3.48Å; E110-S114 VanDerWaalsContact O-CB 3.29Å; E110-S114 WeakPolarHBondContact O-CB 3.18Å; E110-S114 PolarHBondContact O-N 2.66Å; E110-S114 PolarHBondContact O-OG 3.33Å
111	T	69.3	Low	62.5	Low	57 Å²	57	88.8 Å²	88.8	35%	0.35	51%	0.511	S	S	.	.	H	α-helix	trans	-70.4	-34.8	174	44.7	0	0	0	0	113.6	T109 Y115 H183	T109-T111 PolarHBondContact O-N 3.16Å; T109-T111 VanDerWaalsContact O-N 3.09Å; T109-T111 PolarHBondContact OG1-OG1 3.35Å; T111-Y115 CarbonylContact O-C 3.35Å; T111-Y115 VanDerWaalsContact O-CA 3.31Å; T111-Y115 WeakPolarHBondContact O-CA 3.46Å; T111-Y115 VanDerWaalsContact O-CB 3.27Å; T111-Y115 WeakPolarHBondContact O-CB 3.2Å; T111-Y115 PolarHBondContact O-N 3.47Å; T111-H183 PolarHBondContact OG1-CE1 3.46Å
112	K	69.9	Low	62.6	Low	61 Å²	61	92.4 Å²	92.4	27%	0.265	54%	0.538	S	S	.	.	H	α-helix	trans	-70.3	-36	173.7	-175.8	176.1	-174.5	170.8	0	111.3	T108 T109 G116 D182	T108-K112 HydrophobicContact CG2-CD 4.29Å; T109-K112 WeakPolarHBondContact O-CA 3.26Å; T109-K112 WeakPolarHBondContact O-CB 3.18Å; T109-K112 PolarHBondContact O-N 3.22Å; T109-K112 VanDerWaalsContact OG1-CB 3.23Å; T109-K112 WeakPolarHBondContact OG1-CB 3.49Å; T109-K112 PolarHBondContact OG1-N 2.82Å; T109-K112 VanDerWaalsContact OG1-N 3.14Å; K112-G116 VanDerWaalsContact O-CA 3.23Å; K112-G116 WeakPolarHBondContact O-CA 3.4Å; K112-G116 PolarHBondContact O-N 3.39Å; K112-D182 HydrophobicContact CD-CB 4.08Å; K112-D182 IonicContact NZ-OD1 3.86Å; K112-D182 PolarHBondContact NZ-OD1 3.14Å; K112-D182 IonicContact NZ-OD2 3.51Å; K112-D182 PolarHBondContact NZ-OD2 2.97Å
113	E	73.7	Confident	62.2	Low	151 Å²	151	92.7 Å²	92.7	71%	0.706	54%	0.535	S	S	*	.	H	α-helix	trans	-67.9	-44.9	175.3	-174.1	172.6	-165.3	0	0	111.6	T109 E110	T109-E113 PolarHBondContact O-N 2.86Å; E110-E113 PolarHBondContact O-N 3.48Å
114	S	71.7	Confident	62	Low	85 Å²	85	97.7 Å²	97.7	59%	0.594	56%	0.558	S	S	*	*	H	α-helix	trans	-81.8	-31.7	-176.6	-50.2	0	0	0	0	113.6	E110	E110-S114 VanDerWaalsContact O-CB 3.29Å; E110-S114 WeakPolarHBondContact O-CB 3.18Å; E110-S114 PolarHBondContact O-N 2.66Å; E110-S114 PolarHBondContact O-OG 3.33Å
115	Y	67.7	Low	61.3	Low	97 Å²	97	101.2 Å²	101.2	38%	0.38	56%	0.557	S	S	.	*	S	Bend	trans	-129.4	39.1	-173	-51.8	-79.8	0	0	0	112.1	T111 G117	T111-Y115 CarbonylContact O-C 3.35Å; T111-Y115 VanDerWaalsContact O-CA 3.31Å; T111-Y115 WeakPolarHBondContact O-CA 3.46Å; T111-Y115 VanDerWaalsContact O-CB 3.27Å; T111-Y115 WeakPolarHBondContact O-CB 3.2Å; T111-Y115 PolarHBondContact O-N 3.47Å; Y115-G117 PolarHBondContact O-N 2.88Å
116	G	66.3	Low	61.1	Low	36 Å²	36	105.9 Å²	105.9	37%	0.371	56%	0.561	S	S	.	*	B	Isolated β-bridge	trans	-50.9	138.1	173.6	0	0	0	0	0	111.5	K112	K112-G116 VanDerWaalsContact O-CA 3.23Å; K112-G116 WeakPolarHBondContact O-CA 3.4Å; K112-G116 PolarHBondContact O-N 3.39Å
117	G	63.5	Low	60.5	Low	31 Å²	31	102.4 Å²	102.4	32%	0.32	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-60.7	162.4	162.9	0	0	0	0	0	110.4	Y115 D119	Y115-G117 PolarHBondContact O-N 2.88Å; G117-D119 PolarHBondContact O-N 3.29Å
118	V	62.6	Low	59.6	Low	141 Å²	141	106.6 Å²	106.6	86%	0.855	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-55.2	126.7	165.5	179.7	0	0	0	0	106.6	G120	V118-G120 PolarHBondContact O-N 2.94Å
119	D	61.7	Low	59	Low	154 Å²	154	107.4 Å²	107.4	82%	0.824	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-48.9	118.9	174	-74.5	-32.2	0	0	0	107.2	G117	G117-D119 PolarHBondContact O-N 3.29Å
120	G	57.8	Low	58.4	Low	24 Å²	24	107.2 Å²	107.2	25%	0.247	58%	0.576	C	S	.	*	P	Polyproline II helix	trans	-52.6	158.9	171.7	0	0	0	0	0	108.9	V118 S122	V118-G120 PolarHBondContact O-N 2.94Å; G120-S122 PolarHBondContact O-N 3.04Å
121	P	54.2	Low	57.8	Low	62 Å²	62	108.3 Å²	108.3	40%	0.403	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-46.6	117.3	-177.1	18.7	-31.2	0	0	0	110.5	E123 L124	P121-E123 CarbonylContact C-O 3.58Å; P121-E123 CarbonylContact O-C 3.25Å; P121-E123 PolarHBondContact O-N 3.41Å; P121-L124 PolarHBondContact O-N 3.26Å
122	S	53.9	Low	57.4	Low	129 Å²	129	110.2 Å²	110.2	90%	0.902	59%	0.587	S	S	*	*	S	Bend	trans	-53.4	-29.8	-176.7	164.9	0	0	0	0	111.9	G120 L124	G120-S122 PolarHBondContact O-N 3.04Å; S122-L124 PolarHBondContact O-N 3.25Å
123	E	48.1	Very low	57.1	Low	150 Å²	150	108.6 Å²	108.6	70%	0.701	58%	0.58	S	S	*	*	S	Bend	trans	-82.9	105.4	162.2	-67.8	176	177.6	0	0	106.3	P121 W125	P121-E123 CarbonylContact C-O 3.58Å; P121-E123 CarbonylContact O-C 3.25Å; P121-E123 PolarHBondContact O-N 3.41Å; E123-W125 PolarHBondContact O-N 2.85Å
124	L	48.4	Very low	56.8	Low	138 Å²	138	105.6 Å²	105.6	72%	0.723	57%	0.566	S	S	*	*			trans	-50.8	93.6	147.3	-78.4	165.8	0	0	0	104.9	P121 S122 R126	P121-L124 PolarHBondContact O-N 3.26Å; S122-L124 PolarHBondContact O-N 3.25Å; L124-R126 HydrophobicContact CB-CG 4.09Å; L124-R126 PolarHBondContact O-N 2.82Å
125	W	42.6	Very low	56.5	Low	186 Å²	186	106.2 Å²	106.2	71%	0.705	56%	0.561	S	S	*	*			trans	-60	83.4	154.8	-142.2	86.2	0	0	0	101.8	E123 P127	E123-W125 PolarHBondContact O-N 2.85Å; W125-P127 VanDerWaalsContact C-N 3.3Å; W125-P127 HydrophobicContact CE3-CB 4.14Å; W125-P127 HydrophobicContact CE3-CG 4.27Å; W125-P127 HydrophobicContact CZ3-CB 3.98Å; W125-P127 WeakPolarHBondContact O-CD 3.19Å; W125-P127 VanDerWaalsContact O-N 3.16Å
126	R	48.9	Very low	56.4	Low	192 Å²	192	108.6 Å²	108.6	73%	0.725	58%	0.576	S	S	*	*			trans	-68.8	102.8	161.9	-64.5	-171.6	-166.4	-154.3	3.5	100.2	L124 L128	L124-R126 HydrophobicContact CB-CG 4.09Å; L124-R126 PolarHBondContact O-N 2.82Å; R126-L128 PolarHBondContact O-N 3Å
127	P	46.2	Very low	56.5	Low	31 Å²	31	109.2 Å²	109.2	20%	0.201	57%	0.571	C	S	.	*			trans	-54.2	122.4	158.3	4.2	11.8	0	0	0	102.5	W125 S129 M130	W125-P127 VanDerWaalsContact C-N 3.3Å; W125-P127 HydrophobicContact CE3-CB 4.14Å; W125-P127 HydrophobicContact CE3-CG 4.27Å; W125-P127 HydrophobicContact CZ3-CB 3.98Å; W125-P127 WeakPolarHBondContact O-CD 3.19Å; W125-P127 VanDerWaalsContact O-N 3.16Å; P127-S129 PolarHBondContact O-N 2.81Å; P127-M130 HydrophobicContact CB-CE 4.4Å; P127-M130 HydrophobicContact CB-CG 4.2Å; P127-M130 HydrophobicContact CG-CB 3.86Å; P127-M130 HydrophobicContact CG-CE 3.22Å; P127-M130 HydrophobicContact CG-CG 3.69Å; P127-M130 HydrophobicContact CG-SD 4.17Å; P127-M130 PolarHBondContact O-N 3.27Å
128	L	42.8	Very low	56.6	Low	190 Å²	190	108.8 Å²	108.8	100%	0.995	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	6	-169	-82.4	147.8	0	0	0	114.2	R126	R126-L128 PolarHBondContact O-N 3Å
129	S	51.1	Low	56.8	Low	108 Å²	108	107.8 Å²	107.8	76%	0.755	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-7.8	179.2	58	0	0	0	0	116.2	P127 R131	P127-S129 PolarHBondContact O-N 2.81Å; S129-R131 PolarHBondContact O-N 2.93Å
130	M	54.8	Low	57	Low	63 Å²	63	104.3 Å²	104.3	31%	0.31	53%	0.53	S	S	.	.			trans	-89.4	100.2	-179.1	-71.3	-151.1	-74.4	0	0	111.4	P127 L172	P127-M130 HydrophobicContact CB-CE 4.4Å; P127-M130 HydrophobicContact CB-CG 4.2Å; P127-M130 HydrophobicContact CG-CB 3.86Å; P127-M130 HydrophobicContact CG-CE 3.22Å; P127-M130 HydrophobicContact CG-CG 3.69Å; P127-M130 HydrophobicContact CG-SD 4.17Å; P127-M130 PolarHBondContact O-N 3.27Å; M130-L172 HydrophobicContact CE-CD1 4.24Å
131	R	59.2	Low	57.6	Low	189 Å²	189	109.9 Å²	109.9	71%	0.713	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-70.5	143.8	171	-159	172.2	178.8	161.6	-2.8	109.2	S129	S129-R131 PolarHBondContact O-N 2.93Å
132	P	61.2	Low	58.2	Low	96 Å²	96	107.4 Å²	107.4	62%	0.623	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-55.6	142.9	171.1	21.8	-31.8	0	0	0	110.4	E134	P132-E134 PolarHBondContact O-N 3.48Å
133	F	63.4	Low	58.8	Low	28 Å²	28	105.4 Å²	105.4	12%	0.123	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-75.6	120	-176.8	-62.1	-100.6	0	0	0	109.3	I147 I148 L172 P174	F133-I147 HydrophobicContact CE1-CB 3.95Å; F133-I147 HydrophobicContact CE1-CD1 4.11Å; F133-I147 HydrophobicContact CE1-CG2 3.92Å; F133-I147 HydrophobicContact CZ-CB 4.37Å; F133-I147 HydrophobicContact CZ-CD1 4.3Å; F133-I147 HydrophobicContact CZ-CG2 3.86Å; F133-I148 HydrophobicContact CD1-CD1 4.42Å; F133-I148 HydrophobicContact CE1-CD1 3.92Å; F133-I148 HydrophobicContact CE1-CG1 4.1Å; F133-I148 HydrophobicContact CZ-CD1 4.25Å; F133-L172 HydrophobicContact CD2-CB 3.81Å; F133-L172 HydrophobicContact CD2-CD2 4.21Å; F133-L172 HydrophobicContact CD2-CG 4.48Å; F133-L172 WeakPolarHBondContact CD2-O 3.44Å; F133-L172 HydrophobicContact CE2-CB 3.5Å; F133-L172 VanDerWaalsContact CE2-CB 3.5Å; F133-L172 HydrophobicContact CE2-CD1 4.02Å; F133-L172 HydrophobicContact CE2-CD2 4.14Å; F133-L172 HydrophobicContact CE2-CG 4.08Å; F133-P174 HydrophobicContact CB-CB 4.46Å
134	E	66.1	Low	59.6	Low	88 Å²	88	98.7 Å²	98.7	41%	0.411	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-83.2	127.7	168.6	-68.5	175.7	-160.9	0	0	108.2	P132 E136 D137 H138	P132-E134 PolarHBondContact O-N 3.48Å; E134-E136 PolarHBondContact O-N 3.31Å; E134-D137 HydrophobicContact CB-CB 4.07Å; E134-D137 WeakPolarHBondContact O-CB 3.4Å; E134-D137 PolarHBondContact O-N 2.9Å; E134-D137 VanDerWaalsContact O-N 3.13Å; E134-H138 PolarHBondContact O-N 2.78Å; E134-H138 VanDerWaalsContact O-N 3.1Å
135	I	66.4	Low	60.4	Low	98 Å²	98	94.7 Å²	94.7	50%	0.503	47%	0.471	S	S	.	.	H	α-helix	trans	-58.4	-37.7	179.8	-81	168.5	0	0	0	110.4	H138 H139 P174	I135-H138 PolarHBondContact O-N 3.43Å; I135-H139 VanDerWaalsContact CG2-CD2 3.46Å; I135-H139 WeakPolarHBondContact CG2-CD2 3.42Å; I135-H139 PolarHBondContact O-CD2 3.11Å; I135-H139 PolarHBondContact O-N 2.86Å; I135-P174 HydrophobicContact CG1-CB 3.93Å
136	E	65.5	Low	61.2	Low	146 Å²	146	91.6 Å²	91.6	68%	0.682	47%	0.468	S	S	*	.	H	α-helix	trans	-61.9	-44	175.7	-63.4	-173.2	173.2	0	0	111.9	E134 H138 H139 T140	E134-E136 PolarHBondContact O-N 3.31Å; E136-H138 VanDerWaalsContact C-N 3.28Å; E136-H138 PolarHBondContact O-N 3.46Å; E136-H139 PolarHBondContact O-N 3.31Å; E136-T140 WeakPolarHBondContact O-CB 3.25Å; E136-T140 WeakPolarHBondContact O-CG2 3.4Å; E136-T140 PolarHBondContact O-N 2.87Å; E136-T140 PolarHBondContact O-OG1 3.23Å
