A0A3Q0KTR5_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A3Q0KTR5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 93 aa.

						>A0A3Q0KTR5_SCHMA|A0A3Q0KTR5
MPQNISGVNWPNVYRLGSLVDLKQNQFQRLKVVIRSPNEKDFILQNGYKSCAASKEDGAKAFLSAALIHSSDLSHESQKVAQQAIQAKRTVRL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	45.9	Very low	229 Å²	229	117.9 Å²	117.9	100%	1.128	64%	0.642	S	S	*	*				0	125.4	0	-74.7	175.7	162.9	0	0	108.1	Q3	M1-Q3 PolarHBondContact O-N 3.23Å
2	P	41.4	Very low	46.5	Very low	132 Å²	132	113.8 Å²	113.8	86%	0.857	62%	0.619	S	S	*	*			trans	-69	115.3	172.2	29	-28.3	0	0	0	107.2	N4	P2-N4 PolarHBondContact O-N 3.49Å; P2-N4 VanDerWaalsContact O-N 3.1Å
3	Q	39.7	Very low	47.3	Very low	170 Å²	170	111.2 Å²	111.2	79%	0.794	61%	0.608	S	S	*	*			trans	-60.7	115.7	173.6	-75.5	174.8	-19.6	0	0	107.3	M1 I5	M1-Q3 PolarHBondContact O-N 3.23Å; Q3-I5 HydrophobicContact CB-CG1 4.33Å; Q3-I5 WeakPolarHBondContact O-CG1 3.18Å; Q3-I5 PolarHBondContact O-N 3.45Å
4	N	42.9	Very low	47.5	Very low	152 Å²	152	112.1 Å²	112.1	81%	0.813	60%	0.6	S	S	*	*			trans	-70.5	98.9	168.8	-167.1	12	0	0	0	105.8	P2 S6	P2-N4 PolarHBondContact O-N 3.49Å; P2-N4 VanDerWaalsContact O-N 3.1Å; N4-S6 PolarHBondContact O-N 3.46Å
5	I	47	Very low	48.2	Very low	86 Å²	86	111.3 Å²	111.3	44%	0.441	59%	0.585	S	S	.	*			trans	-79.6	77	-174	-51.6	140.6	0	0	0	106.8	Q3 G7 V8 F42	Q3-I5 HydrophobicContact CB-CG1 4.33Å; Q3-I5 WeakPolarHBondContact O-CG1 3.18Å; Q3-I5 PolarHBondContact O-N 3.45Å; I5-G7 PolarHBondContact O-N 3.05Å; I5-V8 HydrophobicContact CB-CG2 4.04Å; I5-V8 HydrophobicContact CG2-CG2 3.44Å; I5-V8 VanDerWaalsContact CG2-CG2 3.44Å; I5-F42 HydrophobicContact CB-CE2 4.37Å; I5-F42 HydrophobicContact CD1-CD2 3.51Å; I5-F42 HydrophobicContact CD1-CE2 3.04Å; I5-F42 HydrophobicContact CD1-CZ 3.99Å; I5-F42 HydrophobicContact CG1-CE2 4.28Å
6	S	44.1	Very low	48.6	Very low	119 Å²	119	110.6 Å²	110.6	83%	0.832	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	23.5	178.7	-175.7	0	0	0	0	113.3	N4	N4-S6 PolarHBondContact O-N 3.46Å
7	G	47	Very low	49.1	Very low	61 Å²	61	107.1 Å²	107.1	63%	0.629	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142	7	-172.5	0	0	0	0	0	114.8	I5 N9	I5-G7 PolarHBondContact O-N 3.05Å; G7-N9 PolarHBondContact O-N 3.26Å; G7-N9 VanDerWaalsContact O-N 3.17Å
8	V	46.6	Very low	49.3	Very low	29 Å²	29	105.5 Å²	105.5	18%	0.176	58%	0.576	C	S	.	*			trans	-81.7	98.3	171.8	-169.9	0	0	0	0	106.9	I5 W10 E39 F42	I5-V8 HydrophobicContact CB-CG2 4.04Å; I5-V8 HydrophobicContact CG2-CG2 3.44Å; I5-V8 VanDerWaalsContact CG2-CG2 3.44Å; V8-W10 PolarHBondContact O-N 2.87Å; V8-E39 HydrophobicContact CG1-CG 3.97Å; V8-F42 HydrophobicContact CB-CD1 4.14Å; V8-F42 HydrophobicContact CB-CE1 4.06Å; V8-F42 HydrophobicContact CG1-CD1 3.62Å; V8-F42 HydrophobicContact CG1-CE1 3.9Å; V8-F42 HydrophobicContact CG1-CG 4.49Å; V8-F42 HydrophobicContact CG2-CD1 3.66Å; V8-F42 HydrophobicContact CG2-CD2 4.36Å; V8-F42 HydrophobicContact CG2-CE1 3.67Å; V8-F42 HydrophobicContact CG2-CE2 4.4Å; V8-F42 HydrophobicContact CG2-CG 3.98Å; V8-F42 HydrophobicContact CG2-CZ 4.02Å
9	N	51.2	Low	49.5	Very low	95 Å²	95	106.6 Å²	106.6	51%	0.508	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-65.9	120.5	167.8	-154.2	7.5	0	0	0	105.7	G7 P11	G7-N9 PolarHBondContact O-N 3.26Å; G7-N9 VanDerWaalsContact O-N 3.17Å; N9-P11 VanDerWaalsContact O-N 3.09Å
10	W	53.2	Low	49.3	Very low	211 Å²	211	107.3 Å²	107.3	80%	0.799	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-54.7	125.7	177.8	-75.1	96	0	0	0	107.6	V8 N12	V8-W10 PolarHBondContact O-N 2.87Å; W10-N12 PolarHBondContact O-N 3.41Å
11	P	58	Low	49.3	Very low	13 Å²	13	108.1 Å²	108.1	8%	0.084	59%	0.592	C	S	.	*	P	Polyproline II helix	trans	-58.5	140.5	-177.9	27.6	-38.9	0	0	0	108.6	N9 V13 V32 V33 I34 I43	N9-P11 VanDerWaalsContact O-N 3.09Å; P11-V13 WeakPolarHBondContact O-CG2 3.47Å; P11-V13 PolarHBondContact O-N 3.43Å; P11-V32 HydrophobicContact CB-CG1 3.34Å; P11-V32 HydrophobicContact CG-CG1 3.18Å; P11-V33 WeakPolarHBondContact CA-O 3.38Å; P11-V33 WeakPolarHBondContact CB-O 3.4Å; P11-I34 HydrophobicContact CB-CG1 4.15Å; P11-I43 HydrophobicContact CB-CD1 4.26Å; P11-I43 HydrophobicContact CG-CD1 3.55Å
12	N	53.3	Low	50.2	Low	68 Å²	68	100.1 Å²	100.1	36%	0.364	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.2	113.5	172.6	-79.6	-7	0	0	0	107.8	W10 Y14 V33	W10-N12 PolarHBondContact O-N 3.41Å; N12-Y14 HydrophobicContact CB-CD2 4.17Å; N12-Y14 HydrophobicContact CB-CE2 3.36Å; N12-Y14 PolarHBondContact ND2-OH 3.22Å; N12-Y14 WeakPolarHBondContact O-CD2 3.33Å; N12-V33 PolarHBondContact N-O 3.02Å; N12-V33 PolarHBondContact O-N 3.06Å
