A0A5K4F2C0_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F2C0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 142 aa.

						>A0A5K4F2C0_SCHMA|A0A5K4F2C0
MLDESQKRLIQEFESWYQQCFMESLNQNDPELHNNQLNSKTLNNTINKNNKVTVCNIKQNTDENDYLMQFKQAQENYFSNRTDLLSYQRAKDMVTYKQVYQRKQQNLKKFHRTLKFGSIIMPNELNNSLFEEQKCNTTDIPA
					

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	49.4	Very low	54.5	Low	235 Å²	235	109.7 Å²	109.7	100%	1.158	53%	0.533	S	S	*	.				0	124.3	0	-157.7	171.6	178.5	0	0	105.2
2	L	54.7	Low	54.9	Low	65 Å²	65	109.2 Å²	109.2	34%	0.34	53%	0.529	S	S	.	.			trans	-64.2	136.3	-177.4	-66.2	167.2	0	0	0	109.7	Q6 K7 I10	L2-Q6 VanDerWaalsContact CA-OE1 3.28Å; L2-Q6 HydrophobicContact CB-CB 4.17Å; L2-Q6 HydrophobicContact CD2-CB 4.04Å; L2-Q6 VanDerWaalsContact CD2-OE1 3.27Å; L2-K7 HydrophobicContact CB-CG 4.16Å; L2-I10 HydrophobicContact CD1-CD1 3.66Å
3	D	58.6	Low	54.8	Low	74 Å²	74	104.8 Å²	104.8	40%	0.396	51%	0.506	S	S	.	.			trans	-72.8	165.8	171.3	70.3	53	0	0	0	111.1	S5 Q6 K7	D3-S5 PolarHBondContact O-N 3.42Å; D3-S5 WeakPolarHBondContact OD1-CA 3.16Å; D3-S5 VanDerWaalsContact OD1-CB 3.31Å; D3-S5 WeakPolarHBondContact OD1-CB 3.12Å; D3-S5 PolarHBondContact OD1-N 2.97Å; D3-S5 PolarHBondContact OD1-OG 2.97Å; D3-Q6 VanDerWaalsContact N-OE1 3.08Å; D3-Q6 PolarHBondContact O-N 2.72Å; D3-Q6 WeakPolarHBondContact OD1-CG 3.37Å; D3-Q6 PolarHBondContact OD1-N 3.1Å; D3-K7 PolarHBondContact O-N 2.85Å
4	E	56.9	Low	55	Low	134 Å²	134	103.1 Å²	103.1	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-62.1	-30.1	-177.5	-75.1	-56.8	138.6	0	0	113.3	K7 R8	E4-K7 PolarHBondContact O-N 3.49Å; E4-K7 IonicContact OE1-NZ 2.75Å; E4-K7 PolarHBondContact OE1-NZ 2.86Å; E4-R8 WeakPolarHBondContact O-CB 3.26Å; E4-R8 PolarHBondContact O-N 2.92Å
5	S	52.1	Low	55.3	Low	73 Å²	73	99.9 Å²	99.9	51%	0.51	49%	0.489	S	S	.	.	H	α-helix	trans	-69	-39.5	177.2	77.3	0	0	0	0	111.3	D3 R8 L9	D3-S5 PolarHBondContact O-N 3.42Å; D3-S5 WeakPolarHBondContact OD1-CA 3.16Å; D3-S5 VanDerWaalsContact OD1-CB 3.31Å; D3-S5 WeakPolarHBondContact OD1-CB 3.12Å; D3-S5 PolarHBondContact OD1-N 2.97Å; D3-S5 PolarHBondContact OD1-OG 2.97Å; S5-R8 PolarHBondContact O-N 2.91Å; S5-L9 PolarHBondContact O-N 2.92Å
6	Q	46.1	Very low	55.6	Low	82 Å²	82	99.9 Å²	99.9	38%	0.383	48%	0.483	S	S	.	.	H	α-helix	trans	-67.8	-40.9	176.3	-67.5	172.3	-19.8	0	0	111.7	L2 D3 R8 L9 I10	L2-Q6 VanDerWaalsContact CA-OE1 3.28Å; L2-Q6 HydrophobicContact CB-CB 4.17Å; L2-Q6 HydrophobicContact CD2-CB 4.04Å; L2-Q6 VanDerWaalsContact CD2-OE1 3.27Å; D3-Q6 VanDerWaalsContact N-OE1 3.08Å; D3-Q6 PolarHBondContact O-N 2.72Å; D3-Q6 WeakPolarHBondContact OD1-CG 3.37Å; D3-Q6 PolarHBondContact OD1-N 3.1Å; Q6-R8 VanDerWaalsContact C-N 3.33Å; Q6-R8 PolarHBondContact O-N 3.44Å; Q6-L9 PolarHBondContact O-N 3.12Å; Q6-I10 WeakPolarHBondContact O-CD1 3.38Å; Q6-I10 VanDerWaalsContact O-CG1 3.3Å; Q6-I10 WeakPolarHBondContact O-CG1 3.24Å; Q6-I10 PolarHBondContact O-N 3.39Å
7	K	56.3	Low	55.4	Low	82 Å²	82	100.2 Å²	100.2	36%	0.357	48%	0.478	S	S	.	.	H	α-helix	trans	-61.3	-42.8	174.3	-68.6	179	-167.2	168.3	0	111.7	L2 D3 E4 I10 Q11	L2-K7 HydrophobicContact CB-CG 4.16Å; D3-K7 PolarHBondContact O-N 2.85Å; E4-K7 PolarHBondContact O-N 3.49Å; E4-K7 IonicContact OE1-NZ 2.75Å; E4-K7 PolarHBondContact OE1-NZ 2.86Å; K7-I10 PolarHBondContact O-N 2.93Å; K7-Q11 WeakPolarHBondContact O-CG 3.37Å; K7-Q11 PolarHBondContact O-N 2.84Å
8	R	56.8	Low	55.3	Low	165 Å²	165	101.4 Å²	101.4	62%	0.623	48%	0.483	S	S	*	.	H	α-helix	trans	-63.6	-45.8	178.5	-172.9	178.2	178.8	170.3	7.5	111.9	E4 S5 Q6 I10 Q11 E12	E4-R8 WeakPolarHBondContact O-CB 3.26Å; E4-R8 PolarHBondContact O-N 2.92Å; S5-R8 PolarHBondContact O-N 2.91Å; Q6-R8 VanDerWaalsContact C-N 3.33Å; Q6-R8 PolarHBondContact O-N 3.44Å; R8-I10 VanDerWaalsContact C-N 3.33Å; R8-I10 PolarHBondContact O-N 3.41Å; R8-Q11 PolarHBondContact O-N 3.42Å; R8-E12 IonicContact CZ-OE1 3.01Å; R8-E12 IonicContact NE-OE1 3.01Å; R8-E12 PolarHBondContact NE-OE1 3.42Å; R8-E12 IonicContact NH2-OE1 2.73Å; R8-E12 WeakPolarHBondContact O-CG 3.47Å; R8-E12 PolarHBondContact O-N 3.3Å
9	L	53	Low	55.2	Low	116 Å²	116	102.1 Å²	102.1	61%	0.607	49%	0.486	S	S	*	.	H	α-helix	trans	-58.5	-43	175	-96.9	154.4	0	0	0	112.3	S5 Q6 E12 F13	S5-L9 PolarHBondContact O-N 2.92Å; Q6-L9 PolarHBondContact O-N 3.12Å; L9-E12 PolarHBondContact O-N 2.94Å; L9-F13 WeakPolarHBondContact O-CB 3.1Å; L9-F13 PolarHBondContact O-N 3.46Å
10	I	54.9	Low	54.9	Low	49 Å²	49	99.8 Å²	99.8	25%	0.251	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-44.2	176.5	-70.9	164.7	0	0	0	110.9	L2 Q6 K7 R8 F13 E14 Y77	L2-I10 HydrophobicContact CD1-CD1 3.66Å; Q6-I10 WeakPolarHBondContact O-CD1 3.38Å; Q6-I10 VanDerWaalsContact O-CG1 3.3Å; Q6-I10 WeakPolarHBondContact O-CG1 3.24Å; Q6-I10 PolarHBondContact O-N 3.39Å; K7-I10 PolarHBondContact O-N 2.93Å; R8-I10 VanDerWaalsContact C-N 3.33Å; R8-I10 PolarHBondContact O-N 3.41Å; I10-F13 PolarHBondContact O-N 2.88Å; I10-E14 HydrophobicContact CG2-CG 4.41Å; I10-E14 WeakPolarHBondContact O-CB 3.41Å; I10-E14 WeakPolarHBondContact O-CG 3.5Å; I10-E14 PolarHBondContact O-N 3Å; I10-Y77 HydrophobicContact CG2-CE2 4.29Å
11	Q	60.6	Low	54.5	Low	132 Å²	132	99.5 Å²	99.5	62%	0.617	48%	0.477	S	S	*	.	H	α-helix	trans	-63.8	-42.3	177.2	-78.3	-179.1	-20.8	0	0	112.7	K7 R8 E14 S15	K7-Q11 WeakPolarHBondContact O-CG 3.37Å; K7-Q11 PolarHBondContact O-N 2.84Å; R8-Q11 PolarHBondContact O-N 3.42Å; Q11-E14 PolarHBondContact O-N 3.29Å; Q11-S15 VanDerWaalsContact O-CB 3.31Å; Q11-S15 WeakPolarHBondContact O-CB 3.34Å; Q11-S15 PolarHBondContact O-N 3.01Å
12	E	59.3	Low	54.5	Low	103 Å²	103	92.1 Å²	92.1	48%	0.481	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-41.4	176.5	-73.9	176.2	-169	0	0	110.9	R8 L9 S15 W16	R8-E12 IonicContact CZ-OE1 3.01Å; R8-E12 IonicContact NE-OE1 3.01Å; R8-E12 PolarHBondContact NE-OE1 3.42Å; R8-E12 IonicContact NH2-OE1 2.73Å; R8-E12 WeakPolarHBondContact O-CG 3.47Å; R8-E12 PolarHBondContact O-N 3.3Å; L9-E12 PolarHBondContact O-N 2.94Å; E12-S15 PolarHBondContact O-N 3.42Å; E12-W16 VanDerWaalsContact O-CB 3.32Å; E12-W16 WeakPolarHBondContact O-CB 3.39Å; E12-W16 PolarHBondContact O-N 3.29Å
13	F	54.3	Low	54	Low	52 Å²	52	93.3 Å²	93.3	23%	0.228	45%	0.445	C	S	.	.	H	α-helix	trans	-64	-46.2	174.4	179.2	-98	0	0	0	112.6	L9 I10 S15 W16 Y17 Y77	L9-F13 WeakPolarHBondContact O-CB 3.1Å; L9-F13 PolarHBondContact O-N 3.46Å; I10-F13 PolarHBondContact O-N 2.88Å; F13-S15 VanDerWaalsContact C-N 3.33Å; F13-S15 PolarHBondContact O-N 2.55Å; F13-W16 HydrophobicContact CD2-CE3 4.46Å; F13-W16 HydrophobicContact CE2-CE3 4.4Å; F13-W16 HydrophobicContact CE2-CZ3 4.36Å; F13-W16 PolarHBondContact O-N 2.87Å; F13-Y17 VanDerWaalsContact O-CB 3.28Å; F13-Y17 WeakPolarHBondContact O-CB 3.31Å; F13-Y17 PolarHBondContact O-N 3.37Å; F13-Y77 AromaticContact CD1-CD2 3.98Å; F13-Y77 HydrophobicContact CD1-CD2 3.98Å; F13-Y77 AromaticContact CD1-CE2 3.95Å; F13-Y77 HydrophobicContact CD1-CE2 3.95Å; F13-Y77 HydrophobicContact CD1-CG 4.36Å; F13-Y77 HydrophobicContact CE1-CD1 4.05Å; F13-Y77 HydrophobicContact CE1-CD2 4.14Å; F13-Y77 HydrophobicContact CE1-CE1 4.13Å; F13-Y77 HydrophobicContact CE1-CE2 4.21Å; F13-Y77 HydrophobicContact CE1-CG 4.06Å