137	D	67.4	Low	61.8	Low	49 Å²	49	85.2 Å²	85.2	26%	0.262	45%	0.448	S	S	.	.	H	α-helix	trans	-65.5	-29.8	176.6	-81.6	-2.8	0	0	0	112.8	E134 T140 G142 S144	E134-D137 HydrophobicContact CB-CB 4.07Å; E134-D137 WeakPolarHBondContact O-CB 3.4Å; E134-D137 PolarHBondContact O-N 2.9Å; E134-D137 VanDerWaalsContact O-N 3.13Å; D137-T140 WeakPolarHBondContact CA-OG1 3.27Å; D137-T140 CarbonylContact O-C 3.07Å; D137-T140 PolarHBondContact O-OG1 2.75Å; D137-G142 WeakPolarHBondContact O-CA 3.31Å; D137-G142 PolarHBondContact O-N 3.04Å; D137-S144 VanDerWaalsContact CB-OG 3.28Å; D137-S144 WeakPolarHBondContact CB-OG 3.19Å; D137-S144 PolarHBondContact O-OG 3.07Å; D137-S144 VanDerWaalsContact O-OG 3.06Å
138	H	66.7	Low	62.2	Low	23 Å²	23	86.7 Å²	86.7	11%	0.106	45%	0.453	C	S	.	.	H	α-helix	trans	-76.1	-40.6	178.2	-177.1	5.5	0	0	0	111.3	E134 I135 E136 T140 S144 Y175	E134-H138 PolarHBondContact O-N 2.78Å; E134-H138 VanDerWaalsContact O-N 3.1Å; I135-H138 PolarHBondContact O-N 3.43Å; E136-H138 VanDerWaalsContact C-N 3.28Å; E136-H138 PolarHBondContact O-N 3.46Å; H138-T140 CarbonylContact C-O 3.58Å; H138-S144 VanDerWaalsContact CA-OG 3.3Å; H138-S144 WeakPolarHBondContact CA-OG 3.46Å; H138-S144 PolarHBondContact N-OG 3.42Å; H138-Y175 AromaticContact CD2-CE2 3.49Å; H138-Y175 VanDerWaalsContact CD2-CE2 3.49Å; H138-Y175 WeakPolarHBondContact CD2-CE2 3.37Å; H138-Y175 AromaticContact CD2-CZ 3.58Å; H138-Y175 PolarHBondContact CD2-OH 2.69Å; H138-Y175 AromaticContact NE2-CE2 3.13Å; H138-Y175 WeakPolarHBondContact NE2-CE2 3.37Å; H138-Y175 AromaticContact NE2-CZ 3.42Å; H138-Y175 PolarHBondContact NE2-OH 2.97Å
139	H	67.3	Low	62.6	Low	120 Å²	120	79.1 Å²	79.1	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-71.5	-33.6	177.9	-69.7	-49.4	0	0	0	112.1	I135 E136	I135-H139 VanDerWaalsContact CG2-CD2 3.46Å; I135-H139 WeakPolarHBondContact CG2-CD2 3.42Å; I135-H139 PolarHBondContact O-CD2 3.11Å; I135-H139 PolarHBondContact O-N 2.86Å; E136-H139 PolarHBondContact O-N 3.31Å
140	T	65.5	Low	62.6	Low	80 Å²	80	78.1 Å²	78.1	49%	0.491	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	166.1	167.6	59.6	0	0	0	0	110.5	E136 D137 H138 G142 K145	E136-T140 WeakPolarHBondContact O-CB 3.25Å; E136-T140 WeakPolarHBondContact O-CG2 3.4Å; E136-T140 PolarHBondContact O-N 2.87Å; E136-T140 PolarHBondContact O-OG1 3.23Å; D137-T140 WeakPolarHBondContact CA-OG1 3.27Å; D137-T140 CarbonylContact O-C 3.07Å; D137-T140 PolarHBondContact O-OG1 2.75Å; H138-T140 CarbonylContact C-O 3.58Å; T140-G142 PolarHBondContact O-N 3.38Å; T140-K145 WeakPolarHBondContact O-CD 3.03Å
141	D	69.6	Low	62.4	Low	142 Å²	142	82 Å²	82	76%	0.759	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	46.9	173.1	-76.3	-33.3	0	0	0	111.4	K145	D141-K145 VanDerWaalsContact OD1-CD 3.29Å; D141-K145 WeakPolarHBondContact OD1-CD 3.47Å; D141-K145 WeakPolarHBondContact OD1-CE 3.24Å; D141-K145 IonicContact OD1-NZ 3.18Å; D141-K145 PolarHBondContact OD1-NZ 3Å
142	G	68.1	Low	62.1	Low	10 Å²	10	81.4 Å²	81.4	10%	0.103	44%	0.438	C	S	.	.			trans	-78	170.3	-179.1	0	0	0	0	0	113.2	D137 T140 S144 K145	D137-G142 WeakPolarHBondContact O-CA 3.31Å; D137-G142 PolarHBondContact O-N 3.04Å; T140-G142 PolarHBondContact O-N 3.38Å; G142-S144 PolarHBondContact O-N 3.14Å; G142-S144 VanDerWaalsContact O-N 3.08Å; G142-K145 WeakPolarHBondContact O-CB 3.34Å; G142-K145 PolarHBondContact O-N 3.3Å
143	P	65.2	Low	62	Low	86 Å²	86	78.3 Å²	78.3	56%	0.558	42%	0.417	S	S	*	.	H	α-helix	trans	-59.4	-22.8	-178.5	22.7	-31.9	0	0	0	113.7	K145 N146	P143-K145 VanDerWaalsContact C-N 3.35Å; P143-N146 WeakPolarHBondContact O-CB 3.43Å; P143-N146 PolarHBondContact O-N 3.43Å
144	S	64.4	Low	62.1	Low	10 Å²	10	81.2 Å²	81.2	7%	0.07	45%	0.445	C	S	.	.	H	α-helix	trans	-68.1	-32.6	175.6	68.3	0	0	0	0	112.6	D137 H138 G142 N146 I147 I148	D137-S144 VanDerWaalsContact CB-OG 3.28Å; D137-S144 WeakPolarHBondContact CB-OG 3.19Å; D137-S144 PolarHBondContact O-OG 3.07Å; D137-S144 VanDerWaalsContact O-OG 3.06Å; H138-S144 VanDerWaalsContact CA-OG 3.3Å; H138-S144 WeakPolarHBondContact CA-OG 3.46Å; H138-S144 PolarHBondContact N-OG 3.42Å; G142-S144 PolarHBondContact O-N 3.14Å; G142-S144 VanDerWaalsContact O-N 3.08Å; S144-N146 VanDerWaalsContact C-N 3.26Å; S144-N146 PolarHBondContact O-N 3.48Å; S144-I147 PolarHBondContact O-N 3.49Å; S144-I147 VanDerWaalsContact O-N 3.12Å; S144-I148 PolarHBondContact O-N 3.34Å; S144-I148 VanDerWaalsContact O-N 3.16Å
145	K	65.6	Low	62	Low	54 Å²	54	81.5 Å²	81.5	24%	0.235	46%	0.457	C	S	.	.	H	α-helix	trans	-70.3	-20.9	174.9	-155.1	176.5	-174.9	176.7	0	112.7	T140 D141 G142 P143 I147 I148 P149	T140-K145 WeakPolarHBondContact O-CD 3.03Å; D141-K145 VanDerWaalsContact OD1-CD 3.29Å; D141-K145 WeakPolarHBondContact OD1-CD 3.47Å; D141-K145 WeakPolarHBondContact OD1-CE 3.24Å; D141-K145 IonicContact OD1-NZ 3.18Å; D141-K145 PolarHBondContact OD1-NZ 3Å; G142-K145 WeakPolarHBondContact O-CB 3.34Å; G142-K145 PolarHBondContact O-N 3.3Å; P143-K145 VanDerWaalsContact C-N 3.35Å; K145-I147 VanDerWaalsContact C-N 3.31Å; K145-I148 CarbonylContact O-C 3.48Å; K145-I148 VanDerWaalsContact O-C 3.25Å; K145-P149 WeakPolarHBondContact O-CA 3.42Å; K145-P149 WeakPolarHBondContact O-CB 3.41Å
146	N	60.9	Low	61.8	Low	120 Å²	120	80.1 Å²	80.1	64%	0.642	45%	0.451	S	S	*	.	H	α-helix	trans	-72.5	-25.7	170.8	-68.6	-25.9	0	0	0	112.6	P143 S144 N153	P143-N146 WeakPolarHBondContact O-CB 3.43Å; P143-N146 PolarHBondContact O-N 3.43Å; S144-N146 VanDerWaalsContact C-N 3.26Å; S144-N146 PolarHBondContact O-N 3.48Å; N146-N153 PolarHBondContact O-ND2 2.67Å
147	I	59.4	Low	61.5	Low	59 Å²	59	77.3 Å²	77.3	30%	0.303	45%	0.447	S	S	.	.	H	α-helix	trans	-84	-45.4	179.3	-54.9	171.4	0	0	0	109.7	F133 S144 K145 P149 N153	F133-I147 HydrophobicContact CE1-CB 3.95Å; F133-I147 HydrophobicContact CE1-CD1 4.11Å; F133-I147 HydrophobicContact CE1-CG2 3.92Å; F133-I147 HydrophobicContact CZ-CB 4.37Å; F133-I147 HydrophobicContact CZ-CD1 4.3Å; F133-I147 HydrophobicContact CZ-CG2 3.86Å; S144-I147 PolarHBondContact O-N 3.49Å; S144-I147 VanDerWaalsContact O-N 3.12Å; K145-I147 VanDerWaalsContact C-N 3.31Å; I147-P149 VanDerWaalsContact C-CD 3.49Å; I147-P149 WeakPolarHBondContact O-CD 3.31Å; I147-N153 PolarHBondContact O-ND2 3.15Å
148	I	55.2	Low	61.5	Low	62 Å²	62	78.9 Å²	78.9	32%	0.318	48%	0.475	S	S	.	.	S	Bend	trans	-120.4	80.2	174	-51.2	175.3	0	0	0	108.7	F133 S144 K145	F133-I148 HydrophobicContact CD1-CD1 4.42Å; F133-I148 HydrophobicContact CE1-CD1 3.92Å; F133-I148 HydrophobicContact CE1-CG1 4.1Å; F133-I148 HydrophobicContact CZ-CD1 4.25Å; S144-I148 PolarHBondContact O-N 3.34Å; S144-I148 VanDerWaalsContact O-N 3.16Å; K145-I148 CarbonylContact O-C 3.48Å; K145-I148 VanDerWaalsContact O-C 3.25Å
149	P	51.2	Low	61.5	Low	30 Å²	30	86.6 Å²	86.6	20%	0.195	50%	0.503	C	S	.	.			trans	-71.7	146.8	174.5	27.7	-32	0	0	0	109.1	K145 I147 T151 K152 N153	K145-P149 WeakPolarHBondContact O-CA 3.42Å; K145-P149 WeakPolarHBondContact O-CB 3.41Å; I147-P149 VanDerWaalsContact C-CD 3.49Å; I147-P149 WeakPolarHBondContact O-CD 3.31Å; P149-T151 PolarHBondContact O-N 3.11Å; P149-K152 WeakPolarHBondContact CG-O 3.16Å; P149-N153 WeakPolarHBondContact CD-ND2 3.35Å; P149-N153 HydrophobicContact CG-CB 3.25Å
150	S	50.9	Low	61.7	Low	88 Å²	88	86.5 Å²	86.5	62%	0.615	51%	0.511	S	S	*	.	S	Bend	trans	-32.6	102.4	161	53.1	0	0	0	0	111.6	K152	S150-K152 PolarHBondContact O-N 3.11Å
151	T	52	Low	61.7	Low	143 Å²	143	86.6 Å²	86.6	88%	0.877	51%	0.508	S	S	*	.	S	Bend	trans	50.1	-12.3	175.2	56.9	0	0	0	0	120.1	P149	P149-T151 PolarHBondContact O-N 3.11Å
152	K	51.4	Low	61.7	Low	177 Å²	177	85.3 Å²	85.3	77%	0.77	50%	0.497	S	S	*	.			trans	-148.4	95.6	-170.7	-66.7	-173.2	-179.7	179	0	112.7	P149 S150	P149-K152 WeakPolarHBondContact CG-O 3.16Å; S150-K152 PolarHBondContact O-N 3.11Å
153	N	60.2	Low	61.6	Low	32 Å²	32	89.5 Å²	89.5	17%	0.171	52%	0.522	C	S	.	.			trans	-97.6	101.9	167.8	-159.5	-28.1	0	0	0	110.1	N146 I147 P149 S155 L156 S157	N146-N153 PolarHBondContact O-ND2 2.67Å; I147-N153 PolarHBondContact O-ND2 3.15Å; P149-N153 WeakPolarHBondContact CD-ND2 3.35Å; P149-N153 HydrophobicContact CG-CB 3.25Å; N153-S155 PolarHBondContact O-N 2.97Å; N153-S155 PolarHBondContact OD1-N 3.1Å; N153-S155 VanDerWaalsContact OD1-N 3.14Å; N153-S155 PolarHBondContact OD1-OG 2.93Å; N153-L156 HydrophobicContact CB-CB 4.06Å; N153-L156 HydrophobicContact CB-CD1 4.27Å; N153-L156 HydrophobicContact CB-CG 4.32Å; N153-L156 VanDerWaalsContact ND2-CD1 3.31Å; N153-L156 WeakPolarHBondContact ND2-CD1 3.38Å; N153-L156 PolarHBondContact O-N 3.02Å; N153-S157 WeakPolarHBondContact O-CB 3.42Å; N153-S157 PolarHBondContact O-N 2.95Å
154	A	65.8	Low	61.5	Low	88 Å²	88	92.6 Å²	92.6	73%	0.727	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.5	179.3	0	0	0	0	0	112.9	S157	A154-S157 WeakPolarHBondContact CA-OG 3.26Å; A154-S157 PolarHBondContact O-OG 3.32Å
155	S	62.2	Low	61.4	Low	95 Å²	95	94.9 Å²	94.9	66%	0.664	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-26.7	-179.9	71.6	0	0	0	0	113.4	N153	N153-S155 PolarHBondContact O-N 2.97Å; N153-S155 PolarHBondContact OD1-N 3.1Å; N153-S155 VanDerWaalsContact OD1-N 3.14Å; N153-S155 PolarHBondContact OD1-OG 2.93Å
156	L	63.2	Low	61.5	Low	69 Å²	69	98.5 Å²	98.5	36%	0.361	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.6	-15.6	175.4	-60.9	175.6	0	0	0	112.4	N153 G158 R159	N153-L156 HydrophobicContact CB-CB 4.06Å; N153-L156 HydrophobicContact CB-CD1 4.27Å; N153-L156 HydrophobicContact CB-CG 4.32Å; N153-L156 VanDerWaalsContact ND2-CD1 3.31Å; N153-L156 WeakPolarHBondContact ND2-CD1 3.38Å; N153-L156 PolarHBondContact O-N 3.02Å; L156-G158 PolarHBondContact O-N 2.96Å; L156-G158 VanDerWaalsContact O-N 3.1Å; L156-R159 PolarHBondContact O-N 3Å; L156-R159 VanDerWaalsContact O-N 3.15Å
