VRAX_STAAN Loading...

Protein VraX

AlphaFold DB (Q2G0J9), UniProt , Accession Q99W32, Species STAAN (Staphylococcus aureus (strain N315)), Gene vraX, Length 55 aa.

						>VRAX_STAAN|Q99W32|vraX
MIIYRQYHHEGAPVYEIITKTFQHVSIKCDDSFSDTEIFKLLSLLQDDIDHMKVS
					

Structure Viewer

Loading PAE data...

(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	64.1	Low	82.6	Confident	92 Å²	92	103.8 Å²	103.8	45%	0.453	50%	0.497	S	S	.	.				0	112.2	0	-173.1	-172.8	73.7	0	0	110.9	I3 F39 L42	M1-I3 HydrophobicContact CE-CD1 3.79Å; M1-I3 HydrophobicContact CE-CG1 4.18Å; M1-I3 HydrophobicContact CG-CG1 4.17Å; M1-I3 HydrophobicContact SD-CD1 4.07Å; M1-I3 HydrophobicContact SD-CG1 4.16Å; M1-F39 HydrophobicContact CE-CB 4.02Å; M1-F39 HydrophobicContact CE-CD1 3.36Å; M1-F39 HydrophobicContact CE-CE1 4.11Å; M1-F39 HydrophobicContact CE-CG 3.93Å; M1-F39 HydrophobicContact SD-CB 4.34Å; M1-F39 HydrophobicContact SD-CD1 4.11Å; M1-L42 HydrophobicContact SD-CB 3.73Å; M1-L42 HydrophobicContact SD-CD1 4.49Å
2	I	68.8	Low	83.2	Confident	109 Å²	109	96.5 Å²	96.5	56%	0.559	47%	0.466	S	S	*	.			trans	-108.8	105.1	165.3	-56.3	176.7	0	0	0	105.3	Y4 I18	I2-Y4 PolarHBondContact O-N 3.22Å; I2-I18 HydrophobicContact CG2-CD1 4.29Å
3	I	71.6	Confident	83.8	Confident	48 Å²	48	89.6 Å²	89.6	25%	0.246	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	110.4	164.2	-67	166.9	0	0	0	105.4	M1 I17 F39 L42	M1-I3 HydrophobicContact CE-CD1 3.79Å; M1-I3 HydrophobicContact CE-CG1 4.18Å; M1-I3 HydrophobicContact CG-CG1 4.17Å; M1-I3 HydrophobicContact SD-CD1 4.07Å; M1-I3 HydrophobicContact SD-CG1 4.16Å; I3-I17 HydrophobicContact CG1-CG2 4.34Å; I3-F39 HydrophobicContact CD1-CD1 3.52Å; I3-F39 HydrophobicContact CD1-CE1 3.32Å; I3-L42 HydrophobicContact CD1-CD1 3.67Å; I3-L42 HydrophobicContact CG1-CD1 3.95Å
4	Y	77.2	Confident	84.4	Confident	143 Å²	143	83.6 Å²	83.6	56%	0.561	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	-36.7	-178.8	174.3	-109.6	0	0	0	110.9	I2 E16 I18	I2-Y4 PolarHBondContact O-N 3.22Å; Y4-E16 HydrophobicContact CD1-CB 4.43Å; Y4-E16 PolarHBondContact N-O 3.22Å; Y4-I18 HydrophobicContact CD2-CD1 4.04Å; Y4-I18 HydrophobicContact CG-CD1 4.32Å; Y4-I18 HydrophobicContact CG-CG1 4.44Å
5	R	86.7	Confident	84.9	Confident	141 Å²	141	78.7 Å²	78.7	53%	0.532	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	146	-178.2	-166.4	179.4	-178.8	-174.4	0.2	111.1	Y7 E16	R5-Y7 HydrophobicContact CG-CD1 4.25Å; R5-E16 HydrophobicContact CB-CB 4.09Å; R5-E16 HydrophobicContact CB-CG 4.32Å; R5-E16 WeakPolarHBondContact CB-OE2 3.28Å; R5-E16 WeakPolarHBondContact CD-OE2 3.26Å; R5-E16 PolarHBondContact O-N 2.92Å
6	Q	88.9	Confident	85.3	Confident	103 Å²	103	75.6 Å²	75.6	48%	0.481	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.8	164.2	-176.2	-177.4	-4.4	0	0	108.5	V14 Y15	Q6-V14 WeakPolarHBondContact CA-O 3.26Å; Q6-Y15 HydrophobicContact CB-CD1 4.36Å; Q6-Y15 VanDerWaalsContact CD-CE1 3.45Å; Q6-Y15 HydrophobicContact CG-CD1 3.93Å; Q6-Y15 HydrophobicContact CG-CE1 3.75Å
7	Y	92	Very high	85.6	Confident	70 Å²	70	71.2 Å²	71.2	28%	0.275	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	167.5	175.3	65.4	-82.6	0	0	0	110.5	R5 H9 P13 V14 E16	R5-Y7 HydrophobicContact CG-CD1 4.25Å; Y7-H9 HydrophobicContact CD2-CB 4.37Å; Y7-H9 HydrophobicContact CE2-CB 3.94Å; Y7-P13 CarbonylContact O-C 3.6Å; Y7-V14 HydrophobicContact CD1-CB 4.15Å; Y7-V14 HydrophobicContact CD1-CG1 4.45Å; Y7-V14 HydrophobicContact CD2-CB 4.29Å; Y7-V14 HydrophobicContact CE1-CB 3.77Å; Y7-V14 HydrophobicContact CE1-CG1 3.65Å; Y7-V14 HydrophobicContact CE2-CB 3.92Å; Y7-V14 HydrophobicContact CE2-CG1 4.3Å; Y7-V14 HydrophobicContact CE2-CG2 4.05Å; Y7-V14 HydrophobicContact CG-CB 4.4Å; Y7-V14 PolarHBondContact N-O 3.06Å; Y7-V14 PolarHBondContact O-N 3.46Å; Y7-V14 WeakPolarHBondContact OH-CG1 3.1Å; Y7-E16 HydrophobicContact CE1-CG 4Å; Y7-E16 WeakPolarHBondContact CE1-OE1 3.26Å