14	E	56.8	Low	53.1	Low	82 Å²	82	92.6 Å²	92.6	38%	0.383	45%	0.445	S	S	.	.	H	α-helix	trans	-63.5	-40.1	178	-75.6	-178.7	168.3	0	0	111.6	I10 Q11 Y17 Q18 Y77	I10-E14 HydrophobicContact CG2-CG 4.41Å; I10-E14 WeakPolarHBondContact O-CB 3.41Å; I10-E14 WeakPolarHBondContact O-CG 3.5Å; I10-E14 PolarHBondContact O-N 3Å; Q11-E14 PolarHBondContact O-N 3.29Å; E14-Y17 PolarHBondContact O-N 3.48Å; E14-Q18 WeakPolarHBondContact O-CB 3.36Å; E14-Q18 WeakPolarHBondContact O-CG 3.43Å; E14-Q18 PolarHBondContact O-N 2.91Å; E14-Y77 PolarHBondContact OE1-OH 3.32Å
15	S	59.6	Low	52.1	Low	54 Å²	54	91.3 Å²	91.3	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-64.3	-46.2	175.8	-171.3	0	0	0	0	111.7	Q11 E12 F13 Q18 Q19	Q11-S15 VanDerWaalsContact O-CB 3.31Å; Q11-S15 WeakPolarHBondContact O-CB 3.34Å; Q11-S15 PolarHBondContact O-N 3.01Å; E12-S15 PolarHBondContact O-N 3.42Å; F13-S15 VanDerWaalsContact C-N 3.33Å; F13-S15 PolarHBondContact O-N 2.55Å; S15-Q18 PolarHBondContact O-N 3.28Å; S15-Q19 WeakPolarHBondContact O-CG 3.49Å; S15-Q19 PolarHBondContact O-N 3.4Å
16	W	61.3	Low	51.5	Low	101 Å²	101	91.2 Å²	91.2	38%	0.383	44%	0.436	S	S	.	.	H	α-helix	trans	-62.2	-46	176.1	176.4	82.5	0	0	0	111.9	E12 F13 Q18 Q19 C20 F21 F70	E12-W16 VanDerWaalsContact O-CB 3.32Å; E12-W16 WeakPolarHBondContact O-CB 3.39Å; E12-W16 PolarHBondContact O-N 3.29Å; F13-W16 HydrophobicContact CD2-CE3 4.46Å; F13-W16 HydrophobicContact CE2-CE3 4.4Å; F13-W16 HydrophobicContact CE2-CZ3 4.36Å; F13-W16 PolarHBondContact O-N 2.87Å; W16-Q18 VanDerWaalsContact C-N 3.34Å; W16-Q18 PolarHBondContact O-N 3.48Å; W16-Q19 PolarHBondContact O-N 2.92Å; W16-C20 PolarHBondContact NE1-SG 2.96Å; W16-C20 WeakPolarHBondContact O-CB 3.44Å; W16-C20 PolarHBondContact O-N 3.28Å; W16-C20 PolarHBondContact O-SG 2.9Å; W16-F21 AromaticContact CH2-CE2 3.92Å; W16-F21 HydrophobicContact CH2-CE2 3.92Å; W16-F21 HydrophobicContact CZ3-CE2 4.01Å; W16-F70 AromaticContact CH2-CE2 3.49Å; W16-F70 HydrophobicContact CH2-CE2 3.49Å; W16-F70 VanDerWaalsContact CH2-CE2 3.49Å; W16-F70 AromaticContact CH2-CZ 3.92Å; W16-F70 HydrophobicContact CH2-CZ 3.92Å; W16-F70 HydrophobicContact CZ2-CE2 4.42Å; W16-F70 AromaticContact CZ3-CE2 3.73Å; W16-F70 HydrophobicContact CZ3-CE2 3.73Å; W16-F70 HydrophobicContact CZ3-CZ 4.17Å
17	Y	51.6	Low	51.3	Low	104 Å²	104	94.8 Å²	94.8	41%	0.408	45%	0.453	S	S	.	.	H	α-helix	trans	-60.9	-42.6	178.3	-177.4	-92.9	0	0	0	111.8	F13 E14 C20 F21 M22	F13-Y17 VanDerWaalsContact O-CB 3.28Å; F13-Y17 WeakPolarHBondContact O-CB 3.31Å; F13-Y17 PolarHBondContact O-N 3.37Å; E14-Y17 PolarHBondContact O-N 3.48Å; Y17-C20 PolarHBondContact O-N 3.45Å; Y17-F21 AromaticContact CD2-CD2 3.65Å; Y17-F21 HydrophobicContact CD2-CD2 3.65Å; Y17-F21 HydrophobicContact CD2-CE2 4.18Å; Y17-F21 HydrophobicContact CD2-CG 4.38Å; Y17-F21 HydrophobicContact CE2-CB 4.38Å; Y17-F21 AromaticContact CE2-CD2 3.86Å; Y17-F21 HydrophobicContact CE2-CD2 3.86Å; Y17-F21 HydrophobicContact CE2-CE2 4.45Å; Y17-F21 HydrophobicContact CE2-CG 4.18Å; Y17-F21 HydrophobicContact CG-CD2 4.24Å; Y17-F21 WeakPolarHBondContact O-CB 3.45Å; Y17-F21 PolarHBondContact O-N 3.28Å; Y17-M22 HydrophobicContact CE1-CE 4.31Å
18	Q	54.1	Low	50.5	Low	122 Å²	122	97.5 Å²	97.5	57%	0.57	47%	0.471	S	S	*	.	I	π-helix	trans	-62.8	-44.1	175.6	-77	-176	-2.6	0	0	112.2	E14 S15 W16 M22 E23	E14-Q18 WeakPolarHBondContact O-CB 3.36Å; E14-Q18 WeakPolarHBondContact O-CG 3.43Å; E14-Q18 PolarHBondContact O-N 2.91Å; S15-Q18 PolarHBondContact O-N 3.28Å; W16-Q18 VanDerWaalsContact C-N 3.34Å; W16-Q18 PolarHBondContact O-N 3.48Å; Q18-M22 HydrophobicContact CB-CB 4.46Å; Q18-M22 HydrophobicContact CG-CG 4.47Å; Q18-M22 WeakPolarHBondContact O-CA 3.32Å; Q18-M22 WeakPolarHBondContact O-CB 3.4Å; Q18-M22 PolarHBondContact O-N 2.93Å; Q18-E23 PolarHBondContact O-N 3.05Å
19	Q	52.6	Low	49.5	Very low	115 Å²	115	92.9 Å²	92.9	54%	0.537	46%	0.459	S	S	.	.	I	π-helix	trans	-66.8	-37.5	179.2	-73.1	176.7	9	0	0	112.9	S15 W16	S15-Q19 WeakPolarHBondContact O-CG 3.49Å; S15-Q19 PolarHBondContact O-N 3.4Å; W16-Q19 PolarHBondContact O-N 2.92Å
20	C	48.8	Very low	49.1	Very low	56 Å²	56	92.9 Å²	92.9	38%	0.378	47%	0.466	S	S	.	.	I	π-helix	trans	-82.8	-35.4	-176.6	-70.6	0	0	0	0	113.4	W16 Y17 S24	W16-C20 PolarHBondContact NE1-SG 2.96Å; W16-C20 WeakPolarHBondContact O-CB 3.44Å; W16-C20 PolarHBondContact O-N 3.28Å; W16-C20 PolarHBondContact O-SG 2.9Å; Y17-C20 PolarHBondContact O-N 3.45Å; C20-S24 PolarHBondContact O-OG 2.88Å
21	F	46.8	Very low	48.7	Very low	94 Å²	94	98.4 Å²	98.4	41%	0.412	49%	0.491	S	S	.	.	I	π-helix	trans	-119.7	-32.2	-168.8	-61.9	-82.5	0	0	0	114.3	W16 Y17 S24 L25	W16-F21 AromaticContact CH2-CE2 3.92Å; W16-F21 HydrophobicContact CH2-CE2 3.92Å; W16-F21 HydrophobicContact CZ3-CE2 4.01Å; Y17-F21 AromaticContact CD2-CD2 3.65Å; Y17-F21 HydrophobicContact CD2-CD2 3.65Å; Y17-F21 HydrophobicContact CD2-CE2 4.18Å; Y17-F21 HydrophobicContact CD2-CG 4.38Å; Y17-F21 HydrophobicContact CE2-CB 4.38Å; Y17-F21 AromaticContact CE2-CD2 3.86Å; Y17-F21 HydrophobicContact CE2-CD2 3.86Å; Y17-F21 HydrophobicContact CE2-CE2 4.45Å; Y17-F21 HydrophobicContact CE2-CG 4.18Å; Y17-F21 HydrophobicContact CG-CD2 4.24Å; Y17-F21 WeakPolarHBondContact O-CB 3.45Å; Y17-F21 PolarHBondContact O-N 3.28Å; F21-S24 WeakPolarHBondContact CA-OG 3.48Å; F21-S24 PolarHBondContact O-OG 3.2Å; F21-S24 VanDerWaalsContact O-OG 3.12Å; F21-L25 VanDerWaalsContact O-CD1 3.31Å; F21-L25 WeakPolarHBondContact O-CD1 3.4Å; F21-L25 WeakPolarHBondContact O-CG 3.36Å; F21-L25 PolarHBondContact O-N 3.45Å
22	M	49.5	Very low	48	Very low	79 Å²	79	96.3 Å²	96.3	39%	0.389	48%	0.483	S	S	.	.	I	π-helix	trans	-87.6	-35.2	-179.7	-70.4	-78.2	173.9	0	0	112.4	Y17 Q18 S24 L25 N26	Y17-M22 HydrophobicContact CE1-CE 4.31Å; Q18-M22 HydrophobicContact CB-CB 4.46Å; Q18-M22 HydrophobicContact CG-CG 4.47Å; Q18-M22 WeakPolarHBondContact O-CA 3.32Å; Q18-M22 WeakPolarHBondContact O-CB 3.4Å; Q18-M22 PolarHBondContact O-N 2.93Å; M22-S24 PolarHBondContact O-N 3.37Å; M22-L25 PolarHBondContact O-N 3.45Å; M22-L25 HydrophobicContact SD-CD1 4.26Å; M22-N26 WeakPolarHBondContact O-CB 3.43Å; M22-N26 PolarHBondContact O-N 3.44Å; M22-N26 PolarHBondContact O-ND2 3.4Å
23	E	43.9	Very low	47.3	Very low	90 Å²	90	97.8 Å²	97.8	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-62.9	-30.8	171.6	-80.6	-169.2	178.2	0	0	112.2	Q18 Q27 K51	Q18-E23 PolarHBondContact O-N 3.05Å; E23-Q27 WeakPolarHBondContact O-CG 3.3Å; E23-K51 IonicContact OE2-NZ 3.83Å; E23-K51 PolarHBondContact OE2-NZ 2.73Å
24	S	40	Very low	46.7	Very low	59 Å²	59	102.1 Å²	102.1	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-80.1	-24.9	176.3	36.6	0	0	0	0	113.1	C20 F21 M22	C20-S24 PolarHBondContact O-OG 2.88Å; F21-S24 WeakPolarHBondContact CA-OG 3.48Å; F21-S24 PolarHBondContact O-OG 3.2Å; F21-S24 VanDerWaalsContact O-OG 3.12Å; M22-S24 PolarHBondContact O-N 3.37Å
25	L	35.5	Very low	45.9	Very low	108 Å²	108	105.1 Å²	105.1	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-77.9	-37.1	170.8	-81.7	161.6	0	0	0	112.4	F21 M22 Q27 N28	F21-L25 VanDerWaalsContact O-CD1 3.31Å; F21-L25 WeakPolarHBondContact O-CD1 3.4Å; F21-L25 WeakPolarHBondContact O-CG 3.36Å; F21-L25 PolarHBondContact O-N 3.45Å; M22-L25 PolarHBondContact O-N 3.45Å; M22-L25 HydrophobicContact SD-CD1 4.26Å; L25-Q27 VanDerWaalsContact C-N 3.28Å; L25-Q27 PolarHBondContact O-N 3.49Å; L25-N28 PolarHBondContact O-N 3.03Å