157	S	58.6	Low	61.8	Low	86 Å²	86	97.6 Å²	97.6	60%	0.601	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	111.8	177.1	65.2	0	0	0	0	110	N153 A154	N153-S157 WeakPolarHBondContact O-CB 3.42Å; N153-S157 PolarHBondContact O-N 2.95Å; A154-S157 WeakPolarHBondContact CA-OG 3.26Å; A154-S157 PolarHBondContact O-OG 3.32Å
158	G	67.3	Low	62.2	Low	82 Å²	82	96.4 Å²	96.4	85%	0.845	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.9	-5.8	-179.4	0	0	0	0	0	115.2	L156	L156-G158 PolarHBondContact O-N 2.96Å; L156-G158 VanDerWaalsContact O-N 3.1Å
159	R	67.7	Low	62.9	Low	185 Å²	185	96 Å²	96	70%	0.698	54%	0.54	S	S	*	.			trans	-78	130.2	175.9	-144.4	174.8	-176	-176	0.7	110	L156 L161	L156-R159 PolarHBondContact O-N 3Å; L156-R159 VanDerWaalsContact O-N 3.15Å; R159-L161 PolarHBondContact O-N 3.35Å; R159-L161 VanDerWaalsContact O-N 3.14Å
160	V	71.6	Confident	63.8	Low	119 Å²	119	100.2 Å²	100.2	72%	0.721	55%	0.552	S	S	*	*			trans	-70.6	109	174.8	-179.1	0	0	0	0	108.2
161	L	64.6	Low	64.7	Low	81 Å²	81	102 Å²	102	42%	0.424	55%	0.546	S	S	.	.			trans	-82.2	119.9	174.4	-68.1	171.2	0	0	0	109.5	R159 D165 K166 L169	R159-L161 PolarHBondContact O-N 3.35Å; R159-L161 VanDerWaalsContact O-N 3.14Å; L161-D165 HydrophobicContact CB-CB 4.48Å; L161-D165 HydrophobicContact CD2-CB 4.02Å; L161-K166 HydrophobicContact CB-CG 4.29Å; L161-L169 HydrophobicContact CD1-CD1 4.45Å; L161-L169 HydrophobicContact CD2-CD1 4.24Å
162	H	70.3	Confident	65.5	Low	116 Å²	116	97.5 Å²	97.5	54%	0.537	52%	0.516	S	S	.	.			trans	-71	155.1	171.2	-68.8	-72.3	0	0	0	110	K164 D165 K166	H162-K164 PolarHBondContact O-N 3.39Å; H162-K164 VanDerWaalsContact O-N 3.1Å; H162-D165 IonicContact CD2-OD2 2.67Å; H162-D165 PolarHBondContact N-OD2 3.29Å; H162-D165 WeakPolarHBondContact O-CA 3.13Å; H162-D165 WeakPolarHBondContact O-CB 3.49Å; H162-D165 PolarHBondContact O-N 2.82Å; H162-K166 PolarHBondContact O-N 2.7Å
163	P	66.7	Low	66.5	Low	97 Å²	97	91.4 Å²	91.4	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-51.6	-35.4	177.4	-28.4	35.2	0	0	0	113.6	D165 K166 E167	P163-D165 VanDerWaalsContact C-N 3.33Å; P163-D165 PolarHBondContact O-N 2.7Å; P163-K166 WeakPolarHBondContact O-CB 3.24Å; P163-K166 PolarHBondContact O-N 2.74Å; P163-E167 PolarHBondContact O-N 3.33Å
164	K	61.9	Low	66.9	Low	151 Å²	151	91 Å²	91	66%	0.657	49%	0.491	S	S	*	.	H	α-helix	trans	-63.2	-36	174.9	-63.3	-173.4	177.3	-173.7	0	113.2	H162 K166 E167 T168	H162-K164 PolarHBondContact O-N 3.39Å; H162-K164 VanDerWaalsContact O-N 3.1Å; K164-K166 VanDerWaalsContact C-N 3.32Å; K164-E167 PolarHBondContact O-N 2.9Å; K164-T168 WeakPolarHBondContact O-CG2 3.33Å; K164-T168 PolarHBondContact O-N 2.88Å; K164-T168 VanDerWaalsContact O-N 3.14Å; K164-T168 PolarHBondContact O-OG1 3.38Å
165	D	63.9	Low	67.2	Low	59 Å²	59	93.2 Å²	93.2	32%	0.316	48%	0.482	S	S	.	.	H	α-helix	trans	-70.7	-33.3	178.4	-54.8	-30	0	0	0	110.7	L161 H162 P163 T168 L169	L161-D165 HydrophobicContact CB-CB 4.48Å; L161-D165 HydrophobicContact CD2-CB 4.02Å; H162-D165 IonicContact CD2-OD2 2.67Å; H162-D165 PolarHBondContact N-OD2 3.29Å; H162-D165 WeakPolarHBondContact O-CA 3.13Å; H162-D165 WeakPolarHBondContact O-CB 3.49Å; H162-D165 PolarHBondContact O-N 2.82Å; P163-D165 VanDerWaalsContact C-N 3.33Å; P163-D165 PolarHBondContact O-N 2.7Å; D165-T168 VanDerWaalsContact CA-OG1 3.31Å; D165-T168 WeakPolarHBondContact CA-OG1 3.46Å; D165-T168 PolarHBondContact O-OG1 2.91Å; D165-L169 WeakPolarHBondContact O-CB 3.08Å; D165-L169 WeakPolarHBondContact O-CD1 3.44Å; D165-L169 WeakPolarHBondContact O-CG 3.39Å; D165-L169 PolarHBondContact O-N 2.61Å
166	K	66.9	Low	67.6	Low	130 Å²	130	90.2 Å²	90.2	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-67.8	-41.1	176.9	-65.5	-175.9	179.4	-178.6	0	112.1	L161 H162 P163 K164 R170	L161-K166 HydrophobicContact CB-CG 4.29Å; H162-K166 PolarHBondContact O-N 2.7Å; P163-K166 WeakPolarHBondContact O-CB 3.24Å; P163-K166 PolarHBondContact O-N 2.74Å; K164-K166 VanDerWaalsContact C-N 3.32Å; K166-R170 WeakPolarHBondContact O-CB 3.47Å; K166-R170 PolarHBondContact O-N 3.3Å
167	E	67.2	Low	67.9	Low	101 Å²	101	90.3 Å²	90.3	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-69.6	-40.4	178.7	-70.8	-179	172.1	0	0	112.1	P163 K164 R170 Y171	P163-E167 PolarHBondContact O-N 3.33Å; K164-E167 PolarHBondContact O-N 2.9Å; E167-R170 PolarHBondContact O-N 3.22Å; E167-Y171 PolarHBondContact O-N 3.4Å
168	T	67.2	Low	68.2	Low	34 Å²	34	91.7 Å²	91.7	21%	0.209	47%	0.466	C	S	.	.	H	α-helix	trans	-64.6	-43.4	175.4	47.3	0	0	0	0	111.8	K164 D165 R170 Y171 L172	K164-T168 WeakPolarHBondContact O-CG2 3.33Å; K164-T168 PolarHBondContact O-N 2.88Å; K164-T168 VanDerWaalsContact O-N 3.14Å; K164-T168 PolarHBondContact O-OG1 3.38Å; D165-T168 VanDerWaalsContact CA-OG1 3.31Å; D165-T168 WeakPolarHBondContact CA-OG1 3.46Å; D165-T168 PolarHBondContact O-OG1 2.91Å; T168-R170 PolarHBondContact O-N 2.92Å; T168-Y171 PolarHBondContact O-N 2.81Å; T168-L172 WeakPolarHBondContact O-CB 3.45Å; T168-L172 WeakPolarHBondContact O-CD1 3.3Å; T168-L172 VanDerWaalsContact O-CG 3.25Å; T168-L172 WeakPolarHBondContact O-CG 3.17Å; T168-L172 PolarHBondContact O-N 3.12Å; T168-L172 VanDerWaalsContact O-N 3.14Å
169	L	70.4	Confident	68.2	Low	53 Å²	53	94.3 Å²	94.3	28%	0.277	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-40.7	174	-73.3	169.2	0	0	0	112.5	L161 D165 Y171 L172 D173	L161-L169 HydrophobicContact CD1-CD1 4.45Å; L161-L169 HydrophobicContact CD2-CD1 4.24Å; D165-L169 WeakPolarHBondContact O-CB 3.08Å; D165-L169 WeakPolarHBondContact O-CD1 3.44Å; D165-L169 WeakPolarHBondContact O-CG 3.39Å; D165-L169 PolarHBondContact O-N 2.61Å; L169-Y171 VanDerWaalsContact C-N 3.35Å; L169-Y171 PolarHBondContact O-N 3.08Å; L169-L172 PolarHBondContact O-N 3.42Å; L169-D173 PolarHBondContact O-N 3.01Å; L169-D173 VanDerWaalsContact O-N 3.11Å
170	R	69.6	Low	68.3	Low	118 Å²	118	90.4 Å²	90.4	45%	0.445	44%	0.443	S	S	.	.	H	α-helix	trans	-61.7	-41.7	175.6	-178.7	-177.5	168	-155.3	-8.8	111.8	K166 E167 T168 L172 D173 L176 M180	K166-R170 WeakPolarHBondContact O-CB 3.47Å; K166-R170 PolarHBondContact O-N 3.3Å; E167-R170 PolarHBondContact O-N 3.22Å; T168-R170 PolarHBondContact O-N 2.92Å; R170-L172 PolarHBondContact O-N 2.73Å; R170-D173 PolarHBondContact O-N 3.2Å; R170-L176 HydrophobicContact CG-CD1 4.1Å; R170-L176 HydrophobicContact CG-CD2 4.39Å; R170-M180 PolarHBondContact NH2-O 3.16Å; R170-M180 VanDerWaalsContact NH2-O 3.07Å
171	Y	69.3	Low	68.2	Low	125 Å²	125	87.7 Å²	87.7	49%	0.49	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-31.7	177.8	-111.2	-82.2	0	0	0	112.9	E167 T168 L169 K181	E167-Y171 PolarHBondContact O-N 3.4Å; T168-Y171 PolarHBondContact O-N 2.81Å; L169-Y171 VanDerWaalsContact C-N 3.35Å; L169-Y171 PolarHBondContact O-N 3.08Å; Y171-K181 WeakPolarHBondContact O-CE 3.3Å; Y171-K181 PolarHBondContact O-NZ 3.01Å
172	L	70.4	Confident	68.2	Low	50 Å²	50	86.4 Å²	86.4	26%	0.262	42%	0.415	S	S	.	.	H	α-helix	trans	-88.4	-6.7	-176.6	-73.5	171.6	0	0	0	114.2	M130 F133 T168 L169 R170 P174	M130-L172 HydrophobicContact CE-CD1 4.24Å; F133-L172 HydrophobicContact CD2-CB 3.81Å; F133-L172 HydrophobicContact CD2-CD2 4.21Å; F133-L172 HydrophobicContact CD2-CG 4.48Å; F133-L172 WeakPolarHBondContact CD2-O 3.44Å; F133-L172 HydrophobicContact CE2-CB 3.5Å; F133-L172 VanDerWaalsContact CE2-CB 3.5Å; F133-L172 HydrophobicContact CE2-CD1 4.02Å; F133-L172 HydrophobicContact CE2-CD2 4.14Å; F133-L172 HydrophobicContact CE2-CG 4.08Å; T168-L172 WeakPolarHBondContact O-CB 3.45Å; T168-L172 WeakPolarHBondContact O-CD1 3.3Å; T168-L172 VanDerWaalsContact O-CG 3.25Å; T168-L172 WeakPolarHBondContact O-CG 3.17Å; T168-L172 PolarHBondContact O-N 3.12Å; T168-L172 VanDerWaalsContact O-N 3.14Å; L169-L172 PolarHBondContact O-N 3.42Å; R170-L172 PolarHBondContact O-N 2.73Å; L172-P174 WeakPolarHBondContact O-CD 3.45Å
173	D	71.6	Confident	68.1	Low	49 Å²	49	81.9 Å²	81.9	26%	0.262	39%	0.394	S	S	.	.			trans	-61.6	121.4	179.2	-171.3	-18.3	0	0	0	110.7	L169 R170 Y175 L176 K181	L169-D173 PolarHBondContact O-N 3.01Å; L169-D173 VanDerWaalsContact O-N 3.11Å; R170-D173 PolarHBondContact O-N 3.2Å; D173-Y175 PolarHBondContact O-N 3.36Å; D173-Y175 PolarHBondContact OD1-N 2.84Å; D173-L176 HydrophobicContact CB-CB 4.2Å; D173-L176 HydrophobicContact CB-CD1 3.55Å; D173-L176 HydrophobicContact CB-CG 4.48Å; D173-L176 PolarHBondContact O-N 3.48Å; D173-L176 WeakPolarHBondContact OD2-CD1 3.32Å; D173-K181 PolarHBondContact O-NZ 3.4Å
174	P	68.3	Low	68.3	Low	23 Å²	23	80.8 Å²	80.8	15%	0.149	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.4	179.6	27.4	-34.6	0	0	0	113.4	F133 I135 L172	F133-P174 HydrophobicContact CB-CB 4.46Å; I135-P174 HydrophobicContact CG1-CB 3.93Å; L172-P174 WeakPolarHBondContact O-CD 3.45Å
175	Y	72	Confident	68.7	Low	134 Å²	134	79.5 Å²	79.5	53%	0.525	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.6	178.4	-59.8	-71.6	0	0	0	113.7	H138 D173 T177	H138-Y175 AromaticContact CD2-CE2 3.49Å; H138-Y175 VanDerWaalsContact CD2-CE2 3.49Å; H138-Y175 WeakPolarHBondContact CD2-CE2 3.37Å; H138-Y175 AromaticContact CD2-CZ 3.58Å; H138-Y175 PolarHBondContact CD2-OH 2.69Å; H138-Y175 AromaticContact NE2-CE2 3.13Å; H138-Y175 WeakPolarHBondContact NE2-CE2 3.37Å; H138-Y175 AromaticContact NE2-CZ 3.42Å; H138-Y175 PolarHBondContact NE2-OH 2.97Å; D173-Y175 PolarHBondContact O-N 3.36Å; D173-Y175 PolarHBondContact OD1-N 2.84Å; Y175-T177 PolarHBondContact O-N 2.99Å
176	L	71	Confident	69	Low	32 Å²	32	81.2 Å²	81.2	17%	0.168	38%	0.384	C	S	.	.			trans	-75	119.2	176.8	-110.5	115.4	0	0	0	110.1	R170 D173 M180 K181	R170-L176 HydrophobicContact CG-CD1 4.1Å; R170-L176 HydrophobicContact CG-CD2 4.39Å; D173-L176 HydrophobicContact CB-CB 4.2Å; D173-L176 HydrophobicContact CB-CD1 3.55Å; D173-L176 HydrophobicContact CB-CG 4.48Å; D173-L176 PolarHBondContact O-N 3.48Å; D173-L176 WeakPolarHBondContact OD2-CD1 3.32Å; L176-M180 VanDerWaalsContact CD2-C 3.43Å; L176-M180 HydrophobicContact CD2-CB 3.44Å; L176-M180 VanDerWaalsContact CD2-CB 3.44Å; L176-M180 WeakPolarHBondContact CD2-O 2.98Å; L176-M180 HydrophobicContact CG-CB 3.95Å; L176-K181 HydrophobicContact CB-CD 4.48Å; L176-K181 HydrophobicContact CB-CG 3.94Å; L176-K181 HydrophobicContact CD2-CG 3.8Å; L176-K181 VanDerWaalsContact O-CE 3.24Å; L176-K181 WeakPolarHBondContact O-CE 3.05Å