8	H	90.1	Very high	85.8	Confident	127 Å²	127	70.5 Å²	70.5	59%	0.588	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	135.1	173.8	-69.7	72.3	0	0	0	109.8	A12	H8-A12 WeakPolarHBondContact CA-O 3.38Å
9	H	90.7	Very high	86	Confident	95 Å²	95	67.1 Å²	67.1	44%	0.44	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	120.7	173.2	-171.3	62.6	0	0	0	109.5	Y7 G11 A12 V14 K28	Y7-H9 HydrophobicContact CD2-CB 4.37Å; Y7-H9 HydrophobicContact CE2-CB 3.94Å; H9-G11 PolarHBondContact O-N 3.15Å; H9-A12 PolarHBondContact N-O 3.35Å; H9-A12 PolarHBondContact O-N 3.47Å; H9-A12 VanDerWaalsContact O-N 3.12Å; H9-V14 HydrophobicContact CB-CG2 3.65Å; H9-K28 VanDerWaalsContact O-CE 3.3Å; H9-K28 WeakPolarHBondContact O-CE 3.48Å
10	E	89.8	Confident	86	Confident	156 Å²	156	72.4 Å²	72.4	73%	0.729	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	40.2	-178.8	-53.4	173.4	141.2	0	0	112.9	A12 K28	E10-A12 VanDerWaalsContact C-N 3.33Å; E10-A12 PolarHBondContact O-N 2.76Å; E10-K28 IonicContact OE2-NZ 2.8Å; E10-K28 PolarHBondContact OE2-NZ 3.34Å
11	G	88.3	Confident	86	Confident	58 Å²	58	71 Å²	71	60%	0.598	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	6.3	178.1	0	0	0	0	0	115.6	H9	H9-G11 PolarHBondContact O-N 3.15Å
12	A	89.9	Confident	87	Confident	16 Å²	16	71.6 Å²	71.6	13%	0.132	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.8	178.4	0	0	0	0	0	111.8	H8 H9 E10 K28 C29	H8-A12 WeakPolarHBondContact CA-O 3.38Å; H9-A12 PolarHBondContact N-O 3.35Å; H9-A12 PolarHBondContact O-N 3.47Å; H9-A12 VanDerWaalsContact O-N 3.12Å; E10-A12 VanDerWaalsContact C-N 3.33Å; E10-A12 PolarHBondContact O-N 2.76Å; A12-K28 HydrophobicContact CB-CD 4.37Å; A12-K28 VanDerWaalsContact CB-CE 3.44Å; A12-K28 HydrophobicContact CB-CG 4.03Å; A12-C29 WeakPolarHBondContact CB-O 3.31Å
13	P	90.9	Very high	87.9	Confident	7 Å²	7	73.1 Å²	73.1	5%	0.045	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	135.8	179	27.9	-36.9	0	0	0	110.7	Y7 Y15 K28 C29 D31	Y7-P13 CarbonylContact O-C 3.6Å; P13-Y15 HydrophobicContact CB-CE2 3.76Å; P13-Y15 HydrophobicContact CG-CE2 4.07Å; P13-K28 WeakPolarHBondContact O-CA 3.2Å; P13-C29 VanDerWaalsContact CD-O 3.3Å; P13-C29 WeakPolarHBondContact CD-O 3.11Å; P13-C29 PolarHBondContact O-N 3.45Å; P13-D31 WeakPolarHBondContact CD-OD1 3.38Å
14	V	92.8	Very high	88.7	Confident	5 Å²	5	75.3 Å²	75.3	3%	0.03	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.5	173.1	-174.6	0	0	0	0	108.6	Q6 Y7 H9 I27 K28	Q6-V14 WeakPolarHBondContact CA-O 3.26Å; Y7-V14 HydrophobicContact CD1-CB 4.15Å; Y7-V14 HydrophobicContact CD1-CG1 4.45Å; Y7-V14 HydrophobicContact CD2-CB 4.29Å; Y7-V14 HydrophobicContact CE1-CB 3.77Å; Y7-V14 HydrophobicContact CE1-CG1 3.65Å; Y7-V14 HydrophobicContact CE2-CB 3.92Å; Y7-V14 HydrophobicContact CE2-CG1 4.3Å; Y7-V14 HydrophobicContact CE2-CG2 4.05Å; Y7-V14 HydrophobicContact CG-CB 4.4Å; Y7-V14 PolarHBondContact N-O 3.06Å; Y7-V14 PolarHBondContact O-N 3.46Å; Y7-V14 WeakPolarHBondContact OH-CG1 3.1Å; H9-V14 HydrophobicContact CB-CG2 3.65Å; V14-I27 CarbonylContact C-O 3.54Å; V14-I27 VanDerWaalsContact CA-O 3.29Å; V14-I27 WeakPolarHBondContact CA-O 2.95Å; V14-K28 HydrophobicContact CG2-CB 4Å; V14-K28 HydrophobicContact CG2-CD 4.5Å; V14-K28 HydrophobicContact CG2-CG 3.97Å
15	Y	91.5	Very high	89.3	Confident	11 Å²	11	70.2 Å²	70.2	4%	0.043	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.3	178.8	-56.4	-89	0	0	0	109.1	Q6 P13 S26 I27 C29 I38 L42	Q6-Y15 HydrophobicContact CB-CD1 4.36Å; Q6-Y15 VanDerWaalsContact CD-CE1 3.45Å; Q6-Y15 HydrophobicContact CG-CD1 3.93Å; Q6-Y15 HydrophobicContact CG-CE1 3.75Å; P13-Y15 HydrophobicContact CB-CE2 3.76Å; P13-Y15 HydrophobicContact CG-CE2 4.07Å; Y15-S26 WeakPolarHBondContact O-CA 3.33Å; Y15-I27 PolarHBondContact N-O 3.49Å; Y15-I27 PolarHBondContact O-N 3.47Å; Y15-C29 HydrophobicContact CE2-CB 4.27Å; Y15-I38 HydrophobicContact CD1-CG2 3.98Å; Y15-I38 HydrophobicContact CD2-CG2 4.02Å; Y15-I38 HydrophobicContact CE1-CG2 3.67Å; Y15-I38 HydrophobicContact CE2-CD1 4.09Å; Y15-I38 HydrophobicContact CE2-CG1 4.24Å; Y15-I38 HydrophobicContact CE2-CG2 3.73Å; Y15-I38 HydrophobicContact CG-CG2 4.15Å; Y15-L42 HydrophobicContact CD1-CD1 4.01Å; Y15-L42 HydrophobicContact CG-CD1 3.84Å