13	V	56.2	Low	50.7	Low	80 Å²	80	101.6 Å²	101.6	49%	0.485	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	109	177.3	-175.2	0	0	0	0	107.7	P11 L30 K31 V32	P11-V13 WeakPolarHBondContact O-CG2 3.47Å; P11-V13 PolarHBondContact O-N 3.43Å; V13-L30 HydrophobicContact CG1-CB 3.84Å; V13-L30 HydrophobicContact CG1-CD1 4Å; V13-L30 HydrophobicContact CG1-CD2 3.99Å; V13-L30 HydrophobicContact CG1-CG 4.15Å; V13-K31 CarbonylContact C-O 3.58Å; V13-K31 WeakPolarHBondContact CA-O 3.3Å; V13-V32 HydrophobicContact CG2-CG2 4.4Å
14	Y	51.1	Low	51.3	Low	124 Å²	124	103.2 Å²	103.2	49%	0.486	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.6	135.7	173.1	-58.2	-89.3	0	0	0	109.5	N12 L16 L30 K31 V33	N12-Y14 HydrophobicContact CB-CD2 4.17Å; N12-Y14 HydrophobicContact CB-CE2 3.36Å; N12-Y14 PolarHBondContact ND2-OH 3.22Å; N12-Y14 WeakPolarHBondContact O-CD2 3.33Å; Y14-L16 PolarHBondContact O-N 3.26Å; Y14-L30 CarbonylContact O-C 3.59Å; Y14-K31 PolarHBondContact N-O 3.01Å; Y14-K31 PolarHBondContact O-N 3.28Å; Y14-V33 HydrophobicContact CD2-CB 4.41Å; Y14-V33 HydrophobicContact CD2-CG2 3.64Å; Y14-V33 HydrophobicContact CE2-CB 4.05Å; Y14-V33 HydrophobicContact CE2-CG2 3.55Å
15	R	56.8	Low	51.7	Low	100 Å²	100	103.3 Å²	103.3	38%	0.377	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.7	119.8	175.6	-155.3	169	-169.6	-106	6	109	G17 L19 L22 Q28 L30	R15-G17 PolarHBondContact O-N 3.24Å; R15-L19 VanDerWaalsContact CZ-CD1 3.45Å; R15-L22 VanDerWaalsContact NH2-CD1 3.33Å; R15-Q28 HydrophobicContact CG-CG 4.24Å; R15-Q28 VanDerWaalsContact NH2-CD 3.28Å; R15-L30 HydrophobicContact CG-CD2 4.32Å
16	L	55.9	Low	52.1	Low	101 Å²	101	105 Å²	105	53%	0.529	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.2	94.5	171.9	-94.7	156	0	0	0	107.6	Y14 R29 K31	Y14-L16 PolarHBondContact O-N 3.26Å; L16-R29 HydrophobicContact CB-CB 3.91Å; L16-R29 WeakPolarHBondContact CB-O 3.4Å; L16-R29 PolarHBondContact N-O 2.87Å; L16-K31 HydrophobicContact CD1-CB 3.54Å; L16-K31 HydrophobicContact CD1-CG 4.29Å; L16-K31 HydrophobicContact CG-CB 3.95Å
17	G	56.9	Low	52.7	Low	50 Å²	50	104.3 Å²	104.3	52%	0.515	54%	0.543	S	S	.	.	S	Bend	trans	135.1	150.7	172.3	0	0	0	0	0	114.3	R15	R15-G17 PolarHBondContact O-N 3.24Å
18	S	52.4	Low	53.2	Low	79 Å²	79	103.7 Å²	103.7	55%	0.552	52%	0.523	S	S	*	.			trans	-64.6	140.8	172.5	-173.4	0	0	0	0	110.3	V20 L22	S18-V20 PolarHBondContact O-N 3.33Å; S18-V20 VanDerWaalsContact O-N 3.14Å; S18-V20 VanDerWaalsContact OG-CG2 3.28Å; S18-V20 WeakPolarHBondContact OG-CG2 3.49Å; S18-L22 WeakPolarHBondContact O-CD1 3.38Å
19	L	53.1	Low	53.8	Low	127 Å²	127	110.4 Å²	110.4	67%	0.665	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-60.8	-17.9	174.8	-174.7	65.3	0	0	0	113.2	R15 D21	R15-L19 VanDerWaalsContact CZ-CD1 3.45Å; L19-D21 VanDerWaalsContact C-N 3.33Å; L19-D21 PolarHBondContact O-N 2.88Å
20	V	46.4	Very low	54.2	Low	120 Å²	120	108.6 Å²	108.6	73%	0.727	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-75.1	-17.4	-163.4	-171.1	0	0	0	0	113.7	S18	S18-V20 PolarHBondContact O-N 3.33Å; S18-V20 VanDerWaalsContact O-N 3.14Å; S18-V20 VanDerWaalsContact OG-CG2 3.28Å; S18-V20 WeakPolarHBondContact OG-CG2 3.49Å
21	D	48.9	Very low	54.5	Low	124 Å²	124	104.2 Å²	104.2	66%	0.663	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-119.7	10.8	-174.9	-69.4	-52	0	0	0	115.7	L19 K23	L19-D21 VanDerWaalsContact C-N 3.33Å; L19-D21 PolarHBondContact O-N 2.88Å; D21-K23 PolarHBondContact O-N 3.4Å
22	L	51.4	Low	54.6	Low	62 Å²	62	105.5 Å²	105.5	33%	0.325	53%	0.53	S	S	.	.			trans	-75.4	90.9	177.7	-74.9	107	0	0	0	111.3	R15 S18 Q28	R15-L22 VanDerWaalsContact NH2-CD1 3.33Å; S18-L22 WeakPolarHBondContact O-CD1 3.38Å; L22-Q28 HydrophobicContact CD2-CB 3.91Å; L22-Q28 HydrophobicContact CD2-CG 4.31Å; L22-Q28 VanDerWaalsContact CD2-NE2 3.25Å
23	K	52.1	Low	54.9	Low	163 Å²	163	104.9 Å²	104.9	71%	0.709	53%	0.528	S	S	*	.			trans	-58.7	141.8	157.9	-71.9	-173.1	176.7	-177.4	0	108.8	D21 N25 Q26	D21-K23 PolarHBondContact O-N 3.4Å; K23-N25 PolarHBondContact O-N 2.91Å; K23-Q26 HydrophobicContact CB-CG 4.39Å; K23-Q26 PolarHBondContact O-N 2.96Å
24	Q	52.8	Low	55.2	Low	203 Å²	203	103.5 Å²	103.5	95%	0.949	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-9.3	-174.4	-91.5	172.8	-41.7	0	0	116.6
25	N	52	Low	55.7	Low	154 Å²	154	105.7 Å²	105.7	82%	0.824	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	15.4	179	-77.8	-8.4	0	0	0	114.5	K23	K23-N25 PolarHBondContact O-N 2.91Å
26	Q	54.2	Low	55.9	Low	122 Å²	122	102.8 Å²	102.8	57%	0.57	52%	0.52	S	S	*	.			trans	-96.5	126.3	177	-72.2	-164	-12.3	0	0	112.2	K23 Q28	K23-Q26 HydrophobicContact CB-CG 4.39Å; K23-Q26 PolarHBondContact O-N 2.96Å; Q26-Q28 PolarHBondContact O-N 3.31Å; Q26-Q28 VanDerWaalsContact O-N 3.12Å
