A0A077ZI29_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZI29, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 106 aa.

						>A0A077ZI29_TRITR|A0A077ZI29
MKIEVASVPDFITFDSDEEAFKPYCHVMDKADDEVSLRFGINEVQTEKKMLLTFCLEYLLIIPVNITQLFIADNANAMNFLQAGLSLLTVGPSGNSSDNEVTHNVK
					

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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	28.9	Very low	29.4	Very low	230 Å²	230	133.5 Å²	133.5	100%	1.133	72%	0.721	S	S	*	*				0	112.8	0	-170.1	170.3	176.7	0	0	106.9
2	K	25	Very low	30.3	Very low	206 Å²	206	129.2 Å²	129.2	90%	0.896	70%	0.696	S	S	*	*			trans	-89.7	121	172.6	-84.2	-178.6	173.6	-178.7	0	106.5
3	I	23.9	Very low	31.2	Very low	144 Å²	144	127.8 Å²	127.8	74%	0.738	70%	0.696	S	S	*	*			trans	-85.6	113.4	172.2	-60.8	174.1	0	0	0	105.8	V5	I3-V5 PolarHBondContact O-N 3.05Å
4	E	22.8	Very low	32.3	Very low	184 Å²	184	121.6 Å²	121.6	86%	0.86	66%	0.658	S	S	*	*			trans	-77.7	115	168	-73.3	-177.3	167.2	0	0	107.9	A6	E4-A6 PolarHBondContact O-N 3.26Å
5	V	28.4	Very low	33.5	Very low	113 Å²	113	124.5 Å²	124.5	69%	0.685	67%	0.673	S	S	*	*			trans	-79.1	103.7	170.4	-174	0	0	0	0	106.4	I3 S7	I3-V5 PolarHBondContact O-N 3.05Å; V5-S7 PolarHBondContact O-N 3.22Å
6	A	26.8	Very low	34.5	Very low	82 Å²	82	119.6 Å²	119.6	68%	0.678	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-58	136.5	172.4	0	0	0	0	0	109.5	E4 V8	E4-A6 PolarHBondContact O-N 3.26Å; A6-V8 PolarHBondContact O-N 3.14Å; A6-V8 VanDerWaalsContact O-N 3.16Å
7	S	30.1	Very low	35.4	Very low	116 Å²	116	117.9 Å²	117.9	81%	0.811	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-53.4	119.1	176	54.7	0	0	0	0	110.2	V5	V5-S7 PolarHBondContact O-N 3.22Å
8	V	31.6	Very low	36.7	Very low	44 Å²	44	119.1 Å²	119.1	27%	0.267	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-77.9	131.4	-179.1	-174.5	0	0	0	0	109.2	A6 I71 A72 A75	A6-V8 PolarHBondContact O-N 3.14Å; A6-V8 VanDerWaalsContact O-N 3.16Å; V8-I71 VanDerWaalsContact CG1-C 3.49Å; V8-I71 HydrophobicContact CG1-CB 3.93Å; V8-I71 HydrophobicContact CG1-CG2 3.76Å; V8-A72 HydrophobicContact CB-CB 3.82Å; V8-A72 HydrophobicContact CG1-CB 3.98Å; V8-A72 VanDerWaalsContact CG1-N 3.35Å; V8-A72 HydrophobicContact CG2-CB 4.22Å; V8-A75 HydrophobicContact CG2-CB 4.4Å
9	P	34.1	Very low	37.5	Very low	95 Å²	95	116.8 Å²	116.8	62%	0.617	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-59.4	143.4	179.1	-23.8	34.6	0	0	0	112.7	F11	P9-F11 PolarHBondContact O-N 3.08Å
10	D	34.4	Very low	38.1	Very low	143 Å²	143	111.4 Å²	111.4	77%	0.765	60%	0.599	S	S	*	*	S	Bend	trans	-61.6	122.8	179.2	-71.3	-43.3	0	0	0	111.6
11	F	37.7	Very low	38.8	Very low	111 Å²	111	111.3 Å²	111.3	49%	0.487	59%	0.594	S	S	.	*			trans	44.3	116.5	161	-54.3	-84.3	0	0	0	119.4	P9 F70	P9-F11 PolarHBondContact O-N 3.08Å; F11-F70 HydrophobicContact CD1-CD1 4.39Å; F11-F70 HydrophobicContact CD1-CE1 4.29Å; F11-F70 AromaticContact CE1-CD1 3.76Å; F11-F70 HydrophobicContact CE1-CD1 3.76Å; F11-F70 AromaticContact CE1-CE1 3.27Å; F11-F70 HydrophobicContact CE1-CE1 3.27Å; F11-F70 AromaticContact CE1-CZ 3.72Å; F11-F70 HydrophobicContact CE1-CZ 3.72Å; F11-F70 HydrophobicContact CZ-CD1 4.23Å; F11-F70 AromaticContact CZ-CE1 3.57Å; F11-F70 HydrophobicContact CZ-CE1 3.57Å; F11-F70 HydrophobicContact CZ-CZ 4.24Å
12	I	39.9	Very low	40	Very low	82 Å²	82	105.4 Å²	105.4	42%	0.421	56%	0.562	S	S	.	*			trans	-87.3	115.1	152.6	-74.2	158.4	0	0	0	106.5	F14 I71	I12-F14 HydrophobicContact CG2-CD1 4.2Å; I12-F14 HydrophobicContact CG2-CD2 4.15Å; I12-F14 HydrophobicContact CG2-CE1 3.8Å; I12-F14 HydrophobicContact CG2-CE2 3.74Å; I12-F14 HydrophobicContact CG2-CG 4.37Å; I12-F14 HydrophobicContact CG2-CZ 3.55Å; I12-I71 HydrophobicContact CB-CD1 4.24Å; I12-I71 HydrophobicContact CB-CG1 4.09Å; I12-I71 HydrophobicContact CD1-CD1 3.76Å; I12-I71 HydrophobicContact CD1-CG1 3.74Å; I12-I71 HydrophobicContact CG1-CD1 3.44Å; I12-I71 VanDerWaalsContact CG1-CD1 3.44Å; I12-I71 HydrophobicContact CG1-CG1 3.68Å
13	T	41.8	Very low	41.2	Very low	112 Å²	112	98.3 Å²	98.3	69%	0.687	54%	0.537	S	S	*	.			trans	-88.6	131.6	164.2	53.2	0	0	0	0	108.7
14	F	46.8	Very low	42.4	Very low	40 Å²	40	95.9 Å²	95.9	18%	0.175	52%	0.519	C	S	.	.			trans	-96.4	141.6	169.8	-62.1	-82.9	0	0	0	109.3	I12 S16 E19 A20 P23 L69	I12-F14 HydrophobicContact CG2-CD1 4.2Å; I12-F14 HydrophobicContact CG2-CD2 4.15Å; I12-F14 HydrophobicContact CG2-CE1 3.8Å; I12-F14 HydrophobicContact CG2-CE2 3.74Å; I12-F14 HydrophobicContact CG2-CG 4.37Å; I12-F14 HydrophobicContact CG2-CZ 3.55Å; F14-S16 WeakPolarHBondContact CB-O 3.3Å; F14-S16 PolarHBondContact O-N 3.01Å; F14-E19 HydrophobicContact CB-CB 4.15Å; F14-E19 HydrophobicContact CD1-CB 4.29Å; F14-E19 WeakPolarHBondContact CD1-O 3.19Å; F14-A20 HydrophobicContact CB-CB 3.77Å; F14-A20 HydrophobicContact CD1-CB 4.36Å; F14-A20 HydrophobicContact CD2-CB 3.45Å; F14-A20 VanDerWaalsContact CD2-CB 3.45Å; F14-A20 HydrophobicContact CE2-CB 4.09Å; F14-A20 HydrophobicContact CG-CB 3.6Å; F14-P23 HydrophobicContact CE1-CG 3.8Å; F14-P23 HydrophobicContact CZ-CG 4.07Å; F14-L69 HydrophobicContact CE2-CB 4Å; F14-L69 HydrophobicContact CE2-CD2 4.25Å
15	D	49.9	Very low	43.7	Very low	165 Å²	165	89.3 Å²	89.3	88%	0.882	49%	0.493	S	S	*	.	S	Bend	trans	-66.6	-17	-179.4	-67.8	-29.6	0	0	0	112.6
16	S	50.4	Low	45	Very low	47 Å²	47	89 Å²	89	33%	0.329	48%	0.484	S	S	.	.	S	Bend	trans	-157.6	163.3	173.6	64.7	0	0	0	0	111.4	F14 E18 E19 A20	F14-S16 WeakPolarHBondContact CB-O 3.3Å; F14-S16 PolarHBondContact O-N 3.01Å; S16-E18 PolarHBondContact O-N 2.69Å; S16-E18 PolarHBondContact OG-N 3.15Å; S16-E19 PolarHBondContact O-N 2.82Å; S16-E19 VanDerWaalsContact O-N 3.17Å; S16-E19 PolarHBondContact OG-N 2.85Å; S16-E19 VanDerWaalsContact OG-N 3.15Å; S16-A20 PolarHBondContact O-N 2.84Å
17	D	49.8	Very low	46.1	Very low	90 Å²	90	88.3 Å²	88.3	48%	0.481	47%	0.471	S	S	.	.	H	α-helix	trans	-58.5	-29.9	170.9	-63.1	-28	0	0	0	111.7	A20 F21 I66	D17-A20 PolarHBondContact O-N 3.05Å; D17-F21 WeakPolarHBondContact O-CB 3.41Å; D17-F21 PolarHBondContact O-N 3.05Å; D17-I66 HydrophobicContact CB-CG2 4.16Å
18	E	58.2	Low	47.1	Very low	139 Å²	139	84.7 Å²	84.7	65%	0.65	44%	0.441	S	S	*	.	H	α-helix	trans	-67	-45.1	175.6	-173.8	-176.9	165.8	0	0	111.7	S16 A20 F21 K22	S16-E18 PolarHBondContact O-N 2.69Å; S16-E18 PolarHBondContact OG-N 3.15Å; E18-A20 VanDerWaalsContact C-N 3.3Å; E18-A20 PolarHBondContact O-N 3.01Å; E18-F21 PolarHBondContact O-N 3.5Å; E18-F21 VanDerWaalsContact O-N 3.13Å; E18-K22 PolarHBondContact O-N 3.44Å