177	T	68.9	Low	69.4	Low	72 Å²	72	80.3 Å²	80.3	44%	0.442	38%	0.38	S	S	.	.			trans	-63.7	155.1	171.5	61.6	0	0	0	0	110.8	Y175 Y179 M180 K181	Y175-T177 PolarHBondContact O-N 2.99Å; T177-Y179 PolarHBondContact O-N 3.3Å; T177-Y179 VanDerWaalsContact O-N 3.16Å; T177-M180 HydrophobicContact CG2-SD 4.48Å; T177-M180 PolarHBondContact O-N 3.18Å; T177-M180 VanDerWaalsContact OG1-CG 3.26Å; T177-M180 WeakPolarHBondContact OG1-CG 3.45Å; T177-M180 PolarHBondContact OG1-N 3.42Å; T177-K181 PolarHBondContact O-N 3.12Å
178	T	66.3	Low	69.8	Low	114 Å²	114	80 Å²	80	70%	0.699	39%	0.386	S	S	*	.	H	α-helix	trans	-51.5	-38.7	173.6	48.4	0	0	0	0	111.7	K181 D182	T178-K181 PolarHBondContact O-N 2.85Å; T178-D182 WeakPolarHBondContact O-CB 3.43Å; T178-D182 PolarHBondContact O-N 2.67Å
179	Y	65.6	Low	70.4	Confident	137 Å²	137	84.9 Å²	84.9	54%	0.537	41%	0.407	S	S	.	.	H	α-helix	trans	-59.5	-47.3	173.9	-170.3	-91.2	0	0	0	112.5	T177 K181 D182 H183	T177-Y179 PolarHBondContact O-N 3.3Å; T177-Y179 VanDerWaalsContact O-N 3.16Å; Y179-K181 VanDerWaalsContact C-N 3.28Å; Y179-K181 PolarHBondContact O-N 3.46Å; Y179-D182 PolarHBondContact O-N 2.81Å; Y179-H183 AromaticContact CD1-CD2 3.93Å; Y179-H183 AromaticContact CD2-CD2 3.18Å; Y179-H183 WeakPolarHBondContact CD2-CD2 3.4Å; Y179-H183 AromaticContact CD2-NE2 3.42Å; Y179-H183 WeakPolarHBondContact CD2-NE2 3.3Å; Y179-H183 HydrophobicContact CE1-CB 4.46Å; Y179-H183 AromaticContact CE1-CD2 3.99Å; Y179-H183 AromaticContact CE2-CD2 3.25Å; Y179-H183 WeakPolarHBondContact CE2-CD2 3.29Å; Y179-H183 AromaticContact CE2-NE2 3.4Å; Y179-H183 WeakPolarHBondContact CE2-NE2 3.46Å; Y179-H183 AromaticContact CG-CD2 3.53Å; Y179-H183 AromaticContact CZ-CD2 3.67Å; Y179-H183 WeakPolarHBondContact O-CB 3.49Å; Y179-H183 PolarHBondContact O-CD2 3.05Å; Y179-H183 PolarHBondContact O-N 3.2Å
180	M	70.1	Confident	70.5	Confident	104 Å²	104	83.9 Å²	83.9	51%	0.512	40%	0.401	S	S	.	.	H	α-helix	trans	-69.5	-24.1	179.4	-70.6	169.7	166	0	0	113.7	R170 L176 T177	R170-M180 PolarHBondContact NH2-O 3.16Å; R170-M180 VanDerWaalsContact NH2-O 3.07Å; L176-M180 VanDerWaalsContact CD2-C 3.43Å; L176-M180 HydrophobicContact CD2-CB 3.44Å; L176-M180 VanDerWaalsContact CD2-CB 3.44Å; L176-M180 WeakPolarHBondContact CD2-O 2.98Å; L176-M180 HydrophobicContact CG-CB 3.95Å; T177-M180 HydrophobicContact CG2-SD 4.48Å; T177-M180 PolarHBondContact O-N 3.18Å; T177-M180 VanDerWaalsContact OG1-CG 3.26Å; T177-M180 WeakPolarHBondContact OG1-CG 3.45Å; T177-M180 PolarHBondContact OG1-N 3.42Å
181	K	69.3	Low	70.6	Confident	62 Å²	62	82 Å²	82	27%	0.27	40%	0.4	S	S	.	.	H	α-helix	trans	-77.1	-44.8	175	-65.3	-172	-174.8	-162	0	111	Y171 D173 L176 T177 T178 Y179	Y171-K181 WeakPolarHBondContact O-CE 3.3Å; Y171-K181 PolarHBondContact O-NZ 3.01Å; D173-K181 PolarHBondContact O-NZ 3.4Å; L176-K181 HydrophobicContact CB-CD 4.48Å; L176-K181 HydrophobicContact CB-CG 3.94Å; L176-K181 HydrophobicContact CD2-CG 3.8Å; L176-K181 VanDerWaalsContact O-CE 3.24Å; L176-K181 WeakPolarHBondContact O-CE 3.05Å; T177-K181 PolarHBondContact O-N 3.12Å; T178-K181 PolarHBondContact O-N 2.85Å; Y179-K181 VanDerWaalsContact C-N 3.28Å; Y179-K181 PolarHBondContact O-N 3.46Å
182	D	66.2	Low	70.7	Confident	53 Å²	53	84.3 Å²	84.3	28%	0.283	41%	0.412	S	S	.	.	H	α-helix	trans	-82.1	-26.1	-173.5	-76.2	-16.2	0	0	0	113.9	K112 T178 Y179	K112-D182 HydrophobicContact CD-CB 4.08Å; K112-D182 IonicContact NZ-OD1 3.86Å; K112-D182 PolarHBondContact NZ-OD1 3.14Å; K112-D182 IonicContact NZ-OD2 3.51Å; K112-D182 PolarHBondContact NZ-OD2 2.97Å; T178-D182 WeakPolarHBondContact O-CB 3.43Å; T178-D182 PolarHBondContact O-N 2.67Å; Y179-D182 PolarHBondContact O-N 2.81Å
183	H	67.4	Low	70.4	Confident	22 Å²	22	89.8 Å²	89.8	10%	0.102	44%	0.436	C	S	.	.	B	Isolated β-bridge	trans	-106	132.4	-177.2	-59.9	-69	0	0	0	112	T109 T111 Y179	T109-H183 PolarHBondContact OG1-CE1 2.94Å; T111-H183 PolarHBondContact OG1-CE1 3.46Å; Y179-H183 AromaticContact CD1-CD2 3.93Å; Y179-H183 AromaticContact CD2-CD2 3.18Å; Y179-H183 WeakPolarHBondContact CD2-CD2 3.4Å; Y179-H183 AromaticContact CD2-NE2 3.42Å; Y179-H183 WeakPolarHBondContact CD2-NE2 3.3Å; Y179-H183 HydrophobicContact CE1-CB 4.46Å; Y179-H183 AromaticContact CE1-CD2 3.99Å; Y179-H183 AromaticContact CE2-CD2 3.25Å; Y179-H183 WeakPolarHBondContact CE2-CD2 3.29Å; Y179-H183 AromaticContact CE2-NE2 3.4Å; Y179-H183 WeakPolarHBondContact CE2-NE2 3.46Å; Y179-H183 AromaticContact CG-CD2 3.53Å; Y179-H183 AromaticContact CZ-CD2 3.67Å; Y179-H183 WeakPolarHBondContact O-CB 3.49Å; Y179-H183 PolarHBondContact O-CD2 3.05Å; Y179-H183 PolarHBondContact O-N 3.2Å
184	R	71.7	Confident	69.9	Low	74 Å²	74	89.1 Å²	89.1	28%	0.279	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-79.4	159.1	172	66.5	171.9	170.9	108.7	-5.5	111.6	W186 E190	R184-W186 PolarHBondContact O-N 2.86Å; R184-E190 IonicContact CZ-OE1 3.01Å; R184-E190 IonicContact CZ-OE2 3.4Å; R184-E190 IonicContact NH1-OE1 2.77Å; R184-E190 PolarHBondContact NH1-OE1 2.91Å; R184-E190 IonicContact NH1-OE2 2.78Å; R184-E190 PolarHBondContact NH1-OE2 3.09Å; R184-E190 VanDerWaalsContact NH1-OE2 3.16Å; R184-E190 IonicContact NH2-OE1 2.66Å; R184-E190 PolarHBondContact NH2-OE1 3.28Å; R184-E190 IonicContact NH2-OE2 3.69Å
185	V	70.2	Confident	69.2	Low	124 Å²	124	91 Å²	91	75%	0.752	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-63.6	131.4	167.2	-177.1	0	0	0	0	108.4
186	W	69.3	Low	68.6	Low	94 Å²	94	93.4 Å²	93.4	36%	0.356	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-68.6	142.1	-180	-66.4	7.8	0	0	0	110.7	R184 E190 L191 T194	R184-W186 PolarHBondContact O-N 2.86Å; W186-E190 WeakPolarHBondContact CA-OE2 3.36Å; W186-L191 HydrophobicContact CB-CD1 4.38Å; W186-L191 HydrophobicContact CB-CD2 4.46Å; W186-L191 HydrophobicContact CB-CG 4.05Å; W186-L191 HydrophobicContact CD2-CD2 4.38Å; W186-L191 HydrophobicContact CE3-CD2 3.41Å; W186-L191 VanDerWaalsContact CE3-CD2 3.41Å; W186-L191 HydrophobicContact CE3-CG 3.98Å; W186-L191 HydrophobicContact CZ3-CD2 4Å; W186-T194 HydrophobicContact CH2-CG2 4.33Å; W186-T194 HydrophobicContact CZ3-CG2 3.77Å
187	K	74.8	Confident	67.7	Low	111 Å²	111	100.8 Å²	100.8	48%	0.483	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-71.9	150.2	172.2	-69.7	177.6	-176.8	176.8	0	109.4	E189 E190 L191	K187-E189 PolarHBondContact O-N 3.28Å; K187-E189 VanDerWaalsContact O-N 3.08Å; K187-E190 HydrophobicContact CB-CG 4.16Å; K187-E190 PolarHBondContact N-OE2 3.3Å; K187-E190 PolarHBondContact O-N 3.07Å; K187-L191 PolarHBondContact O-N 3.08Å; K187-L191 VanDerWaalsContact O-N 3.14Å
188	P	75.4	Confident	67	Low	94 Å²	94	101.1 Å²	101.1	61%	0.61	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.3	175.7	24.5	-34.1	0	0	0	113.1	K192	P188-K192 WeakPolarHBondContact O-CG 3.47Å
189	E	80.2	Confident	66.2	Low	137 Å²	137	101.3 Å²	101.3	64%	0.64	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-43.9	173.8	-65.6	166.3	-174.1	0	0	112	K187 L191 K192 E193	K187-E189 PolarHBondContact O-N 3.28Å; K187-E189 VanDerWaalsContact O-N 3.08Å; E189-L191 VanDerWaalsContact C-N 3.31Å; E189-L191 PolarHBondContact O-N 3.32Å; E189-K192 WeakPolarHBondContact O-CB 3.35Å; E189-K192 PolarHBondContact O-N 2.48Å; E189-K192 VanDerWaalsContact O-N 3.08Å; E189-E193 PolarHBondContact O-N 3.1Å
190	E	72.2	Confident	65.7	Low	33 Å²	33	99.2 Å²	99.2	15%	0.154	49%	0.491	C	S	.	.	H	α-helix	trans	-65.7	-36	178.4	-65.9	160	-173.3	0	0	111.2	R184 W186 K187 K192 E193 T194	R184-E190 IonicContact CZ-OE1 3.01Å; R184-E190 IonicContact CZ-OE2 3.4Å; R184-E190 IonicContact NH1-OE1 2.77Å; R184-E190 PolarHBondContact NH1-OE1 2.91Å; R184-E190 IonicContact NH1-OE2 2.78Å; R184-E190 PolarHBondContact NH1-OE2 3.09Å; R184-E190 VanDerWaalsContact NH1-OE2 3.16Å; R184-E190 IonicContact NH2-OE1 2.66Å; R184-E190 PolarHBondContact NH2-OE1 3.28Å; R184-E190 IonicContact NH2-OE2 3.69Å; W186-E190 WeakPolarHBondContact CA-OE2 3.36Å; K187-E190 HydrophobicContact CB-CG 4.16Å; K187-E190 PolarHBondContact N-OE2 3.3Å; K187-E190 PolarHBondContact O-N 3.07Å; E190-K192 PolarHBondContact O-N 2.89Å; E190-E193 PolarHBondContact O-N 2.76Å; E190-T194 PolarHBondContact O-N 3.14Å
191	L	72.8	Confident	64.8	Low	79 Å²	79	96.3 Å²	96.3	41%	0.414	48%	0.479	S	S	.	.	H	α-helix	trans	-65	-25.5	174	-76.7	163.9	0	0	0	113.1	W186 K187 E189 T194	W186-L191 HydrophobicContact CB-CD1 4.38Å; W186-L191 HydrophobicContact CB-CD2 4.46Å; W186-L191 HydrophobicContact CB-CG 4.05Å; W186-L191 HydrophobicContact CD2-CD2 4.38Å; W186-L191 HydrophobicContact CE3-CD2 3.41Å; W186-L191 VanDerWaalsContact CE3-CD2 3.41Å; W186-L191 HydrophobicContact CE3-CG 3.98Å; W186-L191 HydrophobicContact CZ3-CD2 4Å; K187-L191 PolarHBondContact O-N 3.08Å; K187-L191 VanDerWaalsContact O-N 3.14Å; E189-L191 VanDerWaalsContact C-N 3.31Å; E189-L191 PolarHBondContact O-N 3.32Å; L191-T194 PolarHBondContact O-OG1 2.88Å
192	K	70.1	Confident	63.8	Low	173 Å²	173	99.5 Å²	99.5	75%	0.752	49%	0.49	S	S	*	.	H	α-helix	trans	-79.7	-27	177.1	-71.1	169.9	-177.1	-178	0	112.6	P188 E189 E190	P188-K192 WeakPolarHBondContact O-CG 3.47Å; E189-K192 WeakPolarHBondContact O-CB 3.35Å; E189-K192 PolarHBondContact O-N 2.48Å; E189-K192 VanDerWaalsContact O-N 3.08Å; E190-K192 PolarHBondContact O-N 2.89Å
193	E	66	Low	63.1	Low	164 Å²	164	99.6 Å²	99.6	77%	0.766	49%	0.49	S	S	*	.	H	α-helix	trans	-76.4	-27.2	176.4	-70.7	-177.2	171.3	0	0	112.2	E189 E190 S195	E189-E193 PolarHBondContact O-N 3.1Å; E190-E193 PolarHBondContact O-N 2.76Å; E193-S195 PolarHBondContact O-N 3.09Å; E193-S195 VanDerWaalsContact O-N 3.14Å