16	E	91.6	Very high	89.5	Confident	29 Å²	29	66.8 Å²	66.8	14%	0.136	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.5	172.6	-65.4	-177.8	166.7	0	0	109.3	Y4 R5 Y7 V25	Y4-E16 HydrophobicContact CD1-CB 4.43Å; Y4-E16 PolarHBondContact N-O 3.22Å; R5-E16 HydrophobicContact CB-CB 4.09Å; R5-E16 HydrophobicContact CB-CG 4.32Å; R5-E16 WeakPolarHBondContact CB-OE2 3.28Å; R5-E16 WeakPolarHBondContact CD-OE2 3.26Å; R5-E16 PolarHBondContact O-N 2.92Å; Y7-E16 HydrophobicContact CE1-CG 4Å; Y7-E16 WeakPolarHBondContact CE1-OE1 3.26Å; E16-V25 WeakPolarHBondContact CA-O 3.44Å
17	I	90.9	Very high	89.6	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	145.5	173.9	63.2	173.5	0	0	0	110.2	I3 T19 H24 V25 I27 L42 L45 Q46	I3-I17 HydrophobicContact CG1-CG2 4.34Å; I17-T19 HydrophobicContact CD1-CG2 4.12Å; I17-T19 HydrophobicContact CG1-CG2 4.14Å; I17-H24 WeakPolarHBondContact O-CA 3.46Å; I17-V25 HydrophobicContact CG1-CB 4.05Å; I17-V25 PolarHBondContact N-O 2.95Å; I17-V25 PolarHBondContact O-N 3.42Å; I17-I27 HydrophobicContact CD1-CD1 3.74Å; I17-I27 HydrophobicContact CG1-CD1 3.67Å; I17-I27 HydrophobicContact CG2-CD1 4.46Å; I17-L42 HydrophobicContact CG2-CB 4.19Å; I17-L42 HydrophobicContact CG2-CD1 4.26Å; I17-L42 HydrophobicContact CG2-CD2 3.99Å; I17-L42 HydrophobicContact CG2-CG 4.37Å; I17-L45 HydrophobicContact CD1-CB 4.44Å; I17-Q46 HydrophobicContact CD1-CB 4.18Å
18	I	89.4	Confident	89.6	Confident	59 Å²	59	64.5 Å²	64.5	30%	0.303	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.3	172.1	-64	170.4	0	0	0	108.7	I2 Y4 Q23 Q46	I2-I18 HydrophobicContact CG2-CD1 4.29Å; Y4-I18 HydrophobicContact CD2-CD1 4.04Å; Y4-I18 HydrophobicContact CG-CD1 4.32Å; Y4-I18 HydrophobicContact CG-CG1 4.44Å; I18-Q23 VanDerWaalsContact CA-O 3.31Å; I18-Q23 WeakPolarHBondContact CA-O 3.3Å; I18-Q23 WeakPolarHBondContact CG2-O 3.28Å; I18-Q46 PolarHBondContact O-NE2 2.89Å
19	T	88.1	Confident	89.5	Confident	5 Å²	5	59 Å²	59	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	150.7	176.5	68	0	0	0	0	110	I17 T21 F22 Q23 V25 I49 D50	I17-T19 HydrophobicContact CD1-CG2 4.12Å; I17-T19 HydrophobicContact CG1-CG2 4.14Å; T19-T21 VanDerWaalsContact C-N 3.33Å; T19-F22 PolarHBondContact OG1-N 3.25Å; T19-Q23 PolarHBondContact N-O 3.01Å; T19-Q23 CarbonylContact O-C 3.52Å; T19-Q23 WeakPolarHBondContact O-CA 3.35Å; T19-Q23 PolarHBondContact O-N 2.95Å; T19-V25 HydrophobicContact CG2-CB 4.49Å; T19-V25 HydrophobicContact CG2-CG2 4.02Å; T19-I49 HydrophobicContact CG2-CB 4.17Å; T19-I49 HydrophobicContact CG2-CD1 4.27Å; T19-I49 HydrophobicContact CG2-CG2 3.7Å; T19-D50 WeakPolarHBondContact CA-OD1 3.44Å; T19-D50 WeakPolarHBondContact CB-OD1 3.42Å
20	K	86.6	Confident	89.2	Confident	174 Å²	174	58.7 Å²	58.7	76%	0.757	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-38.3	178.2	-65.8	175.9	-173.1	170.3	0	111.4	D50	K20-D50 HydrophobicContact CD-CB 4.4Å; K20-D50 PolarHBondContact N-OD1 3.01Å
21	T	85.5	Confident	88.8	Confident	43 Å²	43	56.7 Å²	56.7	26%	0.264	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-46.6	-172.5	-55.6	0	0	0	0	112.6	T19 I49 M52 V54	T19-T21 VanDerWaalsContact C-N 3.33Å; T21-I49 WeakPolarHBondContact CB-O 3.3Å; T21-I49 PolarHBondContact OG1-O 2.83Å; T21-M52 HydrophobicContact CG2-CE 4.17Å; T21-V54 HydrophobicContact CG2-CG2 3.18Å