19	E	51.8	Low	48.2	Very low	77 Å²	77	87.4 Å²	87.4	36%	0.36	45%	0.454	S	S	.	.	H	α-helix	trans	-65.5	-35.1	174.8	-72	-60.9	149.3	0	0	111.7	F14 S16 F21 K22 P23	F14-E19 HydrophobicContact CB-CB 4.15Å; F14-E19 HydrophobicContact CD1-CB 4.29Å; F14-E19 WeakPolarHBondContact CD1-O 3.19Å; S16-E19 PolarHBondContact O-N 2.82Å; S16-E19 VanDerWaalsContact O-N 3.17Å; S16-E19 PolarHBondContact OG-N 2.85Å; S16-E19 VanDerWaalsContact OG-N 3.15Å; E19-F21 PolarHBondContact O-N 3.31Å; E19-K22 PolarHBondContact O-N 2.92Å; E19-K22 IonicContact OE1-NZ 2.63Å; E19-K22 PolarHBondContact OE1-NZ 3.41Å; E19-K22 IonicContact OE2-NZ 3.48Å; E19-K22 PolarHBondContact OE2-NZ 2.91Å; E19-P23 WeakPolarHBondContact O-CD 3.41Å
20	A	50	Low	49.2	Very low	8 Å²	8	88.8 Å²	88.8	7%	0.066	45%	0.451	C	S	.	.	H	α-helix	trans	-64.2	-30.7	172.9	0	0	0	0	0	112.4	F14 S16 D17 E18 I66	F14-A20 HydrophobicContact CB-CB 3.77Å; F14-A20 HydrophobicContact CD1-CB 4.36Å; F14-A20 HydrophobicContact CD2-CB 3.45Å; F14-A20 VanDerWaalsContact CD2-CB 3.45Å; F14-A20 HydrophobicContact CE2-CB 4.09Å; F14-A20 HydrophobicContact CG-CB 3.6Å; S16-A20 PolarHBondContact O-N 2.84Å; D17-A20 PolarHBondContact O-N 3.05Å; E18-A20 VanDerWaalsContact C-N 3.3Å; E18-A20 PolarHBondContact O-N 3.01Å; A20-I66 HydrophobicContact CB-CG2 4.22Å
21	F	52	Low	50	Low	110 Å²	110	82.9 Å²	82.9	48%	0.482	42%	0.422	S	S	.	.	H	α-helix	trans	-82.8	-23.9	-177.2	-154.6	-105.2	0	0	0	113.5	D17 E18 E19 Y24 C25	D17-F21 WeakPolarHBondContact O-CB 3.41Å; D17-F21 PolarHBondContact O-N 3.05Å; E18-F21 PolarHBondContact O-N 3.5Å; E18-F21 VanDerWaalsContact O-N 3.13Å; E19-F21 PolarHBondContact O-N 3.31Å; F21-Y24 HydrophobicContact CD1-CD1 4.37Å; F21-Y24 AromaticContact CD2-CD1 3.91Å; F21-Y24 HydrophobicContact CD2-CD1 3.91Å; F21-Y24 HydrophobicContact CD2-CE1 4.5Å; F21-Y24 HydrophobicContact CD2-CG 4.34Å; F21-Y24 AromaticContact CE1-CD1 4Å; F21-Y24 HydrophobicContact CE1-CD1 4Å; F21-Y24 HydrophobicContact CE1-CE1 4.26Å; F21-Y24 AromaticContact CE2-CD1 3.48Å; F21-Y24 HydrophobicContact CE2-CD1 3.48Å; F21-Y24 VanDerWaalsContact CE2-CD1 3.48Å; F21-Y24 AromaticContact CE2-CE1 3.63Å; F21-Y24 HydrophobicContact CE2-CE1 3.63Å; F21-Y24 HydrophobicContact CE2-CG 4.21Å; F21-Y24 HydrophobicContact CG-CD1 4.33Å; F21-Y24 AromaticContact CZ-CD1 3.53Å; F21-Y24 HydrophobicContact CZ-CD1 3.53Å; F21-Y24 AromaticContact CZ-CE1 3.49Å; F21-Y24 HydrophobicContact CZ-CE1 3.49Å; F21-Y24 VanDerWaalsContact CZ-CE1 3.49Å; F21-Y24 VanDerWaalsContact O-CB 3.3Å; F21-Y24 WeakPolarHBondContact O-CB 3.12Å; F21-Y24 PolarHBondContact O-N 2.72Å; F21-C25 WeakPolarHBondContact CD1-SG 3.03Å; F21-C25 WeakPolarHBondContact CE1-SG 3.46Å; F21-C25 PolarHBondContact O-N 3.44Å; F21-C25 PolarHBondContact O-SG 3.37Å
22	K	55.2	Low	50.7	Low	105 Å²	105	82 Å²	82	46%	0.457	42%	0.422	S	S	.	.	H	α-helix	trans	-61	-48.5	178.8	-71.9	175.1	-172.1	171.8	0	113.4	E18 E19 Y24 C25 H26	E18-K22 PolarHBondContact O-N 3.44Å; E19-K22 PolarHBondContact O-N 2.92Å; E19-K22 IonicContact OE1-NZ 2.63Å; E19-K22 PolarHBondContact OE1-NZ 3.41Å; E19-K22 IonicContact OE2-NZ 3.48Å; E19-K22 PolarHBondContact OE2-NZ 2.91Å; K22-Y24 VanDerWaalsContact C-N 3.26Å; K22-Y24 PolarHBondContact O-N 3.32Å; K22-C25 PolarHBondContact O-N 2.82Å; K22-H26 WeakPolarHBondContact O-CB 3.49Å; K22-H26 PolarHBondContact O-N 3Å
23	P	49	Very low	51.5	Low	57 Å²	57	83.4 Å²	83.4	37%	0.37	43%	0.43	S	S	.	.	H	α-helix	trans	-60.4	-37	173.4	-22.8	32.5	0	0	0	112.4	F14 E19 H26 V27	F14-P23 HydrophobicContact CE1-CG 3.8Å; F14-P23 HydrophobicContact CZ-CG 4.07Å; E19-P23 WeakPolarHBondContact O-CD 3.41Å; P23-H26 PolarHBondContact O-N 3.49Å; P23-V27 WeakPolarHBondContact O-CB 3.39Å; P23-V27 VanDerWaalsContact O-CG2 3.26Å; P23-V27 WeakPolarHBondContact O-CG2 3.44Å; P23-V27 PolarHBondContact O-N 3.49Å
24	Y	49	Very low	52	Low	93 Å²	93	82 Å²	82	37%	0.365	42%	0.416	S	S	.	.	H	α-helix	trans	-59.1	-53.2	175.5	169.4	-89	0	0	0	111.1	F21 K22 H26 V27 M28 L60	F21-Y24 HydrophobicContact CD1-CD1 4.37Å; F21-Y24 AromaticContact CD2-CD1 3.91Å; F21-Y24 HydrophobicContact CD2-CD1 3.91Å; F21-Y24 HydrophobicContact CD2-CE1 4.5Å; F21-Y24 HydrophobicContact CD2-CG 4.34Å; F21-Y24 AromaticContact CE1-CD1 4Å; F21-Y24 HydrophobicContact CE1-CD1 4Å; F21-Y24 HydrophobicContact CE1-CE1 4.26Å; F21-Y24 AromaticContact CE2-CD1 3.48Å; F21-Y24 HydrophobicContact CE2-CD1 3.48Å; F21-Y24 VanDerWaalsContact CE2-CD1 3.48Å; F21-Y24 AromaticContact CE2-CE1 3.63Å; F21-Y24 HydrophobicContact CE2-CE1 3.63Å; F21-Y24 HydrophobicContact CE2-CG 4.21Å; F21-Y24 HydrophobicContact CG-CD1 4.33Å; F21-Y24 AromaticContact CZ-CD1 3.53Å; F21-Y24 HydrophobicContact CZ-CD1 3.53Å; F21-Y24 AromaticContact CZ-CE1 3.49Å; F21-Y24 HydrophobicContact CZ-CE1 3.49Å; F21-Y24 VanDerWaalsContact CZ-CE1 3.49Å; F21-Y24 VanDerWaalsContact O-CB 3.3Å; F21-Y24 WeakPolarHBondContact O-CB 3.12Å; F21-Y24 PolarHBondContact O-N 2.72Å; K22-Y24 VanDerWaalsContact C-N 3.26Å; K22-Y24 PolarHBondContact O-N 3.32Å; Y24-H26 VanDerWaalsContact C-N 3.32Å; Y24-H26 PolarHBondContact O-N 3.1Å; Y24-V27 PolarHBondContact O-N 3.42Å; Y24-M28 HydrophobicContact CD1-CG 4.4Å; Y24-M28 HydrophobicContact CD2-CE 4.15Å; Y24-M28 HydrophobicContact CE1-CE 4.39Å; Y24-M28 HydrophobicContact CE1-CG 4.08Å; Y24-M28 HydrophobicContact CE2-CE 3.35Å; Y24-M28 HydrophobicContact CE2-CG 4.38Å; Y24-M28 VanDerWaalsContact CZ-CE 3.48Å; Y24-M28 VanDerWaalsContact O-CG 3.31Å; Y24-M28 WeakPolarHBondContact O-CG 3.19Å; Y24-M28 PolarHBondContact O-N 3.38Å; Y24-M28 WeakPolarHBondContact OH-CE 3.2Å; Y24-L60 HydrophobicContact CD2-CD1 4.31Å; Y24-L60 HydrophobicContact CD2-CD2 3.85Å; Y24-L60 HydrophobicContact CE2-CD1 3.61Å; Y24-L60 HydrophobicContact CE2-CD2 3.68Å; Y24-L60 HydrophobicContact CE2-CG 4.31Å
25	C	51.4	Low	51.9	Low	47 Å²	47	81.4 Å²	81.4	32%	0.318	42%	0.416	S	S	.	.	H	α-helix	trans	-58.1	-44.8	177.1	-68.6	0	0	0	0	111.7	F21 K22 V27 M28 D29	F21-C25 WeakPolarHBondContact CD1-SG 3.03Å; F21-C25 WeakPolarHBondContact CE1-SG 3.46Å; F21-C25 PolarHBondContact O-N 3.44Å; F21-C25 PolarHBondContact O-SG 3.37Å; K22-C25 PolarHBondContact O-N 2.82Å; C25-V27 VanDerWaalsContact C-N 3.34Å; C25-V27 PolarHBondContact O-N 2.81Å; C25-M28 WeakPolarHBondContact O-CB 3.35Å; C25-M28 PolarHBondContact O-N 2.91Å; C25-M28 VanDerWaalsContact O-N 3.15Å; C25-D29 WeakPolarHBondContact O-CB 3.25Å; C25-D29 VanDerWaalsContact O-CG 3.25Å; C25-D29 PolarHBondContact O-N 2.91Å
