A0A077ZNT2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZNT2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 122 aa.

						>A0A077ZNT2_TRITR|A0A077ZNT2
MSPKAIRRYKKTYGLDVDSSLPDEEVIDLMVKHCLSQSEDPNEIIRDSLRILRSSTPVDSGGEEECSDINVSVLNSTPFIEIREEYRAFGATTGTVINMDQSKDRKDKFCQHSKWSSPANDL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59.6	Low	71.8	Confident	139 Å²	139	98.5 Å²	98.5	69%	0.685	46%	0.459	S	S	*	.				0	148.8	0	-171.3	179	-70.2	0	0	108.7	A5 I6 I27 M30	M1-A5 HydrophobicContact CG-CB 3.75Å; M1-A5 HydrophobicContact SD-CB 4.14Å; M1-I6 HydrophobicContact CB-CG1 4.4Å; M1-I6 HydrophobicContact CG-CG1 4.19Å; M1-I6 HydrophobicContact SD-CG1 3.91Å; M1-I27 HydrophobicContact CB-CD1 4.43Å; M1-M30 HydrophobicContact CE-CE 3.8Å; M1-M30 HydrophobicContact SD-CE 3.33Å; M1-M30 WeakPolarHBondContact SD-CE 3.5Å; M1-M30 HydrophobicContact SD-SD 4.43Å
2	S	73	Confident	72	Confident	66 Å²	66	98.8 Å²	98.8	46%	0.462	47%	0.473	S	S	.	.			trans	-74.6	145.5	178.7	71	0	0	0	0	111.6	K4 A5 I6	S2-K4 PolarHBondContact O-N 3.28Å; S2-K4 VanDerWaalsContact O-N 3.09Å; S2-A5 WeakPolarHBondContact O-CA 3.44Å; S2-A5 WeakPolarHBondContact O-CB 3.24Å; S2-A5 PolarHBondContact O-N 2.67Å; S2-A5 WeakPolarHBondContact OG-CB 3.45Å; S2-A5 PolarHBondContact OG-N 3.22Å; S2-I6 PolarHBondContact O-N 2.91Å; S2-I6 VanDerWaalsContact O-N 3.11Å
3	P	72.2	Confident	72.3	Confident	74 Å²	74	99.5 Å²	99.5	48%	0.481	47%	0.469	S	S	.	.	H	α-helix	trans	-55.8	-30.1	177.2	-28.7	35.3	0	0	0	113.7	I6 R7	P3-I6 PolarHBondContact O-N 3.29Å; P3-R7 WeakPolarHBondContact O-CG 3.4Å; P3-R7 PolarHBondContact O-N 3.32Å
4	K	75.5	Confident	72.6	Confident	141 Å²	141	97.2 Å²	97.2	61%	0.613	49%	0.485	S	S	*	.	H	α-helix	trans	-66.3	-39.4	174.2	-172.5	177.1	-178.4	177.7	0	112.1	S2 R8	S2-K4 PolarHBondContact O-N 3.28Å; S2-K4 VanDerWaalsContact O-N 3.09Å; K4-R8 WeakPolarHBondContact O-CG 3.37Å; K4-R8 PolarHBondContact O-N 3.3Å
5	A	69.3	Low	72.7	Confident	34 Å²	34	93.4 Å²	93.4	28%	0.281	47%	0.467	S	S	.	.	H	α-helix	trans	-68.2	-40.8	176.3	0	0	0	0	0	111.3	M1 S2 R8 Y9	M1-A5 HydrophobicContact CG-CB 3.75Å; M1-A5 HydrophobicContact SD-CB 4.14Å; S2-A5 WeakPolarHBondContact O-CA 3.44Å; S2-A5 WeakPolarHBondContact O-CB 3.24Å; S2-A5 PolarHBondContact O-N 2.67Å; S2-A5 WeakPolarHBondContact OG-CB 3.45Å; S2-A5 PolarHBondContact OG-N 3.22Å; A5-R8 PolarHBondContact O-N 3.3Å; A5-Y9 WeakPolarHBondContact O-CB 3.48Å; A5-Y9 PolarHBondContact O-N 3Å