194	T	60.6	Low	62.3	Low	36 Å²	36	105 Å²	105	22%	0.221	52%	0.52	C	S	.	.	S	Bend	trans	-66.4	116.8	172.8	53.8	0	0	0	0	109.9	W186 E190 L191 E196	W186-T194 HydrophobicContact CH2-CG2 4.33Å; W186-T194 HydrophobicContact CZ3-CG2 3.77Å; E190-T194 PolarHBondContact O-N 3.14Å; L191-T194 PolarHBondContact O-OG1 2.88Å; T194-E196 PolarHBondContact O-N 3.47Å
195	S	53.8	Low	61.3	Low	61 Å²	61	107.1 Å²	107.1	43%	0.427	54%	0.541	S	S	.	.			trans	-51.7	130.8	-179.6	95	0	0	0	0	109.8	E193 K197 N198	E193-S195 PolarHBondContact O-N 3.09Å; E193-S195 VanDerWaalsContact O-N 3.14Å; S195-K197 PolarHBondContact O-N 2.85Å; S195-K197 PolarHBondContact OG-N 3.38Å; S195-N198 PolarHBondContact O-N 3Å
196	E	57.7	Low	60.4	Low	185 Å²	185	104 Å²	104	86%	0.864	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-11.1	177.6	-64.2	179	160.8	0	0	112.8	T194	T194-E196 PolarHBondContact O-N 3.47Å
197	K	54	Low	59.3	Low	188 Å²	188	102.8 Å²	102.8	82%	0.817	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-1.5	-179.6	-60.5	-176.1	179.9	-179.7	0	114.7	S195 M199	S195-K197 PolarHBondContact O-N 2.85Å; S195-K197 PolarHBondContact OG-N 3.38Å; K197-M199 PolarHBondContact O-N 3.08Å
198	N	53.8	Low	58	Low	78 Å²	78	103.7 Å²	103.7	42%	0.417	54%	0.54	S	S	.	.			trans	-72.4	96.5	172.3	-73.8	-12	0	0	0	109	S195 P200 T201 Y202	S195-N198 PolarHBondContact O-N 3Å; N198-P200 VanDerWaalsContact C-N 3.27Å; N198-P200 WeakPolarHBondContact O-CD 3.37Å; N198-P200 VanDerWaalsContact O-N 3.08Å; N198-T201 PolarHBondContact O-N 3.25Å; N198-T201 PolarHBondContact O-OG1 3.32Å; N198-Y202 PolarHBondContact O-N 3.07Å
199	M	49.6	Very low	56.6	Low	119 Å²	119	102.5 Å²	102.5	59%	0.586	53%	0.533	S	S	*	.	H	α-helix	trans	-45.3	-37.3	-177.7	-77.9	-166	83.5	0	0	115.5	K197 T201 L203 V213	K197-M199 PolarHBondContact O-N 3.08Å; M199-T201 VanDerWaalsContact C-N 3.33Å; M199-T201 PolarHBondContact O-N 3.1Å; M199-L203 WeakPolarHBondContact O-CD1 3.38Å; M199-L203 VanDerWaalsContact O-CG 3.26Å; M199-L203 WeakPolarHBondContact O-CG 3.29Å; M199-L203 PolarHBondContact O-N 3.37Å; M199-V213 HydrophobicContact CE-CG1 4.13Å
200	P	53.6	Low	55.2	Low	93 Å²	93	102.2 Å²	102.2	60%	0.604	54%	0.54	S	S	*	.	H	α-helix	trans	-67.8	-32.4	178.8	-18	31.3	0	0	0	113.2	N198	N198-P200 VanDerWaalsContact C-N 3.27Å; N198-P200 WeakPolarHBondContact O-CD 3.37Å; N198-P200 VanDerWaalsContact O-N 3.08Å
201	T	52.1	Low	53.7	Low	42 Å²	42	102.9 Å²	102.9	26%	0.258	55%	0.549	S	S	.	.	H	α-helix	trans	-82.4	-37.7	-176.8	-26.7	0	0	0	0	111.2	N198 M199 L203 N204 V205	N198-T201 PolarHBondContact O-N 3.25Å; N198-T201 PolarHBondContact O-OG1 3.32Å; M199-T201 VanDerWaalsContact C-N 3.33Å; M199-T201 PolarHBondContact O-N 3.1Å; T201-L203 VanDerWaalsContact C-N 3.34Å; T201-L203 PolarHBondContact O-N 3.38Å; T201-N204 PolarHBondContact O-N 3.04Å; T201-V205 WeakPolarHBondContact O-CG2 3.45Å; T201-V205 PolarHBondContact O-N 3.46Å
202	Y	48.5	Very low	52.1	Low	129 Å²	129	105.8 Å²	105.8	51%	0.506	56%	0.564	S	S	.	*	H	α-helix	trans	-60.2	-43.6	175.9	-175.5	-97.8	0	0	0	111.9	N198 N204 V205 T206	N198-Y202 PolarHBondContact O-N 3.07Å; Y202-N204 PolarHBondContact O-N 3.06Å; Y202-V205 PolarHBondContact O-N 3.18Å; Y202-T206 HydrophobicContact CE2-CG2 4.34Å; Y202-T206 PolarHBondContact O-N 3.13Å; Y202-T206 PolarHBondContact O-OG1 3.3Å
203	L	50.8	Low	50.6	Low	55 Å²	55	102.4 Å²	102.4	29%	0.288	56%	0.558	S	S	.	*	H	α-helix	trans	-67	-32.5	-177.2	-70.8	167.2	0	0	0	113.4	M199 T201	M199-L203 WeakPolarHBondContact O-CD1 3.38Å; M199-L203 VanDerWaalsContact O-CG 3.26Å; M199-L203 WeakPolarHBondContact O-CG 3.29Å; M199-L203 PolarHBondContact O-N 3.37Å; T201-L203 VanDerWaalsContact C-N 3.34Å; T201-L203 PolarHBondContact O-N 3.38Å
204	N	50.4	Low	49.1	Very low	135 Å²	135	104.5 Å²	104.5	72%	0.722	57%	0.565	S	S	*	*	H	α-helix	trans	-79.1	-30.7	178.2	-76.9	-20.2	0	0	0	113.3	T201 Y202	T201-N204 PolarHBondContact O-N 3.04Å; Y202-N204 PolarHBondContact O-N 3.06Å
205	V	51.6	Low	47.9	Very low	120 Å²	120	106.4 Å²	106.4	73%	0.727	59%	0.592	S	S	*	*	H	α-helix	trans	-78.1	-27.6	-178.7	173.1	0	0	0	0	112	T201 Y202	T201-V205 WeakPolarHBondContact O-CG2 3.45Å; T201-V205 PolarHBondContact O-N 3.46Å; Y202-V205 PolarHBondContact O-N 3.18Å
206	T	50.8	Low	47	Very low	59 Å²	59	108.2 Å²	108.2	36%	0.362	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.7	-0.1	-171.9	48.8	0	0	0	0	114.3	Y202 Y208	Y202-T206 HydrophobicContact CE2-CG2 4.34Å; Y202-T206 PolarHBondContact O-N 3.13Å; Y202-T206 PolarHBondContact O-OG1 3.3Å; T206-Y208 VanDerWaalsContact C-N 3.29Å; T206-Y208 HydrophobicContact CG2-CE2 4.49Å; T206-Y208 PolarHBondContact O-N 2.94Å; T206-Y208 WeakPolarHBondContact OG1-CD2 3.43Å
207	G	46.2	Very low	46.5	Very low	68 Å²	68	109.5 Å²	109.5	70%	0.701	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.5	20.8	173	0	0	0	0	0	114.9
208	Y	48.6	Very low	45.9	Very low	130 Å²	130	105 Å²	105	51%	0.51	60%	0.602	S	S	.	*			trans	-71.7	137.8	-179.5	-79.9	-81.5	0	0	0	111.8	T206 T210	T206-Y208 VanDerWaalsContact C-N 3.29Å; T206-Y208 HydrophobicContact CG2-CE2 4.49Å; T206-Y208 PolarHBondContact O-N 2.94Å; T206-Y208 WeakPolarHBondContact OG1-CD2 3.43Å; Y208-T210 PolarHBondContact O-N 3.33Å
209	P	45.1	Very low	45.8	Very low	69 Å²	69	110.6 Å²	110.6	45%	0.448	62%	0.623	S	S	.	*			trans	-63.4	125.3	174.8	24.7	-31.5	0	0	0	110.3	S211 I226	P209-S211 PolarHBondContact O-N 2.76Å; P209-I226 HydrophobicContact CB-CD1 4.06Å; P209-I226 HydrophobicContact CG-CD1 4.08Å
210	T	51.3	Low	45.8	Very low	131 Å²	131	110.4 Å²	110.4	80%	0.804	63%	0.631	S	S	*	*	S	Bend	trans	-68.4	16.4	-175.1	47.2	0	0	0	0	115.2	Y208	Y208-T210 PolarHBondContact O-N 3.33Å
211	S	40.8	Very low	45.7	Very low	47 Å²	47	112.2 Å²	112.2	33%	0.329	63%	0.634	S	S	.	*			trans	-111.3	115	178.6	67.9	0	0	0	0	110.9	P209	P209-S211 PolarHBondContact O-N 2.76Å
212	N	38.7	Very low	45.6	Very low	139 Å²	139	114.7 Å²	114.7	74%	0.743	65%	0.651	S	S	*	*			trans	107.8	71.9	169	-52.9	-10	0	0	0	114.4
213	V	38.4	Very low	45.9	Very low	102 Å²	102	115.4 Å²	115.4	62%	0.618	66%	0.662	S	S	*	*			trans	-118.7	78.5	162.1	-172.3	0	0	0	0	109.1	M199	M199-V213 HydrophobicContact CE-CG1 4.13Å
214	F	35.5	Very low	46.2	Very low	209 Å²	209	122 Å²	122	92%	0.917	69%	0.691	S	S	*	*	S	Bend	trans	-126.9	125.9	142.1	-103.5	-87.1	0	0	0	105.7
215	G	34.4	Very low	46.3	Very low	76 Å²	76	118.2 Å²	118.2	78%	0.784	69%	0.685	S	S	*	*			trans	-55.5	145.5	-161.9	0	0	0	0	0	114.8
216	S	35.3	Very low	46.3	Very low	98 Å²	98	116 Å²	116	69%	0.685	67%	0.668	S	S	*	*			trans	-179.3	142.7	154.2	31.7	0	0	0	0	109.3	S218	S216-S218 PolarHBondContact O-N 3.08Å
217	E	48.2	Very low	46.2	Very low	212 Å²	212	116.7 Å²	116.7	99%	0.991	69%	0.687	S	S	*	*			trans	-69.6	24.1	-165.2	-57.5	172.2	150.6	0	0	115
218	S	41.3	Very low	46.5	Very low	93 Å²	93	120.6 Å²	120.6	65%	0.65	68%	0.684	S	S	*	*			trans	-101.3	131.9	-174.5	60.3	0	0	0	0	112.4	S216	S216-S218 PolarHBondContact O-N 3.08Å
219	K	50.9	Low	46.9	Very low	197 Å²	197	122.9 Å²	122.9	86%	0.857	70%	0.7	S	S	*	*			trans	-41.9	138.9	-176.1	-61.7	174.3	-178.8	177.7	0	113.9
220	P	48.9	Very low	47.4	Very low	115 Å²	115	129.5 Å²	129.5	75%	0.747	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-66.8	139.6	-179.3	27.9	-33.7	0	0	0	111.9
221	I	52.7	Low	47.9	Very low	131 Å²	131	131.5 Å²	131.5	67%	0.672	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-75.2	133.9	177.4	-57.7	169.1	0	0	0	108.7
222	P	50	Low	48.8	Very low	93 Å²	93	131.4 Å²	131.4	60%	0.604	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-64	148.7	178.6	24.1	-32.1	0	0	0	112.7	E224 G225	P222-E224 PolarHBondContact O-N 3.29Å; P222-G225 PolarHBondContact O-N 3.01Å
223	I	55.3	Low	49.9	Very low	145 Å²	145	131.6 Å²	131.6	74%	0.744	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-53.3	-26.1	-174.4	-61.2	165.8	0	0	0	112.7	G225	I223-G225 PolarHBondContact O-N 2.83Å
224	E	55.4	Low	51	Low	192 Å²	192	131.6 Å²	131.6	90%	0.897	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-71.1	-13.9	179.1	-61.8	178.7	176.4	0	0	113.8	P222	P222-E224 PolarHBondContact O-N 3.29Å
225	G	52.5	Low	52.3	Low	57 Å²	57	124.9 Å²	124.9	59%	0.588	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-85.8	-5.9	-179.8	0	0	0	0	0	115.7	P222 I223 G227	P222-G225 PolarHBondContact O-N 3.01Å; I223-G225 PolarHBondContact O-N 2.83Å; G225-G227 VanDerWaalsContact C-N 3.32Å; G225-G227 PolarHBondContact O-N 3.24Å
226	I	52.4	Low	53.8	Low	73 Å²	73	126.6 Å²	126.6	37%	0.374	68%	0.683	S	S	.	*			trans	-96.2	54.1	-172.4	-45.3	177.2	0	0	0	110.5	P209 K228	P209-I226 HydrophobicContact CB-CD1 4.06Å; P209-I226 HydrophobicContact CG-CD1 4.08Å; I226-K228 HydrophobicContact CG2-CD 4.17Å; I226-K228 HydrophobicContact CG2-CG 4.08Å; I226-K228 PolarHBondContact O-N 2.95Å
227	G	48.3	Very low	55.6	Low	74 Å²	74	129.4 Å²	129.4	76%	0.763	69%	0.689	S	S	*	*			trans	-78	61.3	168.1	0	0	0	0	0	111.5	G225 Q229	G225-G227 VanDerWaalsContact C-N 3.32Å; G225-G227 PolarHBondContact O-N 3.24Å; G227-Q229 PolarHBondContact O-N 3.07Å; G227-Q229 VanDerWaalsContact O-N 3.09Å
228	K	52.7	Low	56.2	Low	149 Å²	149	127.2 Å²	127.2	65%	0.648	68%	0.676	S	S	*	*			trans	-79.8	91.8	179.1	-72.1	-176.1	179.2	175.8	0	110	I226 K230	I226-K228 HydrophobicContact CG2-CD 4.17Å; I226-K228 HydrophobicContact CG2-CG 4.08Å; I226-K228 PolarHBondContact O-N 2.95Å; K228-K230 PolarHBondContact O-N 3.21Å
229	Q	56.3	Low	57	Low	178 Å²	178	128.9 Å²	128.9	83%	0.832	67%	0.672	S	S	*	*			trans	-54.7	126.6	156	-68	-174.5	-5.7	0	0	107.4	G227 Q231	G227-Q229 PolarHBondContact O-N 3.07Å; G227-Q229 VanDerWaalsContact O-N 3.09Å; Q229-Q231 PolarHBondContact O-N 3.21Å
230	K	56.5	Low	57.7	Low	209 Å²	209	125.9 Å²	125.9	91%	0.909	67%	0.665	S	S	*	*			trans	-58.8	105.1	174.8	-83.6	-177.7	176.1	179	0	107.8	K228	K228-K230 PolarHBondContact O-N 3.21Å