27	F	57.5	Low	56.4	Low	105 Å²	105	102.8 Å²	102.8	46%	0.461	53%	0.526	S	S	.	.			trans	-59.8	115.2	173.2	-66.1	-69.4	0	0	0	110.3	R29 K60	F27-R29 PolarHBondContact O-N 3.48Å; F27-K60 HydrophobicContact CD1-CB 3.95Å; F27-K60 HydrophobicContact CE1-CB 3.25Å; F27-K60 HydrophobicContact CE1-CD 3.69Å; F27-K60 HydrophobicContact CE1-CG 4.12Å; F27-K60 HydrophobicContact CE2-CD 4.49Å; F27-K60 HydrophobicContact CZ-CB 3.81Å; F27-K60 HydrophobicContact CZ-CD 3.4Å; F27-K60 VanDerWaalsContact CZ-CD 3.4Å; F27-K60 HydrophobicContact CZ-CG 4.23Å
28	Q	56.7	Low	56.7	Low	48 Å²	48	106.6 Å²	106.6	22%	0.224	53%	0.534	C	S	.	.			trans	-71.2	118.7	171.1	-179.7	124.8	73.6	0	0	109.7	R15 L22 Q26 L30	R15-Q28 HydrophobicContact CG-CG 4.24Å; R15-Q28 VanDerWaalsContact NH2-CD 3.28Å; L22-Q28 HydrophobicContact CD2-CB 3.91Å; L22-Q28 HydrophobicContact CD2-CG 4.31Å; L22-Q28 VanDerWaalsContact CD2-NE2 3.25Å; Q26-Q28 PolarHBondContact O-N 3.31Å; Q26-Q28 VanDerWaalsContact O-N 3.12Å; Q28-L30 HydrophobicContact CG-CD2 3.94Å; Q28-L30 HydrophobicContact CG-CG 4.34Å; Q28-L30 PolarHBondContact O-N 3.34Å
29	R	59.5	Low	57.2	Low	169 Å²	169	103.6 Å²	103.6	64%	0.638	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.7	168	-67.9	-176.3	-179.5	178.8	0.2	108.7	L16 F27	L16-R29 HydrophobicContact CB-CB 3.91Å; L16-R29 WeakPolarHBondContact CB-O 3.4Å; L16-R29 PolarHBondContact N-O 2.87Å; F27-R29 PolarHBondContact O-N 3.48Å
30	L	60.7	Low	57.6	Low	57 Å²	57	99 Å²	99	30%	0.298	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.9	173.2	-64.4	174.4	0	0	0	107.7	V13 Y14 R15 Q28 A65	V13-L30 HydrophobicContact CG1-CB 3.84Å; V13-L30 HydrophobicContact CG1-CD1 4Å; V13-L30 HydrophobicContact CG1-CD2 3.99Å; V13-L30 HydrophobicContact CG1-CG 4.15Å; Y14-L30 CarbonylContact O-C 3.59Å; R15-L30 HydrophobicContact CG-CD2 4.32Å; Q28-L30 HydrophobicContact CG-CD2 3.94Å; Q28-L30 HydrophobicContact CG-CG 4.34Å; Q28-L30 PolarHBondContact O-N 3.34Å; L30-A65 WeakPolarHBondContact O-CB 3.33Å
31	K	59.1	Low	58.5	Low	120 Å²	120	95.5 Å²	95.5	52%	0.522	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	111.6	168	-169	175.4	-177.5	177.8	0	107.6	V13 Y14 L16 V33	V13-K31 CarbonylContact C-O 3.58Å; V13-K31 WeakPolarHBondContact CA-O 3.3Å; Y14-K31 PolarHBondContact N-O 3.01Å; Y14-K31 PolarHBondContact O-N 3.28Å; L16-K31 HydrophobicContact CD1-CB 3.54Å; L16-K31 HydrophobicContact CD1-CG 4.29Å; L16-K31 HydrophobicContact CG-CB 3.95Å; K31-V33 HydrophobicContact CG-CG2 4.37Å
32	V	59.6	Low	59.2	Low	40 Å²	40	92.1 Å²	92.1	24%	0.242	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	111.4	174.4	-176	0	0	0	0	107.3	P11 V13 I34	P11-V32 HydrophobicContact CB-CG1 3.34Å; P11-V32 HydrophobicContact CG-CG1 3.18Å; V13-V32 HydrophobicContact CG2-CG2 4.4Å; V32-I34 HydrophobicContact CG1-CD1 4.36Å; V32-I34 HydrophobicContact CG1-CG1 3.87Å; V32-I34 PolarHBondContact O-N 2.94Å
33	V	60	Low	59.8	Low	54 Å²	54	90 Å²	90	33%	0.327	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	106.8	176.3	176.9	0	0	0	0	108.6	P11 N12 Y14 K31	P11-V33 WeakPolarHBondContact CA-O 3.38Å; P11-V33 WeakPolarHBondContact CB-O 3.4Å; N12-V33 PolarHBondContact N-O 3.02Å; N12-V33 PolarHBondContact O-N 3.06Å; Y14-V33 HydrophobicContact CD2-CB 4.41Å; Y14-V33 HydrophobicContact CD2-CG2 3.64Å; Y14-V33 HydrophobicContact CE2-CB 4.05Å; Y14-V33 HydrophobicContact CE2-CG2 3.55Å; K31-V33 HydrophobicContact CG-CG2 4.37Å
34	I	61.9	Low	60.4	Low	52 Å²	52	84 Å²	84	27%	0.267	41%	0.407	S	S	.	.			trans	-97.7	126.4	-177.9	-55.5	169.7	0	0	0	107.8	P11 V32 S36 E39 K40 I43	P11-I34 HydrophobicContact CB-CG1 4.15Å; V32-I34 HydrophobicContact CG1-CD1 4.36Å; V32-I34 HydrophobicContact CG1-CG1 3.87Å; V32-I34 PolarHBondContact O-N 2.94Å; I34-S36 WeakPolarHBondContact CG2-O 3.41Å; I34-E39 HydrophobicContact CG2-CB 3.43Å; I34-E39 VanDerWaalsContact CG2-CB 3.43Å; I34-K40 HydrophobicContact CD1-CB 3.83Å; I34-K40 HydrophobicContact CD1-CG 3.94Å; I34-K40 HydrophobicContact CG2-CB 4Å; I34-I43 HydrophobicContact CD1-CD1 4.08Å; I34-I43 HydrophobicContact CG1-CD1 3.99Å
35	R	62.8	Low	60.9	Low	169 Å²	169	79.9 Å²	79.9	64%	0.638	39%	0.388	S	S	*	.	S	Bend	trans	-90.2	-20.7	-173.9	-66.2	-175.6	-179.3	179.2	3.4	112.5	E39	R35-E39 PolarHBondContact N-OE2 3.37Å
36	S	61.1	Low	61.3	Low	40 Å²	40	74.9 Å²	74.9	28%	0.28	36%	0.361	S	S	.	.	S	Bend	trans	-134.2	148.3	176.3	68.6	0	0	0	0	113.4	I34 N38 E39 K40	I34-S36 WeakPolarHBondContact CG2-O 3.41Å; S36-N38 PolarHBondContact O-N 2.9Å; S36-E39 PolarHBondContact N-OE2 2.75Å; S36-E39 VanDerWaalsContact N-OE2 3.14Å; S36-E39 WeakPolarHBondContact O-CB 3.45Å; S36-E39 PolarHBondContact O-N 3.12Å; S36-E39 VanDerWaalsContact O-N 3.13Å; S36-E39 WeakPolarHBondContact OG-CB 3.39Å; S36-E39 WeakPolarHBondContact OG-CG 3.27Å; S36-E39 PolarHBondContact OG-N 2.94Å; S36-K40 PolarHBondContact O-N 3.42Å