6	I	69.2	Low	72.6	Confident	7 Å²	7	98.2 Å²	98.2	4%	0.036	49%	0.494	C	S	.	.	H	α-helix	trans	-58.3	-50.4	173.8	-65.6	172.5	0	0	0	110.9	M1 S2 P3 R8 Y9 K10 V26 I27 M30	M1-I6 HydrophobicContact CB-CG1 4.4Å; M1-I6 HydrophobicContact CG-CG1 4.19Å; M1-I6 HydrophobicContact SD-CG1 3.91Å; S2-I6 PolarHBondContact O-N 2.91Å; S2-I6 VanDerWaalsContact O-N 3.11Å; P3-I6 PolarHBondContact O-N 3.29Å; I6-R8 VanDerWaalsContact C-N 3.32Å; I6-R8 PolarHBondContact O-N 3.25Å; I6-Y9 PolarHBondContact O-N 3.3Å; I6-K10 WeakPolarHBondContact O-CG 3.41Å; I6-K10 PolarHBondContact O-N 3.42Å; I6-V26 HydrophobicContact CG2-CB 4.49Å; I6-V26 HydrophobicContact CG2-CG1 3.39Å; I6-I27 HydrophobicContact CD1-CD1 4.45Å; I6-I27 HydrophobicContact CD1-CG1 4.13Å; I6-M30 HydrophobicContact CB-SD 4.23Å; I6-M30 HydrophobicContact CG1-SD 4.12Å; I6-M30 HydrophobicContact CG2-SD 3.95Å
7	R	73.4	Confident	72.4	Confident	194 Å²	194	93.5 Å²	93.5	73%	0.732	47%	0.472	S	S	*	.	H	α-helix	trans	-59.8	-40.3	177.3	-72.5	179.3	-171.4	-172.9	2.5	112.7	P3 K11	P3-R7 WeakPolarHBondContact O-CG 3.4Å; P3-R7 PolarHBondContact O-N 3.32Å; R7-K11 WeakPolarHBondContact O-CB 3.42Å; R7-K11 PolarHBondContact O-N 3.2Å; R7-K11 VanDerWaalsContact O-N 3.09Å
8	R	74.1	Confident	72.5	Confident	161 Å²	161	93.2 Å²	93.2	61%	0.608	47%	0.472	S	S	*	.	H	α-helix	trans	-62.2	-47.6	174.9	-80.4	-179.1	176.1	-168.8	-2.8	110.7	K4 A5 I6 K11 T12	K4-R8 WeakPolarHBondContact O-CG 3.37Å; K4-R8 PolarHBondContact O-N 3.3Å; A5-R8 PolarHBondContact O-N 3.3Å; I6-R8 VanDerWaalsContact C-N 3.32Å; I6-R8 PolarHBondContact O-N 3.25Å; R8-K11 PolarHBondContact O-N 3.33Å; R8-T12 WeakPolarHBondContact O-CB 3.4Å; R8-T12 PolarHBondContact O-N 3.06Å; R8-T12 PolarHBondContact O-OG1 3.16Å
9	Y	70.8	Confident	72.6	Confident	31 Å²	31	94.4 Å²	94.4	12%	0.122	49%	0.489	C	S	.	.	H	α-helix	trans	-60.9	-48.4	-179.8	-168.8	-82.3	0	0	0	112	A5 I6 K11 T12 Y13 L15 M30 H33 C34	A5-Y9 WeakPolarHBondContact O-CB 3.48Å; A5-Y9 PolarHBondContact O-N 3Å; I6-Y9 PolarHBondContact O-N 3.3Å; Y9-K11 VanDerWaalsContact C-N 3.27Å; Y9-K11 PolarHBondContact O-N 3.43Å; Y9-T12 PolarHBondContact O-N 3.02Å; Y9-T12 VanDerWaalsContact O-N 3.16Å; Y9-Y13 AromaticContact CD1-CD2 3.83Å; Y9-Y13 HydrophobicContact CD1-CD2 3.83Å; Y9-Y13 AromaticContact CD2-CD2 3.69Å; Y9-Y13 HydrophobicContact CD2-CD2 3.69Å; Y9-Y13 AromaticContact CD2-CE2 3.56Å; Y9-Y13 HydrophobicContact CD2-CE2 3.56Å; Y9-Y13 AromaticContact CE1-CD2 3.68Å; Y9-Y13 HydrophobicContact CE1-CD2 3.68Å; Y9-Y13 HydrophobicContact CE1-CE2 4.32Å; Y9-Y13 HydrophobicContact CE1-CG 