231	Q	61.4	Low	58.2	Low	172 Å²	172	124.9 Å²	124.9	80%	0.804	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-75.9	139.9	171.3	-69	-172	-16	0	0	108.5	Q229	Q229-Q231 PolarHBondContact O-N 3.21Å
232	P	60.4	Low	58.6	Low	45 Å²	45	122.7 Å²	122.7	29%	0.292	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-60.2	149.1	175	25.7	-33.6	0	0	0	109.7	I234 P242	P232-I234 PolarHBondContact O-N 3.23Å; P232-P242 HydrophobicContact CB-CB 3.58Å; P232-P242 HydrophobicContact CG-CB 3.44Å; P232-P242 VanDerWaalsContact CG-CB 3.44Å
233	M	62	Low	58.9	Low	143 Å²	143	121.3 Å²	121.3	70%	0.704	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.5	116.2	178.2	-157.3	174.6	72.3	0	0	108.5
234	I	61.4	Low	59	Low	103 Å²	103	121.4 Å²	121.4	53%	0.528	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	115.1	178.6	-59.5	169.1	0	0	0	107.7	P232 T236	P232-I234 PolarHBondContact O-N 3.23Å; I234-T236 HydrophobicContact CG2-CG2 4.11Å
235	D	61.3	Low	59	Low	67 Å²	67	116.1 Å²	116.1	36%	0.358	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.6	99.9	167.7	-176.1	-1.9	0	0	0	108.5	L237 K238 F239	D235-L237 PolarHBondContact O-N 3.15Å; D235-L237 PolarHBondContact OD1-N 3.42Å; D235-K238 PolarHBondContact O-N 3.17Å; D235-F239 HydrophobicContact CB-CB 4.47Å; D235-F239 HydrophobicContact CB-CD2 4.28Å; D235-F239 CarbonylContact O-C 3.23Å; D235-F239 VanDerWaalsContact O-C 3.23Å; D235-F239 PolarHBondContact O-N 3.09Å; D235-F239 VanDerWaalsContact O-O 3.08Å
236	T	66.8	Low	59	Low	113 Å²	113	120.2 Å²	120.2	69%	0.693	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-11.7	-175.9	44.6	0	0	0	0	114.1	I234 N240	I234-T236 HydrophobicContact CG2-CG2 4.11Å; T236-N240 PolarHBondContact O-OD1 2.93Å
237	L	73.4	Confident	58.7	Low	156 Å²	156	127.3 Å²	127.3	82%	0.817	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-29.2	-178.9	-69.3	171.9	0	0	0	113.9	D235	D235-L237 PolarHBondContact O-N 3.15Å; D235-L237 PolarHBondContact OD1-N 3.42Å
238	K	60.8	Low	58.8	Low	166 Å²	166	131.4 Å²	131.4	72%	0.722	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.3	-26.2	-173	-91.1	-179.2	175.4	175.9	0	114.9	D235	D235-K238 PolarHBondContact O-N 3.17Å
239	F	57.6	Low	58.8	Low	128 Å²	128	132.3 Å²	132.3	56%	0.561	68%	0.676	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-137.2	83.5	-172.8	-57.2	-70.9	0	0	0	110.3	D235 C241	D235-F239 HydrophobicContact CB-CB 4.47Å; D235-F239 HydrophobicContact CB-CD2 4.28Å; D235-F239 CarbonylContact O-C 3.23Å; D235-F239 VanDerWaalsContact O-C 3.23Å; D235-F239 PolarHBondContact O-N 3.09Å; D235-F239 VanDerWaalsContact O-O 3.08Å; F239-C241 PolarHBondContact O-N 2.75Å; F239-C241 VanDerWaalsContact O-N 3.12Å
240	N	65.3	Low	58.4	Low	134 Å²	134	129.6 Å²	129.6	72%	0.717	67%	0.674	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.5	-6.1	179.1	-66.8	-8.2	0	0	0	113.8	T236	T236-N240 PolarHBondContact O-OD1 2.93Å
241	C	60.3	Low	58.2	Low	94 Å²	94	126.1 Å²	126.1	64%	0.635	66%	0.663	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	177.4	-64.4	0	0	0	0	110	F239 T243	F239-C241 PolarHBondContact O-N 2.75Å; F239-C241 VanDerWaalsContact O-N 3.12Å; C241-T243 PolarHBondContact O-N 2.67Å
242	P	60.6	Low	57.5	Low	85 Å²	85	122.3 Å²	122.3	55%	0.552	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-62.7	119.6	177	24.7	-32	0	0	0	110.5	P232	P232-P242 HydrophobicContact CB-CB 3.58Å; P232-P242 HydrophobicContact CG-CB 3.44Å; P232-P242 VanDerWaalsContact CG-CB 3.44Å
243	T	56.6	Low	57	Low	65 Å²	65	128.8 Å²	128.8	40%	0.399	68%	0.682	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	110.3	175.4	29.2	0	0	0	0	111.1	C241 S245	C241-T243 PolarHBondContact O-N 2.67Å; T243-S245 VanDerWaalsContact C-N 3.26Å; T243-S245 PolarHBondContact O-N 2.86Å
244	D	56.9	Low	56.3	Low	147 Å²	147	130 Å²	130	79%	0.786	69%	0.686	S	S	*	*			trans	-81.2	69.8	162.8	-91.8	-15.2	0	0	0	109.3
245	S	55.7	Low	55.7	Low	80 Å²	80	130.6 Å²	130.6	56%	0.559	69%	0.694	S	S	*	*			trans	-105.1	94.7	-179.1	65.7	0	0	0	0	112.1	T243	T243-S245 VanDerWaalsContact C-N 3.26Å; T243-S245 PolarHBondContact O-N 2.86Å
246	T	52.2	Low	55.2	Low	143 Å²	143	129.9 Å²	129.9	88%	0.877	70%	0.697	S	S	*	*			trans	-87.3	16.6	152.1	49.3	0	0	0	0	112.1	I248	T246-I248 PolarHBondContact O-N 3.1Å
247	R	46.7	Very low	54.4	Low	223 Å²	223	133.8 Å²	133.8	84%	0.842	71%	0.707	S	S	*	*			trans	-91	86.2	-175.4	-74.9	-175.6	176.4	178.9	-0.7	111.4	Q249	R247-Q249 PolarHBondContact O-N 3.19Å
248	I	50.4	Low	53.4	Low	160 Å²	160	131.7 Å²	131.7	82%	0.821	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-53.4	122	146.9	-60.4	169.9	0	0	0	105.5	T246	T246-I248 PolarHBondContact O-N 3.1Å
249	Q	52.6	Low	52.7	Low	168 Å²	168	131.7 Å²	131.7	79%	0.785	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-61.8	137.6	176.5	-66.9	-148.9	4.3	0	0	109	R247 I251	R247-Q249 PolarHBondContact O-N 3.19Å; Q249-I251 PolarHBondContact O-N 3.46Å
250	P	47.2	Very low	52.6	Low	121 Å²	121	132 Å²	132	79%	0.786	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-57.8	135.3	174.9	24.9	-32.1	0	0	0	108.8	S252	P250-S252 PolarHBondContact O-N 3.35Å; P250-S252 VanDerWaalsContact O-N 3.13Å
251	I	52.3	Low	52.3	Low	135 Å²	135	128.1 Å²	128.1	69%	0.692	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-56.7	119.4	179.1	-62	167.9	0	0	0	107.8	Q249 H253	Q249-I251 PolarHBondContact O-N 3.46Å; I251-H253 PolarHBondContact O-N 2.91Å
252	S	47.3	Very low	52.3	Low	93 Å²	93	128.7 Å²	128.7	65%	0.65	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-66	122.1	170.5	58.3	0	0	0	0	108.1	P250 H254	P250-S252 PolarHBondContact O-N 3.35Å; P250-S252 VanDerWaalsContact O-N 3.13Å; S252-H254 PolarHBondContact O-N 3.12Å
253	H	48.5	Very low	52.2	Low	181 Å²	181	129.4 Å²	129.4	84%	0.838	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-63.2	126.8	176.9	-61.2	64.3	0	0	0	108.2	I251 V255	I251-H253 PolarHBondContact O-N 2.91Å; H253-V255 PolarHBondContact O-N 3.18Å
254	H	48.6	Very low	52.6	Low	168 Å²	168	130.2 Å²	130.2	78%	0.778	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-64	129.4	173.8	-62.9	-74.6	0	0	0	109.1	S252 A256	S252-H254 PolarHBondContact O-N 3.12Å; H254-A256 PolarHBondContact O-N 3.2Å
255	V	49.1	Very low	53	Low	115 Å²	115	126.7 Å²	126.7	70%	0.697	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-65.5	123.1	170.8	178.5	0	0	0	0	107.5	H253 H257 F259	H253-V255 PolarHBondContact O-N 3.18Å; V255-H257 PolarHBondContact O-N 3.33Å; V255-F259 HydrophobicContact CG1-CD2 4.44Å
256	A	49.4	Very low	53.5	Low	53 Å²	53	130 Å²	130	44%	0.438	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-54.5	130.3	179	0	0	0	0	0	110.6	H254 T258 F259	H254-A256 PolarHBondContact O-N 3.2Å; A256-T258 PolarHBondContact O-N 3.27Å; A256-F259 HydrophobicContact CB-CE2 4.36Å
257	H	50.4	Low	54	Low	195 Å²	195	126.4 Å²	126.4	90%	0.903	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	14.3	-178.2	-66	-70.2	0	0	0	114.6	V255	V255-H257 PolarHBondContact O-N 3.33Å
258	T	52.5	Low	54.8	Low	112 Å²	112	124.9 Å²	124.9	69%	0.687	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-10.8	-175.1	48.3	0	0	0	0	113.9	A256 E260	A256-T258 PolarHBondContact O-N 3.27Å; T258-E260 PolarHBondContact O-N 3.13Å
259	F	45.9	Very low	55.4	Low	165 Å²	165	121.6 Å²	121.6	72%	0.724	63%	0.625	S	S	*	*			trans	-83.9	110.7	178.5	-63.4	-73.8	0	0	0	110.3	V255 A256 S261	V255-F259 HydrophobicContact CG1-CD2 4.44Å; A256-F259 HydrophobicContact CB-CE2 4.36Å; F259-S261 PolarHBondContact O-N 3.29Å
260	E	56.3	Low	55.8	Low	134 Å²	134	115.4 Å²	115.4	63%	0.626	60%	0.6	S	S	*	*			trans	-56.3	134.5	160.7	-68.9	-174.8	170.4	0	0	108.2	T258 Q264	T258-E260 PolarHBondContact O-N 3.13Å; E260-Q264 VanDerWaalsContact CA-OE1 3.29Å; E260-Q264 HydrophobicContact CB-CB 4.01Å
261	S	59.5	Low	56.7	Low	54 Å²	54	117.8 Å²	117.8	38%	0.378	61%	0.606	S	S	.	*			trans	-61.6	150.9	174.3	62.6	0	0	0	0	109.2	F259 Y263 Q264 S265	F259-S261 PolarHBondContact O-N 3.29Å; S261-Y263 CarbonylContact O-C 3.59Å; S261-Y263 PolarHBondContact O-N 3.32Å; S261-Q264 WeakPolarHBondContact O-CA 3.28Å; S261-Q264 WeakPolarHBondContact O-CB 3.41Å; S261-Q264 PolarHBondContact O-N 2.93Å; S261-Q264 WeakPolarHBondContact OG-CG 3.4Å; S261-Q264 PolarHBondContact OG-N 3.48Å; S261-S265 PolarHBondContact O-N 3.38Å; S261-S265 VanDerWaalsContact O-N 3.11Å
262	T	59.6	Low	57.4	Low	105 Å²	105	112.8 Å²	112.8	64%	0.644	58%	0.583	S	S	*	*	H	α-helix	trans	-51.4	-31.3	174	43.7	0	0	0	0	112	S265 E266	T262-S265 PolarHBondContact O-OG 3.3Å; T262-E266 WeakPolarHBondContact O-CB 3.36Å; T262-E266 PolarHBondContact O-N 3.47Å
263	Y	59.4	Low	58.1	Low	101 Å²	101	116.2 Å²	116.2	40%	0.396	59%	0.593	S	S	.	*	H	α-helix	trans	-63.1	-40.4	171.1	-171.6	-96.8	0	0	0	113.5	W17 S261 Y267	W17-Y263 HydrophobicContact CB-CE1 4.45Å; S261-Y263 CarbonylContact O-C 3.59Å; S261-Y263 PolarHBondContact O-N 3.32Å; Y263-Y267 HydrophobicContact CD2-CD2 4.34Å; Y263-Y267 AromaticContact CE2-CD2 3.71Å; Y263-Y267 HydrophobicContact CE2-CD2 3.71Å; Y263-Y267 AromaticContact CE2-CE2 3.77Å; Y263-Y267 HydrophobicContact CE2-CE2 3.77Å; Y263-Y267 HydrophobicContact CE2-CG 4.16Å; Y263-Y267 AromaticContact CZ-CD2 3.98Å; Y263-Y267 AromaticContact CZ-CE2 3.88Å; Y263-Y267 AromaticContact CZ-CZ 3.85Å; Y263-Y267 WeakPolarHBondContact O-CB 3.47Å; Y263-Y267 PolarHBondContact O-N 3.3Å; Y263-Y267 PolarHBondContact OH-OH 3.34Å
264	Q	63.2	Low	58.8	Low	82 Å²	82	113.3 Å²	113.3	38%	0.383	58%	0.583	S	S	.	*	H	α-helix	trans	-70.5	-39	176.8	-75.4	171.6	-15.6	0	0	112.5	E260 S261	E260-Q264 VanDerWaalsContact CA-OE1 3.29Å; E260-Q264 HydrophobicContact CB-CB 4.01Å; S261-Q264 WeakPolarHBondContact O-CA 3.28Å; S261-Q264 WeakPolarHBondContact O-CB 3.41Å; S261-Q264 PolarHBondContact O-N 2.93Å; S261-Q264 WeakPolarHBondContact OG-CG 3.4Å; S261-Q264 PolarHBondContact OG-N 3.48Å
265	S	65.5	Low	59.4	Low	73 Å²	73	109.7 Å²	109.7	51%	0.51	56%	0.563	S	S	.	*	H	α-helix	trans	-77.4	-34.8	-176.2	60.1	0	0	0	0	113.6	S261 T262	S261-S265 PolarHBondContact O-N 3.38Å; S261-S265 VanDerWaalsContact O-N 3.11Å; T262-S265 PolarHBondContact O-OG 3.3Å