37	P	64.5	Low	61.4	Low	100 Å²	100	69.8 Å²	69.8	65%	0.649	34%	0.342	S	S	*	.	H	α-helix	trans	-55.5	-35.9	173.8	-23.2	32.4	0	0	0	112.7	E39 K40 D41	P37-E39 PolarHBondContact O-N 3.03Å; P37-K40 WeakPolarHBondContact O-CB 3.15Å; P37-K40 PolarHBondContact O-N 2.97Å; P37-K40 VanDerWaalsContact O-N 3.12Å; P37-D41 PolarHBondContact O-N 3.18Å
38	N	64.7	Low	61.1	Low	130 Å²	130	69.8 Å²	69.8	70%	0.695	34%	0.34	S	S	*	.	H	α-helix	trans	-65.6	-37.3	178.9	-63.6	4.5	0	0	0	112.3	S36 K40 F42	S36-N38 PolarHBondContact O-N 2.9Å; N38-K40 VanDerWaalsContact C-N 3.29Å; N38-K40 PolarHBondContact O-N 3.46Å; N38-F42 WeakPolarHBondContact O-CB 3.48Å; N38-F42 PolarHBondContact O-N 3.15Å
39	E	62.2	Low	60.6	Low	16 Å²	16	74.5 Å²	74.5	8%	0.075	36%	0.359	C	S	.	.	H	α-helix	trans	-62.6	-38.5	173.1	-78.6	166.9	-179.6	0	0	110.7	V8 I34 R35 S36 P37 F42 I43	V8-E39 HydrophobicContact CG1-CG 3.97Å; I34-E39 HydrophobicContact CG2-CB 3.43Å; I34-E39 VanDerWaalsContact CG2-CB 3.43Å; R35-E39 PolarHBondContact N-OE2 3.37Å; S36-E39 PolarHBondContact N-OE2 2.75Å; S36-E39 VanDerWaalsContact N-OE2 3.14Å; S36-E39 WeakPolarHBondContact O-CB 3.45Å; S36-E39 PolarHBondContact O-N 3.12Å; S36-E39 VanDerWaalsContact O-N 3.13Å; S36-E39 WeakPolarHBondContact OG-CB 3.39Å; S36-E39 WeakPolarHBondContact OG-CG 3.27Å; S36-E39 PolarHBondContact OG-N 2.94Å; P37-E39 PolarHBondContact O-N 3.03Å; E39-F42 PolarHBondContact O-N 2.92Å; E39-I43 HydrophobicContact CB-CD1 4.46Å; E39-I43 VanDerWaalsContact O-CB 3.31Å; E39-I43 WeakPolarHBondContact O-CB 3.49Å; E39-I43 WeakPolarHBondContact O-CD1 3.35Å; E39-I43 WeakPolarHBondContact O-CG1 3.43Å; E39-I43 PolarHBondContact O-N 2.98Å
40	K	62.1	Low	59.8	Low	32 Å²	32	70.3 Å²	70.3	14%	0.139	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-50	179.4	-178.9	-175.6	170.8	-177.1	0	111.4	I34 S36 P37 N38 F42 I43 L44 D72	I34-K40 HydrophobicContact CD1-CB 3.83Å; I34-K40 HydrophobicContact CD1-CG 3.94Å; I34-K40 HydrophobicContact CG2-CB 4Å; S36-K40 PolarHBondContact O-N 3.42Å; P37-K40 WeakPolarHBondContact O-CB 3.15Å; P37-K40 PolarHBondContact O-N 2.97Å; P37-K40 VanDerWaalsContact O-N 3.12Å; N38-K40 VanDerWaalsContact C-N 3.29Å; N38-K40 PolarHBondContact O-N 3.46Å; K40-F42 VanDerWaalsContact C-N 3.32Å; K40-F42 PolarHBondContact O-N 3.22Å; K40-I43 PolarHBondContact O-N 3.42Å; K40-L44 HydrophobicContact CG-CD1 4.01Å; K40-L44 WeakPolarHBondContact O-CB 3.5Å; K40-L44 VanDerWaalsContact O-CG 3.26Å; K40-L44 WeakPolarHBondContact O-CG 3.46Å; K40-L44 PolarHBondContact O-N 2.96Å; K40-D72 PolarHBondContact NZ-O 2.73Å
41	D	64.3	Low	58.7	Low	45 Å²	45	69.2 Å²	69.2	24%	0.241	35%	0.353	C	S	.	.	H	α-helix	trans	-66.3	-36.3	179	-72.7	-34.5	0	0	0	111.6	P37 L44 Q45 S77	P37-D41 PolarHBondContact O-N 3.18Å; D41-L44 PolarHBondContact O-N 3.48Å; D41-Q45 VanDerWaalsContact O-CB 3.31Å; D41-Q45 WeakPolarHBondContact O-CB 3.24Å; D41-Q45 VanDerWaalsContact O-CG 3.24Å; D41-Q45 WeakPolarHBondContact O-CG 3.31Å; D41-Q45 PolarHBondContact O-N 3.43Å; D41-S77 PolarHBondContact OD1-OG 2.87Å; D41-S77 VanDerWaalsContact OD1-OG 3.1Å
42	F	63.4	Low	57.8	Low	54 Å²	54	68 Å²	68	24%	0.237	37%	0.365	C	S	.	.	H	α-helix	trans	-62.5	-45.5	174	-179	-100.8	0	0	0	112.5	I5 V8 N38 E39 K40 L44 Q45 N46	I5-F42 HydrophobicContact CB-CE2 4.37Å; I5-F42 HydrophobicContact CD1-CD2 3.51Å; I5-F42 HydrophobicContact CD1-CE2 3.04Å; I5-F42 HydrophobicContact CD1-CZ 3.99Å; I5-F42 HydrophobicContact CG1-CE2 4.28Å; V8-F42 HydrophobicContact CB-CD1 4.14Å; V8-F42 HydrophobicContact CB-CE1 4.06Å; V8-F42 HydrophobicContact CG1-CD1 3.62Å; V8-F42 HydrophobicContact CG1-CE1 3.9Å; V8-F42 HydrophobicContact CG1-CG 4.49Å; V8-F42 HydrophobicContact CG2-CD1 3.66Å; V8-F42 HydrophobicContact CG2-CD2 4.36Å; V8-F42 HydrophobicContact CG2-CE1 3.67Å; V8-F42 HydrophobicContact CG2-CE2 4.4Å; V8-F42 HydrophobicContact CG2-CG 3.98Å; V8-F42 HydrophobicContact CG2-CZ 4.02Å; N38-F42 WeakPolarHBondContact O-CB 3.48Å; N38-F42 PolarHBondContact O-N 3.15Å; E39-F42 PolarHBondContact O-N 2.92Å; K40-F42 VanDerWaalsContact C-N 3.32Å; K40-F42 PolarHBondContact O-N 3.22Å; F42-L44 VanDerWaalsContact C-N 3.35Å; F42-Q45 PolarHBondContact O-N 3.1Å; F42-N46 WeakPolarHBondContact CD2-ND2 3.26Å; F42-N46 WeakPolarHBondContact CE1-ND2 3.47Å; F42-N46 WeakPolarHBondContact CE2-ND2 3.22Å; F42-N46 WeakPolarHBondContact CZ-ND2 3.36Å; F42-N46 WeakPolarHBondContact O-CB 3.44Å; F42-N46 PolarHBondContact O-N 2.89Å; F42-N46 PolarHBondContact O-ND2 3.31Å