22	F	86.1	Confident	88.8	Confident	105 Å²	105	58.5 Å²	58.5	46%	0.461	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	2.9	-174.2	-63.9	-72.1	0	0	0	114.1	T19 H24 V25 I49 M52	T19-F22 PolarHBondContact OG1-N 3.25Å; F22-H24 PolarHBondContact O-N 3.39Å; F22-V25 HydrophobicContact CB-CG2 3.99Å; F22-V25 HydrophobicContact CD2-CG2 4.34Å; F22-I49 HydrophobicContact CD2-CG2 3.51Å; F22-I49 HydrophobicContact CE2-CG2 3.95Å; F22-M52 HydrophobicContact CE1-CE 4.39Å; F22-M52 HydrophobicContact CE2-CE 3.57Å; F22-M52 HydrophobicContact CE2-SD 4.19Å; F22-M52 HydrophobicContact CZ-CE 3.3Å; F22-M52 HydrophobicContact CZ-SD 4.29Å
23	Q	86.6	Confident	88.5	Confident	141 Å²	141	61.8 Å²	61.8	66%	0.659	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	66	-57.1	-171.4	-51.7	175.3	26.8	0	0	112.8	I18 T19	I18-Q23 VanDerWaalsContact CA-O 3.31Å; I18-Q23 WeakPolarHBondContact CA-O 3.3Å; I18-Q23 WeakPolarHBondContact CG2-O 3.28Å; T19-Q23 PolarHBondContact N-O 3.01Å; T19-Q23 CarbonylContact O-C 3.52Å; T19-Q23 WeakPolarHBondContact O-CA 3.35Å; T19-Q23 PolarHBondContact O-N 2.95Å
24	H	88	Confident	88.4	Confident	94 Å²	94	64.1 Å²	64.1	44%	0.435	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	135.7	-179	-62.9	-87.6	0	0	0	111.4	I17 F22	I17-H24 WeakPolarHBondContact O-CA 3.46Å; F22-H24 PolarHBondContact O-N 3.39Å
25	V	90.1	Very high	88.1	Confident	35 Å²	35	68.8 Å²	68.8	21%	0.212	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.4	171.8	180	0	0	0	0	109	E16 I17 T19 F22 I27 I49	E16-V25 WeakPolarHBondContact CA-O 3.44Å; I17-V25 HydrophobicContact CG1-CB 4.05Å; I17-V25 PolarHBondContact N-O 2.95Å; I17-V25 PolarHBondContact O-N 3.42Å; T19-V25 HydrophobicContact CG2-CB 4.49Å; T19-V25 HydrophobicContact CG2-CG2 4.02Å; F22-V25 HydrophobicContact CB-CG2 3.99Å; F22-V25 HydrophobicContact CD2-CG2 4.34Å; V25-I27 HydrophobicContact CB-CD1 4.39Å; V25-I27 HydrophobicContact CG1-CD1 3.85Å; V25-I27 HydrophobicContact CG1-CG1 4.4Å; V25-I49 HydrophobicContact CG1-CD1 4.32Å; V25-I49 HydrophobicContact CG2-CD1 4.15Å
26	S	92.2	Very high	88	Confident	69 Å²	69	72.3 Å²	72.3	48%	0.483	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.5	176.8	-51	0	0	0	0	109.8	Y15	Y15-S26 WeakPolarHBondContact O-CA 3.33Å
27	I	90.7	Very high	88	Confident	25 Å²	25	75.5 Å²	75.5	13%	0.128	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.8	179.3	-58.6	84.9	0	0	0	108	V14 Y15 I17 V25 L42 L45	V14-I27 CarbonylContact C-O 3.54Å; V14-I27 VanDerWaalsContact CA-O 3.29Å; V14-I27 WeakPolarHBondContact CA-O 2.95Å; Y15-I27 PolarHBondContact N-O 3.49Å; Y15-I27 PolarHBondContact O-N 3.47Å; I17-I27 HydrophobicContact CD1-CD1 3.74Å; I17-I27 HydrophobicContact CG1-CD1 3.67Å; I17-I27 HydrophobicContact CG2-CD1 4.46Å; V25-I27 HydrophobicContact CB-CD1 4.39Å; V25-I27 HydrophobicContact CG1-CD1 3.85Å; V25-I27 HydrophobicContact CG1-CG1 4.4Å; I27-L42 HydrophobicContact CB-CD2 4.04Å; I27-L42 HydrophobicContact CD1-CD2 3.77Å; I27-L42 HydrophobicContact CG1-CD2 3.98Å; I27-L42 HydrophobicContact CG2-CD2 4.42Å; I27-L45 HydrophobicContact CG1-CD1 3.96Å; I27-L45 HydrophobicContact CG2-CD1 4.49Å
28	K	91.9	Very high	87.9	Confident	100 Å²	100	75.6 Å²	75.6	44%	0.435	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124	171.8	-174.6	177.6	-177.4	-175.1	0	108.6	H9 E10 A12 P13 V14	H9-K28 VanDerWaalsContact O-CE 3.3Å; H9-K28 WeakPolarHBondContact O-CE 3.48Å; E10-K28 IonicContact OE2-NZ 2.8Å; E10-K28 PolarHBondContact OE2-NZ 3.34Å; A12-K28 HydrophobicContact CB-CD 4.37Å; A12-K28 VanDerWaalsContact CB-CE 3.44Å; A12-K28 HydrophobicContact CB-CG 4.03Å; P13-K28 WeakPolarHBondContact O-CA 3.2Å; V14-K28 HydrophobicContact CG2-CB 4Å; V14-K28 HydrophobicContact CG2-CD 4.5Å; V14-K28 HydrophobicContact CG2-CG 3.97Å
29	C	87	Confident	87.9	Confident	12 Å²	12	77 Å²	77	8%	0.081	40%	0.399	C	S	.	.			trans	-114.9	157.5	176.5	-61.2	0	0	0	0	110.1	A12 P13 Y15 F33 I38	A12-C29 WeakPolarHBondContact CB-O 3.31Å; P13-C29 VanDerWaalsContact CD-O 3.3Å; P13-C29 WeakPolarHBondContact CD-O 3.11Å; P13-C29 PolarHBondContact O-N 3.45Å; Y15-C29 HydrophobicContact CE2-CB 4.27Å; C29-F33 HydrophobicContact CB-CD2 4.33Å; C29-I38 HydrophobicContact CB-CD1 3.78Å