26	H	55.3	Low	52	Low	107 Å²	107	76.8 Å²	76.8	50%	0.495	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-36.3	-178.5	-173	75.6	0	0	0	113.4	K22 P23 Y24 K30	K22-H26 WeakPolarHBondContact O-CB 3.49Å; K22-H26 PolarHBondContact O-N 3Å; P23-H26 PolarHBondContact O-N 3.49Å; Y24-H26 VanDerWaalsContact C-N 3.32Å; Y24-H26 PolarHBondContact O-N 3.1Å; H26-K30 VanDerWaalsContact NE2-CE 3.3Å; H26-K30 WeakPolarHBondContact NE2-CE 3.13Å; H26-K30 WeakPolarHBondContact O-CB 3.36Å; H26-K30 WeakPolarHBondContact O-CG 3.49Å; H26-K30 PolarHBondContact O-N 3.44Å; H26-K30 VanDerWaalsContact O-N 3.1Å
27	V	49.2	Very low	52.2	Low	66 Å²	66	81.9 Å²	81.9	40%	0.4	42%	0.419	S	S	.	.	H	α-helix	trans	-68.4	-41.2	173.9	171.1	0	0	0	0	110.4	P23 Y24 C25 K30 A31	P23-V27 WeakPolarHBondContact O-CB 3.39Å; P23-V27 VanDerWaalsContact O-CG2 3.26Å; P23-V27 WeakPolarHBondContact O-CG2 3.44Å; P23-V27 PolarHBondContact O-N 3.49Å; Y24-V27 PolarHBondContact O-N 3.42Å; C25-V27 VanDerWaalsContact C-N 3.34Å; C25-V27 PolarHBondContact O-N 2.81Å; V27-K30 PolarHBondContact O-N 3.39Å; V27-A31 WeakPolarHBondContact O-CB 3.5Å; V27-A31 PolarHBondContact O-N 2.93Å
28	M	51	Low	52	Low	40 Å²	40	85.4 Å²	85.4	20%	0.197	43%	0.426	C	S	.	.	H	α-helix	trans	-63.3	-48.2	176.5	-69.9	-59	-174	0	0	112.1	Y24 C25 K30 A31 D32 L56 L60	Y24-M28 HydrophobicContact CD1-CG 4.4Å; Y24-M28 HydrophobicContact CD2-CE 4.15Å; Y24-M28 HydrophobicContact CE1-CE 4.39Å; Y24-M28 HydrophobicContact CE1-CG 4.08Å; Y24-M28 HydrophobicContact CE2-CE 3.35Å; Y24-M28 HydrophobicContact CE2-CG 4.38Å; Y24-M28 VanDerWaalsContact CZ-CE 3.48Å; Y24-M28 VanDerWaalsContact O-CG 3.31Å; Y24-M28 WeakPolarHBondContact O-CG 3.19Å; Y24-M28 PolarHBondContact O-N 3.38Å; Y24-M28 WeakPolarHBondContact OH-CE 3.2Å; C25-M28 WeakPolarHBondContact O-CB 3.35Å; C25-M28 PolarHBondContact O-N 2.91Å; C25-M28 VanDerWaalsContact O-N 3.15Å; M28-K30 VanDerWaalsContact C-N 3.32Å; M28-K30 PolarHBondContact O-N 2.88Å; M28-A31 PolarHBondContact O-N 3.47Å; M28-D32 WeakPolarHBondContact O-CB 3.28Å; M28-D32 PolarHBondContact O-N 3.25Å; M28-L56 HydrophobicContact CE-CB 4.42Å; M28-L56 HydrophobicContact CE-CD1 4.48Å; M28-L56 HydrophobicContact CE-CD2 3.98Å; M28-L56 HydrophobicContact SD-CD1 3.92Å; M28-L56 HydrophobicContact SD-CD2 3.8Å; M28-L56 HydrophobicContact SD-CG 4.4Å; M28-L60 HydrophobicContact CE-CD1 3.36Å
29	D	56.1	Low	51.3	Low	101 Å²	101	82.2 Å²	82.2	54%	0.54	41%	0.41	S	S	.	.	H	α-helix	trans	-59.5	-45.1	178.4	-69.3	-18.5	0	0	0	110.6	C25 A31 D32 D33	C25-D29 WeakPolarHBondContact O-CB 3.25Å; C25-D29 VanDerWaalsContact O-CG 3.25Å; C25-D29 PolarHBondContact O-N 2.91Å; D29-A31 PolarHBondContact O-N 2.88Å; D29-D32 PolarHBondContact O-N 3.22Å; D29-D33 WeakPolarHBondContact O-CB 3.26Å; D29-D33 PolarHBondContact O-N 3.15Å
30	K	54.1	Low	51.1	Low	125 Å²	125	80.9 Å²	80.9	54%	0.543	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-39.7	175.8	-81.9	-172.8	170.1	-173.5	0	113.5	H26 V27 M28 E34	H26-K30 VanDerWaalsContact NE2-CE 3.3Å; H26-K30 WeakPolarHBondContact NE2-CE 3.13Å; H26-K30 WeakPolarHBondContact O-CB 3.36Å; H26-K30 WeakPolarHBondContact O-CG 3.49Å; H26-K30 PolarHBondContact O-N 3.44Å; H26-K30 VanDerWaalsContact O-N 3.1Å; V27-K30 PolarHBondContact O-N 3.39Å; M28-K30 VanDerWaalsContact C-N 3.32Å; M28-K30 PolarHBondContact O-N 2.88Å; K30-E34 VanDerWaalsContact O-CB 3.28Å; K30-E34 WeakPolarHBondContact O-CB 3.47Å; K30-E34 PolarHBondContact O-N 3.49Å
31	A	50.8	Low	51	Low	18 Å²	18	88 Å²	88	15%	0.149	45%	0.452	C	S	.	.	H	α-helix	trans	-66.9	-42.4	178.4	0	0	0	0	0	110.9	V27 M28 D29 E34 V35	V27-A31 WeakPolarHBondContact O-CB 3.5Å; V27-A31 PolarHBondContact O-N 2.93Å; M28-A31 PolarHBondContact O-N 3.47Å; D29-A31 PolarHBondContact O-N 2.88Å; A31-E34 PolarHBondContact O-N 2.72Å; A31-V35 WeakPolarHBondContact O-CB 3.35Å; A31-V35 WeakPolarHBondContact O-CG2 3.28Å; A31-V35 PolarHBondContact O-N 2.75Å
32	D	52.1	Low	50.8	Low	94 Å²	94	88.9 Å²	88.9	50%	0.503	46%	0.462	S	S	.	.	H	α-helix	trans	-65.6	-42.3	176.8	-163.2	45.6	0	0	0	111.6	M28 D29 V35 S36	M28-D32 WeakPolarHBondContact O-CB 3.28Å; M28-D32 PolarHBondContact O-N 3.25Å; D29-D32 PolarHBondContact O-N 3.22Å; D32-V35 PolarHBondContact O-N 3.49Å; D32-S36 WeakPolarHBondContact O-CB 3.46Å; D32-S36 PolarHBondContact O-N 3.26Å; D32-S36 PolarHBondContact O-OG 2.79Å
33	D	58	Low	50.4	Low	110 Å²	110	93 Å²	93	59%	0.588	48%	0.482	S	S	*	.	H	α-helix	trans	-60.4	-46.1	173.3	-81.9	-16.9	0	0	0	111.6	D29 S36 L37	D29-D33 WeakPolarHBondContact O-CB 3.26Å; D29-D33 PolarHBondContact O-N 3.15Å; D33-S36 PolarHBondContact O-N 3.26Å; D33-L37 WeakPolarHBondContact O-CB 3.19Å; D33-L37 PolarHBondContact O-N 3.43Å
34	E	50.9	Low	50.3	Low	82 Å²	82	94 Å²	94	38%	0.383	49%	0.488	S	S	.	.	H	α-helix	trans	-68.1	-37.9	-178.4	-172	169	-167.6	0	0	111.8	K30 A31 R38	K30-E34 VanDerWaalsContact O-CB 3.28Å; K30-E34 WeakPolarHBondContact O-CB 3.47Å; K30-E34 PolarHBondContact O-N 3.49Å; A31-E34 PolarHBondContact O-N 2.72Å; E34-R38 HydrophobicContact CG-CG 4.42Å; E34-R38 VanDerWaalsContact O-CB 3.28Å; E34-R38 WeakPolarHBondContact O-CB 3.33Å; E34-R38 VanDerWaalsContact O-CG 3.25Å; E34-R38 WeakPolarHBondContact O-CG 3.31Å; E34-R38 PolarHBondContact O-N 3.32Å; E34-R38 IonicContact OE1-CZ 3Å; E34-R38 IonicContact OE1-NE 3.08Å; E34-R38 PolarHBondContact OE1-NE 2.75Å; E34-R38 VanDerWaalsContact OE1-NE 3.08Å; E34-R38 IonicContact OE1-NH1 3.94Å; E34-R38 IonicContact OE1-NH2 2.64Å; E34-R38 PolarHBondContact OE1-NH2 2.64Å
35	V	46.7	Very low	50.1	Low	28 Å²	28	91.5 Å²	91.5	17%	0.17	48%	0.479	C	S	.	.	H	α-helix	trans	-66.6	-44.9	174.3	169	0	0	0	0	110.5	A31 D32 R38 F39 L52	A31-V35 WeakPolarHBondContact O-CB 3.35Å; A31-V35 WeakPolarHBondContact O-CG2 3.28Å; A31-V35 PolarHBondContact O-N 2.75Å; D32-V35 PolarHBondContact O-N 3.49Å; V35-R38 PolarHBondContact O-N 2.71Å; V35-F39 HydrophobicContact CG1-CD2 4.33Å; V35-F39 WeakPolarHBondContact O-CB 3.31Å; V35-F39 WeakPolarHBondContact O-CD2 3.47Å; V35-F39 PolarHBondContact O-N 2.83Å; V35-L52 HydrophobicContact CB-CD2 4.49Å; V35-L52 HydrophobicContact CG1-CD2 4.39Å; V35-L52 HydrophobicContact CG2-CD1 4.35Å; V35-L52 HydrophobicContact CG2-CD2 3.77Å