43	I	64.7	Low	56.7	Low	17 Å²	17	70.5 Å²	70.5	9%	0.087	39%	0.39	C	S	.	.	H	α-helix	trans	-64.7	-39.6	177.6	-71.8	159.7	0	0	0	110.9	P11 I34 E39 K40 G47 F62	P11-I43 HydrophobicContact CB-CD1 4.26Å; P11-I43 HydrophobicContact CG-CD1 3.55Å; I34-I43 HydrophobicContact CD1-CD1 4.08Å; I34-I43 HydrophobicContact CG1-CD1 3.99Å; E39-I43 HydrophobicContact CB-CD1 4.46Å; E39-I43 VanDerWaalsContact O-CB 3.31Å; E39-I43 WeakPolarHBondContact O-CB 3.49Å; E39-I43 WeakPolarHBondContact O-CD1 3.35Å; E39-I43 WeakPolarHBondContact O-CG1 3.43Å; E39-I43 PolarHBondContact O-N 2.98Å; K40-I43 PolarHBondContact O-N 3.42Å; I43-G47 WeakPolarHBondContact O-CA 3.28Å; I43-G47 PolarHBondContact O-N 3.28Å; I43-F62 HydrophobicContact CG2-CE1 3.31Å; I43-F62 HydrophobicContact CG2-CZ 3.34Å
44	L	65.5	Low	55.7	Low	36 Å²	36	71 Å²	71	19%	0.188	40%	0.395	C	S	.	.	H	α-helix	trans	-68.9	-44.1	177.2	-70.8	170.5	0	0	0	111.6	K40 D41 F42 Y48 A66 L73	K40-L44 HydrophobicContact CG-CD1 4.01Å; K40-L44 WeakPolarHBondContact O-CB 3.5Å; K40-L44 VanDerWaalsContact O-CG 3.26Å; K40-L44 WeakPolarHBondContact O-CG 3.46Å; K40-L44 PolarHBondContact O-N 2.96Å; D41-L44 PolarHBondContact O-N 3.48Å; F42-L44 VanDerWaalsContact C-N 3.35Å; L44-Y48 WeakPolarHBondContact O-CB 2.86Å; L44-Y48 PolarHBondContact O-N 3.14Å; L44-Y48 VanDerWaalsContact O-N 3.12Å; L44-A66 HydrophobicContact CD2-CB 4.49Å; L44-L73 HydrophobicContact CD1-CD2 3.53Å
45	Q	61.8	Low	54.8	Low	117 Å²	117	77.7 Å²	77.7	55%	0.547	42%	0.423	S	S	.	.	H	α-helix	trans	-66.3	-42.5	178.5	-73.8	-178.9	29.4	0	0	112.5	D41 F42 K49	D41-Q45 VanDerWaalsContact O-CB 3.31Å; D41-Q45 WeakPolarHBondContact O-CB 3.24Å; D41-Q45 VanDerWaalsContact O-CG 3.24Å; D41-Q45 WeakPolarHBondContact O-CG 3.31Å; D41-Q45 PolarHBondContact O-N 3.43Å; F42-Q45 PolarHBondContact O-N 3.1Å; Q45-K49 PolarHBondContact O-N 3.43Å
46	N	60.3	Low	53.7	Low	49 Å²	49	77.2 Å²	77.2	26%	0.262	43%	0.428	S	S	.	.	H	α-helix	trans	-83.5	-32.7	179	-70.1	-37.5	0	0	0	113.4	F42 Y48 K49 S50	F42-N46 WeakPolarHBondContact CD2-ND2 3.26Å; F42-N46 WeakPolarHBondContact CE1-ND2 3.47Å; F42-N46 WeakPolarHBondContact CE2-ND2 3.22Å; F42-N46 WeakPolarHBondContact CZ-ND2 3.36Å; F42-N46 WeakPolarHBondContact O-CB 3.44Å; F42-N46 PolarHBondContact O-N 2.89Å; F42-N46 PolarHBondContact O-ND2 3.31Å; N46-Y48 PolarHBondContact O-N 3.41Å; N46-K49 PolarHBondContact O-N 3.31Å; N46-K49 VanDerWaalsContact O-N 3.1Å; N46-S50 WeakPolarHBondContact O-CB 3.39Å; N46-S50 PolarHBondContact O-N 2.76Å; N46-S50 PolarHBondContact O-OG 3.12Å
47	G	56.2	Low	53	Low	16 Å²	16	80.7 Å²	80.7	17%	0.165	44%	0.443	C	S	.	.	H	α-helix	trans	-53.9	-42.2	169.3	0	0	0	0	0	109.9	I43 C51	I43-G47 WeakPolarHBondContact O-CA 3.28Å; I43-G47 PolarHBondContact O-N 3.28Å; G47-C51 VanDerWaalsContact O-CB 3.27Å; G47-C51 WeakPolarHBondContact O-CB 3.21Å; G47-C51 PolarHBondContact O-N 3.1Å; G47-C51 PolarHBondContact O-SG 3.47Å
48	Y	51.7	Low	51.9	Low	105 Å²	105	78.2 Å²	78.2	41%	0.412	44%	0.436	S	S	.	.	H	α-helix	trans	-65.6	-43.7	174.2	-165.3	-95.5	0	0	0	113.3	L44 N46 C51 V80 A84	L44-Y48 WeakPolarHBondContact O-CB 2.86Å; L44-Y48 PolarHBondContact O-N 3.14Å; L44-Y48 VanDerWaalsContact O-N 3.12Å; N46-Y48 PolarHBondContact O-N 3.41Å; Y48-C51 PolarHBondContact O-N 2.61Å; Y48-V80 HydrophobicContact CD2-CG1 3.77Å; Y48-V80 HydrophobicContact CE2-CG1 3.98Å; Y48-V80 HydrophobicContact CG-CG1 4.09Å; Y48-A84 HydrophobicContact CE2-CB 4.27Å
49	K	46.7	Very low	50.8	Low	147 Å²	147	73.1 Å²	73.1	64%	0.639	41%	0.412	S	S	*	.	H	α-helix	trans	-67.8	-36.7	178.8	-71.5	-178.6	-179.2	-179.4	0	113.3	Q45 N46 C51	Q45-K49 PolarHBondContact O-N 3.43Å; N46-K49 PolarHBondContact O-N 3.31Å; N46-K49 VanDerWaalsContact O-N 3.1Å; K49-C51 VanDerWaalsContact C-N 3.31Å
50	S	43.5	Very low	49.8	Very low	81 Å²	81	77.6 Å²	77.6	57%	0.566	43%	0.431	S	S	*	.	H	α-helix	trans	-75.7	-20.4	175.6	-53.7	0	0	0	0	112.6	N46 A52	N46-S50 WeakPolarHBondContact O-CB 3.39Å; N46-S50 PolarHBondContact O-N 2.76Å; N46-S50 PolarHBondContact O-OG 3.12Å; S50-A52 VanDerWaalsContact C-N 3.33Å
51	C	37.3	Very low	49	Very low	34 Å²	34	77.5 Å²	77.5	23%	0.23	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.1	175.2	-77.8	0	0	0	0	114.1	G47 Y48 K49 A59	G47-C51 VanDerWaalsContact O-CB 3.27Å; G47-C51 WeakPolarHBondContact O-CB 3.21Å; G47-C51 PolarHBondContact O-N 3.1Å; G47-C51 PolarHBondContact O-SG 3.47Å; Y48-C51 PolarHBondContact O-N 2.61Å; K49-C51 VanDerWaalsContact C-N 3.31Å; C51-A59 HydrophobicContact CB-CB 3.84Å; C51-A59 VanDerWaalsContact SG-CA 3.55Å; C51-A59 WeakPolarHBondContact SG-CB 2.77Å
52	A	38.9	Very low	48.2	Very low	94 Å²	94	79.1 Å²	79.1	78%	0.777	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.9	176.6	0	0	0	0	0	113.8	S50	S50-A52 VanDerWaalsContact C-N 3.33Å
53	A	37.8	Very low	47.3	Very low	92 Å²	92	80 Å²	80	76%	0.76	45%	0.448	S	S	*	.	S	Bend	trans	-107.9	-12.4	-174.4	0	0	0	0	0	114.8