30	D	85.1	Confident	88.1	Confident	89 Å²	89	83.2 Å²	83.2	48%	0.476	43%	0.425	S	S	.	.			trans	-74.9	165	164.4	62.6	51.9	0	0	0	111	S32 F33	D30-S32 PolarHBondContact O-N 3.14Å; D30-S32 WeakPolarHBondContact OD1-CB 3.37Å; D30-S32 PolarHBondContact OD1-N 3.07Å; D30-S32 PolarHBondContact OD1-OG 2.9Å; D30-F33 VanDerWaalsContact OD1-CD2 3.28Å; D30-F33 WeakPolarHBondContact OD1-CD2 3.36Å; D30-F33 WeakPolarHBondContact OD1-CE2 3.49Å
31	D	81.4	Confident	88.3	Confident	114 Å²	114	77.8 Å²	77.8	61%	0.61	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	5.2	-178.9	-67.5	-27.7	0	0	0	113.7	P13	P13-D31 WeakPolarHBondContact CD-OD1 3.38Å
32	S	87.8	Confident	88.6	Confident	95 Å²	95	75.8 Å²	75.8	66%	0.664	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.2	-175.1	77.7	0	0	0	0	113.6	D30	D30-S32 PolarHBondContact O-N 3.14Å; D30-S32 WeakPolarHBondContact OD1-CB 3.37Å; D30-S32 PolarHBondContact OD1-N 3.07Å; D30-S32 PolarHBondContact OD1-OG 2.9Å
33	F	84.4	Confident	88.7	Confident	86 Å²	86	73.2 Å²	73.2	38%	0.377	39%	0.388	S	S	.	.	S	Bend	trans	-85.2	137.4	-178.8	-65.2	-83.2	0	0	0	112.2	C29 D30 E37 I38	C29-F33 HydrophobicContact CB-CD2 4.33Å; D30-F33 VanDerWaalsContact OD1-CD2 3.28Å; D30-F33 WeakPolarHBondContact OD1-CD2 3.36Å; D30-F33 WeakPolarHBondContact OD1-CE2 3.49Å; F33-E37 HydrophobicContact CB-CB 4.43Å; F33-E37 HydrophobicContact CD1-CB 4.1Å; F33-I38 HydrophobicContact CB-CD1 3.45Å; F33-I38 VanDerWaalsContact CB-CD1 3.45Å; F33-I38 HydrophobicContact CB-CG1 3.66Å; F33-I38 HydrophobicContact CD2-CD1 4.15Å; F33-I38 HydrophobicContact CG-CD1 3.85Å
34	S	88.5	Confident	89	Confident	55 Å²	55	71.9 Å²	71.9	39%	0.385	38%	0.384	S	S	.	.			trans	-70.2	155	165.4	66.4	0	0	0	0	111.2	T36 E37 I38	S34-T36 PolarHBondContact O-N 3.16Å; S34-T36 VanDerWaalsContact O-N 3.09Å; S34-E37 WeakPolarHBondContact CB-OE2 3.44Å; S34-E37 PolarHBondContact N-OE2 3.29Å; S34-E37 PolarHBondContact O-N 3.29Å; S34-E37 WeakPolarHBondContact OG-CG 3.24Å; S34-E37 PolarHBondContact OG-N 3.31Å; S34-E37 PolarHBondContact OG-OE2 2.77Å; S34-I38 PolarHBondContact O-N 3.13Å
35	D	85.9	Confident	89.1	Confident	103 Å²	103	70 Å²	70	55%	0.551	38%	0.377	S	S	*	.	H	α-helix	trans	-51.8	-37	174.5	-69.4	-18.6	0	0	0	112.3	I38 F39	D35-I38 PolarHBondContact O-N 2.75Å; D35-F39 HydrophobicContact CB-CD2 4.41Å; D35-F39 HydrophobicContact CB-CE2 3.91Å; D35-F39 HydrophobicContact CB-CZ 4.48Å; D35-F39 WeakPolarHBondContact O-CD2 3.35Å; D35-F39 WeakPolarHBondContact O-CG 3.33Å; D35-F39 PolarHBondContact O-N 3.09Å
36	T	90.1	Very high	89.2	Confident	86 Å²	86	69.9 Å²	69.9	53%	0.528	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-40.3	178.5	-61.8	0	0	0	0	112.3	S34 K40	S34-T36 PolarHBondContact O-N 3.16Å; S34-T36 VanDerWaalsContact O-N 3.09Å; T36-K40 WeakPolarHBondContact O-CG 3.28Å; T36-K40 PolarHBondContact O-N 2.93Å; T36-K40 VanDerWaalsContact O-N 3.13Å
37	E	90.7	Very high	89.1	Confident	96 Å²	96	70.8 Å²	70.8	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-69.3	-41.8	176.7	-71.1	162.3	133.6	0	0	111	F33 S34 K40 L41	F33-E37 HydrophobicContact CB-CB 4.43Å; F33-E37 HydrophobicContact CD1-CB 4.1Å; S34-E37 WeakPolarHBondContact CB-OE2 3.44Å; S34-E37 PolarHBondContact N-OE2 3.29Å; S34-E37 PolarHBondContact O-N 3.29Å; S34-E37 WeakPolarHBondContact OG-CG 3.24Å; S34-E37 PolarHBondContact OG-N 3.31Å; S34-E37 PolarHBondContact OG-OE2 2.77Å; E37-K40 PolarHBondContact O-N 2.73Å; E37-L41 WeakPolarHBondContact O-CB 3.29Å; E37-L41 PolarHBondContact O-N 3.26Å