4.28Å; Y9-Y13 AromaticContact CE2-CD2 3.57Å; Y9-Y13 HydrophobicContact CE2-CD2 3.57Å; Y9-Y13 AromaticContact CE2-CE2 3.34Å; Y9-Y13 HydrophobicContact CE2-CE2 3.34Å; Y9-Y13 AromaticContact CG-CD2 3.82Å; Y9-Y13 HydrophobicContact CG-CD2 3.82Å; Y9-Y13 HydrophobicContact CG-CE2 4.16Å; Y9-Y13 AromaticContact CZ-CD2 3.56Å; Y9-Y13 AromaticContact CZ-CE2 3.76Å; Y9-Y13 WeakPolarHBondContact O-CD2 3.36Å; Y9-Y13 PolarHBondContact O-N 2.83Å; Y9-L15 HydrophobicContact CD1-CD1 3.96Å; Y9-L15 HydrophobicContact CE1-CD1 3.54Å; Y9-L15 HydrophobicContact CE1-CG 4.45Å; Y9-M30 HydrophobicContact CD1-CB 4.17Å; Y9-M30 HydrophobicContact CD1-CE 3.6Å; Y9-M30 HydrophobicContact CD1-CG 3.53Å; Y9-M30 HydrophobicContact CD1-SD 3.89Å; Y9-M30 HydrophobicContact CD2-CE 3.68Å; Y9-M30 HydrophobicContact CE1-CB 3.97Å; Y9-M30 HydrophobicContact CE1-CE 4.27Å; Y9-M30 HydrophobicContact CE1-CG 3.75Å; Y9-M30 HydrophobicContact CE2-CE 4.33Å; Y9-M30 HydrophobicContact CG-CE 3.26Å; Y9-M30 HydrophobicContact CG-CG 4.24Å; Y9-M30 HydrophobicContact CG-SD 4.08Å; Y9-M30 PolarHBondContact OH-O 2.91Å; Y9-H33 AromaticContact CE1-ND1 3.9Å; Y9-H33 AromaticContact CZ-ND1 3.74Å; Y9-H33 PolarHBondContact OH-ND1 2.97Å; Y9-C34 PolarHBondContact OH-N 3.4Å; Y9-C34 PolarHBondContact OH-SG 3.02Å
10	K	75	Confident	72.9	Confident	48 Å²	48	94 Å²	94	21%	0.209	50%	0.495	C	S	.	.	H	α-helix	trans	-52.8	-45.7	173.8	-69.9	-172.1	-176.5	-164.1	0	111.5	I6 G14 L15 V17 V26	I6-K10 WeakPolarHBondContact O-CG 3.41Å; I6-K10 PolarHBondContact O-N 3.42Å; K10-G14 WeakPolarHBondContact O-CA 3.46Å; K10-G14 PolarHBondContact O-N 3.16Å; K10-L15 PolarHBondContact O-N 3Å; K10-V17 HydrophobicContact CD-CB 4Å; K10-V17 HydrophobicContact CD-CG2 4.35Å; K10-V17 VanDerWaalsContact CE-CB 3.46Å; K10-V17 HydrophobicContact CG-CB 4.49Å; K10-V17 HydrophobicContact CG-CG2 4.3Å; K10-V17 VanDerWaalsContact NZ-CG1 3.28Å; K10-V17 PolarHBondContact NZ-O 2.84Å; K10-V26 VanDerWaalsContact CE-CG1 3.42Å
11	K	77.2	Confident	73.2	Confident	188 Å²	188	91.9 Å²	91.9	82%	0.817	48%	0.484	S	S	*	.	H	α-helix	trans	-67	-41.1	178.9	-173.9	178.9	-179.7	-179	0	112.9	R7 R8 Y9	R7-K11 WeakPolarHBondContact O-CB 3.42Å; R7-K11 PolarHBondContact O-N 3.2Å; R7-K11 VanDerWaalsContact O-N 3.09Å; R8-K11 PolarHBondContact O-N 3.33Å; Y9-K11 VanDerWaalsContact C-N 3.27Å; Y9-K11 PolarHBondContact O-N 3.43Å