54	S	38.8	Very low	46.3	Very low	64 Å²	64	81.3 Å²	81.3	45%	0.448	46%	0.458	S	S	.	.			trans	-105.3	105.4	-178	-174.2	0	0	0	0	110.6	E56	S54-E56 PolarHBondContact O-N 3.12Å
55	K	41.8	Very low	45.3	Very low	193 Å²	193	81.3 Å²	81.3	84%	0.839	46%	0.464	S	S	*	.			trans	-55.9	117.7	166.5	-70.5	176.7	176.4	176.6	0	108.7	D57	K55-D57 PolarHBondContact O-N 3.37Å
56	E	41.4	Very low	44.6	Very low	159 Å²	159	77.2 Å²	77.2	74%	0.743	45%	0.45	S	S	*	.	S	Bend	trans	90.7	-33.2	148.1	-67.8	178	115	0	0	122.8	S54	S54-E56 PolarHBondContact O-N 3.12Å
57	D	45.9	Very low	43.8	Very low	113 Å²	113	81.8 Å²	81.8	60%	0.604	47%	0.474	S	S	*	.	S	Bend	trans	-133.2	-31.7	-174.2	-89.3	-56.9	0	0	0	118.3	K55 A59	K55-D57 PolarHBondContact O-N 3.37Å; D57-A59 PolarHBondContact O-N 3.14Å
58	G	40.9	Very low	43.5	Very low	48 Å²	48	83.8 Å²	83.8	50%	0.495	48%	0.48	S	S	.	.	H	α-helix	trans	-69.6	-33.6	-177.3	0	0	0	0	0	114.2	K60 A61	G58-K60 PolarHBondContact O-N 3.32Å; G58-A61 PolarHBondContact O-N 3.27Å
59	A	41.3	Very low	43.3	Very low	24 Å²	24	85.8 Å²	85.8	20%	0.198	49%	0.493	C	S	.	.	H	α-helix	trans	-73.3	-24.7	-173.8	0	0	0	0	0	113.9	C51 D57	C51-A59 HydrophobicContact CB-CB 3.84Å; C51-A59 VanDerWaalsContact SG-CA 3.55Å; C51-A59 WeakPolarHBondContact SG-CB 2.77Å; D57-A59 PolarHBondContact O-N 3.14Å
60	K	41.4	Very low	43.3	Very low	110 Å²	110	83 Å²	83	48%	0.478	49%	0.492	S	S	.	.	H	α-helix	trans	-76.7	-32.2	177	-74	179.3	-171.6	158.1	0	111.8	F27 G58 S64	F27-K60 HydrophobicContact CD1-CB 3.95Å; F27-K60 HydrophobicContact CE1-CB 3.25Å; F27-K60 HydrophobicContact CE1-CD 3.69Å; F27-K60 HydrophobicContact CE1-CG 4.12Å; F27-K60 HydrophobicContact CE2-CD 4.49Å; F27-K60 HydrophobicContact CZ-CB 3.81Å; F27-K60 HydrophobicContact CZ-CD 3.4Å; F27-K60 VanDerWaalsContact CZ-CD 3.4Å; F27-K60 HydrophobicContact CZ-CG 4.23Å; G58-K60 PolarHBondContact O-N 3.32Å; K60-S64 WeakPolarHBondContact O-CB 3.16Å; K60-S64 PolarHBondContact O-N 3Å; K60-S64 VanDerWaalsContact O-N 3.12Å; K60-S64 PolarHBondContact O-OG 3.1Å
61	A	46.4	Very low	43.8	Very low	29 Å²	29	83.5 Å²	83.5	24%	0.24	50%	0.495	C	S	.	.	H	α-helix	trans	-69.7	-38.3	179.2	0	0	0	0	0	112.3	G58 S64 A65	G58-A61 PolarHBondContact O-N 3.27Å; A61-S64 PolarHBondContact O-OG 3.28Å; A61-A65 WeakPolarHBondContact O-CB 3.33Å; A61-A65 PolarHBondContact O-N 3.31Å; A61-A65 VanDerWaalsContact O-N 3.14Å
62	F	46.3	Very low	44.6	Very low	80 Å²	80	87.7 Å²	87.7	35%	0.351	52%	0.515	S	S	.	.	H	α-helix	trans	-77	-39.7	-175.8	-144.2	-95.3	0	0	0	113	I43 A66	I43-F62 HydrophobicContact CG2-CE1 3.31Å; I43-F62 HydrophobicContact CG2-CZ 3.34Å; F62-A66 PolarHBondContact O-N 3.12Å
63	L	45.1	Very low	45.3	Very low	73 Å²	73	84.4 Å²	84.4	38%	0.382	49%	0.485	S	S	.	.	H	α-helix	trans	-80.8	-16.9	176.9	-71.3	169.4	0	0	0	113.7
64	S	42.4	Very low	46.4	Very low	43 Å²	43	83.1 Å²	83.1	30%	0.301	47%	0.47	S	S	.	.	H	α-helix	trans	-87.8	-27	172.6	60.6	0	0	0	0	113.5	K60 A61	K60-S64 WeakPolarHBondContact O-CB 3.16Å; K60-S64 PolarHBondContact O-N 3Å; K60-S64 VanDerWaalsContact O-N 3.12Å; K60-S64 PolarHBondContact O-OG 3.1Å; A61-S64 PolarHBondContact O-OG 3.28Å
65	A	45.3	Very low	47.7	Very low	37 Å²	37	86.6 Å²	86.6	31%	0.306	48%	0.479	S	S	.	.	H	α-helix	trans	-74.9	-27.8	170.9	0	0	0	0	0	112.4	L30 A61 L67	L30-A65 WeakPolarHBondContact O-CB 3.33Å; A61-A65 WeakPolarHBondContact O-CB 3.33Å; A61-A65 PolarHBondContact O-N 3.31Å; A61-A65 VanDerWaalsContact O-N 3.14Å; A65-L67 PolarHBondContact O-N 3.04Å; A65-L67 VanDerWaalsContact O-N 3.1Å
66	A	47.2	Very low	48.7	Very low	31 Å²	31	82.6 Å²	82.6	26%	0.256	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	40.9	174.4	0	0	0	0	0	113.3	L44 F62 I68	L44-A66 HydrophobicContact CD2-CB 4.49Å; F62-A66 PolarHBondContact O-N 3.12Å; A66-I68 HydrophobicContact CB-CD1 3.97Å; A66-I68 HydrophobicContact CB-CG1 4.25Å; A66-I68 PolarHBondContact O-N 2.81Å
67	L	44.2	Very low	49.5	Very low	145 Å²	145	75.6 Å²	75.6	76%	0.759	43%	0.432	S	S	*	.			trans	-67.9	47.1	157.8	-114.6	147	0	0	0	109.7	A65 H69	A65-L67 PolarHBondContact O-N 3.04Å; A65-L67 VanDerWaalsContact O-N 3.1Å; L67-H69 PolarHBondContact O-N 3.1Å
68	I	48.7	Very low	50.2	Low	57 Å²	57	73.4 Å²	73.4	29%	0.292	42%	0.418	S	S	.	.			trans	-70.3	116.3	173	-64.1	168.9	0	0	0	103.8	A66 S70 L73	A66-I68 HydrophobicContact CB-CD1 3.97Å; A66-I68 HydrophobicContact CB-CG1 4.25Å; A66-I68 PolarHBondContact O-N 2.81Å; I68-S70 PolarHBondContact O-N 3.45Å; I68-L73 HydrophobicContact CB-CD1 4.13Å; I68-L73 HydrophobicContact CG2-CD1 3.78Å; I68-L73 HydrophobicContact CG2-CG 4.22Å
69	H	47.6	Very low	51.6	Low	148 Å²	148	75.9 Å²	75.9	69%	0.685	42%	0.415	S	S	*	.			trans	-36.9	117	169	-90.8	-117	0	0	0	108.9	L67 S71 D72	L67-H69 PolarHBondContact O-N 3.1Å; H69-S71 PolarHBondContact O-N 2.87Å; H69-D72 PolarHBondContact O-N 3.37Å; H69-D72 VanDerWaalsContact O-N 3.1Å