26	N	39.3	Very low	45	Very low	70 Å²	70	110.3 Å²	110.3	37%	0.374	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-75.6	-9.2	-178.6	-73	-17.3	0	0	0	114.4	M22 N28	M22-N26 WeakPolarHBondContact O-CB 3.43Å; M22-N26 PolarHBondContact O-N 3.44Å; M22-N26 PolarHBondContact O-ND2 3.4Å; N26-N28 PolarHBondContact O-N 3.5Å
27	Q	41.9	Very low	43.9	Very low	158 Å²	158	113.2 Å²	113.2	74%	0.738	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-76.6	-10.8	173.2	-77.9	-177.2	4.7	0	0	113.7	E23 L25	E23-Q27 WeakPolarHBondContact O-CG 3.3Å; L25-Q27 VanDerWaalsContact C-N 3.28Å; L25-Q27 PolarHBondContact O-N 3.49Å
28	N	40.4	Very low	43.3	Very low	138 Å²	138	116.5 Å²	116.5	74%	0.738	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-102.3	4.8	-178.9	-66.5	-40.2	0	0	0	113.8	L25 N26	L25-N28 PolarHBondContact O-N 3.03Å; N26-N28 PolarHBondContact O-N 3.5Å
29	D	36.2	Very low	42.7	Very low	68 Å²	68	115.7 Å²	115.7	36%	0.364	61%	0.607	S	S	.	*			trans	-123.4	98.1	-178.9	-157.6	-16.4	0	0	0	111.3	E31	D29-E31 PolarHBondContact O-N 3.03Å; D29-E31 VanDerWaalsContact O-N 3.11Å; D29-E31 PolarHBondContact OD1-N 3.44Å
30	P	44.4	Very low	41.7	Very low	117 Å²	117	119.6 Å²	119.6	76%	0.76	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-16.5	178.5	-20.5	31.5	0	0	0	113.8
31	E	46.6	Very low	41.2	Very low	164 Å²	164	123.3 Å²	123.3	77%	0.766	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-12.9	-171.4	-66.3	-167.8	156.3	0	0	114.2	D29	D29-E31 PolarHBondContact O-N 3.03Å; D29-E31 VanDerWaalsContact O-N 3.11Å; D29-E31 PolarHBondContact OD1-N 3.44Å
32	L	44.5	Very low	40.8	Very low	88 Å²	88	126.5 Å²	126.5	46%	0.461	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-82.6	-12.1	-178.3	-132	96.6	0	0	0	114.2	N34	L32-N34 VanDerWaalsContact C-N 3.33Å; L32-N34 PolarHBondContact O-N 3.43Å
33	H	45.3	Very low	39.9	Very low	135 Å²	135	130.5 Å²	130.5	63%	0.625	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-77.4	-9	-172.4	-96.6	-60.2	0	0	0	115.6
34	N	41.4	Very low	39.8	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-94.4	-7	-173.2	-76.5	-26.3	0	0	0	115.5	L32	L32-N34 VanDerWaalsContact C-N 3.33Å; L32-N34 PolarHBondContact O-N 3.43Å
35	N	40.7	Very low	39.5	Very low	146 Å²	146	136.6 Å²	136.6	78%	0.781	72%	0.723	S	S	*	*	S	Bend	trans	-116.6	5.5	-168.2	-74.3	-29.4	0	0	0	116.8
36	Q	40.8	Very low	40	Very low	162 Å²	162	136.9 Å²	136.9	76%	0.757	72%	0.724	S	S	*	*			trans	-131.5	12.3	-175.4	-81.9	-173.9	-15.7	0	0	117.1	N38	Q36-N38 VanDerWaalsContact C-N 3.27Å; Q36-N38 PolarHBondContact O-N 3.37Å
37	L	38.7	Very low	40.1	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	73%	0.731	S	S	*	*			trans	-79	71.5	172.5	-93.3	150.6	0	0	0	111.7
38	N	37.2	Very low	40.4	Very low	172 Å²	172	139.3 Å²	139.3	92%	0.92	73%	0.734	S	S	*	*			trans	-143.4	22.5	166.6	-102.7	-15.4	0	0	0	114.4	Q36	Q36-N38 VanDerWaalsContact C-N 3.27Å; Q36-N38 PolarHBondContact O-N 3.37Å
39	S	41.6	Very low	40.5	Very low	106 Å²	106	138.9 Å²	138.9	74%	0.741	73%	0.731	S	S	*	*			trans	-113.2	90.2	167.4	48.6	0	0	0	0	110
40	K	32.1	Very low	41	Very low	197 Å²	197	140.5 Å²	140.5	86%	0.857	74%	0.74	S	S	*	*			trans	-49.5	144.9	156.1	-73.6	171.6	174.9	174.2	0	108.1
41	T	37.9	Very low	40.8	Very low	134 Å²	134	140.6 Å²	140.6	82%	0.822	73%	0.728	S	S	*	*			trans	100.8	66.9	167.4	-27.2	0	0	0	0	116.2
42	L	39.4	Very low	40.4	Very low	160 Å²	160	137.7 Å²	137.7	84%	0.838	72%	0.722	S	S	*	*			trans	-159	65.4	145.4	-110.8	142.4	0	0	0	110.2	N44	L42-N44 VanDerWaalsContact C-N 3.29Å; L42-N44 PolarHBondContact O-N 3.22Å
43	N	30.3	Very low	40.2	Very low	163 Å²	163	137.3 Å²	137.3	87%	0.872	72%	0.723	S	S	*	*			trans	-70.3	90.1	161	-79.6	-15.8	0	0	0	107.8
44	N	41	Very low	40.1	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	73%	0.726	S	S	*	*			trans	-143.3	110.8	150.3	-93.1	-26.3	0	0	0	107.8	L42 I46	L42-N44 VanDerWaalsContact C-N 3.29Å; L42-N44 PolarHBondContact O-N 3.22Å; N44-I46 PolarHBondContact O-N 2.89Å
45	T	35.4	Very low	39.9	Very low	147 Å²	147	134.8 Å²	134.8	90%	0.902	73%	0.725	S	S	*	*			trans	-58.5	78.5	175.9	-39.6	0	0	0	0	109.6	N47	T45-N47 VanDerWaalsContact C-N 3.3Å; T45-N47 PolarHBondContact O-N 2.97Å
46	I	44.9	Very low	39.8	Very low	113 Å²	113	134 Å²	134	58%	0.579	72%	0.721	S	S	*	*			trans	-75.7	93.7	174.2	-63.5	174.6	0	0	0	107	N44 K48 K51	N44-I46 PolarHBondContact O-N 2.89Å; I46-K48 PolarHBondContact O-N 3.47Å; I46-K48 VanDerWaalsContact O-N 3.16Å; I46-K51 HydrophobicContact CG2-CG 4.15Å
47	N	42.4	Very low	40	Very low	97 Å²	97	132.4 Å²	132.4	52%	0.519	72%	0.717	S	S	.	*			trans	-38.9	115	167.8	-168.1	-7.8	0	0	0	109.9	T45 N49 N50	T45-N47 VanDerWaalsContact C-N 3.3Å; T45-N47 PolarHBondContact O-N 2.97Å; N47-N49 PolarHBondContact O-N 2.93Å; N47-N50 PolarHBondContact O-N 2.93Å
48	K	46.9	Very low	40.1	Very low	183 Å²	183	132.4 Å²	132.4	80%	0.796	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-20.3	-175.6	-79.2	-179	174.2	-179.7	0	113.2	I46	I46-K48 PolarHBondContact O-N 3.47Å; I46-K48 VanDerWaalsContact O-N 3.16Å
49	N	43.6	Very low	40.1	Very low	128 Å²	128	131.5 Å²	131.5	68%	0.684	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-12	178.2	-65.5	-8.9	0	0	0	114.4	N47 T53	N47-N49 PolarHBondContact O-N 2.93Å; N49-T53 PolarHBondContact O-OG1 2.94Å
50	N	45.5	Very low	39.9	Very low	102 Å²	102	131.8 Å²	131.8	55%	0.545	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.5	-17.7	175.3	-94.3	1.7	0	0	0	113.7	N47 V52 T53	N47-N50 PolarHBondContact O-N 2.93Å; N50-V52 VanDerWaalsContact C-N 3.31Å; N50-V52 PolarHBondContact O-N 2.77Å; N50-T53 PolarHBondContact O-N 3.16Å
51	K	41.7	Very low	40.5	Very low	119 Å²	119	129.1 Å²	129.1	52%	0.517	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.7	-23.8	-177.2	-85.7	-165.6	172.3	-166.7	0	113.3	E23 I46	E23-K51 IonicContact OE2-NZ 3.83Å; E23-K51 PolarHBondContact OE2-NZ 2.73Å; I46-K51 HydrophobicContact CG2-CG 4.15Å
52	V	38.2	Very low	41.1	Very low	104 Å²	104	128.3 Å²	128.3	63%	0.63	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-26.1	178.4	-176.7	0	0	0	0	112	N50	N50-V52 VanDerWaalsContact C-N 3.31Å; N50-V52 PolarHBondContact O-N 2.77Å
53	T	38.9	Very low	41.2	Very low	80 Å²	80	125.8 Å²	125.8	49%	0.491	67%	0.668	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-25.8	-174.6	-32.6	0	0	0	0	113	N49 N50 C55 N56 I57	N49-T53 PolarHBondContact O-OG1 2.94Å; N50-T53 PolarHBondContact O-N 3.16Å; T53-C55 VanDerWaalsContact C-N 3.3Å; T53-C55 PolarHBondContact O-N 3.04Å; T53-N56 PolarHBondContact O-N 2.8Å; T53-I57 WeakPolarHBondContact O-CG1 3.15Å
54	V	43	Very low	42.1	Very low	111 Å²	111	124.1 Å²	124.1	67%	0.673	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-69.6	-27.3	-179.6	178.9	0	0	0	0	112.2
55	C	38.3	Very low	42.7	Very low	112 Å²	112	121.8 Å²	121.8	76%	0.757	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-84.3	-5.8	-179.9	-64.9	0	0	0	0	114.5	T53	T53-C55 VanDerWaalsContact C-N 3.3Å; T53-C55 PolarHBondContact O-N 3.04Å
56	N	38.7	Very low	43.2	Very low	129 Å²	129	122.8 Å²	122.8	69%	0.69	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-115	14.4	-172.1	-76.7	-26.6	0	0	0	114.2	T53 K58	T53-N56 PolarHBondContact O-N 2.8Å; N56-K58 PolarHBondContact O-N 2.87Å; N56-K58 VanDerWaalsContact O-N 3.12Å
57	I	45	Very low	43.6	Very low	130 Å²	130	121.7 Å²	121.7	67%	0.667	63%	0.63	S	S	*	*	S	Bend	trans	-85.3	92	-178.4	-56.8	177.5	0	0	0	110.2	T53	T53-I57 WeakPolarHBondContact O-CG1 3.15Å