12	T	75.2	Confident	74.3	Confident	103 Å²	103	88.6 Å²	88.6	63%	0.632	47%	0.473	S	S	*	.	H	α-helix	trans	-69.9	-44.1	-176.3	-61.4	0	0	0	0	111.8	R8 Y9	R8-T12 WeakPolarHBondContact O-CB 3.4Å; R8-T12 PolarHBondContact O-N 3.06Å; R8-T12 PolarHBondContact O-OG1 3.16Å; Y9-T12 PolarHBondContact O-N 3.02Å; Y9-T12 VanDerWaalsContact O-N 3.16Å
13	Y	75.2	Confident	74.5	Confident	108 Å²	108	89.8 Å²	89.8	42%	0.424	47%	0.474	S	S	.	.	H	α-helix	trans	-99.6	-0.3	-174.2	-64.4	-78.2	0	0	0	113.9	Y9 L15 H33	Y9-Y13 AromaticContact CD1-CD2 3.83Å; Y9-Y13 HydrophobicContact CD1-CD2 3.83Å; Y9-Y13 AromaticContact CD2-CD2 3.69Å; Y9-Y13 HydrophobicContact CD2-CD2 3.69Å; Y9-Y13 AromaticContact CD2-CE2 3.56Å; Y9-Y13 HydrophobicContact CD2-CE2 3.56Å; Y9-Y13 AromaticContact CE1-CD2 3.68Å; Y9-Y13 HydrophobicContact CE1-CD2 3.68Å; Y9-Y13 HydrophobicContact CE1-CE2 4.32Å; Y9-Y13 HydrophobicContact CE1-CG 4.28Å; Y9-Y13 AromaticContact CE2-CD2 3.57Å; Y9-Y13 HydrophobicContact CE2-CD2 3.57Å; Y9-Y13 AromaticContact CE2-CE2 3.34Å; Y9-Y13 HydrophobicContact CE2-CE2 3.34Å; Y9-Y13 AromaticContact CG-CD2 3.82Å; Y9-Y13 HydrophobicContact CG-CD2 3.82Å; Y9-Y13 HydrophobicContact CG-CE2 4.16Å; Y9-Y13 AromaticContact CZ-CD2 3.56Å; Y9-Y13 AromaticContact CZ-CE2 3.76Å; Y9-Y13 WeakPolarHBondContact O-CD2 3.36Å; Y9-Y13 PolarHBondContact O-N 2.83Å; Y13-L15 VanDerWaalsContact C-N 3.25Å; Y13-L15 PolarHBondContact O-N 2.98Å; Y13-H33 AromaticContact CD1-CE1 3.61Å; Y13-H33 AromaticContact CG-CE1 3.71Å
14	G	77.3	Confident	74.9	Confident	67 Å²	67	92.9 Å²	92.9	69%	0.691	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	30.1	178.4	0	0	0	0	0	113.5	K10 D16	K10-G14 WeakPolarHBondContact O-CA 3.46Å; K10-G14 PolarHBondContact O-N 3.16Å; G14-D16 PolarHBondContact O-N 3.01Å
15	L	72.9	Confident	75.2	Confident	40 Å²	40	90.9 Å²	90.9	21%	0.209	48%	0.475	C	S	.	.			trans	-70.6	119.3	178.9	-73.4	-175.8	0	0	0	110.7	Y9 K10 Y13 V17 M30 H33	Y9-L15 HydrophobicContact CD1-CD1 3.96Å; Y9-L15 HydrophobicContact CE1-CD1 3.54Å; Y9-L15 HydrophobicContact CE1-CG 4.45Å; K10-L15 PolarHBondContact O-N 3Å; Y13-L15 VanDerWaalsContact C-N 3.25Å; Y13-L15 PolarHBondContact O-N 2.98Å; L15-V17 VanDerWaalsContact C-N 3.31Å; L15-V17 HydrophobicContact CB-CG2 3.72Å; L15-V17 HydrophobicContact CD1-CG2 4.46Å; L15-V17 PolarHBondContact O-N 3.21Å; L15-M30 HydrophobicContact CD1-CG 4.34Å; L15-H33 HydrophobicContact CD1-CB 4Å; L15-H33 HydrophobicContact CD2-CB 4.25Å; L15-H33 VanDerWaalsContact CD2-CD2 3.48Å; L15-H33 WeakPolarHBondContact CD2-CD2 3.42Å
16	D	71.5	Confident	75.7	Confident	170 Å²	170	89.3 Å²	89.3	91%	0.909	46%	0.462	S	S	*	.			trans	-75.8	85.2	171.2	-167	18.5	0	0	0	109.3	G14	G14-D16 PolarHBondContact O-N 3.01Å