36	S	51.6	Low	50	Low	69 Å²	69	93.8 Å²	93.8	48%	0.483	49%	0.492	S	S	.	.	H	α-helix	trans	-63	-43.1	177.5	-66.9	0	0	0	0	111.9	D32 D33	D32-S36 WeakPolarHBondContact O-CB 3.46Å; D32-S36 PolarHBondContact O-N 3.26Å; D32-S36 PolarHBondContact O-OG 2.79Å; D33-S36 PolarHBondContact O-N 3.26Å
37	L	54	Low	49.6	Very low	153 Å²	153	95.8 Å²	95.8	80%	0.801	50%	0.502	S	S	*	.	H	α-helix	trans	-67.5	-41.6	179.8	-170.3	75.9	0	0	0	112.1	D33	D33-L37 WeakPolarHBondContact O-CB 3.19Å; D33-L37 PolarHBondContact O-N 3.43Å
38	R	44.6	Very low	49.6	Very low	165 Å²	165	96.2 Å²	96.2	62%	0.623	50%	0.498	S	S	*	.	H	α-helix	trans	-83.2	-25.2	-174.1	-70.1	-178.3	-176.8	-141.3	3.4	113.9	E34 V35	E34-R38 HydrophobicContact CG-CG 4.42Å; E34-R38 VanDerWaalsContact O-CB 3.28Å; E34-R38 WeakPolarHBondContact O-CB 3.33Å; E34-R38 VanDerWaalsContact O-CG 3.25Å; E34-R38 WeakPolarHBondContact O-CG 3.31Å; E34-R38 PolarHBondContact O-N 3.32Å; E34-R38 IonicContact OE1-CZ 3Å; E34-R38 IonicContact OE1-NE 3.08Å; E34-R38 PolarHBondContact OE1-NE 2.75Å; E34-R38 VanDerWaalsContact OE1-NE 3.08Å; E34-R38 IonicContact OE1-NH1 3.94Å; E34-R38 IonicContact OE1-NH2 2.64Å; E34-R38 PolarHBondContact OE1-NH2 2.64Å; V35-R38 PolarHBondContact O-N 2.71Å
39	F	44.1	Very low	49.5	Very low	72 Å²	72	99.7 Å²	99.7	32%	0.316	51%	0.512	S	S	.	.	S	Bend	trans	-122.9	33	-168.5	-60.9	-70.8	0	0	0	114.6	V35 I41 Q45 K48	V35-F39 HydrophobicContact CG1-CD2 4.33Å; V35-F39 WeakPolarHBondContact O-CB 3.31Å; V35-F39 WeakPolarHBondContact O-CD2 3.47Å; V35-F39 PolarHBondContact O-N 2.83Å; F39-I41 PolarHBondContact O-N 3.08Å; F39-Q45 PolarHBondContact O-NE2 3.39Å; F39-K48 HydrophobicContact CE1-CD 4.48Å
40	G	47.1	Very low	49.3	Very low	49 Å²	49	100.3 Å²	100.3	51%	0.505	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-8.9	97.3	172	0	0	0	0	0	115	N42	G40-N42 PolarHBondContact O-N 3.48Å; G40-N42 VanDerWaalsContact O-N 3.08Å
41	I	49.1	Very low	49	Very low	157 Å²	157	98.1 Å²	98.1	81%	0.805	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	23.4	69.6	159.3	-36.1	174.5	0	0	0	115.4	F39	F39-I41 PolarHBondContact O-N 3.08Å
42	N	46.9	Very low	49	Very low	128 Å²	128	99.2 Å²	99.2	68%	0.684	51%	0.51	S	S	*	.	S	Bend	trans	-150.3	146.5	167.5	-82.9	-44.5	0	0	0	111.3	G40 V44 Q45	G40-N42 PolarHBondContact O-N 3.48Å; G40-N42 VanDerWaalsContact O-N 3.08Å; N42-V44 PolarHBondContact O-N 2.63Å; N42-Q45 VanDerWaalsContact O-CG 3.3Å; N42-Q45 WeakPolarHBondContact O-CG 3.38Å; N42-Q45 PolarHBondContact O-N 3.39Å; N42-Q45 VanDerWaalsContact O-N 3.15Å
43	E	48.2	Very low	49	Very low	191 Å²	191	97.7 Å²	97.7	89%	0.893	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-31.4	-19.6	-171	-93.3	170.8	147.8	0	0	120.1	Q45	E43-Q45 PolarHBondContact O-N 3.01Å
44	V	46.1	Very low	48.5	Very low	79 Å²	79	97.5 Å²	97.5	48%	0.479	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-10.1	168.8	-167.8	0	0	0	0	112.5	N42 T46 K48	N42-V44 PolarHBondContact O-N 2.63Å; V44-T46 PolarHBondContact O-N 3.38Å; V44-K48 HydrophobicContact CG1-CD 3.61Å; V44-K48 HydrophobicContact CG1-CG 4.01Å; V44-K48 WeakPolarHBondContact O-CB 3.47Å; V44-K48 WeakPolarHBondContact O-CG 3.3Å; V44-K48 PolarHBondContact O-N 3.29Å
45	Q	44.5	Very low	48.4	Very low	41 Å²	41	95.6 Å²	95.6	19%	0.192	49%	0.493	C	S	.	.	H	α-helix	trans	-61.7	-33.1	179.3	-73.3	-76.8	-19.9	0	0	114.4	F39 N42 E43 K49	F39-Q45 PolarHBondContact O-NE2 3.39Å; N42-Q45 VanDerWaalsContact O-CG 3.3Å; N42-Q45 WeakPolarHBondContact O-CG 3.38Å; N42-Q45 PolarHBondContact O-N 3.39Å; N42-Q45 VanDerWaalsContact O-N 3.15Å; E43-Q45 PolarHBondContact O-N 3.01Å; Q45-K49 WeakPolarHBondContact O-CA 3.16Å; Q45-K49 WeakPolarHBondContact O-CB 3.3Å; Q45-K49 WeakPolarHBondContact O-CG 3.39Å; Q45-K49 PolarHBondContact O-N 3.17Å
46	T	50.1	Low	48.5	Very low	95 Å²	95	95.9 Å²	95.9	58%	0.583	49%	0.494	S	S	*	.	H	α-helix	trans	-73.6	-47.9	-174.5	-52.2	0	0	0	0	112.2	V44 M50	V44-T46 PolarHBondContact O-N 3.38Å; T46-M50 HydrophobicContact CG2-CE 4.32Å; T46-M50 WeakPolarHBondContact O-CB 3.24Å; T46-M50 WeakPolarHBondContact O-CG 3.2Å; T46-M50 PolarHBondContact O-N 3.17Å
47	E	45.8	Very low	48.3	Very low	149 Å²	149	98 Å²	98	70%	0.696	50%	0.496	S	S	*	.	H	α-helix	trans	-70.6	-36	179.7	-67.5	179.2	169.3	0	0	111.9	M50 L51	E47-M50 HydrophobicContact CB-CE 4.46Å; E47-M50 HydrophobicContact CG-CE 4.1Å; E47-M50 PolarHBondContact O-N 3.18Å; E47-L51 WeakPolarHBondContact O-CB 3.14Å; E47-L51 PolarHBondContact O-N 2.95Å
48	K	49.3	Very low	47.7	Very low	74 Å²	74	97.4 Å²	97.4	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-75.8	-33.8	176	-68.8	-172.8	-178.6	169.8	0	112.9	F39 V44 L51 L52 L88	F39-K48 HydrophobicContact CE1-CD 4.48Å; V44-K48 HydrophobicContact CG1-CD 3.61Å; V44-K48 HydrophobicContact CG1-CG 4.01Å; V44-K48 WeakPolarHBondContact O-CB 3.47Å; V44-K48 WeakPolarHBondContact O-CG 3.3Å; V44-K48 PolarHBondContact O-N 3.29Å; K48-L51 PolarHBondContact O-N 3.49Å; K48-L52 VanDerWaalsContact O-CB 3.3Å; K48-L52 WeakPolarHBondContact O-CB 3.3Å; K48-L52 PolarHBondContact O-N 3.48Å; K48-L88 HydrophobicContact CD-CD2 4.43Å
49	K	50.5	Low	47.7	Very low	114 Å²	114	92.3 Å²	92.3	50%	0.496	47%	0.469	S	S	.	.	H	α-helix	trans	-63.9	-41.5	167.4	-81.1	179.7	174.7	-172	0	110.8	Q45 L51 L52 T53	Q45-K49 WeakPolarHBondContact O-CA 3.16Å; Q45-K49 WeakPolarHBondContact O-CB 3.3Å; Q45-K49 WeakPolarHBondContact O-CG 3.39Å; Q45-K49 PolarHBondContact O-N 3.17Å; K49-L51 VanDerWaalsContact C-N 3.32Å; K49-L51 PolarHBondContact O-N 2.93Å; K49-L52 PolarHBondContact O-N 3.25Å; K49-T53 WeakPolarHBondContact O-CB 3.48Å; K49-T53 PolarHBondContact O-N 3.15Å; K49-T53 PolarHBondContact O-OG1 2.98Å
50	M	51.3	Low	47.5	Very low	114 Å²	114	93 Å²	93	56%	0.562	48%	0.475	S	S	*	.	H	α-helix	trans	-61.7	-39.7	173.1	-77.1	-171.6	-65.3	0	0	112.2	T46 E47 F54	T46-M50 HydrophobicContact CG2-CE 4.32Å; T46-M50 WeakPolarHBondContact O-CB 3.24Å; T46-M50 WeakPolarHBondContact O-CG 3.2Å; T46-M50 PolarHBondContact O-N 3.17Å; E47-M50 HydrophobicContact CB-CE 4.46Å; E47-M50 HydrophobicContact CG-CE 4.1Å; E47-M50 PolarHBondContact O-N 3.18Å; M50-F54 WeakPolarHBondContact O-CB 3.25Å; M50-F54 PolarHBondContact O-N 3.16Å
51	L	47.5	Very low	47.1	Very low	79 Å²	79	95.9 Å²	95.9	41%	0.414	48%	0.478	S	S	.	.	H	α-helix	trans	-69.3	-38.8	177.2	-166.3	70.8	0	0	0	111.9	E47 K48 K49 F54 C55 L88	E47-L51 WeakPolarHBondContact O-CB 3.14Å; E47-L51 PolarHBondContact O-N 2.95Å; K48-L51 PolarHBondContact O-N 3.49Å; K49-L51 VanDerWaalsContact C-N 3.32Å; K49-L51 PolarHBondContact O-N 2.93Å; L51-F54 PolarHBondContact O-N 3.13Å; L51-C55 WeakPolarHBondContact O-CB 3.38Å; L51-C55 PolarHBondContact O-N 3.39Å; L51-C55 PolarHBondContact O-SG 3.03Å; L51-L88 HydrophobicContact CD2-CD1 4.4Å; L51-L88 HydrophobicContact CD2-CD2 4Å; L51-L88 HydrophobicContact CD2-CG 4.24Å