58	K	39.5	Very low	44.2	Very low	162 Å²	162	122.1 Å²	122.1	70%	0.704	63%	0.63	S	S	*	*			trans	63.4	94	155	-67.9	-176.6	175.9	179.5	0	118	N56 N60	N56-K58 PolarHBondContact O-N 2.87Å; N56-K58 VanDerWaalsContact O-N 3.12Å; K58-N60 PolarHBondContact O-N 3.49Å
59	Q	37.2	Very low	44.4	Very low	154 Å²	154	119 Å²	119	72%	0.72	62%	0.619	S	S	*	*			trans	-62.9	61.6	156.7	-53.2	-169.5	-58.2	0	0	112.6	E63	Q59-E63 WeakPolarHBondContact CG-OE1 3.26Å
60	N	39.2	Very low	44.9	Very low	111 Å²	111	116.1 Å²	116.1	59%	0.594	60%	0.6	S	S	*	*			trans	-109.5	90.8	175.8	-87.5	-2.3	0	0	0	109.6	K58 D62	K58-N60 PolarHBondContact O-N 3.49Å; N60-D62 PolarHBondContact O-N 3.42Å
61	T	44.2	Very low	45.4	Very low	141 Å²	141	116.9 Å²	116.9	87%	0.865	60%	0.598	S	S	*	*	S	Bend	trans	62.2	-15.2	150.7	-6.4	0	0	0	0	119.4
62	D	49.7	Very low	46.1	Very low	118 Å²	118	116.6 Å²	116.6	63%	0.631	60%	0.599	S	S	*	*			trans	-98.1	-4	173.1	-76.1	-22.2	0	0	0	113.1	N60 N64 D65 Y66	N60-D62 PolarHBondContact O-N 3.42Å; D62-N64 PolarHBondContact O-N 3.23Å; D62-N64 VanDerWaalsContact O-N 3.1Å; D62-D65 PolarHBondContact O-N 3.49Å; D62-Y66 PolarHBondContact O-N 3.43Å
63	E	42.5	Very low	46.8	Very low	106 Å²	106	114.2 Å²	114.2	50%	0.495	59%	0.59	S	S	.	*	H	α-helix	trans	-57.4	-29.2	-178.2	-82.4	-171.9	139.6	0	0	112.7	Q59 L67	Q59-E63 WeakPolarHBondContact CG-OE1 3.26Å; E63-L67 WeakPolarHBondContact O-CB 3.3Å; E63-L67 PolarHBondContact O-N 2.97Å
64	N	47.7	Very low	47.6	Very low	129 Å²	129	113.9 Å²	113.9	69%	0.69	58%	0.583	S	S	*	*	H	α-helix	trans	-73.4	-36.6	176.9	-132.9	6.4	0	0	0	111.9	D62 M68	D62-N64 PolarHBondContact O-N 3.23Å; D62-N64 VanDerWaalsContact O-N 3.1Å; N64-M68 WeakPolarHBondContact O-CB 3.22Å; N64-M68 PolarHBondContact O-N 3.24Å
65	D	54.5	Low	48.4	Very low	82 Å²	82	114.7 Å²	114.7	44%	0.439	58%	0.58	S	S	.	*	H	α-helix	trans	-72	-41.5	176	-103.4	16.2	0	0	0	111	D62 M68 Q69	D62-D65 PolarHBondContact O-N 3.49Å; D65-M68 PolarHBondContact O-N 2.91Å; D65-M68 WeakPolarHBondContact OD1-CE 3.36Å; D65-Q69 WeakPolarHBondContact O-CB 3.49Å; D65-Q69 VanDerWaalsContact O-CG 3.26Å; D65-Q69 WeakPolarHBondContact O-CG 3.4Å; D65-Q69 PolarHBondContact O-N 2.86Å
66	Y	46.6	Very low	49.3	Very low	168 Å²	168	113.5 Å²	113.5	66%	0.659	57%	0.566	S	S	*	*	H	α-helix	trans	-67.1	-43.3	176.4	-164.2	-90.7	0	0	0	111.7	D62 M68 Q69 F70	D62-Y66 PolarHBondContact O-N 3.43Å; Y66-M68 VanDerWaalsContact C-N 3.32Å; Y66-M68 PolarHBondContact O-N 3.48Å; Y66-Q69 PolarHBondContact O-N 3.41Å; Y66-F70 VanDerWaalsContact O-CB 3.24Å; Y66-F70 WeakPolarHBondContact O-CB 3.44Å; Y66-F70 PolarHBondContact O-N 2.93Å
67	L	51.5	Low	49.8	Very low	89 Å²	89	109.4 Å²	109.4	47%	0.466	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-36.9	176.3	-175.4	65.4	0	0	0	111.8	E63 F70 K71	E63-L67 WeakPolarHBondContact O-CB 3.3Å; E63-L67 PolarHBondContact O-N 2.97Å; L67-F70 PolarHBondContact O-N 3.48Å; L67-K71 WeakPolarHBondContact O-CG 3.46Å; L67-K71 PolarHBondContact O-N 2.87Å
68	M	57	Low	50	Low	106 Å²	106	108.3 Å²	108.3	52%	0.522	53%	0.531	S	S	.	.	H	α-helix	trans	-68.3	-46.6	175.7	-179.5	169.7	42.8	0	0	111.6	N64 D65 Y66 F70 K71 Q72	N64-M68 WeakPolarHBondContact O-CB 3.22Å; N64-M68 PolarHBondContact O-N 3.24Å; D65-M68 PolarHBondContact O-N 2.91Å; D65-M68 WeakPolarHBondContact OD1-CE 3.36Å; Y66-M68 VanDerWaalsContact C-N 3.32Å; Y66-M68 PolarHBondContact O-N 3.48Å; M68-F70 VanDerWaalsContact C-N 3.27Å; M68-F70 PolarHBondContact O-N 3.49Å; M68-K71 PolarHBondContact O-N 3.37Å; M68-Q72 WeakPolarHBondContact O-CB 3.36Å; M68-Q72 PolarHBondContact O-N 2.83Å
69	Q	50.1	Low	50.8	Low	119 Å²	119	103.7 Å²	103.7	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-60.4	-38.8	173.8	-74	-179.8	53.9	0	0	111.5	D65 Y66 Q72 A73	D65-Q69 WeakPolarHBondContact O-CB 3.49Å; D65-Q69 VanDerWaalsContact O-CG 3.26Å; D65-Q69 WeakPolarHBondContact O-CG 3.4Å; D65-Q69 PolarHBondContact O-N 2.86Å; Y66-Q69 PolarHBondContact O-N 3.41Å; Q69-Q72 PolarHBondContact O-N 3.41Å; Q69-A73 WeakPolarHBondContact O-CB 3.28Å; Q69-A73 PolarHBondContact O-N 2.97Å
70	F	53.7	Low	51.6	Low	66 Å²	66	100.9 Å²	100.9	29%	0.289	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-49.6	175.3	178.5	-95.4	0	0	0	112.2	W16 Y66 L67 M68 Q72 A73 Q74	W16-F70 AromaticContact CH2-CE2 3.49Å; W16-F70 HydrophobicContact CH2-CE2 3.49Å; W16-F70 VanDerWaalsContact CH2-CE2 3.49Å; W16-F70 AromaticContact CH2-CZ 3.92Å; W16-F70 HydrophobicContact CH2-CZ 3.92Å; W16-F70 HydrophobicContact CZ2-CE2 4.42Å; W16-F70 AromaticContact CZ3-CE2 3.73Å; W16-F70 HydrophobicContact CZ3-CE2 3.73Å; W16-F70 HydrophobicContact CZ3-CZ 4.17Å; Y66-F70 VanDerWaalsContact O-CB 3.24Å; Y66-F70 WeakPolarHBondContact O-CB 3.44Å; Y66-F70 PolarHBondContact O-N 2.93Å; L67-F70 PolarHBondContact O-N 3.48Å; M68-F70 VanDerWaalsContact C-N 3.27Å; M68-F70 PolarHBondContact O-N 3.49Å; F70-Q72 VanDerWaalsContact C-N 3.3Å; F70-Q72 PolarHBondContact O-N 2.9Å; F70-A73 PolarHBondContact O-N 2.92Å; F70-Q74 WeakPolarHBondContact O-CB 3.31Å; F70-Q74 PolarHBondContact O-N 3.01Å
71	K	56.2	Low	52.1	Low	118 Å²	118	101.6 Å²	101.6	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-42.9	176.4	-79.3	-174.7	176.6	-176.1	0	111.6	L67 M68 Q74 E75	L67-K71 WeakPolarHBondContact O-CG 3.46Å; L67-K71 PolarHBondContact O-N 2.87Å; M68-K71 PolarHBondContact O-N 3.37Å; K71-Q74 WeakPolarHBondContact O-CB 3.35Å; K71-Q74 PolarHBondContact O-N 2.71Å; K71-E75 WeakPolarHBondContact O-CB 3.24Å; K71-E75 WeakPolarHBondContact O-CG 3.2Å; K71-E75 PolarHBondContact O-N 3.22Å
72	Q	57.5	Low	52.6	Low	114 Å²	114	98.7 Å²	98.7	53%	0.533	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-41.3	178.8	-166.5	175.1	10.2	0	0	112.1	M68 Q69 F70 E75 N76	M68-Q72 WeakPolarHBondContact O-CB 3.36Å; M68-Q72 PolarHBondContact O-N 2.83Å; Q69-Q72 PolarHBondContact O-N 3.41Å; F70-Q72 VanDerWaalsContact C-N 3.3Å; F70-Q72 PolarHBondContact O-N 2.9Å; Q72-E75 PolarHBondContact O-N 2.86Å; Q72-N76 WeakPolarHBondContact O-CB 3.44Å; Q72-N76 PolarHBondContact O-N 2.87Å; Q72-N76 PolarHBondContact O-ND2 2.85Å
73	A	52.6	Low	52.5	Low	53 Å²	53	98.1 Å²	98.1	44%	0.438	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-40.7	174.6	0	0	0	0	0	112	Q69 F70 N76 Y77	Q69-A73 WeakPolarHBondContact O-CB 3.28Å; Q69-A73 PolarHBondContact O-N 2.97Å; F70-A73 PolarHBondContact O-N 2.92Å; A73-N76 PolarHBondContact O-N 3.49Å; A73-Y77 WeakPolarHBondContact O-CB 3.32Å; A73-Y77 PolarHBondContact O-N 3.04Å
74	Q	55.1	Low	52.8	Low	74 Å²	74	98.3 Å²	98.3	35%	0.346	49%	0.487	S	S	.	.	H	α-helix	trans	-63	-47.9	176.1	-175.7	-179.1	-2.3	0	0	111.5	F70 K71 N76 Y77 F78	F70-Q74 WeakPolarHBondContact O-CB 3.31Å; F70-Q74 PolarHBondContact O-N 3.01Å; K71-Q74 WeakPolarHBondContact O-CB 3.35Å; K71-Q74 PolarHBondContact O-N 2.71Å; Q74-N76 PolarHBondContact O-N 3.35Å; Q74-Y77 PolarHBondContact O-N 3.12Å; Q74-F78 HydrophobicContact CG-CD2 3.76Å; Q74-F78 HydrophobicContact CG-CE2 3.49Å; Q74-F78 VanDerWaalsContact CG-CE2 3.49Å; Q74-F78 WeakPolarHBondContact O-CD2 3.37Å; Q74-F78 PolarHBondContact O-N 3.37Å
75	E	59.4	Low	53	Low	128 Å²	128	96.1 Å²	96.1	60%	0.598	47%	0.474	S	S	*	.	H	α-helix	trans	-61.7	-41.6	176.7	-75.1	176	177.7	0	0	112	K71 Q72 F78 S79	K71-E75 WeakPolarHBondContact O-CB 3.24Å; K71-E75 WeakPolarHBondContact O-CG 3.2Å; K71-E75 PolarHBondContact O-N 3.22Å; Q72-E75 PolarHBondContact O-N 2.86Å; E75-F78 PolarHBondContact O-N 2.86Å; E75-S79 VanDerWaalsContact O-CB 3.3Å; E75-S79 WeakPolarHBondContact O-CB 3.36Å; E75-S79 PolarHBondContact O-N 3.48Å; E75-S79 PolarHBondContact O-OG 3.5Å