17	V	69.4	Low	76.1	Confident	18 Å²	18	90.7 Å²	90.7	11%	0.109	47%	0.469	C	S	.	.			trans	-111.9	113.9	179.7	-175.1	0	0	0	0	108.4	K10 L15 S19 L21 V26 L29	K10-V17 HydrophobicContact CD-CB 4Å; K10-V17 HydrophobicContact CD-CG2 4.35Å; K10-V17 VanDerWaalsContact CE-CB 3.46Å; K10-V17 HydrophobicContact CG-CB 4.49Å; K10-V17 HydrophobicContact CG-CG2 4.3Å; K10-V17 VanDerWaalsContact NZ-CG1 3.28Å; K10-V17 PolarHBondContact NZ-O 2.84Å; L15-V17 VanDerWaalsContact C-N 3.31Å; L15-V17 HydrophobicContact CB-CG2 3.72Å; L15-V17 HydrophobicContact CD1-CG2 4.46Å; L15-V17 PolarHBondContact O-N 3.21Å; V17-S19 PolarHBondContact O-N 3.16Å; V17-L21 HydrophobicContact CG1-CD1 3.83Å; V17-V26 HydrophobicContact CG1-CB 4.33Å; V17-V26 HydrophobicContact CG1-CG1 4.09Å; V17-V26 HydrophobicContact CG1-CG2 3.76Å; V17-L29 HydrophobicContact CG1-CD1 3.98Å; V17-L29 HydrophobicContact CG2-CD1 4.41Å
18	D	75.1	Confident	76.4	Confident	88 Å²	88	86 Å²	86	47%	0.471	46%	0.459	S	S	.	.			trans	-50.1	127.9	176.1	-175.8	-1.9	0	0	0	110.4	S20 L21	D18-S20 PolarHBondContact O-N 3.11Å; D18-S20 WeakPolarHBondContact OD1-CB 3.49Å; D18-S20 PolarHBondContact OD1-N 2.95Å; D18-S20 PolarHBondContact OD1-OG 3.45Å; D18-S20 PolarHBondContact OD2-OG 3.34Å; D18-L21 HydrophobicContact CB-CD1 4.15Å; D18-L21 HydrophobicContact CB-CG 4.07Å; D18-L21 PolarHBondContact O-N 3.41Å
19	S	73.2	Confident	76.7	Confident	116 Å²	116	81.7 Å²	81.7	81%	0.811	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.5	177.5	53.3	0	0	0	0	113.8	V17 L21	V17-S19 PolarHBondContact O-N 3.16Å; S19-L21 VanDerWaalsContact C-N 3.34Å
20	S	79.7	Confident	77	Confident	87 Å²	87	80.4 Å²	80.4	61%	0.608	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-16	176.8	78.9	0	0	0	0	113.7	D18	D18-S20 PolarHBondContact O-N 3.11Å; D18-S20 WeakPolarHBondContact OD1-CB 3.49Å; D18-S20 PolarHBondContact OD1-N 2.95Å; D18-S20 PolarHBondContact OD1-OG 3.45Å; D18-S20 PolarHBondContact OD2-OG 3.34Å
21	L	78.8	Confident	77	Confident	50 Å²	50	81.5 Å²	81.5	26%	0.262	45%	0.453	S	S	.	.	S	Bend	trans	-71.8	142.2	-176.5	-61.4	170.9	0	0	0	111.4	V17 D18 S19 E25 V26 L29	V17-L21 HydrophobicContact CG1-CD1 3.83Å; D18-L21 HydrophobicContact CB-CD1 4.15Å; D18-L21 HydrophobicContact CB-CG 4.07Å; D18-L21 PolarHBondContact O-N 3.41Å; S19-L21 VanDerWaalsContact C-N 3.34Å; L21-E25 HydrophobicContact CB-CB 4.43Å; L21-E25 VanDerWaalsContact CD2-OE2 3.24Å; L21-E25 WeakPolarHBondContact CD2-OE2 3.3Å; L21-V26 HydrophobicContact CB-CG2 4.04Å; L21-L29 HydrophobicContact CD1-CD1 4.01Å