52	L	51.1	Low	46.4	Very low	40 Å²	40	94.2 Å²	94.2	21%	0.209	47%	0.47	C	S	.	.	H	α-helix	trans	-67.4	-45.1	174	-178.4	69.2	0	0	0	111.1	V35 K48 K49 F54 C55 L56	V35-L52 HydrophobicContact CB-CD2 4.49Å; V35-L52 HydrophobicContact CG1-CD2 4.39Å; V35-L52 HydrophobicContact CG2-CD1 4.35Å; V35-L52 HydrophobicContact CG2-CD2 3.77Å; K48-L52 VanDerWaalsContact O-CB 3.3Å; K48-L52 WeakPolarHBondContact O-CB 3.3Å; K48-L52 PolarHBondContact O-N 3.48Å; K49-L52 PolarHBondContact O-N 3.25Å; L52-F54 VanDerWaalsContact C-N 3.32Å; L52-F54 PolarHBondContact O-N 3.36Å; L52-C55 CarbonylContact O-C 3.56Å; L52-C55 PolarHBondContact O-N 2.91Å; L52-L56 HydrophobicContact CD1-CD1 4.1Å; L52-L56 HydrophobicContact CD1-CG 4.26Å; L52-L56 HydrophobicContact CD2-CD1 4.37Å; L52-L56 HydrophobicContact CG-CD1 3.78Å; L52-L56 HydrophobicContact CG-CG 4.3Å; L52-L56 VanDerWaalsContact O-CB 3.31Å; L52-L56 WeakPolarHBondContact O-CB 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.48Å; L52-L56 PolarHBondContact O-N 3.4Å
53	T	50.9	Low	45.7	Very low	62 Å²	62	91.6 Å²	91.6	38%	0.38	46%	0.46	S	S	.	.	H	α-helix	trans	-60	-42.9	172.5	-65	0	0	0	0	110.2	K49 L56 E57	K49-T53 WeakPolarHBondContact O-CB 3.48Å; K49-T53 PolarHBondContact O-N 3.15Å; K49-T53 PolarHBondContact O-OG1 2.98Å; T53-L56 PolarHBondContact O-N 3.22Å; T53-E57 HydrophobicContact CG2-CG 3.92Å; T53-E57 VanDerWaalsContact CG2-OE1 3.24Å; T53-E57 WeakPolarHBondContact CG2-OE1 3.42Å; T53-E57 WeakPolarHBondContact O-CA 3.34Å; T53-E57 WeakPolarHBondContact O-CB 3.27Å; T53-E57 WeakPolarHBondContact O-CG 3.04Å; T53-E57 PolarHBondContact O-N 3.18Å
54	F	48.7	Very low	45.1	Very low	106 Å²	106	90 Å²	90	47%	0.465	46%	0.463	S	S	.	.	H	α-helix	trans	-62.7	-46.7	174.2	179.9	-90.9	0	0	0	111.1	M50 L51 L52 Y58	M50-F54 WeakPolarHBondContact O-CB 3.25Å; M50-F54 PolarHBondContact O-N 3.16Å; L51-F54 PolarHBondContact O-N 3.13Å; L52-F54 VanDerWaalsContact C-N 3.32Å; L52-F54 PolarHBondContact O-N 3.36Å; F54-Y58 HydrophobicContact CD1-CD2 4.35Å; F54-Y58 AromaticContact CD2-CD2 3.42Å; F54-Y58 HydrophobicContact CD2-CD2 3.42Å; F54-Y58 VanDerWaalsContact CD2-CD2 3.42Å; F54-Y58 AromaticContact CD2-CE2 3.3Å; F54-Y58 HydrophobicContact CD2-CE2 3.3Å; F54-Y58 HydrophobicContact CD2-CG 4.35Å; F54-Y58 HydrophobicContact CE1-CD2 4.39Å; F54-Y58 HydrophobicContact CE1-CG 4.49Å; F54-Y58 HydrophobicContact CE2-CD1 4.42Å; F54-Y58 AromaticContact CE2-CD2 3.48Å; F54-Y58 HydrophobicContact CE2-CD2 3.48Å; F54-Y58 VanDerWaalsContact CE2-CD2 3.48Å; F54-Y58 HydrophobicContact CE2-CE1 4.23Å; F54-Y58 AromaticContact CE2-CE2 3.24Å; F54-Y58 HydrophobicContact CE2-CE2 3.24Å; F54-Y58 HydrophobicContact CE2-CG 4.06Å; F54-Y58 AromaticContact CE2-CZ 3.64Å; F54-Y58 AromaticContact CG-CD2 3.89Å; F54-Y58 HydrophobicContact CG-CD2 3.89Å; F54-Y58 HydrophobicContact CG-CE2 4.22Å; F54-Y58 HydrophobicContact CZ-CD1 4.43Å; F54-Y58 AromaticContact CZ-CD2 3.98Å; F54-Y58 HydrophobicContact CZ-CD2 3.98Å; F54-Y58 HydrophobicContact CZ-CE2 4.11Å; F54-Y58 HydrophobicContact CZ-CG 4.13Å; F54-Y58 WeakPolarHBondContact O-CB 3.19Å; F54-Y58 WeakPolarHBondContact O-CD2 3.35Å; F54-Y58 PolarHBondContact O-N 3.06Å
55	C	48.6	Very low	44.6	Very low	42 Å²	42	90.2 Å²	90.2	28%	0.284	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-47.1	174.9	-73	0	0	0	0	110.4	L51 L52 L59	L51-C55 WeakPolarHBondContact O-CB 3.38Å; L51-C55 PolarHBondContact O-N 3.39Å; L51-C55 PolarHBondContact O-SG 3.03Å; L52-C55 CarbonylContact O-C 3.56Å; L52-C55 PolarHBondContact O-N 2.91Å; C55-L59 WeakPolarHBondContact O-CA 3.37Å; C55-L59 WeakPolarHBondContact O-CB 3.22Å; C55-L59 PolarHBondContact O-N 3.49Å
56	L	48.9	Very low	44.2	Very low	35 Å²	35	93.1 Å²	93.1	18%	0.183	48%	0.477	C	S	.	.	H	α-helix	trans	-68.8	-45.8	-178.4	-68.4	171.5	0	0	0	112.1	M28 L52 T53 L60	M28-L56 HydrophobicContact CE-CB 4.42Å; M28-L56 HydrophobicContact CE-CD1 4.48Å; M28-L56 HydrophobicContact CE-CD2 3.98Å; M28-L56 HydrophobicContact SD-CD1 3.92Å; M28-L56 HydrophobicContact SD-CD2 3.8Å; M28-L56 HydrophobicContact SD-CG 4.4Å; L52-L56 HydrophobicContact CD1-CD1 4.1Å; L52-L56 HydrophobicContact CD1-CG 4.26Å; L52-L56 HydrophobicContact CD2-CD1 4.37Å; L52-L56 HydrophobicContact CG-CD1 3.78Å; L52-L56 HydrophobicContact CG-CG 4.3Å; L52-L56 VanDerWaalsContact O-CB 3.31Å; L52-L56 WeakPolarHBondContact O-CB 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.48Å; L52-L56 PolarHBondContact O-N 3.4Å; T53-L56 PolarHBondContact O-N 3.22Å; L56-L60 VanDerWaalsContact O-CB 3.25Å; L56-L60 WeakPolarHBondContact O-CB 3.26Å; L56-L60 VanDerWaalsContact O-CD1 3.27Å; L56-L60 WeakPolarHBondContact O-CD1 3.44Å; L56-L60 PolarHBondContact O-N 3.25Å; L56-L60 VanDerWaalsContact O-N 3.1Å
57	E	46.6	Very low	43.4	Very low	112 Å²	112	91.9 Å²	91.9	52%	0.523	47%	0.469	S	S	.	.	H	α-helix	trans	-60.1	-49.8	175.3	-73.3	176.7	171.3	0	0	110	T53 L60 I61	T53-E57 HydrophobicContact CG2-CG 3.92Å; T53-E57 VanDerWaalsContact CG2-OE1 3.24Å; T53-E57 WeakPolarHBondContact CG2-OE1 3.42Å; T53-E57 WeakPolarHBondContact O-CA 3.34Å; T53-E57 WeakPolarHBondContact O-CB 3.27Å; T53-E57 WeakPolarHBondContact O-CG 3.04Å; T53-E57 PolarHBondContact O-N 3.18Å; E57-L60 PolarHBondContact O-N 3.39Å; E57-I61 WeakPolarHBondContact O-CD1 3.17Å; E57-I61 WeakPolarHBondContact O-CG1 3.25Å; E57-I61 PolarHBondContact O-N 3.33Å
58	Y	42.4	Very low	43.1	Very low	142 Å²	142	89.6 Å²	89.6	56%	0.557	46%	0.459	S	S	*	.	H	α-helix	trans	-79.6	-24.7	-176.1	-74.8	-98.6	0	0	0	114.6	F54 L60 I61	F54-Y58 HydrophobicContact CD1-CD2 4.35Å; F54-Y58 AromaticContact CD2-CD2 3.42Å; F54-Y58 HydrophobicContact CD2-CD2 3.42Å; F54-Y58 VanDerWaalsContact CD2-CD2 3.42Å; F54-Y58 AromaticContact CD2-CE2 3.3Å; F54-Y58 HydrophobicContact CD2-CE2 3.3Å; F54-Y58 HydrophobicContact CD2-CG 4.35Å; F54-Y58 HydrophobicContact CE1-CD2 4.39Å; F54-Y58 HydrophobicContact CE1-CG 4.49Å; F54-Y58 HydrophobicContact CE2-CD1 4.42Å; F54-Y58 AromaticContact CE2-CD2 3.48Å; F54-Y58 HydrophobicContact CE2-CD2 3.48Å; F54-Y58 VanDerWaalsContact CE2-CD2 3.48Å; F54-Y58 HydrophobicContact CE2-CE1 4.23Å; F54-Y58 AromaticContact CE2-CE2 3.24Å; F54-Y58 HydrophobicContact CE2-CE2 3.24Å; F54-Y58 HydrophobicContact CE2-CG 4.06Å; F54-Y58 AromaticContact CE2-CZ 3.64Å; F54-Y58 AromaticContact CG-CD2 3.89Å; F54-Y58 HydrophobicContact CG-CD2 3.89Å; F54-Y58 HydrophobicContact CG-CE2 4.22Å; F54-Y58 HydrophobicContact CZ-CD1 4.43Å; F54-Y58 AromaticContact CZ-CD2 3.98Å; F54-Y58 HydrophobicContact CZ-CD2 3.98Å; F54-Y58 HydrophobicContact CZ-CE2 4.11Å; F54-Y58 HydrophobicContact CZ-CG 4.13Å; F54-Y58 WeakPolarHBondContact O-CB 3.19Å; F54-Y58 WeakPolarHBondContact O-CD2 3.35Å; F54-Y58 PolarHBondContact O-N 3.06Å; Y58-L60 VanDerWaalsContact C-N 3.31Å; Y58-I61 HydrophobicContact CD1-CD1 4.29Å; Y58-I61 HydrophobicContact CG-CD1 4.3Å