76	N	58	Low	52.6	Low	87 Å²	87	94.8 Å²	94.8	47%	0.465	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-41.5	174.4	-74.8	-21.5	0	0	0	111.8	Q72 A73 Q74 S79 N80	Q72-N76 WeakPolarHBondContact O-CB 3.44Å; Q72-N76 PolarHBondContact O-N 2.87Å; Q72-N76 PolarHBondContact O-ND2 2.85Å; A73-N76 PolarHBondContact O-N 3.49Å; Q74-N76 PolarHBondContact O-N 3.35Å; N76-S79 PolarHBondContact O-N 2.87Å; N76-N80 VanDerWaalsContact O-CB 3.26Å; N76-N80 WeakPolarHBondContact O-CB 3.42Å; N76-N80 PolarHBondContact O-N 2.94Å; N76-N80 PolarHBondContact O-ND2 3.35Å
77	Y	49	Very low	52.3	Low	43 Å²	43	94.4 Å²	94.4	17%	0.169	47%	0.47	C	S	.	.	H	α-helix	trans	-62.2	-48.1	176.1	-179.7	-92.9	0	0	0	111.4	I10 F13 E14 A73 Q74 N80 R81	I10-Y77 HydrophobicContact CG2-CE2 4.29Å; F13-Y77 AromaticContact CD1-CD2 3.98Å; F13-Y77 HydrophobicContact CD1-CD2 3.98Å; F13-Y77 AromaticContact CD1-CE2 3.95Å; F13-Y77 HydrophobicContact CD1-CE2 3.95Å; F13-Y77 HydrophobicContact CD1-CG 4.36Å; F13-Y77 HydrophobicContact CE1-CD1 4.05Å; F13-Y77 HydrophobicContact CE1-CD2 4.14Å; F13-Y77 HydrophobicContact CE1-CE1 4.13Å; F13-Y77 HydrophobicContact CE1-CE2 4.21Å; F13-Y77 HydrophobicContact CE1-CG 4.06Å; E14-Y77 PolarHBondContact OE1-OH 3.32Å; A73-Y77 WeakPolarHBondContact O-CB 3.32Å; A73-Y77 PolarHBondContact O-N 3.04Å; Q74-Y77 PolarHBondContact O-N 3.12Å; Y77-N80 PolarHBondContact O-N 3.22Å; Y77-R81 WeakPolarHBondContact O-CB 3.28Å; Y77-R81 PolarHBondContact O-N 2.75Å; Y77-R81 PolarHBondContact OH-NH1 3.31Å
78	F	49.7	Very low	52.3	Low	107 Å²	107	94.2 Å²	94.2	47%	0.469	47%	0.467	S	S	.	.	H	α-helix	trans	-67.1	-37	178.8	-76.1	-65.4	0	0	0	112.8	Q74 E75 R81 T82	Q74-F78 HydrophobicContact CG-CD2 3.76Å; Q74-F78 HydrophobicContact CG-CE2 3.49Å; Q74-F78 VanDerWaalsContact CG-CE2 3.49Å; Q74-F78 WeakPolarHBondContact O-CD2 3.37Å; Q74-F78 PolarHBondContact O-N 3.37Å; E75-F78 PolarHBondContact O-N 2.86Å; F78-R81 PolarHBondContact O-N 3.37Å; F78-T82 VanDerWaalsContact O-CB 3.32Å; F78-T82 WeakPolarHBondContact O-CB 3.42Å; F78-T82 PolarHBondContact O-N 2.79Å; F78-T82 PolarHBondContact O-OG1 2.81Å
79	S	55	Low	52.2	Low	65 Å²	65	97.6 Å²	97.6	46%	0.455	47%	0.474	S	S	.	.	H	α-helix	trans	-64.9	-50	175.6	-59.5	0	0	0	0	110.8	E75 N76 R81 T82 D83	E75-S79 VanDerWaalsContact O-CB 3.3Å; E75-S79 WeakPolarHBondContact O-CB 3.36Å; E75-S79 PolarHBondContact O-N 3.48Å; E75-S79 PolarHBondContact O-OG 3.5Å; N76-S79 PolarHBondContact O-N 2.87Å; S79-R81 VanDerWaalsContact C-N 3.32Å; S79-R81 PolarHBondContact O-N 2.91Å; S79-T82 WeakPolarHBondContact O-CB 3.36Å; S79-T82 PolarHBondContact O-N 3.3Å; S79-T82 VanDerWaalsContact O-N 3.12Å; S79-D83 PolarHBondContact O-N 3.12Å
80	N	54	Low	52	Low	95 Å²	95	94.3 Å²	94.3	51%	0.508	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-37.8	177.4	-73.9	-24.7	0	0	0	112.3	N76 Y77 D83 L84	N76-N80 VanDerWaalsContact O-CB 3.26Å; N76-N80 WeakPolarHBondContact O-CB 3.42Å; N76-N80 PolarHBondContact O-N 2.94Å; N76-N80 PolarHBondContact O-ND2 3.35Å; Y77-N80 PolarHBondContact O-N 3.22Å; N80-D83 PolarHBondContact O-N 3.43Å; N80-L84 WeakPolarHBondContact O-CB 3.37Å; N80-L84 PolarHBondContact O-N 3.41Å
81	R	50.3	Low	52	Low	126 Å²	126	96.4 Å²	96.4	48%	0.475	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-37.9	175	-172	173.2	180	122.9	0.7	111.5	Y77 F78 S79 D83 L84 L85	Y77-R81 WeakPolarHBondContact O-CB 3.28Å; Y77-R81 PolarHBondContact O-N 2.75Å; Y77-R81 PolarHBondContact OH-NH1 3.31Å; F78-R81 PolarHBondContact O-N 3.37Å; S79-R81 VanDerWaalsContact C-N 3.32Å; S79-R81 PolarHBondContact O-N 2.91Å; R81-D83 VanDerWaalsContact C-N 3.34Å; R81-L84 PolarHBondContact O-N 2.81Å; R81-L85 HydrophobicContact CG-CD1 4.29Å; R81-L85 WeakPolarHBondContact O-CB 3.34Å; R81-L85 VanDerWaalsContact O-CG 3.28Å; R81-L85 WeakPolarHBondContact O-CG 3.43Å; R81-L85 PolarHBondContact O-N 3Å
82	T	55.2	Low	52.2	Low	80 Å²	80	94.8 Å²	94.8	49%	0.491	47%	0.473	S	S	.	.	H	α-helix	trans	-64.9	-40.2	173.8	-57.7	0	0	0	0	110.8	F78 S79 L85 S86	F78-T82 VanDerWaalsContact O-CB 3.32Å; F78-T82 WeakPolarHBondContact O-CB 3.42Å; F78-T82 PolarHBondContact O-N 2.79Å; F78-T82 PolarHBondContact O-OG1 2.81Å; S79-T82 WeakPolarHBondContact O-CB 3.36Å; S79-T82 PolarHBondContact O-N 3.3Å; S79-T82 VanDerWaalsContact O-N 3.12Å; T82-L85 PolarHBondContact O-N 2.98Å; T82-S86 WeakPolarHBondContact O-CB 3.48Å; T82-S86 PolarHBondContact O-N 2.72Å; T82-S86 PolarHBondContact O-OG 3.47Å
83	D	46.7	Very low	52.4	Low	106 Å²	106	96.2 Å²	96.2	57%	0.567	48%	0.481	S	S	*	.	H	α-helix	trans	-65.5	-40.8	173.8	-77.4	-15.1	0	0	0	111.8	S79 N80 R81 S86 Y87	S79-D83 PolarHBondContact O-N 3.12Å; N80-D83 PolarHBondContact O-N 3.43Å; R81-D83 VanDerWaalsContact C-N 3.34Å; D83-S86 PolarHBondContact O-N 2.85Å; D83-Y87 VanDerWaalsContact O-CB 3.24Å; D83-Y87 WeakPolarHBondContact O-CB 3.4Å; D83-Y87 PolarHBondContact O-N 3.48Å
84	L	50	Low	52.5	Low	109 Å²	109	97.5 Å²	97.5	57%	0.571	48%	0.484	S	S	*	.	H	α-helix	trans	-67.1	-42.2	178.3	-152.6	120.7	0	0	0	111.4	N80 R81 Y87 Q88	N80-L84 WeakPolarHBondContact O-CB 3.37Å; N80-L84 PolarHBondContact O-N 3.41Å; R81-L84 PolarHBondContact O-N 2.81Å; L84-Y87 PolarHBondContact O-N 3.34Å; L84-Q88 WeakPolarHBondContact O-CB 3.31Å; L84-Q88 PolarHBondContact O-N 2.92Å
85	L	51.7	Low	52.5	Low	83 Å²	83	97.2 Å²	97.2	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-37.9	173.4	-72.4	172.9	0	0	0	111.8	R81 T82 Q88 R89	R81-L85 HydrophobicContact CG-CD1 4.29Å; R81-L85 WeakPolarHBondContact O-CB 3.34Å; R81-L85 VanDerWaalsContact O-CG 3.28Å; R81-L85 WeakPolarHBondContact O-CG 3.43Å; R81-L85 PolarHBondContact O-N 3Å; T82-L85 PolarHBondContact O-N 2.98Å; L85-Q88 PolarHBondContact O-N 3.25Å; L85-R89 WeakPolarHBondContact O-CB 3.23Å; L85-R89 VanDerWaalsContact O-CG 3.3Å; L85-R89 WeakPolarHBondContact O-CG 3.3Å; L85-R89 PolarHBondContact O-N 3.4Å
86	S	46.4	Very low	51.8	Low	54 Å²	54	98.9 Å²	98.9	38%	0.378	49%	0.489	S	S	.	.	H	α-helix	trans	-68	-41.5	175.9	-62.2	0	0	0	0	111.3	T82 D83 R89 A90	T82-S86 WeakPolarHBondContact O-CB 3.48Å; T82-S86 PolarHBondContact O-N 2.72Å; T82-S86 PolarHBondContact O-OG 3.47Å; D83-S86 PolarHBondContact O-N 2.85Å; S86-R89 PolarHBondContact O-N 2.87Å; S86-A90 VanDerWaalsContact O-CB 3.23Å; S86-A90 WeakPolarHBondContact O-CB 3.28Å; S86-A90 PolarHBondContact O-N 3.38Å
87	Y	38.8	Very low	51.8	Low	161 Å²	161	101 Å²	101	63%	0.631	49%	0.494	S	S	*	.	H	α-helix	trans	-62.8	-42.9	172.8	178.8	-99.6	0	0	0	111.3	D83 L84 A90 K91	D83-Y87 VanDerWaalsContact O-CB 3.24Å; D83-Y87 WeakPolarHBondContact O-CB 3.4Å; D83-Y87 PolarHBondContact O-N 3.48Å; L84-Y87 PolarHBondContact O-N 3.34Å; Y87-A90 PolarHBondContact O-N 3.34Å; Y87-K91 VanDerWaalsContact O-CB 3.28Å; Y87-K91 WeakPolarHBondContact O-CB 3.26Å; Y87-K91 PolarHBondContact O-N 3.42Å
88	Q	52.8	Low	52.3	Low	84 Å²	84	103.7 Å²	103.7	39%	0.393	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-47	176.4	-171.1	61.4	35.4	0	0	111.2	L84 L85 A90 K91 D92	L84-Q88 WeakPolarHBondContact O-CB 3.31Å; L84-Q88 PolarHBondContact O-N 2.92Å; L85-Q88 PolarHBondContact O-N 3.25Å; Q88-A90 VanDerWaalsContact C-N 3.33Å; Q88-A90 PolarHBondContact O-N 2.82Å; Q88-K91 PolarHBondContact O-N 3.35Å; Q88-D92 PolarHBondContact NE2-OD1 2.71Å; Q88-D92 PolarHBondContact NE2-OD2 3.45Å; Q88-D92 WeakPolarHBondContact O-CB 3.35Å; Q88-D92 PolarHBondContact O-N 3.45Å