266	E	66.5	Low	60.1	Low	149 Å²	149	114 Å²	114	70%	0.696	57%	0.572	S	S	*	*	H	α-helix	trans	-106.1	-15	-169.6	-64.6	178.3	178.5	0	0	114.3	T262 K268	T262-E266 WeakPolarHBondContact O-CB 3.36Å; T262-E266 PolarHBondContact O-N 3.47Å; E266-K268 PolarHBondContact O-N 2.87Å; E266-K268 VanDerWaalsContact O-N 3.14Å
267	Y	63.9	Low	60.6	Low	67 Å²	67	115.4 Å²	115.4	26%	0.263	58%	0.584	S	S	.	*			trans	-77.1	107.5	-172.4	-172.8	-106.4	0	0	0	113.2	F7 Y263 Q269	F7-Y267 VanDerWaalsContact CD1-OH 3.27Å; F7-Y267 WeakPolarHBondContact CD1-OH 3.41Å; F7-Y267 HydrophobicContact CE1-CE1 4.01Å; F7-Y267 AromaticContact CE1-CZ 3.56Å; F7-Y267 WeakPolarHBondContact CE1-OH 3.43Å; F7-Y267 HydrophobicContact CE2-CE1 4.31Å; F7-Y267 AromaticContact CE2-CE2 3.89Å; F7-Y267 HydrophobicContact CE2-CE2 3.89Å; F7-Y267 AromaticContact CE2-CZ 3.54Å; F7-Y267 VanDerWaalsContact CE2-OH 3.28Å; F7-Y267 WeakPolarHBondContact CE2-OH 3.05Å; F7-Y267 AromaticContact CZ-CE1 3.52Å; F7-Y267 HydrophobicContact CZ-CE1 3.52Å; F7-Y267 AromaticContact CZ-CE2 3.91Å; F7-Y267 HydrophobicContact CZ-CE2 3.91Å; F7-Y267 AromaticContact CZ-CZ 3.08Å; F7-Y267 WeakPolarHBondContact CZ-OH 3.34Å; Y263-Y267 HydrophobicContact CD2-CD2 4.34Å; Y263-Y267 AromaticContact CE2-CD2 3.71Å; Y263-Y267 HydrophobicContact CE2-CD2 3.71Å; Y263-Y267 AromaticContact CE2-CE2 3.77Å; Y263-Y267 HydrophobicContact CE2-CE2 3.77Å; Y263-Y267 HydrophobicContact CE2-CG 4.16Å; Y263-Y267 AromaticContact CZ-CD2 3.98Å; Y263-Y267 AromaticContact CZ-CE2 3.88Å; Y263-Y267 AromaticContact CZ-CZ 3.85Å; Y263-Y267 WeakPolarHBondContact O-CB 3.47Å; Y263-Y267 PolarHBondContact O-N 3.3Å; Y263-Y267 PolarHBondContact OH-OH 3.34Å; Y267-Q269 HydrophobicContact CE1-CG 4.42Å
268	K	62	Low	61.1	Low	191 Å²	191	109.1 Å²	109.1	83%	0.83	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-95.2	121.2	168.1	-71.1	-177.6	-179.9	175.8	0	110.4	E266 P270	E266-K268 PolarHBondContact O-N 2.87Å; E266-K268 VanDerWaalsContact O-N 3.14Å; K268-P270 WeakPolarHBondContact O-CD 3.46Å
269	Q	64.5	Low	61.3	Low	91 Å²	91	112.2 Å²	112.2	43%	0.425	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-68.1	120.6	177.1	-136.4	-169.5	-9.8	0	0	109.6	F7 H16 Y267 R275	F7-Q269 HydrophobicContact CE1-CG 4.07Å; F7-Q269 HydrophobicContact CZ-CB 4.49Å; F7-Q269 HydrophobicContact CZ-CG 3.65Å; H16-Q269 PolarHBondContact CE1-NE2 3.43Å; H16-Q269 PolarHBondContact NE2-NE2 3.08Å; H16-Q269 VanDerWaalsContact NE2-NE2 3.18Å; Y267-Q269 HydrophobicContact CE1-CG 4.42Å; Q269-R275 VanDerWaalsContact CB-NH2 3.32Å; Q269-R275 VanDerWaalsContact NE2-NH2 3.17Å
270	P	61.4	Low	61.8	Low	39 Å²	39	109.4 Å²	109.4	25%	0.253	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-67.4	141.9	179.9	26.7	-30.8	0	0	0	109.6	F7 K268 S272 R275	F7-P270 HydrophobicContact CD2-CG 3.74Å; F7-P270 HydrophobicContact CE2-CG 3.37Å; F7-P270 HydrophobicContact CZ-CG 4.07Å; K268-P270 WeakPolarHBondContact O-CD 3.46Å; P270-S272 PolarHBondContact O-N 3.37Å; P270-R275 PolarHBondContact O-NH2 3.27Å
271	N	65.5	Low	61.8	Low	170 Å²	170	106.2 Å²	106.2	91%	0.909	54%	0.544	S	S	*	.			trans	-96.7	66	-174.8	-155.7	15.7	0	0	0	109.5
272	S	65.7	Low	61.7	Low	30 Å²	30	106.6 Å²	106.6	21%	0.21	55%	0.546	C	S	.	.			trans	-101.3	142.5	-177.5	178.3	0	0	0	0	111.7	D4 P270 L274 R275	D4-S272 VanDerWaalsContact OD2-CB 3.23Å; D4-S272 WeakPolarHBondContact OD2-CB 3.07Å; D4-S272 PolarHBondContact OD2-OG 3.1Å; P270-S272 PolarHBondContact O-N 3.37Å; S272-L274 PolarHBondContact O-N 3.15Å; S272-L274 PolarHBondContact OG-N 3.42Å; S272-R275 WeakPolarHBondContact O-CB 3.4Å; S272-R275 PolarHBondContact O-N 3.35Å
273	L	63.9	Low	61.6	Low	165 Å²	165	105 Å²	105	86%	0.864	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-66.9	-21.3	172.5	-74.8	168.9	0	0	0	112.4	R275	L273-R275 PolarHBondContact O-N 3.47Å
274	L	62.8	Low	61.6	Low	121 Å²	121	107.4 Å²	107.4	63%	0.634	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-72.6	-9.7	-179.7	-62.6	175.3	0	0	0	113.2	S272 K276 A277	S272-L274 PolarHBondContact O-N 3.15Å; S272-L274 PolarHBondContact OG-N 3.42Å; L274-K276 PolarHBondContact O-N 3.49Å; L274-A277 WeakPolarHBondContact O-CB 3.25Å; L274-A277 PolarHBondContact O-N 3.05Å
275	R	61.4	Low	61.4	Low	92 Å²	92	104.6 Å²	104.6	35%	0.347	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-54.7	-26.3	177.3	-125.4	-167	-154.4	167.6	31.7	114.6	Q269 P270 S272 L273 A277 D278	Q269-R275 VanDerWaalsContact CB-NH2 3.32Å; Q269-R275 VanDerWaalsContact NE2-NH2 3.17Å; P270-R275 PolarHBondContact O-NH2 3.27Å; S272-R275 WeakPolarHBondContact O-CB 3.4Å; S272-R275 PolarHBondContact O-N 3.35Å; L273-R275 PolarHBondContact O-N 3.47Å; R275-A277 PolarHBondContact O-N 3.18Å; R275-D278 WeakPolarHBondContact CG-OD2 2.91Å; R275-D278 PolarHBondContact O-N 2.93Å
276	K	62	Low	61.3	Low	206 Å²	206	106.1 Å²	106.1	90%	0.896	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-64	-19.5	176.8	-69.1	-173.8	178.6	-178.7	0	112.6	L274	L274-K276 PolarHBondContact O-N 3.49Å
277	A	60.3	Low	61.2	Low	82 Å²	82	103 Å²	103	68%	0.678	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-96.4	-5	178.8	0	0	0	0	0	113.7	L274 R275 K279	L274-A277 WeakPolarHBondContact O-CB 3.25Å; L274-A277 PolarHBondContact O-N 3.05Å; R275-A277 PolarHBondContact O-N 3.18Å; A277-K279 PolarHBondContact O-N 3.04Å; A277-K279 VanDerWaalsContact O-N 3.17Å
278	D	60.7	Low	61.2	Low	63 Å²	63	102.4 Å²	102.4	34%	0.337	54%	0.54	S	S	.	.			trans	-67.4	115.7	179.7	-71.2	-25.1	0	0	0	110	R275 L280	R275-D278 WeakPolarHBondContact CG-OD2 2.91Å; R275-D278 PolarHBondContact O-N 2.93Å; D278-L280 PolarHBondContact O-N 2.73Å
279	K	57.3	Low	61.4	Low	176 Å²	176	97.7 Å²	97.7	77%	0.765	52%	0.523	S	S	*	.			trans	-72.5	99.4	169.1	-73.9	-175.3	178.9	179.7	0	108.3	A277 C281	A277-K279 PolarHBondContact O-N 3.04Å; A277-K279 VanDerWaalsContact O-N 3.17Å; K279-C281 PolarHBondContact O-N 3.01Å
280	L	57.3	Low	61.4	Low	106 Å²	106	93.8 Å²	93.8	56%	0.555	51%	0.506	S	S	*	.			trans	-71.4	110.5	177.6	-68.5	163.3	0	0	0	109.7	H16 D278 P282	H16-L280 HydrophobicContact CB-CD2 4.06Å; H16-L280 WeakPolarHBondContact CD2-CD2 3.4Å; D278-L280 PolarHBondContact O-N 2.73Å; L280-P282 WeakPolarHBondContact O-CD 3.38Å
281	C	55	Low	61.5	Low	67 Å²	67	96.9 Å²	96.9	45%	0.453	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	99.5	164.3	-160.3	0	0	0	0	107.3	V13 K279 T283	V13-C281 HydrophobicContact CG1-CB 3.83Å; K279-C281 PolarHBondContact O-N 3.01Å; C281-T283 PolarHBondContact O-N 3.06Å; C281-T283 VanDerWaalsContact O-N 3.15Å
282	P	58.3	Low	61.1	Low	63 Å²	63	92.2 Å²	92.2	41%	0.409	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	121.3	177.7	26.5	-31.8	0	0	0	108.2	L280 D284	L280-P282 WeakPolarHBondContact O-CD 3.38Å; P282-D284 PolarHBondContact O-N 3.11Å
283	T	56.8	Low	60.7	Low	72 Å²	72	92.5 Å²	92.5	44%	0.442	51%	0.506	S	S	.	.			trans	-71	119	166.1	-39.7	0	0	0	0	106.4	H15 C281 T285	H15-T283 PolarHBondContact ND1-OG1 3.47Å; C281-T283 PolarHBondContact O-N 3.06Å; C281-T283 VanDerWaalsContact O-N 3.15Å; T283-T285 PolarHBondContact O-N 3.31Å
284	D	58.8	Low	60.4	Low	150 Å²	150	86.9 Å²	86.9	80%	0.802	48%	0.479	S	S	*	.			trans	-55.9	108.4	174.7	-78.3	-26	0	0	0	108.3	P282	P282-D284 PolarHBondContact O-N 3.11Å
285	T	59.5	Low	60.4	Low	23 Å²	23	86.2 Å²	86.2	14%	0.141	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-75.4	135.6	175.6	48.9	0	0	0	0	108.2	R18 T283 F287	R18-T285 HydrophobicContact CB-CG2 4.42Å; R18-T285 WeakPolarHBondContact O-CG2 3.37Å; T283-T285 PolarHBondContact O-N 3.31Å; T285-F287 PolarHBondContact O-N 3.22Å
286	P	63	Low	60.4	Low	106 Å²	106	85 Å²	85	69%	0.688	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-60.2	143.7	177.7	25.5	-33.1	0	0	0	109.2	T288	P286-T288 PolarHBondContact O-N 3.35Å; P286-T288 VanDerWaalsContact O-N 3.15Å
287	F	65.3	Low	60.4	Low	84 Å²	84	78.6 Å²	78.6	37%	0.368	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-51.6	121.5	171.1	161.5	-115.7	0	0	0	109.4	F23 T285 L289 H298	F23-F287 HydrophobicContact CB-CD2 3.41Å; F23-F287 VanDerWaalsContact CB-CD2 3.41Å; F23-F287 HydrophobicContact CB-CE2 3.37Å; F23-F287 HydrophobicContact CB-CG 4.34Å; F23-F287 HydrophobicContact CB-CZ 4.21Å; F23-F287 WeakPolarHBondContact O-CE2 3.43Å; T285-F287 PolarHBondContact O-N 3.22Å; F287-L289 HydrophobicContact CD1-CD2 4.45Å; F287-L289 HydrophobicContact CD1-CG 4.5Å; F287-L289 HydrophobicContact CE1-CD2 3.48Å; F287-L289 VanDerWaalsContact CE1-CD2 3.48Å; F287-L289 HydrophobicContact CE1-CG 3.91Å; F287-L289 HydrophobicContact CZ-CD2 3.94Å; F287-L289 HydrophobicContact CZ-CG 4.45Å; F287-H298 HydrophobicContact CZ-CB 4.41Å
288	T	64.3	Low	60.5	Low	53 Å²	53	78.1 Å²	78.1	33%	0.325	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-89.1	116.5	175.3	48.5	0	0	0	0	109	F21 P286	F21-T288 PolarHBondContact O-OG1 3.06Å; P286-T288 PolarHBondContact O-N 3.35Å; P286-T288 VanDerWaalsContact O-N 3.15Å
289	L	65.3	Low	60.5	Low	93 Å²	93	75.6 Å²	75.6	49%	0.487	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-59.8	139.7	170.8	-72.1	158.4	0	0	0	109.3	F287 H298 T300	F287-L289 HydrophobicContact CD1-CD2 4.45Å; F287-L289 HydrophobicContact CD1-CG 4.5Å; F287-L289 HydrophobicContact CE1-CD2 3.48Å; F287-L289 VanDerWaalsContact CE1-CD2 3.48Å; F287-L289 HydrophobicContact CE1-CG 3.91Å; F287-L289 HydrophobicContact CZ-CD2 3.94Å; F287-L289 HydrophobicContact CZ-CG 4.45Å; L289-H298 VanDerWaalsContact CD2-O 3.29Å; L289-H298 WeakPolarHBondContact CD2-O 3.43Å; L289-T300 HydrophobicContact CD1-CG2 3.85Å
290	P	64.4	Low	60.4	Low	9 Å²	9	70 Å²	70	6%	0.058	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-67.7	154.3	173.1	26.6	-27.9	0	0	0	110.7	Y22 L296 H298 A299	Y22-P290 HydrophobicContact CD1-CB 4.35Å; Y22-P290 HydrophobicContact CE1-CB 4.37Å; P290-L296 HydrophobicContact CB-CD1 3.77Å; P290-L296 HydrophobicContact CG-CB 4.23Å; P290-L296 HydrophobicContact CG-CD1 3.94Å; P290-H298 WeakPolarHBondContact CD-O 3.46Å; P290-A299 HydrophobicContact CG-CB 4Å