59	L	43.2	Very low	42.6	Very low	58 Å²	58	89.8 Å²	89.8	30%	0.304	46%	0.463	S	S	.	.	H	α-helix	trans	-79.8	-16.8	173.8	-152.2	85.9	0	0	0	111.8	C55 A77 F80 L81	C55-L59 WeakPolarHBondContact O-CA 3.37Å; C55-L59 WeakPolarHBondContact O-CB 3.22Å; C55-L59 PolarHBondContact O-N 3.49Å; L59-A77 HydrophobicContact CD1-CB 4.08Å; L59-A77 HydrophobicContact CD2-CB 3.68Å; L59-A77 HydrophobicContact CG-CB 3.6Å; L59-F80 HydrophobicContact CD1-CB 3.56Å; L59-F80 HydrophobicContact CD1-CG 4.34Å; L59-L81 HydrophobicContact CD2-CB 4.36Å; L59-L81 HydrophobicContact CD2-CD1 3.73Å; L59-L81 HydrophobicContact CD2-CG 4.26Å
60	L	41.3	Very low	42.1	Very low	85 Å²	85	87.9 Å²	87.9	45%	0.445	46%	0.455	S	S	.	.	S	Bend	trans	-99.8	-1	172.2	-83.2	141.3	0	0	0	114.4	Y24 M28 L56 E57 Y58 I62	Y24-L60 HydrophobicContact CD2-CD1 4.31Å; Y24-L60 HydrophobicContact CD2-CD2 3.85Å; Y24-L60 HydrophobicContact CE2-CD1 3.61Å; Y24-L60 HydrophobicContact CE2-CD2 3.68Å; Y24-L60 HydrophobicContact CE2-CG 4.31Å; M28-L60 HydrophobicContact CE-CD1 3.36Å; L56-L60 VanDerWaalsContact O-CB 3.25Å; L56-L60 WeakPolarHBondContact O-CB 3.26Å; L56-L60 VanDerWaalsContact O-CD1 3.27Å; L56-L60 WeakPolarHBondContact O-CD1 3.44Å; L56-L60 PolarHBondContact O-N 3.25Å; L56-L60 VanDerWaalsContact O-N 3.1Å; E57-L60 PolarHBondContact O-N 3.39Å; Y58-L60 VanDerWaalsContact C-N 3.31Å; L60-I62 PolarHBondContact O-N 3.36Å
61	I	37.6	Very low	41.6	Very low	110 Å²	110	84.6 Å²	84.6	56%	0.564	44%	0.439	S	S	*	.			trans	-80.3	43.2	177.9	-75	158.8	0	0	0	112.3	E57 Y58	E57-I61 WeakPolarHBondContact O-CD1 3.17Å; E57-I61 WeakPolarHBondContact O-CG1 3.25Å; E57-I61 PolarHBondContact O-N 3.33Å; Y58-I61 HydrophobicContact CD1-CD1 4.29Å; Y58-I61 HydrophobicContact CG-CD1 4.3Å
62	I	34.9	Very low	40.8	Very low	123 Å²	123	82.5 Å²	82.5	63%	0.631	43%	0.433	S	S	*	.	S	Bend	trans	-155.7	123.2	165.7	-47.4	177.8	0	0	0	110.4	L60	L60-I62 PolarHBondContact O-N 3.36Å
63	P	33.1	Very low	40.5	Very low	73 Å²	73	83.7 Å²	83.7	47%	0.474	44%	0.439	S	S	.	.			cis	-120.7	173.6	-24.1	36.1	-18.2	0	0	0	112.6	N65	P63-N65 PolarHBondContact O-N 3.26Å
64	V	34.9	Very low	40.1	Very low	158 Å²	158	84.6 Å²	84.6	96%	0.958	44%	0.442	S	S	*	.	S	Bend	trans	-66.6	36.2	-169.4	-159.8	0	0	0	0	115.4
65	N	35.5	Very low	39.8	Very low	82 Å²	82	81.6 Å²	81.6	44%	0.439	44%	0.436	S	S	.	.			trans	-147.4	99.6	176.8	-164.8	-5.8	0	0	0	110.2	P63 T67 Q68	P63-N65 PolarHBondContact O-N 3.26Å; N65-T67 PolarHBondContact O-N 3.42Å; N65-T67 PolarHBondContact OD1-OG1 3.1Å; N65-Q68 PolarHBondContact O-N 3.33Å
66	I	36.6	Very low	39.6	Very low	102 Å²	102	82.8 Å²	82.8	52%	0.523	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16	-170.7	-62.4	166.6	0	0	0	112.7	D17 A20	D17-I66 HydrophobicContact CB-CG2 4.16Å; A20-I66 HydrophobicContact CB-CG2 4.22Å
67	T	33.6	Very low	39.5	Very low	69 Å²	69	81.8 Å²	81.8	42%	0.423	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-7	-177.6	-18.9	0	0	0	0	114.6	N65	N65-T67 PolarHBondContact O-N 3.42Å; N65-T67 PolarHBondContact OD1-OG1 3.1Å
68	Q	38.3	Very low	39.6	Very low	102 Å²	102	81.3 Å²	81.3	48%	0.477	44%	0.436	S	S	.	.			trans	-125.3	50.6	-173.9	-65	-174.8	-10.4	0	0	112.7	N65 F70	N65-Q68 PolarHBondContact O-N 3.33Å; Q68-F70 WeakPolarHBondContact O-CD2 3.03Å; Q68-F70 PolarHBondContact O-N 2.87Å
69	L	39.1	Very low	40	Very low	77 Å²	77	79.1 Å²	79.1	40%	0.403	43%	0.434	S	S	.	.			trans	-66.8	103.9	176.7	-139.1	85.3	0	0	0	110	F14 I71	F14-L69 HydrophobicContact CE2-CB 4Å; F14-L69 HydrophobicContact CE2-CD2 4.25Å; L69-I71 PolarHBondContact O-N 2.78Å
70	F	40.3	Very low	40.2	Very low	75 Å²	75	83.2 Å²	83.2	33%	0.329	45%	0.449	S	S	.	.			trans	-67.7	120.5	177.8	-73.6	-93.8	0	0	0	110.5	F11 Q68 A72 D73 N74	F11-F70 HydrophobicContact CD1-CD1 4.39Å; F11-F70 HydrophobicContact CD1-CE1 4.29Å; F11-F70 AromaticContact CE1-CD1 3.76Å; F11-F70 HydrophobicContact CE1-CD1 3.76Å; F11-F70 AromaticContact CE1-CE1 3.27Å; F11-F70 HydrophobicContact CE1-CE1 3.27Å; F11-F70 AromaticContact CE1-CZ 3.72Å; F11-F70 HydrophobicContact CE1-CZ 3.72Å; F11-F70 HydrophobicContact CZ-CD1 4.23Å; F11-F70 AromaticContact CZ-CE1 3.57Å; F11-F70 HydrophobicContact CZ-CE1 3.57Å; F11-F70 HydrophobicContact CZ-CZ 4.24Å; Q68-F70 WeakPolarHBondContact O-CD2 3.03Å; Q68-F70 PolarHBondContact O-N 2.87Å; F70-A72 PolarHBondContact O-N 3.21Å; F70-D73 HydrophobicContact CB-CB 4.26Å; F70-D73 PolarHBondContact O-N 2.68Å; F70-N74 PolarHBondContact O-N 3.45Å
71	I	39.3	Very low	40.6	Very low	45 Å²	45	81 Å²	81	23%	0.231	44%	0.438	C	S	.	.	H	α-helix	trans	-58.8	-31.1	171	-47.1	178.3	0	0	0	110.4	V8 I12 L69 D73 N74 A75	V8-I71 VanDerWaalsContact CG1-C 3.49Å; V8-I71 HydrophobicContact CG1-CB 3.93Å; V8-I71 HydrophobicContact CG1-CG2 3.76Å; I12-I71 HydrophobicContact CB-CD1 4.24Å; I12-I71 HydrophobicContact CB-CG1 4.09Å; I12-I71 HydrophobicContact CD1-CD1 3.76Å; I12-I71 HydrophobicContact CD1-CG1 3.74Å; I12-I71 HydrophobicContact CG1-CD1 3.44Å; I12-I71 VanDerWaalsContact CG1-CD1 3.44Å; I12-I71 HydrophobicContact CG1-CG1 3.68Å; L69-I71 PolarHBondContact O-N 2.78Å; I71-D73 PolarHBondContact O-N 3.47Å; I71-N74 PolarHBondContact O-N 3.41Å; I71-N74 VanDerWaalsContact O-N 3.16Å; I71-A75 PolarHBondContact O-N 2.86Å; I71-A75 VanDerWaalsContact O-N 3.15Å
72	A	32.4	Very low	41.1	Very low	35 Å²	35	82.2 Å²	82.2	29%	0.289	44%	0.441	S	S	.	.	H	α-helix	trans	-61.5	-40.4	177.9	0	0	0	0	0	113.3	V8 F70 N74 N76	V8-A72 HydrophobicContact CB-CB 3.82Å; V8-A72 HydrophobicContact CG1-CB 3.98Å; V8-A72 VanDerWaalsContact CG1-N 3.35Å; V8-A72 HydrophobicContact CG2-CB 4.22Å; F70-A72 PolarHBondContact O-N 3.21Å; A72-N74 VanDerWaalsContact C-N 3.32Å; A72-N76 PolarHBondContact O-N 3.47Å; A72-N76 PolarHBondContact O-ND2 3.16Å