89	R	53.7	Low	52.3	Low	178 Å²	178	101.9 Å²	101.9	67%	0.672	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-41.1	173.8	-75.2	177.4	-173	166.3	2.4	112.2	L85 S86 D92 M93	L85-R89 WeakPolarHBondContact O-CB 3.23Å; L85-R89 VanDerWaalsContact O-CG 3.3Å; L85-R89 WeakPolarHBondContact O-CG 3.3Å; L85-R89 PolarHBondContact O-N 3.4Å; S86-R89 PolarHBondContact O-N 2.87Å; R89-D92 PolarHBondContact O-N 2.81Å; R89-M93 WeakPolarHBondContact O-CB 3.45Å; R89-M93 PolarHBondContact O-N 2.85Å
90	A	47.1	Very low	51.9	Low	50 Å²	50	104.4 Å²	104.4	41%	0.413	51%	0.506	S	S	.	.	H	α-helix	trans	-66.4	-42.4	177.1	0	0	0	0	0	111.2	S86 Y87 Q88 M93 V94	S86-A90 VanDerWaalsContact O-CB 3.23Å; S86-A90 WeakPolarHBondContact O-CB 3.28Å; S86-A90 PolarHBondContact O-N 3.38Å; Y87-A90 PolarHBondContact O-N 3.34Å; Q88-A90 VanDerWaalsContact C-N 3.33Å; Q88-A90 PolarHBondContact O-N 2.82Å; A90-M93 PolarHBondContact O-N 3.34Å; A90-V94 WeakPolarHBondContact O-CB 3.32Å; A90-V94 VanDerWaalsContact O-CG2 3.26Å; A90-V94 WeakPolarHBondContact O-CG2 3.3Å; A90-V94 PolarHBondContact O-N 2.83Å
91	K	53.8	Low	52.3	Low	109 Å²	109	104.6 Å²	104.6	47%	0.474	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-42.8	174.9	-174.4	-177.6	177.1	-173.6	0	111.4	Y87 Q88 V94 T95	Y87-K91 VanDerWaalsContact O-CB 3.28Å; Y87-K91 WeakPolarHBondContact O-CB 3.26Å; Y87-K91 PolarHBondContact O-N 3.42Å; Q88-K91 PolarHBondContact O-N 3.35Å; K91-V94 PolarHBondContact O-N 3.47Å; K91-T95 VanDerWaalsContact O-CB 3.3Å; K91-T95 WeakPolarHBondContact O-CB 3.44Å; K91-T95 PolarHBondContact O-N 3.35Å; K91-T95 PolarHBondContact O-OG1 3.46Å
92	D	59.8	Low	52.5	Low	84 Å²	84	106.3 Å²	106.3	45%	0.449	51%	0.51	S	S	.	.	H	α-helix	trans	-67.3	-39.4	176.8	-67.6	-19.4	0	0	0	110.7	Q88 R89 T95 Y96	Q88-D92 PolarHBondContact NE2-OD1 2.71Å; Q88-D92 PolarHBondContact NE2-OD2 3.45Å; Q88-D92 WeakPolarHBondContact O-CB 3.35Å; Q88-D92 PolarHBondContact O-N 3.45Å; R89-D92 PolarHBondContact O-N 2.81Å; D92-T95 PolarHBondContact O-N 2.8Å; D92-Y96 WeakPolarHBondContact O-CB 3.19Å; D92-Y96 PolarHBondContact O-N 2.9Å
93	M	60.5	Low	52.3	Low	145 Å²	145	109.5 Å²	109.5	71%	0.714	52%	0.517	S	S	*	.	H	α-helix	trans	-64.5	-43.2	172.3	-94.7	-139.9	173.7	0	0	112.9	R89 A90 Y96 K97	R89-M93 WeakPolarHBondContact O-CB 3.45Å; R89-M93 PolarHBondContact O-N 2.85Å; A90-M93 PolarHBondContact O-N 3.34Å; M93-Y96 PolarHBondContact O-N 2.87Å; M93-K97 WeakPolarHBondContact O-CB 3.46Å; M93-K97 PolarHBondContact O-N 3.22Å
94	V	55.8	Low	52.9	Low	80 Å²	80	107.8 Å²	107.8	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-64.6	-44	176.8	169.9	0	0	0	0	109.9	A90 K91 K97 Q98	A90-V94 WeakPolarHBondContact O-CB 3.32Å; A90-V94 VanDerWaalsContact O-CG2 3.26Å; A90-V94 WeakPolarHBondContact O-CG2 3.3Å; A90-V94 PolarHBondContact O-N 2.83Å; K91-V94 PolarHBondContact O-N 3.47Å; V94-K97 PolarHBondContact O-N 3.3Å; V94-Q98 HydrophobicContact CG1-CG 4.49Å; V94-Q98 WeakPolarHBondContact O-CB 3.31Å; V94-Q98 VanDerWaalsContact O-CG 3.31Å; V94-Q98 WeakPolarHBondContact O-CG 3.3Å; V94-Q98 PolarHBondContact O-N 3.11Å
95	T	55.2	Low	53.6	Low	67 Å²	67	108.7 Å²	108.7	41%	0.411	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-47.1	177	-54.6	0	0	0	0	110.6	K91 D92 K97 Q98 V99	K91-T95 VanDerWaalsContact O-CB 3.3Å; K91-T95 WeakPolarHBondContact O-CB 3.44Å; K91-T95 PolarHBondContact O-N 3.35Å; K91-T95 PolarHBondContact O-OG1 3.46Å; D92-T95 PolarHBondContact O-N 2.8Å; T95-K97 PolarHBondContact O-N 3.45Å; T95-Q98 PolarHBondContact O-N 2.87Å; T95-V99 HydrophobicContact CG2-CG2 4.47Å; T95-V99 WeakPolarHBondContact O-CB 3.41Å; T95-V99 VanDerWaalsContact O-CG2 3.3Å; T95-V99 WeakPolarHBondContact O-CG2 3.21Å; T95-V99 PolarHBondContact O-N 2.79Å
96	Y	43.8	Very low	53.7	Low	163 Å²	163	109.8 Å²	109.8	64%	0.639	51%	0.513	S	S	*	.	H	α-helix	trans	-58.3	-46.9	175	179.5	-92.6	0	0	0	111.3	D92 M93 Q98 V99 Y100	D92-Y96 WeakPolarHBondContact O-CB 3.19Å; D92-Y96 PolarHBondContact O-N 2.9Å; M93-Y96 PolarHBondContact O-N 2.87Å; Y96-Q98 PolarHBondContact O-N 3.31Å; Y96-V99 PolarHBondContact O-N 2.77Å; Y96-Y100 WeakPolarHBondContact O-CB 3.35Å; Y96-Y100 PolarHBondContact O-N 3.43Å
97	K	58.7	Low	54.1	Low	133 Å²	133	112.6 Å²	112.6	58%	0.578	52%	0.524	S	S	*	.	H	α-helix	trans	-62.1	-42.3	178.2	-171.1	175.6	-177.4	177.8	0	111.6	M93 V94 T95 Q101	M93-K97 WeakPolarHBondContact O-CB 3.46Å; M93-K97 PolarHBondContact O-N 3.22Å; V94-K97 PolarHBondContact O-N 3.3Å; T95-K97 PolarHBondContact O-N 3.45Å; K97-Q101 VanDerWaalsContact O-CB 3.3Å; K97-Q101 WeakPolarHBondContact O-CB 3.3Å; K97-Q101 WeakPolarHBondContact O-CG 3.49Å; K97-Q101 PolarHBondContact O-N 3.28Å
98	Q	59.3	Low	54.9	Low	98 Å²	98	111.4 Å²	111.4	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-44.7	175.7	-74.7	179.9	3.3	0	0	112.1	V94 T95 Y96 Q101 R102	V94-Q98 HydrophobicContact CG1-CG 4.49Å; V94-Q98 WeakPolarHBondContact O-CB 3.31Å; V94-Q98 VanDerWaalsContact O-CG 3.31Å; V94-Q98 WeakPolarHBondContact O-CG 3.3Å; V94-Q98 PolarHBondContact O-N 3.11Å; T95-Q98 PolarHBondContact O-N 2.87Å; Y96-Q98 PolarHBondContact O-N 3.31Å; Q98-Q101 PolarHBondContact O-N 2.87Å; Q98-R102 WeakPolarHBondContact O-CB 3.21Å; Q98-R102 WeakPolarHBondContact O-CG 3.48Å; Q98-R102 PolarHBondContact O-N 3.45Å
99	V	49	Very low	55.1	Low	70 Å²	70	114.5 Å²	114.5	42%	0.424	53%	0.534	S	S	.	.	H	α-helix	trans	-63.4	-44.4	176.7	171.2	0	0	0	0	110.7	T95 Y96 R102 K103	T95-V99 HydrophobicContact CG2-CG2 4.47Å; T95-V99 WeakPolarHBondContact O-CB 3.41Å; T95-V99 VanDerWaalsContact O-CG2 3.3Å; T95-V99 WeakPolarHBondContact O-CG2 3.21Å; T95-V99 PolarHBondContact O-N 2.79Å; Y96-V99 PolarHBondContact O-N 2.77Å; V99-R102 PolarHBondContact O-N 3.27Å; V99-K103 WeakPolarHBondContact O-CG 3.15Å; V99-K103 PolarHBondContact O-N 2.88Å
100	Y	47.7	Very low	54.9	Low	118 Å²	118	111.7 Å²	111.7	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-62.3	-45.6	177	-175.2	-93.7	0	0	0	111.5	Y96 R102 K103 Q104	Y96-Y100 WeakPolarHBondContact O-CB 3.35Å; Y96-Y100 PolarHBondContact O-N 3.43Å; Y100-R102 PolarHBondContact O-N 2.87Å; Y100-K103 PolarHBondContact O-N 3.36Å; Y100-Q104 HydrophobicContact CD1-CG 4.07Å; Y100-Q104 HydrophobicContact CE1-CG 3.65Å; Y100-Q104 WeakPolarHBondContact O-CB 3.33Å; Y100-Q104 WeakPolarHBondContact O-CG 3.33Å; Y100-Q104 PolarHBondContact O-N 3.49Å; Y100-Q104 PolarHBondContact OH-NE2 3.35Å
101	Q	62.5	Low	55.1	Low	98 Å²	98	113.7 Å²	113.7	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-42.1	175.2	-77	176.8	-14.4	0	0	112.3	K97 Q98 Q104 Q105	K97-Q101 VanDerWaalsContact O-CB 3.3Å; K97-Q101 WeakPolarHBondContact O-CB 3.3Å; K97-Q101 WeakPolarHBondContact O-CG 3.49Å; K97-Q101 PolarHBondContact O-N 3.28Å; Q98-Q101 PolarHBondContact O-N 2.87Å; Q101-Q104 WeakPolarHBondContact O-CB 3.47Å; Q101-Q104 PolarHBondContact O-N 3.34Å; Q101-Q105 WeakPolarHBondContact O-CB 3.46Å; Q101-Q105 WeakPolarHBondContact O-CG 3.37Å; Q101-Q105 PolarHBondContact O-N 2.86Å