38	I	90.7	Very high	89.1	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	40%	0.396	C	S	.	.	H	α-helix	trans	-58.2	-50.3	173.6	-67.7	-57.8	0	0	0	110.9	Y15 C29 F33 S34 D35 K40 L41 L42	Y15-I38 HydrophobicContact CD1-CG2 3.98Å; Y15-I38 HydrophobicContact CD2-CG2 4.02Å; Y15-I38 HydrophobicContact CE1-CG2 3.67Å; Y15-I38 HydrophobicContact CE2-CD1 4.09Å; Y15-I38 HydrophobicContact CE2-CG1 4.24Å; Y15-I38 HydrophobicContact CE2-CG2 3.73Å; Y15-I38 HydrophobicContact CG-CG2 4.15Å; C29-I38 HydrophobicContact CB-CD1 3.78Å; F33-I38 HydrophobicContact CB-CD1 3.45Å; F33-I38 VanDerWaalsContact CB-CD1 3.45Å; F33-I38 HydrophobicContact CB-CG1 3.66Å; F33-I38 HydrophobicContact CD2-CD1 4.15Å; F33-I38 HydrophobicContact CG-CD1 3.85Å; S34-I38 PolarHBondContact O-N 3.13Å; D35-I38 PolarHBondContact O-N 2.75Å; I38-K40 VanDerWaalsContact C-N 3.28Å; I38-K40 PolarHBondContact O-N 3.23Å; I38-L41 WeakPolarHBondContact O-CB 3.46Å; I38-L41 PolarHBondContact O-N 3.05Å; I38-L41 VanDerWaalsContact O-N 3.17Å; I38-L42 HydrophobicContact CG2-CD1 3.6Å; I38-L42 HydrophobicContact CG2-CG 4.04Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.4Å; I38-L42 PolarHBondContact O-N 3Å
39	F	89.1	Confident	89	Confident	87 Å²	87	71.3 Å²	71.3	38%	0.382	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-36.1	-179.9	-65.6	-42.5	0	0	0	112.8	M1 I3 D35 S43	M1-F39 HydrophobicContact CE-CB 4.02Å; M1-F39 HydrophobicContact CE-CD1 3.36Å; M1-F39 HydrophobicContact CE-CE1 4.11Å; M1-F39 HydrophobicContact CE-CG 3.93Å; M1-F39 HydrophobicContact SD-CB 4.34Å; M1-F39 HydrophobicContact SD-CD1 4.11Å; I3-F39 HydrophobicContact CD1-CD1 3.52Å; I3-F39 HydrophobicContact CD1-CE1 3.32Å; D35-F39 HydrophobicContact CB-CD2 4.41Å; D35-F39 HydrophobicContact CB-CE2 3.91Å; D35-F39 HydrophobicContact CB-CZ 4.48Å; D35-F39 WeakPolarHBondContact O-CD2 3.35Å; D35-F39 WeakPolarHBondContact O-CG 3.33Å; D35-F39 PolarHBondContact O-N 3.09Å; F39-S43 VanDerWaalsContact O-CB 3.3Å; F39-S43 WeakPolarHBondContact O-CB 3.5Å; F39-S43 PolarHBondContact O-N 3.49Å; F39-S43 PolarHBondContact O-OG 3.37Å
40	K	91.4	Very high	89.2	Confident	136 Å²	136	72.5 Å²	72.5	59%	0.591	39%	0.387	S	S	*	.	H	α-helix	trans	-64.3	-48.8	173.2	-76.4	174	178.6	178.5	0	111.2	T36 E37 I38 S43 L44	T36-K40 WeakPolarHBondContact O-CG 3.28Å; T36-K40 PolarHBondContact O-N 2.93Å; T36-K40 VanDerWaalsContact O-N 3.13Å; E37-K40 PolarHBondContact O-N 2.73Å; I38-K40 VanDerWaalsContact C-N 3.28Å; I38-K40 PolarHBondContact O-N 3.23Å; K40-S43 PolarHBondContact O-N 2.82Å; K40-L44 WeakPolarHBondContact O-CG 3.34Å; K40-L44 PolarHBondContact O-N 3.17Å
41	L	90.6	Very high	89.4	Confident	61 Å²	61	74.6 Å²	74.6	32%	0.319	39%	0.394	S	S	.	.	H	α-helix	trans	-57.5	-50.5	177.4	175	64.2	0	0	0	111.4	E37 I38 S43 L44 L45	E37-L41 WeakPolarHBondContact O-CB 3.29Å; E37-L41 PolarHBondContact O-N 3.26Å; I38-L41 WeakPolarHBondContact O-CB 3.46Å; I38-L41 PolarHBondContact O-N 3.05Å; I38-L41 VanDerWaalsContact O-N 3.17Å; L41-S43 VanDerWaalsContact C-N 3.28Å; L41-S43 PolarHBondContact O-N 3.36Å; L41-L44 PolarHBondContact O-N 2.89Å; L41-L45 HydrophobicContact CD1-CD1 4.01Å; L41-L45 HydrophobicContact CD1-CG 4.2Å; L41-L45 HydrophobicContact CG-CD1 3.97Å; L41-L45 WeakPolarHBondContact O-CG 2.92Å; L41-L45 PolarHBondContact O-N 2.98Å
42	L	91.3	Very high	89.8	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-63.9	-34.3	-179.2	-66.9	178.9	0	0	0	112.4	M1 I3 Y15 I17 I27 I38 Q46	M1-L42 HydrophobicContact SD-CB 3.73Å; M1-L42 HydrophobicContact SD-CD1 4.49Å; I3-L42 HydrophobicContact CD1-CD1 3.67Å; I3-L42 HydrophobicContact CG1-CD1 3.95Å; Y15-L42 HydrophobicContact CD1-CD1 4.01Å; Y15-L42 HydrophobicContact CG-CD1 3.84Å; I17-L42 HydrophobicContact CG2-CB 4.19Å; I17-L42 HydrophobicContact CG2-CD1 4.26Å; I17-L42 HydrophobicContact CG2-CD2 3.99Å; I17-L42 HydrophobicContact CG2-CG 4.37Å; I27-L42 HydrophobicContact CB-CD2 4.04Å; I27-L42 HydrophobicContact CD1-CD2 3.77Å; I27-L42 HydrophobicContact CG1-CD2 3.98Å; I27-L42 HydrophobicContact CG2-CD2 4.42Å; I38-L42 HydrophobicContact CG2-CD1 3.6Å; I38-L42 HydrophobicContact CG2-CG 4.04Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.4Å; I38-L42 PolarHBondContact O-N 3Å; L42-Q46 VanDerWaalsContact O-CB 3.28Å; L42-Q46 WeakPolarHBondContact O-CB 3.46Å; L42-Q46 PolarHBondContact O-N 3.03Å