73	D	44.2	Very low	41.5	Very low	65 Å²	65	78.3 Å²	78.3	35%	0.348	43%	0.427	S	S	.	.	H	α-helix	trans	-75.4	-26.6	176.4	-72.9	-26.3	0	0	0	111.3	F70 I71 A77	F70-D73 HydrophobicContact CB-CB 4.26Å; F70-D73 PolarHBondContact O-N 2.68Å; I71-D73 PolarHBondContact O-N 3.47Å; D73-A77 WeakPolarHBondContact O-CA 3.39Å; D73-A77 WeakPolarHBondContact O-CB 3.32Å; D73-A77 PolarHBondContact O-N 2.81Å
74	N	42.2	Very low	41.9	Very low	81 Å²	81	75.8 Å²	75.8	43%	0.433	41%	0.414	S	S	.	.	H	α-helix	trans	-72.5	-37.4	178.7	-153.2	-3.4	0	0	0	112.8	F70 I71 A72 A77 M78	F70-N74 PolarHBondContact O-N 3.45Å; I71-N74 PolarHBondContact O-N 3.41Å; I71-N74 VanDerWaalsContact O-N 3.16Å; A72-N74 VanDerWaalsContact C-N 3.32Å; N74-A77 PolarHBondContact O-N 2.99Å; N74-M78 WeakPolarHBondContact O-CB 3.39Å; N74-M78 VanDerWaalsContact O-CG 3.22Å; N74-M78 WeakPolarHBondContact O-CG 3.26Å; N74-M78 PolarHBondContact O-N 2.68Å
75	A	42.9	Very low	42.4	Very low	42 Å²	42	71.3 Å²	71.3	35%	0.347	39%	0.385	S	S	.	.	H	α-helix	trans	-68.6	-40.4	174.5	0	0	0	0	0	111.9	V8 I71 N79	V8-A75 HydrophobicContact CG2-CB 4.4Å; I71-A75 PolarHBondContact O-N 2.86Å; I71-A75 VanDerWaalsContact O-N 3.15Å; A75-N79 WeakPolarHBondContact O-CB 3.34Å; A75-N79 VanDerWaalsContact O-CG 3.3Å; A75-N79 PolarHBondContact O-N 3.3Å; A75-N79 PolarHBondContact O-ND2 2.83Å
76	N	44.3	Very low	42.8	Very low	68 Å²	68	70.2 Å²	70.2	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-65.7	-42.2	172.3	-74	-30.5	0	0	0	110.9	A72 M78 N79 F80	A72-N76 PolarHBondContact O-N 3.47Å; A72-N76 PolarHBondContact O-ND2 3.16Å; N76-M78 PolarHBondContact O-N 2.81Å; N76-N79 CarbonylContact O-C 3.6Å; N76-N79 PolarHBondContact O-N 3.44Å; N76-F80 WeakPolarHBondContact O-CB 3.02Å; N76-F80 VanDerWaalsContact O-CD2 3.31Å; N76-F80 WeakPolarHBondContact O-CD2 3.4Å; N76-F80 PolarHBondContact O-N 3.19Å
77	A	47	Very low	42.8	Very low	14 Å²	14	71.6 Å²	71.6	12%	0.116	39%	0.391	C	S	.	.	H	α-helix	trans	-58.7	-47.6	175.9	0	0	0	0	0	111.1	L59 D73 N74 F80 L81	L59-A77 HydrophobicContact CD1-CB 4.08Å; L59-A77 HydrophobicContact CD2-CB 3.68Å; L59-A77 HydrophobicContact CG-CB 3.6Å; D73-A77 WeakPolarHBondContact O-CA 3.39Å; D73-A77 WeakPolarHBondContact O-CB 3.32Å; D73-A77 PolarHBondContact O-N 2.81Å; N74-A77 PolarHBondContact O-N 2.99Å; A77-F80 CarbonylContact O-C 3.54Å; A77-F80 WeakPolarHBondContact O-CB 2.86Å; A77-F80 PolarHBondContact O-N 2.89Å; A77-F80 VanDerWaalsContact O-N 3.15Å; A77-L81 WeakPolarHBondContact O-CB 3.35Å; A77-L81 PolarHBondContact O-N 2.76Å
78	M	48.2	Very low	43	Very low	101 Å²	101	71.5 Å²	71.5	50%	0.498	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-39.4	176.8	-72.6	-62.1	-63.4	0	0	112.6	N74 N76 F80 L81 Q82	N74-M78 WeakPolarHBondContact O-CB 3.39Å; N74-M78 VanDerWaalsContact O-CG 3.22Å; N74-M78 WeakPolarHBondContact O-CG 3.26Å; N74-M78 PolarHBondContact O-N 2.68Å; N76-M78 PolarHBondContact O-N 2.81Å; M78-F80 VanDerWaalsContact C-N 3.32Å; M78-L81 PolarHBondContact O-N 3.3Å; M78-Q82 WeakPolarHBondContact O-CB 3.36Å; M78-Q82 PolarHBondContact O-N 3.19Å
79	N	51.3	Low	42.9	Very low	96 Å²	96	72 Å²	72	51%	0.513	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-36.4	171.9	-76.1	-26.5	0	0	0	111.9	A75 N76 A83	A75-N79 WeakPolarHBondContact O-CB 3.34Å; A75-N79 VanDerWaalsContact O-CG 3.3Å; A75-N79 PolarHBondContact O-N 3.3Å; A75-N79 PolarHBondContact O-ND2 2.83Å; N76-N79 CarbonylContact O-C 3.6Å; N76-N79 PolarHBondContact O-N 3.44Å; N79-A83 VanDerWaalsContact O-CB 3.24Å; N79-A83 WeakPolarHBondContact O-CB 3.5Å; N79-A83 PolarHBondContact O-N 2.75Å
80	F	46.1	Very low	42.6	Very low	145 Å²	145	74 Å²	74	64%	0.636	41%	0.413	S	S	*	.	H	α-helix	trans	-69.9	-38	175	-100.4	-83.2	0	0	0	112	L59 N76 A77 M78 A83 G84	L59-F80 HydrophobicContact CD1-CB 3.56Å; L59-F80 HydrophobicContact CD1-CG 4.34Å; N76-F80 WeakPolarHBondContact O-CB 3.02Å; N76-F80 VanDerWaalsContact O-CD2 3.31Å; N76-F80 WeakPolarHBondContact O-CD2 3.4Å; N76-F80 PolarHBondContact O-N 3.19Å; A77-F80 CarbonylContact O-C 3.54Å; A77-F80 WeakPolarHBondContact O-CB 2.86Å; A77-F80 PolarHBondContact O-N 2.89Å; A77-F80 VanDerWaalsContact O-N 3.15Å; M78-F80 VanDerWaalsContact C-N 3.32Å; F80-A83 CarbonylContact O-C 3.59Å; F80-A83 PolarHBondContact O-N 2.84Å; F80-G84 PolarHBondContact O-N 2.77Å
81	L	50.7	Low	42	Very low	39 Å²	39	73.1 Å²	73.1	20%	0.204	43%	0.426	C	S	.	.	H	α-helix	trans	-67	-44.5	175.6	-139	156.2	0	0	0	109.6	L59 A77 M78 A83 G84 L85	L59-L81 HydrophobicContact CD2-CB 4.36Å; L59-L81 HydrophobicContact CD2-CD1 3.73Å; L59-L81 HydrophobicContact CD2-CG 4.26Å; A77-L81 WeakPolarHBondContact O-CB 3.35Å; A77-L81 PolarHBondContact O-N 2.76Å; M78-L81 PolarHBondContact O-N 3.3Å; L81-A83 VanDerWaalsContact C-N 3.34Å; L81-A83 PolarHBondContact O-N 3.15Å; L81-G84 PolarHBondContact O-N 3.25Å; L81-L85 HydrophobicContact CD2-CD1 3.66Å; L81-L85 HydrophobicContact CD2-CG 4.14Å; L81-L85 WeakPolarHBondContact O-CB 3.22Å; L81-L85 VanDerWaalsContact O-CG 3.25Å; L81-L85 WeakPolarHBondContact O-CG 3.31Å; L81-L85 PolarHBondContact O-N 2.97Å
82	Q	47.1	Very low	41.5	Very low	134 Å²	134	77 Å²	77	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-61.4	-40.8	171.4	-174.1	174.7	-7.8	0	0	111.8	M78 S86	M78-Q82 WeakPolarHBondContact O-CB 3.36Å; M78-Q82 PolarHBondContact O-N 3.19Å; Q82-S86 VanDerWaalsContact O-CB 3.26Å; Q82-S86 WeakPolarHBondContact O-CB 3.41Å; Q82-S86 PolarHBondContact O-N 3Å; Q82-S86 PolarHBondContact O-OG 3.04Å
83	A	45	Very low	41.4	Very low	41 Å²	41	81 Å²	81	34%	0.339	48%	0.48	S	S	.	.	H	α-helix	trans	-65.1	-44.4	175	0	0	0	0	0	111.5	N79 F80 L81 S86 L87	N79-A83 VanDerWaalsContact O-CB 3.24Å; N79-A83 WeakPolarHBondContact O-CB 3.5Å; N79-A83 PolarHBondContact O-N 2.75Å; F80-A83 CarbonylContact O-C 3.59Å; F80-A83 PolarHBondContact O-N 2.84Å; L81-A83 VanDerWaalsContact C-N 3.34Å; L81-A83 PolarHBondContact O-N 3.15Å; A83-S86 WeakPolarHBondContact CA-OG 3.32Å; A83-S86 PolarHBondContact O-N 3.35Å; A83-S86 VanDerWaalsContact O-N 3.16Å; A83-S86 PolarHBondContact O-OG 3.48Å; A83-L87 WeakPolarHBondContact O-CG 3.24Å; A83-L87 PolarHBondContact O-N 3.32Å
84	G	41.5	Very low	40.7	Very low	20 Å²	20	81 Å²	81	21%	0.206	50%	0.495	C	S	.	.	H	α-helix	trans	-62.2	-42.8	175.7	0	0	0	0	0	112.6	F80 L81 S86 L87 L88	F80-G84 PolarHBondContact O-N 2.77Å; L81-G84 PolarHBondContact O-N 3.25Å; G84-S86 VanDerWaalsContact C-N 3.34Å; G84-L87 PolarHBondContact O-N 2.95Å; G84-L88 PolarHBondContact O-N 3.39Å