102	R	53.8	Low	55.1	Low	162 Å²	162	117.1 Å²	117.1	61%	0.611	54%	0.537	S	S	*	.	H	α-helix	trans	-62.4	-43.8	174	-76.1	179.1	-177.9	175	2.5	111.6	Q98 V99 Y100 Q105 N106	Q98-R102 WeakPolarHBondContact O-CB 3.21Å; Q98-R102 WeakPolarHBondContact O-CG 3.48Å; Q98-R102 PolarHBondContact O-N 3.45Å; V99-R102 PolarHBondContact O-N 3.27Å; Y100-R102 PolarHBondContact O-N 2.87Å; R102-Q105 PolarHBondContact O-N 3.45Å; R102-N106 WeakPolarHBondContact O-CB 3.41Å; R102-N106 VanDerWaalsContact O-CG 3.22Å; R102-N106 PolarHBondContact O-N 3.48Å; R102-N106 PolarHBondContact O-ND2 2.86Å
103	K	52.1	Low	54.6	Low	147 Å²	147	116.5 Å²	116.5	64%	0.639	54%	0.537	S	S	*	.	H	α-helix	trans	-61	-44.7	174.8	-77.3	-172.3	176.2	-173.5	0	111.7	V99 Y100 N106 L107	V99-K103 WeakPolarHBondContact O-CG 3.15Å; V99-K103 PolarHBondContact O-N 2.88Å; Y100-K103 PolarHBondContact O-N 3.36Å; K103-N106 PolarHBondContact O-N 3.07Å; K103-L107 WeakPolarHBondContact O-CB 3.45Å; K103-L107 PolarHBondContact O-N 2.94Å
104	Q	59.4	Low	53.8	Low	71 Å²	71	112.2 Å²	112.2	33%	0.332	52%	0.517	S	S	.	.	H	α-helix	trans	-59.9	-45	174.7	-84.2	-95.3	-8.6	0	0	112.5	Y100 Q101 L107 K108	Y100-Q104 HydrophobicContact CD1-CG 4.07Å; Y100-Q104 HydrophobicContact CE1-CG 3.65Å; Y100-Q104 WeakPolarHBondContact O-CB 3.33Å; Y100-Q104 WeakPolarHBondContact O-CG 3.33Å; Y100-Q104 PolarHBondContact O-N 3.49Å; Y100-Q104 PolarHBondContact OH-NE2 3.35Å; Q101-Q104 WeakPolarHBondContact O-CB 3.47Å; Q101-Q104 PolarHBondContact O-N 3.34Å; Q104-L107 PolarHBondContact O-N 3.31Å; Q104-K108 WeakPolarHBondContact O-CG 3.33Å; Q104-K108 PolarHBondContact O-N 2.81Å
105	Q	63.4	Low	53.4	Low	128 Å²	128	115.4 Å²	115.4	60%	0.598	52%	0.524	S	S	*	.	H	α-helix	trans	-65.2	-43.3	176.4	-74.3	175.7	-6.9	0	0	111.8	Q101 R102 K108 K109	Q101-Q105 WeakPolarHBondContact O-CB 3.46Å; Q101-Q105 WeakPolarHBondContact O-CG 3.37Å; Q101-Q105 PolarHBondContact O-N 2.86Å; R102-Q105 PolarHBondContact O-N 3.45Å; Q105-K108 PolarHBondContact O-N 3.42Å; Q105-K109 WeakPolarHBondContact O-CB 3.37Å; Q105-K109 PolarHBondContact O-N 2.96Å
106	N	55.1	Low	52.9	Low	105 Å²	105	120.7 Å²	120.7	56%	0.561	54%	0.542	S	S	*	.	H	α-helix	trans	-63.3	-41.3	176.1	-74	-14.4	0	0	0	111.6	R102 K103 K109 F110	R102-N106 WeakPolarHBondContact O-CB 3.41Å; R102-N106 VanDerWaalsContact O-CG 3.22Å; R102-N106 PolarHBondContact O-N 3.48Å; R102-N106 PolarHBondContact O-ND2 2.86Å; K103-N106 PolarHBondContact O-N 3.07Å; N106-K109 PolarHBondContact O-N 3.42Å; N106-F110 WeakPolarHBondContact O-CB 3.35Å; N106-F110 PolarHBondContact O-N 2.84Å
107	L	54.2	Low	52.4	Low	114 Å²	114	115.7 Å²	115.7	60%	0.597	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-43.6	174.8	-171.8	72.6	0	0	0	111.5	K103 Q104 K109 F110 H111	K103-L107 WeakPolarHBondContact O-CB 3.45Å; K103-L107 PolarHBondContact O-N 2.94Å; Q104-L107 PolarHBondContact O-N 3.31Å; L107-K109 VanDerWaalsContact C-N 3.33Å; L107-K109 PolarHBondContact O-N 3.36Å; L107-F110 PolarHBondContact O-N 3.3Å; L107-H111 WeakPolarHBondContact O-CB 3.45Å; L107-H111 PolarHBondContact O-N 2.87Å
108	K	55.6	Low	51.6	Low	136 Å²	136	114.4 Å²	114.4	59%	0.591	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-40.7	174.2	-76.1	178.9	-177.9	-178.6	0	111.9	Q104 Q105 R112	Q104-K108 WeakPolarHBondContact O-CG 3.33Å; Q104-K108 PolarHBondContact O-N 2.81Å; Q105-K108 PolarHBondContact O-N 3.42Å; K108-R112 WeakPolarHBondContact O-CB 3.44Å; K108-R112 WeakPolarHBondContact O-CG 3.36Å; K108-R112 PolarHBondContact O-N 3.47Å
109	K	56	Low	50.6	Low	148 Å²	148	115 Å²	115	64%	0.643	55%	0.552	S	S	*	*	H	α-helix	trans	-64.6	-47.1	175.7	-168.8	178.8	-179.2	-177.3	0	110.7	Q105 N106 L107 R112 T113	Q105-K109 WeakPolarHBondContact O-CB 3.37Å; Q105-K109 PolarHBondContact O-N 2.96Å; N106-K109 PolarHBondContact O-N 3.42Å; L107-K109 VanDerWaalsContact C-N 3.33Å; L107-K109 PolarHBondContact O-N 3.36Å; K109-R112 PolarHBondContact O-N 3Å; K109-T113 PolarHBondContact O-N 2.88Å; K109-T113 PolarHBondContact O-OG1 3.35Å
110	F	50.2	Low	50.5	Low	119 Å²	119	119.6 Å²	119.6	52%	0.522	57%	0.573	S	S	.	*	H	α-helix	trans	-59.5	-47	175.9	-179.5	-106.7	0	0	0	112	N106 L107 R112 T113 L114	N106-F110 WeakPolarHBondContact O-CB 3.35Å; N106-F110 PolarHBondContact O-N 2.84Å; L107-F110 PolarHBondContact O-N 3.3Å; F110-R112 VanDerWaalsContact C-N 3.33Å; F110-R112 PolarHBondContact O-N 3.16Å; F110-T113 WeakPolarHBondContact O-CB 3.5Å; F110-T113 PolarHBondContact O-N 2.88Å; F110-T113 VanDerWaalsContact O-N 3.16Å; F110-L114 HydrophobicContact CD1-CD1 3.73Å; F110-L114 HydrophobicContact CD1-CG 4.46Å; F110-L114 HydrophobicContact CE1-CD1 3.27Å; F110-L114 HydrophobicContact CE1-CG 4.13Å; F110-L114 HydrophobicContact CE2-CD1 4.44Å; F110-L114 HydrophobicContact CE2-CG 4.5Å; F110-L114 HydrophobicContact CG-CD1 4.5Å; F110-L114 HydrophobicContact CZ-CD1 3.67Å; F110-L114 HydrophobicContact CZ-CD2 4.42Å; F110-L114 HydrophobicContact CZ-CG 4.14Å; F110-L114 PolarHBondContact O-N 3.24Å
111	H	52.2	Low	50.1	Low	93 Å²	93	116.5 Å²	116.5	43%	0.431	56%	0.563	S	S	.	*	H	α-helix	trans	-63.6	-37.4	177	-173.1	44	0	0	0	112.3	L107 L114 K115	L107-H111 WeakPolarHBondContact O-CB 3.45Å; L107-H111 PolarHBondContact O-N 2.87Å; H111-L114 PolarHBondContact O-N 2.81Å; H111-K115 WeakPolarHBondContact NE2-CE 3.45Å; H111-K115 PolarHBondContact NE2-NZ 3.05Å; H111-K115 WeakPolarHBondContact O-CB 3.43Å; H111-K115 PolarHBondContact O-N 3.34Å
112	R	52.8	Low	49.1	Very low	180 Å²	180	115.1 Å²	115.1	68%	0.679	56%	0.563	S	S	*	*	H	α-helix	trans	-64.1	-43.8	171.6	-78.9	-177.7	179.3	-171.1	-0.5	111.8	K108 K109 F110 L114 K115 F116	K108-R112 WeakPolarHBondContact O-CB 3.44Å; K108-R112 WeakPolarHBondContact O-CG 3.36Å; K108-R112 PolarHBondContact O-N 3.47Å; K109-R112 PolarHBondContact O-N 3Å; F110-R112 VanDerWaalsContact C-N 3.33Å; F110-R112 PolarHBondContact O-N 3.16Å; R112-L114 VanDerWaalsContact C-N 3.3Å; R112-L114 PolarHBondContact O-N 2.91Å; R112-K115 PolarHBondContact O-N 3.42Å; R112-F116 WeakPolarHBondContact O-CD2 3.44Å; R112-F116 PolarHBondContact O-N 3.28Å
113	T	50.4	Low	48.8	Very low	71 Å²	71	113.9 Å²	113.9	44%	0.436	57%	0.568	S	S	.	*	H	α-helix	trans	-61.4	-38.7	175.9	-54.7	0	0	0	0	111.7	K109 F110	K109-T113 PolarHBondContact O-N 2.88Å; K109-T113 PolarHBondContact O-OG1 3.35Å; F110-T113 WeakPolarHBondContact O-CB 3.5Å; F110-T113 PolarHBondContact O-N 2.88Å; F110-T113 VanDerWaalsContact O-N 3.16Å
114	L	42.1	Very low	48.6	Very low	56 Å²	56	114.9 Å²	114.9	29%	0.293	58%	0.575	S	S	.	*	H	α-helix	trans	-67	-44.2	173.9	-75.7	172.5	0	0	0	112.7	F110 H111 R112	F110-L114 HydrophobicContact CD1-CD1 3.73Å; F110-L114 HydrophobicContact CD1-CG 4.46Å; F110-L114 HydrophobicContact CE1-CD1 3.27Å; F110-L114 HydrophobicContact CE1-CG 4.13Å; F110-L114 HydrophobicContact CE2-CD1 4.44Å; F110-L114 HydrophobicContact CE2-CG 4.5Å; F110-L114 HydrophobicContact CG-CD1 4.5Å; F110-L114 HydrophobicContact CZ-CD1 3.67Å; F110-L114 HydrophobicContact CZ-CD2 4.42Å; F110-L114 HydrophobicContact CZ-CG 4.14Å; F110-L114 PolarHBondContact O-N 3.24Å; H111-L114 PolarHBondContact O-N 2.81Å; R112-L114 VanDerWaalsContact C-N 3.3Å; R112-L114 PolarHBondContact O-N 2.91Å
115	K	47.5	Very low	47.8	Very low	147 Å²	147	115.7 Å²	115.7	64%	0.639	58%	0.581	S	S	*	*	H	α-helix	trans	-71.4	-26.4	-177.7	-98.6	-177.3	171.4	168.9	0	114.6	H111 R112	H111-K115 WeakPolarHBondContact NE2-CE 3.45Å; H111-K115 PolarHBondContact NE2-NZ 3.05Å; H111-K115 WeakPolarHBondContact O-CB 3.43Å; H111-K115 PolarHBondContact O-N 3.34Å; R112-K115 PolarHBondContact O-N 3.42Å