22	P	82.5	Confident	77.1	Confident	69 Å²	69	79.1 Å²	79.1	45%	0.448	44%	0.443	S	S	.	.			trans	-64.2	149.9	172.4	28.9	-34.1	0	0	0	110.6	E24 E25 V26	P22-E24 PolarHBondContact O-N 3.47Å; P22-E25 HydrophobicContact CG-CB 4.06Å; P22-E25 HydrophobicContact CG-CG 3.74Å; P22-E25 WeakPolarHBondContact CG-OE1 3.38Å; P22-E25 PolarHBondContact O-N 2.94Å; P22-V26 PolarHBondContact O-N 3.19Å
23	D	77.2	Confident	77.2	Confident	92 Å²	92	75.7 Å²	75.7	49%	0.492	42%	0.42	S	S	.	.	H	α-helix	trans	-53.3	-33.4	-176.7	-79.4	-15.7	0	0	0	113	V26 I27	D23-V26 WeakPolarHBondContact O-CB 3.48Å; D23-V26 PolarHBondContact O-N 3.29Å; D23-I27 WeakPolarHBondContact O-CD1 3.32Å; D23-I27 VanDerWaalsContact O-CG1 3.23Å; D23-I27 WeakPolarHBondContact O-CG1 3.43Å; D23-I27 PolarHBondContact O-N 3.5Å
24	E	80.4	Confident	77.1	Confident	138 Å²	138	73.4 Å²	73.4	65%	0.645	42%	0.418	S	S	*	.	H	α-helix	trans	-63.9	-44.4	177.7	-58	-58.6	166.3	0	0	112.5	P22 V26 I27 D28	P22-E24 PolarHBondContact O-N 3.47Å; E24-V26 VanDerWaalsContact C-N 3.29Å; E24-V26 PolarHBondContact O-N 2.93Å; E24-I27 PolarHBondContact O-N 3.36Å; E24-D28 PolarHBondContact O-N 3.36Å
25	E	82.2	Confident	76.7	Confident	99 Å²	99	75.4 Å²	75.4	46%	0.463	41%	0.413	S	S	.	.	H	α-helix	trans	-67.5	-33.9	176.9	-72.4	178	-153.6	0	0	111.4	L21 P22 D28 L29	L21-E25 HydrophobicContact CB-CB 4.43Å; L21-E25 VanDerWaalsContact CD2-OE2 3.24Å; L21-E25 WeakPolarHBondContact CD2-OE2 3.3Å; P22-E25 HydrophobicContact CG-CB 4.06Å; P22-E25 HydrophobicContact CG-CG 3.74Å; P22-E25 WeakPolarHBondContact CG-OE1 3.38Å; P22-E25 PolarHBondContact O-N 2.94Å; E25-D28 PolarHBondContact O-N 3.23Å; E25-L29 WeakPolarHBondContact O-CG 3.47Å; E25-L29 PolarHBondContact O-N 3.09Å
26	V	78.8	Confident	76.8	Confident	2 Å²	2	77.6 Å²	77.6	1%	0.012	43%	0.431	C	S	.	.	H	α-helix	trans	-64.4	-43	173.2	179.7	0	0	0	0	110.8	I6 K10 V17 L21 P22 D23 E24 L29 M30	I6-V26 HydrophobicContact CG2-CB 4.49Å; I6-V26 HydrophobicContact CG2-CG1 3.39Å; K10-V26 VanDerWaalsContact CE-CG1 3.42Å; V17-V26 HydrophobicContact CG1-CB 4.33Å; V17-V26 HydrophobicContact CG1-CG1 4.09Å; V17-V26 HydrophobicContact CG1-CG2 3.76Å; L21-V26 HydrophobicContact CB-CG2 4.04Å; P22-V26 PolarHBondContact O-N 3.19Å; D23-V26 WeakPolarHBondContact O-CB 3.48Å; D23-V26 PolarHBondContact O-N 3.29Å; E24-V26 VanDerWaalsContact C-N 3.29Å; E24-V26 PolarHBondContact O-N 2.93Å; V26-L29 PolarHBondContact O-N 3.23Å; V26-M30 HydrophobicContact CG1-CG 4.49Å; V26-M30 HydrophobicContact CG1-SD 4.1Å; V26-M30 VanDerWaalsContact O-CG 3.24Å; V26-M30 WeakPolarHBondContact O-CG 3.23Å; V26-M30 PolarHBondContact O-N 2.87Å