43	S	90.1	Very high	89.7	Confident	52 Å²	52	78.3 Å²	78.3	36%	0.364	39%	0.394	S	S	.	.	H	α-helix	trans	-69.1	-42.1	175.7	-62.1	0	0	0	0	112	F39 K40 L41 Q46 D47	F39-S43 VanDerWaalsContact O-CB 3.3Å; F39-S43 WeakPolarHBondContact O-CB 3.5Å; F39-S43 PolarHBondContact O-N 3.49Å; F39-S43 PolarHBondContact O-OG 3.37Å; K40-S43 PolarHBondContact O-N 2.82Å; L41-S43 VanDerWaalsContact C-N 3.28Å; L41-S43 PolarHBondContact O-N 3.36Å; S43-Q46 PolarHBondContact O-N 2.97Å; S43-D47 PolarHBondContact O-N 2.69Å; S43-D47 VanDerWaalsContact O-N 3.09Å
44	L	91.7	Very high	89.6	Confident	113 Å²	113	78.6 Å²	78.6	59%	0.592	40%	0.403	S	S	*	.	H	α-helix	trans	-62.1	-49.1	174.7	-70.7	169	0	0	0	111.1	K40 L41 Q46 D47 D48	K40-L44 WeakPolarHBondContact O-CG 3.34Å; K40-L44 PolarHBondContact O-N 3.17Å; L41-L44 PolarHBondContact O-N 2.89Å; L44-Q46 VanDerWaalsContact C-N 3.34Å; L44-Q46 PolarHBondContact O-N 2.88Å; L44-D47 PolarHBondContact O-N 2.84Å; L44-D48 PolarHBondContact O-N 3.42Å
45	L	91.3	Very high	89.2	Confident	55 Å²	55	84.9 Å²	84.9	29%	0.288	45%	0.447	S	S	.	.	H	α-helix	trans	-60.6	-43.6	178.4	-72.2	173.6	0	0	0	111.9	I17 I27 L41 D47 D48 I49	I17-L45 HydrophobicContact CD1-CB 4.44Å; I27-L45 HydrophobicContact CG1-CD1 3.96Å; I27-L45 HydrophobicContact CG2-CD1 4.49Å; L41-L45 HydrophobicContact CD1-CD1 4.01Å; L41-L45 HydrophobicContact CD1-CG 4.2Å; L41-L45 HydrophobicContact CG-CD1 3.97Å; L41-L45 WeakPolarHBondContact O-CG 2.92Å; L41-L45 PolarHBondContact O-N 2.98Å; L45-D47 VanDerWaalsContact C-N 3.32Å; L45-D47 PolarHBondContact O-N 3.09Å; L45-D48 PolarHBondContact O-N 2.79Å; L45-I49 HydrophobicContact CB-CD1 4.43Å; L45-I49 VanDerWaalsContact O-CB 3.26Å; L45-I49 WeakPolarHBondContact O-CB 3.48Å; L45-I49 VanDerWaalsContact O-CD1 3.26Å; L45-I49 WeakPolarHBondContact O-CD1 3.2Å; L45-I49 WeakPolarHBondContact O-CG1 3.47Å; L45-I49 PolarHBondContact O-N 2.85Å
46	Q	90.6	Very high	89.3	Confident	31 Å²	31	84 Å²	84	15%	0.145	44%	0.442	C	S	.	.	H	α-helix	trans	-58.9	-46.2	177.1	-176.1	179.6	49.5	0	0	111.2	I17 I18 L42 S43 L44 I49 D50	I17-Q46 HydrophobicContact CD1-CB 4.18Å; I18-Q46 PolarHBondContact O-NE2 2.89Å; L42-Q46 VanDerWaalsContact O-CB 3.28Å; L42-Q46 WeakPolarHBondContact O-CB 3.46Å; L42-Q46 PolarHBondContact O-N 3.03Å; S43-Q46 PolarHBondContact O-N 2.97Å; L44-Q46 VanDerWaalsContact C-N 3.34Å; L44-Q46 PolarHBondContact O-N 2.88Å; Q46-I49 PolarHBondContact O-N 2.85Å; Q46-D50 VanDerWaalsContact O-CB 3.28Å; Q46-D50 WeakPolarHBondContact O-CB 3.33Å; Q46-D50 PolarHBondContact O-N 2.85Å
47	D	91.4	Very high	89.3	Confident	89 Å²	89	83.8 Å²	83.8	48%	0.476	44%	0.437	S	S	.	.	H	α-helix	trans	-64.9	-47.3	-178.8	-164.4	67.9	0	0	0	111.7	S43 L44 L45 I49 D50 H51	S43-D47 PolarHBondContact O-N 2.69Å; S43-D47 VanDerWaalsContact O-N 3.09Å; L44-D47 PolarHBondContact O-N 2.84Å; L45-D47 VanDerWaalsContact C-N 3.32Å; L45-D47 PolarHBondContact O-N 3.09Å; D47-I49 VanDerWaalsContact C-N 3.32Å; D47-I49 PolarHBondContact O-N 2.81Å; D47-D50 PolarHBondContact O-N 2.95Å; D47-H51 PolarHBondContact O-N 2.54Å; D47-H51 PolarHBondContact O-ND1 2.74Å; D47-H51 IonicContact OD1-CE1 3.15Å; D47-H51 PolarHBondContact OD1-CE1 3.45Å; D47-H51 IonicContact OD1-ND1 3.47Å; D47-H51 PolarHBondContact OD1-ND1 2.86Å; D47-H51 IonicContact OD2-CE1 3.76Å; D47-H51 IonicContact OD2-ND1 3.57Å
48	D	91	Very high	89.2	Confident	111 Å²	111	83.2 Å²	83.2	59%	0.594	44%	0.437	S	S	*	.	H	α-helix	trans	-60.6	-42.2	177.7	-75.5	-21.8	0	0	0	111.7	L44 L45 H51 M52	L44-D48 PolarHBondContact O-N 3.42Å; L45-D48 PolarHBondContact O-N 2.79Å; D48-H51 PolarHBondContact O-N 2.95Å; D48-M52 PolarHBondContact O-N 3.12Å