70	S	47.1	Very low	52.6	Low	88 Å²	88	77.2 Å²	77.2	62%	0.615	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-54.5	-16.9	-174.9	43.8	0	0	0	0	113.3	I68 D72 Q78	I68-S70 PolarHBondContact O-N 3.45Å; S70-D72 VanDerWaalsContact C-N 3.33Å; S70-D72 PolarHBondContact O-N 2.92Å; S70-Q78 PolarHBondContact O-NE2 3.48Å
71	S	52.9	Low	53.5	Low	92 Å²	92	74.1 Å²	74.1	64%	0.643	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-66.5	-20.9	176.7	41.9	0	0	0	0	115.4	H69	H69-S71 PolarHBondContact O-N 2.87Å
72	D	54.6	Low	54.3	Low	121 Å²	121	78.7 Å²	78.7	65%	0.647	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-108.2	10.2	-178.7	-67.8	-61	0	0	0	114	K40 H69 S70	K40-D72 PolarHBondContact NZ-O 2.73Å; H69-D72 PolarHBondContact O-N 3.37Å; H69-D72 VanDerWaalsContact O-N 3.1Å; S70-D72 VanDerWaalsContact C-N 3.33Å; S70-D72 PolarHBondContact O-N 2.92Å
73	L	54.4	Low	55.3	Low	26 Å²	26	79.9 Å²	79.9	14%	0.136	44%	0.439	C	S	.	.	S	Bend	trans	-95.8	134.7	178.2	-77.4	123.5	0	0	0	110.3	L44 I68 S77 Q78	L44-L73 HydrophobicContact CD1-CD2 3.53Å; I68-L73 HydrophobicContact CB-CD1 4.13Å; I68-L73 HydrophobicContact CG2-CD1 3.78Å; I68-L73 HydrophobicContact CG2-CG 4.22Å; L73-S77 VanDerWaalsContact CD2-CB 3.5Å; L73-Q78 HydrophobicContact CB-CG 3.79Å; L73-Q78 PolarHBondContact O-NE2 3.02Å
74	S	61.2	Low	56.1	Low	64 Å²	64	77.1 Å²	77.1	45%	0.448	43%	0.426	S	S	.	.			trans	-53.2	149.5	166.5	178.1	0	0	0	0	110.5	E76 S77 Q78	S74-E76 PolarHBondContact O-N 3.36Å; S74-E76 VanDerWaalsContact O-N 3.12Å; S74-S77 WeakPolarHBondContact O-CA 3.2Å; S74-S77 WeakPolarHBondContact O-CB 3.11Å; S74-S77 PolarHBondContact O-N 3.26Å; S74-Q78 PolarHBondContact O-N 2.77Å
75	H	65.3	Low	57	Low	138 Å²	138	80.2 Å²	80.2	64%	0.639	44%	0.438	S	S	*	.	H	α-helix	trans	-51.5	-37.9	-178.7	-174.2	-94.7	0	0	0	112.6	Q78 K79	H75-Q78 PolarHBondContact O-N 2.73Å; H75-K79 PolarHBondContact O-N 2.97Å
76	E	63.3	Low	57.7	Low	108 Å²	108	85 Å²	85	51%	0.505	45%	0.454	S	S	.	.	H	α-helix	trans	-66.2	-44.5	176	-75.1	-57.6	115.1	0	0	112.4	S74 Q78 K79 V80	S74-E76 PolarHBondContact O-N 3.36Å; S74-E76 VanDerWaalsContact O-N 3.12Å; E76-Q78 VanDerWaalsContact C-N 3.28Å; E76-Q78 PolarHBondContact O-N 3.35Å; E76-K79 WeakPolarHBondContact O-CB 3.35Å; E76-K79 PolarHBondContact O-N 3.33Å; E76-K79 VanDerWaalsContact O-N 3.15Å; E76-V80 WeakPolarHBondContact O-CG2 3.31Å; E76-V80 PolarHBondContact O-N 3.38Å
77	S	57.9	Low	58.4	Low	12 Å²	12	86.3 Å²	86.3	8%	0.084	47%	0.465	C	S	.	.	H	α-helix	trans	-65.2	-32.9	178.3	-58.5	0	0	0	0	111.6	D41 L73 S74 A81	D41-S77 PolarHBondContact OD1-OG 2.87Å; D41-S77 VanDerWaalsContact OD1-OG 3.1Å; L73-S77 VanDerWaalsContact CD2-CB 3.5Å; S74-S77 WeakPolarHBondContact O-CA 3.2Å; S74-S77 WeakPolarHBondContact O-CB 3.11Å; S74-S77 PolarHBondContact O-N 3.26Å; S77-A81 WeakPolarHBondContact O-CB 3.49Å; S77-A81 PolarHBondContact O-N 3.13Å
78	Q	61.6	Low	58.8	Low	68 Å²	68	85.5 Å²	85.5	32%	0.318	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-44.8	171.1	-64.8	-179.2	18	0	0	112	S70 L73 S74 H75 E76 V80 A81 Q82	S70-Q78 PolarHBondContact O-NE2 3.48Å; L73-Q78 HydrophobicContact CB-CG 3.79Å; L73-Q78 PolarHBondContact O-NE2 3.02Å; S74-Q78 PolarHBondContact O-N 2.77Å; H75-Q78 PolarHBondContact O-N 2.73Å; E76-Q78 VanDerWaalsContact C-N 3.28Å; E76-Q78 PolarHBondContact O-N 3.35Å; Q78-V80 VanDerWaalsContact C-N 3.35Å; Q78-V80 PolarHBondContact O-N 3.47Å; Q78-A81 PolarHBondContact O-N 3.17Å; Q78-Q82 WeakPolarHBondContact O-CB 3.42Å; Q78-Q82 WeakPolarHBondContact O-CG 3.07Å; Q78-Q82 PolarHBondContact O-N 3.23Å
79	K	68.7	Low	58.8	Low	100 Å²	100	92.7 Å²	92.7	44%	0.435	48%	0.479	S	S	.	.	H	α-helix	trans	-61	-43	178.1	-171.5	179.5	179.2	-176.3	0	111.7	H75 E76 Q82 Q83	H75-K79 PolarHBondContact O-N 2.97Å; E76-K79 WeakPolarHBondContact O-CB 3.35Å; E76-K79 PolarHBondContact O-N 3.33Å; E76-K79 VanDerWaalsContact O-N 3.15Å; K79-Q82 PolarHBondContact O-N 2.88Å; K79-Q83 WeakPolarHBondContact O-CB 3.45Å; K79-Q83 WeakPolarHBondContact O-CG 3.15Å; K79-Q83 PolarHBondContact O-N 3.47Å
80	V	63.5	Low	58.8	Low	52 Å²	52	91.2 Å²	91.2	32%	0.315	48%	0.48	S	S	.	.	H	α-helix	trans	-64.4	-44.3	176.1	174.6	0	0	0	0	111.2	Y48 E76 Q78 Q82 Q83 A84	Y48-V80 HydrophobicContact CD2-CG1 3.77Å; Y48-V80 HydrophobicContact CE2-CG1 3.98Å; Y48-V80 HydrophobicContact CG-CG1 4.09Å; E76-V80 WeakPolarHBondContact O-CG2 3.31Å; E76-V80 PolarHBondContact O-N 3.38Å; Q78-V80 VanDerWaalsContact C-N 3.35Å; Q78-V80 PolarHBondContact O-N 3.47Å; V80-Q82 PolarHBondContact O-N 3.12Å; V80-Q83 PolarHBondContact O-N 2.95Å; V80-A84 PolarHBondContact O-N 2.95Å