27	I	78.1	Confident	76.7	Confident	36 Å²	36	73.4 Å²	73.4	19%	0.185	41%	0.406	C	S	.	.	H	α-helix	trans	-62.3	-45.2	176.7	-70.4	163.2	0	0	0	110.1	M1 I6 D23 E24 L29 M30 V31	M1-I27 HydrophobicContact CB-CD1 4.43Å; I6-I27 HydrophobicContact CD1-CD1 4.45Å; I6-I27 HydrophobicContact CD1-CG1 4.13Å; D23-I27 WeakPolarHBondContact O-CD1 3.32Å; D23-I27 VanDerWaalsContact O-CG1 3.23Å; D23-I27 WeakPolarHBondContact O-CG1 3.43Å; D23-I27 PolarHBondContact O-N 3.5Å; E24-I27 PolarHBondContact O-N 3.36Å; I27-L29 VanDerWaalsContact C-N 3.34Å; I27-L29 PolarHBondContact O-N 2.89Å; I27-M30 WeakPolarHBondContact O-CB 3.34Å; I27-M30 PolarHBondContact O-N 3.42Å; I27-M30 VanDerWaalsContact O-N 3.14Å; I27-V31 HydrophobicContact CG2-CG2 4.3Å; I27-V31 WeakPolarHBondContact O-CG2 3.24Å; I27-V31 PolarHBondContact O-N 2.84Å
28	D	80.2	Confident	76.3	Confident	96 Å²	96	78.1 Å²	78.1	51%	0.513	44%	0.44	S	S	.	.	H	α-helix	trans	-59.7	-42.3	177.3	-85.5	-4.7	0	0	0	112.6	E24 E25 V31 K32	E24-D28 PolarHBondContact O-N 3.36Å; E25-D28 PolarHBondContact O-N 3.23Å; D28-V31 PolarHBondContact O-N 3.41Å; D28-K32 WeakPolarHBondContact O-CB 3.4Å; D28-K32 VanDerWaalsContact O-CG 3.32Å; D28-K32 WeakPolarHBondContact O-CG 3.46Å; D28-K32 PolarHBondContact O-N 3.33Å
29	L	79.3	Confident	75.8	Confident	70 Å²	70	78.7 Å²	78.7	37%	0.366	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-42.2	174.5	-73.9	170.8	0	0	0	111.8	V17 L21 E25 V26 I27 K32 H33	V17-L29 HydrophobicContact CG1-CD1 3.98Å; V17-L29 HydrophobicContact CG2-CD1 4.41Å; L21-L29 HydrophobicContact CD1-CD1 4.01Å; E25-L29 WeakPolarHBondContact O-CG 3.47Å; E25-L29 PolarHBondContact O-N 3.09Å; V26-L29 PolarHBondContact O-N 3.23Å; I27-L29 VanDerWaalsContact C-N 3.34Å; I27-L29 PolarHBondContact O-N 2.89Å; L29-K32 PolarHBondContact O-N 3.13Å; L29-H33 WeakPolarHBondContact O-CB 3.47Å; L29-H33 PolarHBondContact O-N 2.89Å
30	M	78	Confident	75.4	Confident	4 Å²	4	76.6 Å²	76.6	2%	0.02	42%	0.42	C	S	.	.	