49	I	89.8	Confident	89.1	Confident	25 Å²	25	87.9 Å²	87.9	13%	0.128	46%	0.462	C	S	.	.	H	α-helix	trans	-69.1	-42.9	179.4	-69.4	164.1	0	0	0	111.5	T19 T21 F22 V25 L45 Q46 D47 H51 M52	T19-I49 HydrophobicContact CG2-CB 4.17Å; T19-I49 HydrophobicContact CG2-CD1 4.27Å; T19-I49 HydrophobicContact CG2-CG2 3.7Å; T21-I49 WeakPolarHBondContact CB-O 3.3Å; T21-I49 PolarHBondContact OG1-O 2.83Å; F22-I49 HydrophobicContact CD2-CG2 3.51Å; F22-I49 HydrophobicContact CE2-CG2 3.95Å; V25-I49 HydrophobicContact CG1-CD1 4.32Å; V25-I49 HydrophobicContact CG2-CD1 4.15Å; L45-I49 HydrophobicContact CB-CD1 4.43Å; L45-I49 VanDerWaalsContact O-CB 3.26Å; L45-I49 WeakPolarHBondContact O-CB 3.48Å; L45-I49 VanDerWaalsContact O-CD1 3.26Å; L45-I49 WeakPolarHBondContact O-CD1 3.2Å; L45-I49 WeakPolarHBondContact O-CG1 3.47Å; L45-I49 PolarHBondContact O-N 2.85Å; Q46-I49 PolarHBondContact O-N 2.85Å; D47-I49 VanDerWaalsContact C-N 3.32Å; D47-I49 PolarHBondContact O-N 2.81Å; I49-H51 PolarHBondContact O-N 3.17Å; I49-M52 VanDerWaalsContact O-CB 3.26Å; I49-M52 WeakPolarHBondContact O-CB 3.3Å; I49-M52 PolarHBondContact O-N 2.8Å; I49-M52 VanDerWaalsContact O-N 3.14Å
50	D	89.6	Confident	89.1	Confident	37 Å²	37	88 Å²	88	20%	0.198	47%	0.467	C	S	.	.	H	α-helix	trans	-65.9	-26.6	179	-83.6	3.4	0	0	0	112.3	T19 K20 Q46 D47	T19-D50 WeakPolarHBondContact CA-OD1 3.44Å; T19-D50 WeakPolarHBondContact CB-OD1 3.42Å; K20-D50 HydrophobicContact CD-CB 4.4Å; K20-D50 PolarHBondContact N-OD1 3.01Å; Q46-D50 VanDerWaalsContact O-CB 3.28Å; Q46-D50 WeakPolarHBondContact O-CB 3.33Å; Q46-D50 PolarHBondContact O-N 2.85Å; D47-D50 PolarHBondContact O-N 2.95Å
51	H	91	Very high	89	Confident	133 Å²	133	84.8 Å²	84.8	62%	0.616	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-1.6	174.8	-65.6	102.9	0	0	0	113.8	D47 D48 I49 K53	D47-H51 PolarHBondContact O-N 2.54Å; D47-H51 PolarHBondContact O-ND1 2.74Å; D47-H51 IonicContact OD1-CE1 3.15Å; D47-H51 PolarHBondContact OD1-CE1 3.45Å; D47-H51 IonicContact OD1-ND1 3.47Å; D47-H51 PolarHBondContact OD1-ND1 2.86Å; D47-H51 IonicContact OD2-CE1 3.76Å; D47-H51 IonicContact OD2-ND1 3.57Å; D48-H51 PolarHBondContact O-N 2.95Å; I49-H51 PolarHBondContact O-N 3.17Å; H51-K53 PolarHBondContact O-N 2.95Å
52	M	89.3	Confident	88.9	Confident	82 Å²	82	86.5 Å²	86.5	40%	0.404	47%	0.468	S	S	.	.			trans	-66.9	118.6	-179.3	-159.9	-173.8	78.2	0	0	110.4	T21 F22 D48 I49 V54	T21-M52 HydrophobicContact CG2-CE 4.17Å; F22-M52 HydrophobicContact CE1-CE 4.39Å; F22-M52 HydrophobicContact CE2-CE 3.57Å; F22-M52 HydrophobicContact CE2-SD 4.19Å; F22-M52 HydrophobicContact CZ-CE 3.3Å; F22-M52 HydrophobicContact CZ-SD 4.29Å; D48-M52 PolarHBondContact O-N 3.12Å; I49-M52 VanDerWaalsContact O-CB 3.26Å; I49-M52 WeakPolarHBondContact O-CB 3.3Å; I49-M52 PolarHBondContact O-N 2.8Å; I49-M52 VanDerWaalsContact O-N 3.14Å; M52-V54 HydrophobicContact CE-CG1 4.35Å; M52-V54 HydrophobicContact CE-CG2 3.79Å; M52-V54 PolarHBondContact O-N 3.25Å; M52-V54 VanDerWaalsContact O-N 3.16Å
53	K	85.8	Confident	88.7	Confident	204 Å²	204	93.2 Å²	93.2	89%	0.887	50%	0.504	S	S	*	.			trans	-77.1	101.3	173	-66.2	-176.9	-177.8	179.4	0	109.4	H51	H51-K53 PolarHBondContact O-N 2.95Å
54	V	80.9	Confident	88.6	Confident	92 Å²	92	96.6 Å²	96.6	56%	0.558	52%	0.516	S	S	*	.			trans	-82.1	130	168.8	-142.7	0	0	0	0	108.5	T21 M52	T21-V54 HydrophobicContact CG2-CG2 3.18Å; M52-V54 HydrophobicContact CE-CG1 4.35Å; M52-V54 HydrophobicContact CE-CG2 3.79Å; M52-V54 PolarHBondContact O-N 3.25Å; M52-V54 VanDerWaalsContact O-N 3.16Å
55	S	80.6	Confident	88.3	Confident	187 Å²	187	95.1 Å²	95.1	100%	1.308	51%	0.509	S	S	*	.			trans	-68.8	0	-178.5	58.5	0	0	0	0	113.3

Retrieved 55 of 55 residues in 116.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).