85	L	45.1	Very low	40.1	Very low	64 Å²	64	84.8 Å²	84.8	34%	0.335	52%	0.515	S	S	.	.	H	α-helix	trans	-67	-33.9	172.8	-70.2	170.1	0	0	0	112.2	L81 L88 T89	L81-L85 HydrophobicContact CD2-CD1 3.66Å; L81-L85 HydrophobicContact CD2-CG 4.14Å; L81-L85 WeakPolarHBondContact O-CB 3.22Å; L81-L85 VanDerWaalsContact O-CG 3.25Å; L81-L85 WeakPolarHBondContact O-CG 3.31Å; L81-L85 PolarHBondContact O-N 2.97Å; L85-L88 HydrophobicContact CD2-CD1 4.06Å; L85-L88 WeakPolarHBondContact O-CB 3.44Å; L85-L88 PolarHBondContact O-N 3.26Å; L85-T89 PolarHBondContact O-N 3.36Å; L85-T89 VanDerWaalsContact O-N 3.16Å; L85-T89 PolarHBondContact O-OG1 3.41Å
86	S	43.4	Very low	39.6	Very low	60 Å²	60	88.1 Å²	88.1	42%	0.42	54%	0.536	S	S	.	.	H	α-helix	trans	-70.4	-32.1	175	77.7	0	0	0	0	112.6	Q82 A83 G84 L88 T89	Q82-S86 VanDerWaalsContact O-CB 3.26Å; Q82-S86 WeakPolarHBondContact O-CB 3.41Å; Q82-S86 PolarHBondContact O-N 3Å; Q82-S86 PolarHBondContact O-OG 3.04Å; A83-S86 WeakPolarHBondContact CA-OG 3.32Å; A83-S86 PolarHBondContact O-N 3.35Å; A83-S86 VanDerWaalsContact O-N 3.16Å; A83-S86 PolarHBondContact O-OG 3.48Å; G84-S86 VanDerWaalsContact C-N 3.34Å; S86-L88 VanDerWaalsContact C-N 3.31Å; S86-T89 VanDerWaalsContact C-OG1 3.28Å; S86-T89 VanDerWaalsContact CA-OG1 3.26Å; S86-T89 WeakPolarHBondContact CA-OG1 3.2Å; S86-T89 PolarHBondContact O-N 3.2Å; S86-T89 PolarHBondContact O-OG1 3.15Å
87	L	36.5	Very low	38.9	Very low	130 Å²	130	89.2 Å²	89.2	68%	0.681	55%	0.549	S	S	*	.	H	α-helix	trans	-69.1	-31.6	171	-70	167.9	0	0	0	111.1	A83 G84 T89 V90	A83-L87 WeakPolarHBondContact O-CG 3.24Å; A83-L87 PolarHBondContact O-N 3.32Å; G84-L87 PolarHBondContact O-N 2.95Å; L87-T89 VanDerWaalsContact C-N 3.31Å; L87-T89 PolarHBondContact O-N 3.24Å; L87-V90 PolarHBondContact O-N 3.31Å
88	L	37.5	Very low	38.2	Very low	67 Å²	67	95.1 Å²	95.1	35%	0.351	58%	0.579	S	S	.	*	H	α-helix	trans	-69.9	-23.2	171.4	-78.9	160.8	0	0	0	113.5	K48 L51 G84 L85 S86 V90	K48-L88 HydrophobicContact CD-CD2 4.43Å; L51-L88 HydrophobicContact CD2-CD1 4.4Å; L51-L88 HydrophobicContact CD2-CD2 4Å; L51-L88 HydrophobicContact CD2-CG 4.24Å; G84-L88 PolarHBondContact O-N 3.39Å; L85-L88 HydrophobicContact CD2-CD1 4.06Å; L85-L88 WeakPolarHBondContact O-CB 3.44Å; L85-L88 PolarHBondContact O-N 3.26Å; S86-L88 VanDerWaalsContact C-N 3.31Å; L88-V90 PolarHBondContact O-N 3.16Å
89	T	37.1	Very low	37.5	Very low	112 Å²	112	97.4 Å²	97.4	69%	0.687	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	4.6	173.7	39.6	0	0	0	0	114.6	L85 S86 L87 G91	L85-T89 PolarHBondContact O-N 3.36Å; L85-T89 VanDerWaalsContact O-N 3.16Å; L85-T89 PolarHBondContact O-OG1 3.41Å; S86-T89 VanDerWaalsContact C-OG1 3.28Å; S86-T89 VanDerWaalsContact CA-OG1 3.26Å; S86-T89 WeakPolarHBondContact CA-OG1 3.2Å; S86-T89 PolarHBondContact O-N 3.2Å; S86-T89 PolarHBondContact O-OG1 3.15Å; L87-T89 VanDerWaalsContact C-N 3.31Å; L87-T89 PolarHBondContact O-N 3.24Å; T89-G91 PolarHBondContact O-N 2.72Å
90	V	32.7	Very low	36.5	Very low	119 Å²	119	101.5 Å²	101.5	72%	0.721	61%	0.609	S	S	*	*	S	Bend	trans	-89.2	91.3	177.1	-170.4	0	0	0	0	110.2	L87 L88	L87-V90 PolarHBondContact O-N 3.31Å; L88-V90 PolarHBondContact O-N 3.16Å
91	G	28.4	Very low	36	Very low	58 Å²	58	99.6 Å²	99.6	60%	0.598	61%	0.609	S	S	*	*			trans	132.4	96.6	159.8	0	0	0	0	0	114.1	T89 S93	T89-G91 PolarHBondContact O-N 2.72Å; G91-S93 PolarHBondContact O-N 2.78Å
92	P	27.5	Very low	35	Very low	125 Å²	125	102.6 Å²	102.6	81%	0.812	63%	0.629	S	S	*	*			trans	-56.3	125.1	145.2	27.5	-29.5	0	0	0	105.3	G94	P92-G94 VanDerWaalsContact C-N 3.28Å; P92-G94 PolarHBondContact O-N 3.49Å
93	S	31.8	Very low	34.5	Very low	120 Å²	120	104 Å²	104	84%	0.839	64%	0.635	S	S	*	*			trans	-52.5	103.7	166.6	50.5	0	0	0	0	106.5	G91 N95	G91-S93 PolarHBondContact O-N 2.78Å; S93-N95 PolarHBondContact O-N 3.46Å
94	G	29.3	Very low	34	Very low	64 Å²	64	109.5 Å²	109.5	66%	0.66	66%	0.659	S	S	*	*			trans	-54.9	128.6	175.4	0	0	0	0	0	107.6	P92 S96	P92-G94 VanDerWaalsContact C-N 3.28Å; P92-G94 PolarHBondContact O-N 3.49Å; G94-S96 PolarHBondContact O-N 3.33Å
95	N	28.2	Very low	33.9	Very low	161 Å²	161	115 Å²	115	86%	0.861	69%	0.688	S	S	*	*			trans	24.8	99.3	154.1	-59.4	-7.4	0	0	0	116	S93	S93-N95 PolarHBondContact O-N 3.46Å
96	S	32.3	Very low	33.4	Very low	112 Å²	112	124.7 Å²	124.7	78%	0.783	73%	0.728	S	S	*	*			trans	-117.2	80.4	137	76	0	0	0	0	108.6	G94	G94-S96 PolarHBondContact O-N 3.33Å
97	S	30.6	Very low	32.9	Very low	91 Å²	91	128 Å²	128	64%	0.636	74%	0.743	S	S	*	*			trans	-55.4	141.9	133.8	50.1	0	0	0	0	106.8
98	D	31.5	Very low	32.7	Very low	139 Å²	139	127.8 Å²	127.8	74%	0.743	75%	0.746	S	S	*	*			trans	90.3	74.6	176	-42.6	-26.7	0	0	0	115
99	N	33.4	Very low	32.5	Very low	149 Å²	149	131.2 Å²	131.2	80%	0.797	77%	0.768	S	S	*	*				-167.2	105	116.7	-107.5	-11.1	0	0	0	111.4	V101	N99-V101 PolarHBondContact O-N 3.27Å; N99-V101 VanDerWaalsContact O-N 3.14Å
100	E	30.7	Very low	32.2	Very low	181 Å²	181	132.4 Å²	132.4	85%	0.846	77%	0.773	S	S	*	*			trans	-52.9	106.2	159.1	-158.3	178.8	-166.3	0	0	108.9	T102	E100-T102 HydrophobicContact CG-CG2 4.49Å
101	V	34.8	Very low	32.2	Very low	106 Å²	106	133.2 Å²	133.2	64%	0.642	78%	0.776	S	S	*	*			trans	-102.9	92.6	165.2	-179.6	0	0	0	0	107.1	N99 H103	N99-V101 PolarHBondContact O-N 3.27Å; N99-V101 VanDerWaalsContact O-N 3.14Å; V101-H103 PolarHBondContact O-N 3.16Å
102	T	29.9	Very low	32.4	Very low	102 Å²	102	138.2 Å²	138.2	63%	0.626	79%	0.788	S	S	*	*			trans	-63.2	109.3	164.9	44.5	0	0	0	0	109.5	E100 N104	E100-T102 HydrophobicContact CG-CG2 4.49Å; T102-N104 PolarHBondContact O-N 3.49Å
103	H	37.5	Very low	32.8	Very low	162 Å²	162	139.1 Å²	139.1	75%	0.75	79%	0.787	S	S	*	*			trans	-80	95.1	160.1	-79.4	-77.2	0	0	0	108.7	V101 V105	V101-H103 PolarHBondContact O-N 3.16Å; H103-V105 PolarHBondContact O-N 3.49Å
104	N	34.4	Very low	32.9	Very low	157 Å²	157	140.6 Å²	140.6	84%	0.84	78%	0.783	S	S	*	*			trans	-65.6	100.1	159.9	-81.7	-19.5	0	0	0	108.1	T102	T102-N104 PolarHBondContact O-N 3.49Å
105	V	39.6	Very low	33.1	Very low	137 Å²	137	147 Å²	147	83%	0.83	79%	0.793	S	S	*	*			trans	-79.8	121.1	159.5	-177.8	0	0	0	0	106.4	H103	H103-V105 PolarHBondContact O-N 3.49Å
106	K	34.7	Very low	33.6	Very low	267 Å²	267	145.7 Å²	145.7	100%	1.161	79%	0.787	S	S	*	*			trans	-66.2	0	175.1	-168.1	-177.9	-177.8	-177.3	0	111.5

Retrieved 106 of 106 residues in 284.9 ms (Link to these results)

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