291	D	63.2	Low	60.3	Low	104 Å²	104	68 Å²	68	56%	0.556	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-50.7	140.4	-175.5	-67.9	-20.2	0	0	0	112.1	G293 T294	D291-G293 PolarHBondContact O-N 2.86Å; D291-T294 HydrophobicContact CB-CG2 4.35Å; D291-T294 PolarHBondContact O-N 2.66Å; D291-T294 PolarHBondContact O-OG1 3.46Å
292	P	58.2	Low	60.5	Low	72 Å²	72	69.8 Å²	69.8	47%	0.468	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	131	179.5	21.6	-31.3	0	0	0	110.9	N302	P292-N302 WeakPolarHBondContact CB-OD1 3.44Å
293	G	56	Low	60.1	Low	35 Å²	35	71 Å²	71	36%	0.361	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	-2.8	-179.2	0	0	0	0	0	115.8	D291	D291-G293 PolarHBondContact O-N 2.86Å
294	T	59	Low	59.8	Low	48 Å²	48	76 Å²	76	29%	0.294	42%	0.422	S	S	.	.			trans	-65.9	143.9	167.9	48.1	0	0	0	0	111.1	Y98 D291 L296 A299	Y98-T294 PolarHBondContact OH-O 3.25Å; D291-T294 HydrophobicContact CB-CG2 4.35Å; D291-T294 PolarHBondContact O-N 2.66Å; D291-T294 PolarHBondContact O-OG1 3.46Å; T294-L296 PolarHBondContact O-N 3.17Å; T294-A299 WeakPolarHBondContact O-CB 3.28Å; T294-A299 WeakPolarHBondContact OG1-CB 2.73Å
295	V	62.4	Low	59.4	Low	106 Å²	106	78.6 Å²	78.6	64%	0.642	43%	0.426	S	S	*	.	S	Bend	trans	-74.7	35.9	-179.5	-162.7	0	0	0	0	111.5	L94	L94-V295 HydrophobicContact CB-CG1 4.15Å; L94-V295 HydrophobicContact CD1-CG1 4.29Å; L94-V295 HydrophobicContact CD2-CG1 4.39Å
296	L	61.6	Low	58.7	Low	68 Å²	68	80.7 Å²	80.7	36%	0.356	44%	0.438	S	S	.	.			trans	-103.6	138.8	-177.6	-61.4	-178.3	0	0	0	109.4	M29 P290 T294 H298 A299	M29-L296 HydrophobicContact CE-CB 4.44Å; M29-L296 HydrophobicContact CE-CD1 4.27Å; M29-L296 HydrophobicContact CE-CD2 3.67Å; M29-L296 HydrophobicContact CE-CG 4.34Å; M29-L296 HydrophobicContact SD-CD2 4.44Å; P290-L296 HydrophobicContact CB-CD1 3.77Å; P290-L296 HydrophobicContact CG-CB 4.23Å; P290-L296 HydrophobicContact CG-CD1 3.94Å; T294-L296 PolarHBondContact O-N 3.17Å; L296-H298 PolarHBondContact O-N 3.21Å; L296-H298 VanDerWaalsContact O-N 3.12Å; L296-A299 HydrophobicContact CB-CB 4.28Å; L296-A299 VanDerWaalsContact O-CB 3.3Å; L296-A299 WeakPolarHBondContact O-CB 2.89Å; L296-A299 PolarHBondContact O-N 3.36Å
297	V	62.3	Low	57.4	Low	70 Å²	70	83.7 Å²	83.7	42%	0.424	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.7	-178.4	-174.1	0	0	0	0	112.7	F89 L94	F89-V297 HydrophobicContact CD1-CG1 4.49Å; F89-V297 HydrophobicContact CD1-CG2 4Å; F89-V297 HydrophobicContact CE1-CB 3.94Å; F89-V297 HydrophobicContact CE1-CG1 3.41Å; F89-V297 VanDerWaalsContact CE1-CG1 3.41Å; F89-V297 HydrophobicContact CE1-CG2 3.34Å; F89-V297 HydrophobicContact CE2-CG1 4.44Å; F89-V297 HydrophobicContact CZ-CB 4.35Å; F89-V297 HydrophobicContact CZ-CG1 3.37Å; F89-V297 HydrophobicContact CZ-CG2 4.22Å; L94-V297 HydrophobicContact CD1-CG2 4.46Å
298	H	61	Low	56.2	Low	73 Å²	73	87.2 Å²	87.2	34%	0.338	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	4.9	-177.3	-52.9	-76.7	0	0	0	113	P24 F287 L289 P290 L296	P24-H298 WeakPolarHBondContact CD-CD2 3.42Å; P24-H298 WeakPolarHBondContact CD-NE2 2.74Å; F287-H298 HydrophobicContact CZ-CB 4.41Å; L289-H298 VanDerWaalsContact CD2-O 3.29Å; L289-H298 WeakPolarHBondContact CD2-O 3.43Å; P290-H298 WeakPolarHBondContact CD-O 3.46Å; L296-H298 PolarHBondContact O-N 3.21Å; L296-H298 VanDerWaalsContact O-N 3.12Å
299	A	61.2	Low	55.4	Low	10 Å²	10	86.5 Å²	86.5	8%	0.083	45%	0.453	C	S	.	.	S	Bend	trans	-68.8	142.2	173.2	0	0	0	0	0	110.1	P290 T294 L296 P301	P290-A299 HydrophobicContact CG-CB 4Å; T294-A299 WeakPolarHBondContact O-CB 3.28Å; T294-A299 WeakPolarHBondContact OG1-CB 2.73Å; L296-A299 HydrophobicContact CB-CB 4.28Å; L296-A299 VanDerWaalsContact O-CB 3.3Å; L296-A299 WeakPolarHBondContact O-CB 2.89Å; L296-A299 PolarHBondContact O-N 3.36Å; A299-P301 VanDerWaalsContact O-CD 3.26Å; A299-P301 WeakPolarHBondContact O-CD 3.27Å; A299-P301 VanDerWaalsContact O-N 3.15Å
300	T	55.9	Low	54.4	Low	58 Å²	58	86.9 Å²	86.9	36%	0.356	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-59.8	118.6	170.2	29.1	0	0	0	0	108.5	L289 N302	L289-T300 HydrophobicContact CD1-CG2 3.85Å; T300-N302 PolarHBondContact O-N 2.92Å
301	P	53.9	Low	53.1	Low	64 Å²	64	93.2 Å²	93.2	42%	0.416	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-63.7	136.6	176.4	23.3	-29.7	0	0	0	108.7	Y98 A299 M303	Y98-P301 HydrophobicContact CD1-CB 4.44Å; Y98-P301 HydrophobicContact CE1-CB 4.31Å; A299-P301 VanDerWaalsContact O-CD 3.26Å; A299-P301 WeakPolarHBondContact O-CD 3.27Å; A299-P301 VanDerWaalsContact O-N 3.15Å; P301-M303 HydrophobicContact CB-CG 3.67Å; P301-M303 HydrophobicContact CB-SD 4.45Å; P301-M303 HydrophobicContact CG-CE 4.29Å; P301-M303 HydrophobicContact CG-CG 3.67Å; P301-M303 HydrophobicContact CG-SD 3.97Å; P301-M303 PolarHBondContact O-N 3.23Å
302	N	59.3	Low	52	Low	104 Å²	104	91.9 Å²	91.9	56%	0.556	50%	0.501	S	S	*	.			trans	-68.3	69.3	170.1	-85.2	-11.8	0	0	0	109.7	P292 T300	P292-N302 WeakPolarHBondContact CB-OD1 3.44Å; T300-N302 PolarHBondContact O-N 2.92Å
303	M	51.6	Low	51.3	Low	90 Å²	90	94.7 Å²	94.7	44%	0.443	51%	0.508	S	S	.	.			trans	-80.6	-24.3	-174.6	-69	-156.7	-59.6	0	0	113	P101 P301	P101-M303 HydrophobicContact CG-CB 4.49Å; P101-M303 WeakPolarHBondContact CG-O 3.49Å; P301-M303 HydrophobicContact CB-CG 3.67Å; P301-M303 HydrophobicContact CB-SD 4.45Å; P301-M303 HydrophobicContact CG-CE 4.29Å; P301-M303 HydrophobicContact CG-CG 3.67Å; P301-M303 HydrophobicContact CG-SD 3.97Å; P301-M303 PolarHBondContact O-N 3.23Å
304	Y	50.2	Low	50.6	Low	177 Å²	177	103.7 Å²	103.7	69%	0.694	53%	0.533	S	S	*	.			trans	-127.1	107.1	-177.3	-55	-73.2	0	0	0	110.3	T306	Y304-T306 VanDerWaalsContact C-N 3.26Å; Y304-T306 PolarHBondContact O-N 3.04Å
305	K	49.2	Very low	49.8	Very low	204 Å²	204	108.9 Å²	108.9	89%	0.887	55%	0.554	S	S	*	*			trans	-85	81.4	150.1	-75.4	-172.1	177.9	-174.1	0	106.4
306	T	44.5	Very low	48.7	Very low	66 Å²	66	112.3 Å²	112.3	41%	0.405	56%	0.56	S	S	.	*			trans	-80.6	155.7	167.1	50.7	0	0	0	0	109	Y304 Y308 S309	Y304-T306 VanDerWaalsContact C-N 3.26Å; Y304-T306 PolarHBondContact O-N 3.04Å; T306-Y308 PolarHBondContact O-N 3.28Å; T306-S309 WeakPolarHBondContact O-CB 3.23Å; T306-S309 PolarHBondContact O-N 3.14Å; T306-S309 PolarHBondContact O-OG 3.41Å; T306-S309 VanDerWaalsContact O-OG 3.08Å
307	E	37.3	Very low	47.3	Very low	170 Å²	170	115 Å²	115	79%	0.794	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-48.2	-32.1	173.4	-38.8	-178.6	-144.9	0	0	111.7	S309	E307-S309 VanDerWaalsContact C-N 3.33Å; E307-S309 PolarHBondContact O-N 2.79Å
308	Y	40	Very low	45.9	Very low	158 Å²	158	119.6 Å²	119.6	62%	0.62	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-70.7	-14.1	176.8	-54.6	-67.9	0	0	0	115.8	T306 V310 I311	T306-Y308 PolarHBondContact O-N 3.28Å; Y308-V310 PolarHBondContact O-N 2.94Å; Y308-V310 VanDerWaalsContact O-N 3.09Å; Y308-I311 PolarHBondContact O-N 3.33Å; Y308-I311 VanDerWaalsContact O-N 3.17Å
309	S	47.6	Very low	44.5	Very low	38 Å²	38	127.1 Å²	127.1	27%	0.266	64%	0.641	S	S	.	*	G	3₁₀ helix	trans	-71.2	-2	179.5	75.8	0	0	0	0	113.1	T306 E307	T306-S309 WeakPolarHBondContact O-CB 3.23Å; T306-S309 PolarHBondContact O-N 3.14Å; T306-S309 PolarHBondContact O-OG 3.41Å; T306-S309 VanDerWaalsContact O-OG 3.08Å; E307-S309 VanDerWaalsContact C-N 3.33Å; E307-S309 PolarHBondContact O-N 2.79Å
310	V	44.1	Very low	43.6	Very low	101 Å²	101	133 Å²	133	61%	0.612	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-93.2	-20	175.9	-178	0	0	0	0	111.2	Y308 G312	Y308-V310 PolarHBondContact O-N 2.94Å; Y308-V310 VanDerWaalsContact O-N 3.09Å; V310-G312 PolarHBondContact O-N 3.06Å; V310-G312 VanDerWaalsContact O-N 3.1Å
311	I	36.2	Very low	43	Very low	141 Å²	141	136.9 Å²	136.9	72%	0.723	69%	0.685	S	S	*	*	S	Bend	trans	-86.5	90.6	-177.3	-53.8	178.9	0	0	0	108.6	Y308	Y308-I311 PolarHBondContact O-N 3.33Å; Y308-I311 VanDerWaalsContact O-N 3.17Å
312	G	41.5	Very low	42.4	Very low	76 Å²	76	140.9 Å²	140.9	78%	0.784	70%	0.7	S	S	*	*	S	Bend	trans	101.4	-9.7	170.2	0	0	0	0	0	116.3	V310	V310-G312 PolarHBondContact O-N 3.06Å; V310-G312 VanDerWaalsContact O-N 3.1Å
313	E	43.6	Very low	41.4	Very low	131 Å²	131	143.1 Å²	143.1	61%	0.612	71%	0.709	S	S	*	*			trans	-88.4	120.4	172	-68.8	-172	155.3	0	0	111.1	Q315	E313-Q315 PolarHBondContact O-N 3Å
314	Y	40.5	Very low	40.7	Very low	224 Å²	224	146.4 Å²	146.4	88%	0.878	73%	0.725	S	S	*	*			trans	-67	113.4	169.3	-132.4	-93.3	0	0	0	108	K316	Y314-K316 VanDerWaalsContact C-N 3.3Å; Y314-K316 PolarHBondContact O-N 3.35Å
315	Q	42.4	Very low	40.1	Very low	158 Å²	158	144.4 Å²	144.4	74%	0.738	73%	0.728	S	S	*	*			trans	-61.5	96.7	164.3	-74.6	-175.6	-3.1	0	0	107.8	E313 T317	E313-Q315 PolarHBondContact O-N 3Å; Q315-T317 VanDerWaalsContact C-N 3.28Å; Q315-T317 PolarHBondContact O-N 3.22Å
316	K	38.5	Very low	39.4	Very low	178 Å²	178	140.1 Å²	140.1	77%	0.774	72%	0.716	S	S	*	*			trans	-68.3	95.8	162.2	-86.7	-177.4	177.7	172.7	0	106.7	Y314 I318	Y314-K316 VanDerWaalsContact C-N 3.3Å; Y314-K316 PolarHBondContact O-N 3.35Å; K316-I318 PolarHBondContact O-N 3.35Å
317	T	32.5	Very low	39.1	Very low	123 Å²	123	145.8 Å²	145.8	76%	0.755	74%	0.74	S	S	*	*			trans	-56.2	108.9	162.8	32	0	0	0	0	108	Q315 L319	Q315-T317 VanDerWaalsContact C-N 3.28Å; Q315-T317 PolarHBondContact O-N 3.22Å; T317-L319 PolarHBondContact O-N 2.64Å
318	I	33.1	Very low	39.2	Very low	167 Å²	167	143.8 Å²	143.8	86%	0.856	74%	0.736	S	S	*	*			trans	-70.4	109.7	165.2	-58.7	170.8	0	0	0	105.2	K316	K316-I318 PolarHBondContact O-N 3.35Å
319	L	30.5	Very low	39.1	Very low	231 Å²	231	142.5 Å²	142.5	100%	1.209	75%	0.746	S	S	*	*			trans	-77.6	0	158.2	-84	169.8	0	0	0	109.4	T317	T317-L319 PolarHBondContact O-N 2.64Å

Retrieved 319 of 319 residues in 412.3 ms (Link to these results)

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