116	F	46	Very low	46.6	Very low	178 Å²	178	113 Å²	113	78%	0.781	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	17.7	-170.2	-73	-77.7	0	0	0	115.6	R112	R112-F116 WeakPolarHBondContact O-CD2 3.44Å; R112-F116 PolarHBondContact O-N 3.28Å
117	G	33.1	Very low	46	Very low	58 Å²	58	113.4 Å²	113.4	60%	0.598	57%	0.574	S	S	*	*	S	Bend	trans	96	74.6	151.1	0	0	0	0	0	117.5
118	S	42.3	Very low	45.5	Very low	106 Å²	106	111 Å²	111	74%	0.741	57%	0.566	S	S	*	*	S	Bend	trans	-151.3	-3.4	159.5	-40.2	0	0	0	0	116.1
119	I	38.5	Very low	44.7	Very low	110 Å²	110	108.4 Å²	108.4	56%	0.564	56%	0.558	S	S	*	*			trans	-137.1	107.4	-178.3	-54.2	177.1	0	0	0	108.6	M121	I119-M121 PolarHBondContact O-N 3.43Å
120	I	45.4	Very low	44.1	Very low	167 Å²	167	107.1 Å²	107.1	86%	0.856	55%	0.553	S	S	*	*			trans	-70	106	164.7	-61	172.2	0	0	0	105.8
121	M	40.2	Very low	43.9	Very low	52 Å²	52	106.8 Å²	106.8	26%	0.256	55%	0.553	S	S	.	*			trans	-70.5	125.4	176.2	-168.5	163.9	161	0	0	108.3	I119 N123 L125 N126 L129	I119-M121 PolarHBondContact O-N 3.43Å; M121-N123 PolarHBondContact O-N 3.46Å; M121-L125 HydrophobicContact CE-CB 3.95Å; M121-L125 VanDerWaalsContact CE-O 3.31Å; M121-L125 WeakPolarHBondContact CE-O 3.41Å; M121-L125 HydrophobicContact CG-CB 4.2Å; M121-N126 HydrophobicContact CE-CB 4.41Å; M121-L129 HydrophobicContact CE-CB 4.47Å; M121-L129 HydrophobicContact CE-CD1 3.92Å
122	P	41.4	Very low	43.6	Very low	69 Å²	69	109.2 Å²	109.2	45%	0.448	56%	0.564	S	S	.	*			trans	-56.6	136	177.5	-21.6	31.2	0	0	0	109.9	E124 L125 N126	P122-E124 PolarHBondContact O-N 3.17Å; P122-L125 HydrophobicContact CB-CD1 4.45Å; P122-L125 HydrophobicContact CG-CD1 4.05Å; P122-L125 PolarHBondContact O-N 3.25Å; P122-N126 PolarHBondContact O-N 3.39Å
123	N	46.5	Very low	43.1	Very low	136 Å²	136	107.4 Å²	107.4	73%	0.727	56%	0.564	S	S	*	*	H	α-helix	trans	-52.5	-29.9	-177.4	-75.3	-23.3	0	0	0	112.9	M121 N126 N127	M121-N123 PolarHBondContact O-N 3.46Å; N123-N126 PolarHBondContact O-N 3.4Å; N123-N127 PolarHBondContact O-N 3.28Å
124	E	47.4	Very low	42.9	Very low	168 Å²	168	110.4 Å²	110.4	79%	0.785	57%	0.571	S	S	*	*	H	α-helix	trans	-66.7	-36.8	178	-66.8	165	176.1	0	0	113	P122	P122-E124 PolarHBondContact O-N 3.17Å
125	L	43.1	Very low	42.7	Very low	88 Å²	88	112.2 Å²	112.2	46%	0.461	59%	0.587	S	S	.	*	H	α-helix	trans	-77.4	-27.8	176.9	-96.7	141.4	0	0	0	112.3	M121 P122 L129	M121-L125 HydrophobicContact CE-CB 3.95Å; M121-L125 VanDerWaalsContact CE-O 3.31Å; M121-L125 WeakPolarHBondContact CE-O 3.41Å; M121-L125 HydrophobicContact CG-CB 4.2Å; P122-L125 HydrophobicContact CB-CD1 4.45Å; P122-L125 HydrophobicContact CG-CD1 4.05Å; P122-L125 PolarHBondContact O-N 3.25Å; L125-L129 HydrophobicContact CD2-CD1 3.85Å; L125-L129 PolarHBondContact O-N 3.3Å
126	N	39.1	Very low	42.5	Very low	72 Å²	72	113 Å²	113	39%	0.385	60%	0.598	S	S	.	*	H	α-helix	trans	-71.5	-31.6	180	-160.8	26.5	0	0	0	112	M121 P122 N123 F130	M121-N126 HydrophobicContact CE-CB 4.41Å; P122-N126 PolarHBondContact O-N 3.39Å; N123-N126 PolarHBondContact O-N 3.4Å; N126-F130 WeakPolarHBondContact O-CD2 3.31Å; N126-F130 WeakPolarHBondContact OD1-CE2 3.35Å
127	N	41.3	Very low	42.4	Very low	114 Å²	114	110.1 Å²	110.1	61%	0.61	60%	0.595	S	S	*	*	H	α-helix	trans	-81	-30.1	176.9	-68.8	-21.6	0	0	0	112.6	N123 E131	N123-N127 PolarHBondContact O-N 3.28Å; N127-E131 VanDerWaalsContact O-CB 3.31Å; N127-E131 WeakPolarHBondContact O-CB 3.27Å; N127-E131 VanDerWaalsContact O-CG 3.27Å; N127-E131 WeakPolarHBondContact O-CG 3.31Å; N127-E131 PolarHBondContact O-N 2.75Å
128	S	44.6	Very low	42.8	Very low	62 Å²	62	113 Å²	113	43%	0.434	60%	0.602	S	S	.	*	H	α-helix	trans	-76.3	-43.3	-178.3	170.3	0	0	0	0	113.7	F130 E132	S128-F130 VanDerWaalsContact C-N 3.35Å; S128-F130 PolarHBondContact O-N 3.18Å; S128-E132 PolarHBondContact O-N 3.42Å
129	L	38.6	Very low	42.9	Very low	82 Å²	82	115.6 Å²	115.6	43%	0.429	61%	0.607	S	S	.	*	H	α-helix	trans	-72	-24.2	-175.4	-104.5	123.9	0	0	0	114.6	M121 L125	M121-L129 HydrophobicContact CE-CB 4.47Å; M121-L129 HydrophobicContact CE-CD1 3.92Å; L125-L129 HydrophobicContact CD2-CD1 3.85Å; L125-L129 PolarHBondContact O-N 3.3Å
130	F	42.5	Very low	43.2	Very low	121 Å²	121	117.7 Å²	117.7	53%	0.531	62%	0.618	S	S	.	*	H	α-helix	trans	-100.9	-21.7	-177.9	-70.6	-75.6	0	0	0	113.5	N126 S128	N126-F130 WeakPolarHBondContact O-CD2 3.31Å; N126-F130 WeakPolarHBondContact OD1-CE2 3.35Å; S128-F130 VanDerWaalsContact C-N 3.35Å; S128-F130 PolarHBondContact O-N 3.18Å
131	E	46.3	Very low	43.2	Very low	112 Å²	112	115.4 Å²	115.4	52%	0.523	61%	0.614	S	S	.	*	H	α-helix	trans	-75.5	-35.8	169.2	-76.5	-74.9	123.6	0	0	111.5	N127 Q133 K134	N127-E131 VanDerWaalsContact O-CB 3.31Å; N127-E131 WeakPolarHBondContact O-CB 3.27Å; N127-E131 VanDerWaalsContact O-CG 3.27Å; N127-E131 WeakPolarHBondContact O-CG 3.31Å; N127-E131 PolarHBondContact O-N 2.75Å; E131-Q133 PolarHBondContact O-N 3.4Å; E131-K134 PolarHBondContact O-N 3.4Å; E131-K134 IonicContact OE1-NZ 3.85Å; E131-K134 PolarHBondContact OE1-NZ 2.92Å
132	E	45.5	Very low	43.6	Very low	144 Å²	144	121.1 Å²	121.1	67%	0.673	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-66.2	-21.4	175	-80.6	-173.9	163.2	0	0	113.7	S128 K134	S128-E132 PolarHBondContact O-N 3.42Å; E132-K134 VanDerWaalsContact C-N 3.35Å
133	Q	44.1	Very low	43.7	Very low	142 Å²	142	123.7 Å²	123.7	66%	0.664	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-81	-10.3	175.9	-74.6	-170	-0.2	0	0	114.2	E131 C135	E131-Q133 PolarHBondContact O-N 3.4Å; Q133-C135 VanDerWaalsContact C-N 3.31Å
134	K	45.3	Very low	43.5	Very low	134 Å²	134	123.1 Å²	123.1	58%	0.583	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-80.2	-15.3	173.9	-70.3	178.2	-176.7	164	0	112.9	E131 E132 N136	E131-K134 PolarHBondContact O-N 3.4Å; E131-K134 IonicContact OE1-NZ 3.85Å; E131-K134 PolarHBondContact OE1-NZ 2.92Å; E132-K134 VanDerWaalsContact C-N 3.35Å; K134-N136 PolarHBondContact O-N 3.32Å
135	C	38.4	Very low	43.3	Very low	94 Å²	94	120.6 Å²	120.6	64%	0.635	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	79.5	178.7	-68.1	0	0	0	0	110.3	Q133	Q133-C135 VanDerWaalsContact C-N 3.31Å
136	N	42.8	Very low	43.3	Very low	163 Å²	163	122.5 Å²	122.5	87%	0.872	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	176.4	9.9	153.6	-87.5	-23.6	0	0	0	114.7	K134	K134-N136 PolarHBondContact O-N 3.32Å
137	T	43.8	Very low	43.6	Very low	119 Å²	119	125.6 Å²	125.6	73%	0.73	70%	0.703	S	S	*	*			trans	-100.3	14.4	-179.5	18.6	0	0	0	0	115.5
138	T	42.7	Very low	43.7	Very low	119 Å²	119	126.4 Å²	126.4	73%	0.73	71%	0.709	S	S	*	*	S	Bend	trans	-105.1	6.5	-169.7	-20	0	0	0	0	116.4
139	D	43.2	Very low	43.7	Very low	159 Å²	159	131 Å²	131	85%	0.85	73%	0.729	S	S	*	*			trans	-136.3	56.6	179.3	-74.2	-44.6	0	0	0	113.4
140	I	44.1	Very low	44.1	Very low	154 Å²	154	134.8 Å²	134.8	79%	0.79	75%	0.752	S	S	*	*			trans	-110.4	106.5	160.9	-55	176.7	0	0	0	106.8	A142	I140-A142 PolarHBondContact O-N 2.99Å
141	P	46	Very low	44.2	Very low	119 Å²	119	135.9 Å²	135.9	77%	0.773	77%	0.77	S	S	*	*			trans	-64.6	130.9	169.1	-7.3	22.1	0	0	0	108.5
142	A	48.3	Very low	44	Very low	172 Å²	172	138.1 Å²	138.1	100%	1.421	79%	0.793	S	S	*	*			trans	-68.1	0	165	0	0	0	0	0	111.2	I140	I140-A142 PolarHBondContact O-N 2.99Å

Retrieved 142 of 142 residues in 26.6 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).