81	A	59.3	Low	58.8	Low	44 Å²	44	92.9 Å²	92.9	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-42.6	176.4	0	0	0	0	0	112	S77 Q78 A84 I85	S77-A81 WeakPolarHBondContact O-CB 3.49Å; S77-A81 PolarHBondContact O-N 3.13Å; Q78-A81 PolarHBondContact O-N 3.17Å; A81-A84 PolarHBondContact O-N 2.77Å; A81-I85 VanDerWaalsContact O-CG1 3.3Å; A81-I85 WeakPolarHBondContact O-CG1 3.19Å; A81-I85 PolarHBondContact O-N 3.18Å
82	Q	64.3	Low	58.1	Low	125 Å²	125	99.4 Å²	99.4	58%	0.584	50%	0.497	S	S	*	.	H	α-helix	trans	-63.6	-43.8	175.6	-75.9	-179	-0.5	0	0	112.2	Q78 K79 V80 A84 I85 Q86	Q78-Q82 WeakPolarHBondContact O-CB 3.42Å; Q78-Q82 WeakPolarHBondContact O-CG 3.07Å; Q78-Q82 PolarHBondContact O-N 3.23Å; K79-Q82 PolarHBondContact O-N 2.88Å; V80-Q82 PolarHBondContact O-N 3.12Å; Q82-A84 VanDerWaalsContact C-N 3.31Å; Q82-A84 PolarHBondContact O-N 3.33Å; Q82-I85 PolarHBondContact O-N 3.48Å; Q82-Q86 WeakPolarHBondContact O-CB 3.49Å; Q82-Q86 WeakPolarHBondContact O-CG 3.34Å; Q82-Q86 PolarHBondContact O-N 3.24Å
83	Q	67.5	Low	57.3	Low	106 Å²	106	105.3 Å²	105.3	50%	0.495	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-40.1	174.8	-78.3	-179.3	-5.5	0	0	111.8	K79 V80 Q86 A87	K79-Q83 WeakPolarHBondContact O-CB 3.45Å; K79-Q83 WeakPolarHBondContact O-CG 3.15Å; K79-Q83 PolarHBondContact O-N 3.47Å; V80-Q83 PolarHBondContact O-N 2.95Å; Q83-Q86 PolarHBondContact O-N 3.14Å; Q83-A87 WeakPolarHBondContact O-CB 3.41Å; Q83-A87 PolarHBondContact O-N 2.86Å
84	A	60.9	Low	57.4	Low	15 Å²	15	109.3 Å²	109.3	12%	0.124	55%	0.547	C	S	.	.	H	α-helix	trans	-65.7	-37.2	176.2	0	0	0	0	0	112.7	Y48 V80 A81 Q82 K88	Y48-A84 HydrophobicContact CE2-CB 4.27Å; V80-A84 PolarHBondContact O-N 2.95Å; A81-A84 PolarHBondContact O-N 2.77Å; Q82-A84 VanDerWaalsContact C-N 3.31Å; Q82-A84 PolarHBondContact O-N 3.33Å; A84-K88 WeakPolarHBondContact O-CG 3.4Å; A84-K88 PolarHBondContact O-N 3.21Å
85	I	61.4	Low	57.2	Low	108 Å²	108	111.7 Å²	111.7	55%	0.554	55%	0.552	S	S	*	*	H	α-helix	trans	-69	-43.4	175.6	-67.4	164.8	0	0	0	110.7	A81 Q82 K88 R89	A81-I85 VanDerWaalsContact O-CG1 3.3Å; A81-I85 WeakPolarHBondContact O-CG1 3.19Å; A81-I85 PolarHBondContact O-N 3.18Å; Q82-I85 PolarHBondContact O-N 3.48Å; I85-K88 PolarHBondContact O-N 3.44Å; I85-R89 PolarHBondContact O-N 3.07Å
86	Q	60.9	Low	56.8	Low	137 Å²	137	110.2 Å²	110.2	64%	0.64	55%	0.548	S	S	*	.	H	α-helix	trans	-60.6	-48.4	176.3	-71.6	-93.7	-12.5	0	0	110.9	Q82 Q83 K88 R89 T90	Q82-Q86 WeakPolarHBondContact O-CB 3.49Å; Q82-Q86 WeakPolarHBondContact O-CG 3.34Å; Q82-Q86 PolarHBondContact O-N 3.24Å; Q83-Q86 PolarHBondContact O-N 3.14Å; Q86-K88 VanDerWaalsContact C-N 3.26Å; Q86-K88 PolarHBondContact O-N 3.4Å; Q86-R89 PolarHBondContact O-N 3.1Å; Q86-T90 PolarHBondContact O-N 2.79Å; Q86-T90 PolarHBondContact O-OG1 2.88Å
87	A	60.5	Low	56.4	Low	58 Å²	58	110.4 Å²	110.4	48%	0.479	55%	0.55	S	S	.	*	H	α-helix	trans	-60.7	-32.9	178.5	0	0	0	0	0	113.1	Q83 T90	Q83-A87 WeakPolarHBondContact O-CB 3.41Å; Q83-A87 PolarHBondContact O-N 2.86Å; A87-T90 PolarHBondContact O-N 3.17Å
88	K	53.2	Low	56.3	Low	128 Å²	128	116.5 Å²	116.5	56%	0.557	58%	0.579	S	S	*	*	H	α-helix	trans	-74.3	-23.6	175.9	-74.9	-179.7	-177.3	-178.3	0	113.8	A84 I85 Q86 T90	A84-K88 WeakPolarHBondContact O-CG 3.4Å; A84-K88 PolarHBondContact O-N 3.21Å; I85-K88 PolarHBondContact O-N 3.44Å; Q86-K88 VanDerWaalsContact C-N 3.26Å; Q86-K88 PolarHBondContact O-N 3.4Å; K88-T90 VanDerWaalsContact C-N 3.31Å
89	R	49.2	Very low	55.9	Low	208 Å²	208	119.7 Å²	119.7	79%	0.785	60%	0.597	S	S	*	*	H	α-helix	trans	-74.4	-23.5	174.1	-82.2	-174.7	166.9	-173.5	-3.7	112.4	I85 Q86 V91	I85-R89 PolarHBondContact O-N 3.07Å; Q86-R89 PolarHBondContact O-N 3.1Å; R89-V91 VanDerWaalsContact C-N 3.34Å; R89-V91 PolarHBondContact O-N 3.06Å
90	T	48.2	Very low	55	Low	117 Å²	117	121.1 Å²	121.1	72%	0.718	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-4.6	-178.3	-36.1	0	0	0	0	114.2	Q86 A87 K88	Q86-T90 PolarHBondContact O-N 2.79Å; Q86-T90 PolarHBondContact O-OG1 2.88Å; A87-T90 PolarHBondContact O-N 3.17Å; K88-T90 VanDerWaalsContact C-N 3.31Å
91	V	45.2	Very low	54.4	Low	124 Å²	124	126.5 Å²	126.5	75%	0.752	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	20.4	179.8	-164.9	0	0	0	0	112.1	R89	R89-V91 VanDerWaalsContact C-N 3.34Å; R89-V91 PolarHBondContact O-N 3.06Å
92	R	39.5	Very low	54	Low	228 Å²	228	133.3 Å²	133.3	86%	0.86	65%	0.653	S	S	*	*			trans	-116.9	72.7	168.2	-80.2	-171.3	179.5	172.9	-0.7	110
93	L	36.8	Very low	53	Low	246 Å²	246	134.1 Å²	134.1	100%	1.288	66%	0.659	S	S	*	*			trans	-144.7	0	157.8	-91.6	168.2	0	0	0	107.7

Retrieved 93 of 93 residues in 70.6 ms (Link to these results)

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