H	α-helix	trans	-63.4	-41.9	176.3	-72.3	178	45.1	0	0	111.8	M1 I6 Y9 L15 V26 I27 H33 C34	M1-M30 HydrophobicContact CE-CE 3.8Å; M1-M30 HydrophobicContact SD-CE 3.33Å; M1-M30 WeakPolarHBondContact SD-CE 3.5Å; M1-M30 HydrophobicContact SD-SD 4.43Å; I6-M30 HydrophobicContact CB-SD 4.23Å; I6-M30 HydrophobicContact CG1-SD 4.12Å; I6-M30 HydrophobicContact CG2-SD 3.95Å; Y9-M30 HydrophobicContact CD1-CB 4.17Å; Y9-M30 HydrophobicContact CD1-CE 3.6Å; Y9-M30 HydrophobicContact CD1-CG 3.53Å; Y9-M30 HydrophobicContact CD1-SD 3.89Å; Y9-M30 HydrophobicContact CD2-CE 3.68Å; Y9-M30 HydrophobicContact CE1-CB 3.97Å; Y9-M30 HydrophobicContact CE1-CE 4.27Å; Y9-M30 HydrophobicContact CE1-CG 3.75Å; Y9-M30 HydrophobicContact CE2-CE 4.33Å; Y9-M30 HydrophobicContact CG-CE 3.26Å; Y9-M30 HydrophobicContact CG-CG 4.24Å; Y9-M30 HydrophobicContact CG-SD 4.08Å; Y9-M30 PolarHBondContact OH-O 2.91Å; L15-M30 HydrophobicContact CD1-CG 4.34Å; V26-M30 HydrophobicContact CG1-CG 4.49Å; V26-M30 HydrophobicContact CG1-SD 4.1Å; V26-M30 VanDerWaalsContact O-CG 3.24Å; V26-M30 WeakPolarHBondContact O-CG 3.23Å; V26-M30 PolarHBondContact O-N 2.87Å; I27-M30 WeakPolarHBondContact O-CB 3.34Å; I27-M30 PolarHBondContact O-N 3.42Å; I27-M30 VanDerWaalsContact O-N 3.14Å; M30-H33 PolarHBondContact O-N 3.02Å; M30-C34 PolarHBondContact O-N 2.95Å; M30-C34 PolarHBondContact O-SG 3.38Å; M30-C34 VanDerWaalsContact O-SG 3.41Å
31	V	75.8	Confident	74.6	Confident	70 Å²	70	75.4 Å²	75.4	42%	0.424	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-46.9	176.4	171.3	0	0	0	0	110.5	I27 D28 H33 C34 L35	I27-V31 HydrophobicContact CG2-CG2 4.3Å; I27-V31 WeakPolarHBondContact O-CG2 3.24Å; I27-V31 PolarHBondContact O-N 2.84Å; D28-V31 PolarHBondContact O-N 3.41Å; V31-H33 VanDerWaalsContact C-N 3.28Å; V31-H33 PolarHBondContact O-N 3.37Å; V31-C34 WeakPolarHBondContact O-CB 3.47Å; V31-C34 PolarHBondContact O-N 3.29Å; V31-L35 HydrophobicContact CG1-CD1 3.9Å; V31-L35 HydrophobicContact CG1-CG 4.38Å; V31-L35 VanDerWaalsContact O-CG 3.3Å; V31-L35 WeakPolarHBondContact O-CG 3.46Å; V31-L35 PolarHBondContact O-N 2.89Å
32	K	78	Confident	73.8	Confident	139 Å²	139	77.3 Å²	77.3	60%	0.604	42%	0.42	S	S	*	.	H	α-helix	trans	-58.8	-41	175.6	-74.8	173.1	-175.1	170.8	0	112	D28 L29 L35 S36	D28-K32 WeakPolarHBondContact O-CB 3.4Å; D28-K32 VanDerWaalsContact O-CG 3.32Å; D28-K32 WeakPolarHBondContact O-CG 3.46Å; D28-K32 PolarHBondContact O-N 3.33Å; L29-K32 PolarHBondContact O-N 3.13Å; K32-L35 PolarHBondContact O-N 3.33Å; K32-S36 WeakPolarHBondContact O-CB 3.41Å; K32-S36 PolarHBondContact O-N 3Å; K32-S36 PolarHBondContact O-OG 3.5Å
33	H	78.6	Confident	73	Confident	31 Å²	31	79.6 Å²	79.6	14%	0.144	43%	0.425	C	S	.	.	H	α-helix	trans	-65.2	-46.8	175.7	178.9	-93	0	0	0	111.8	Y9 Y13 L15 L29 M30 V31 L35 S36 Q37	Y9-H33 AromaticContact CE1-ND1 3.9Å; Y9-H33 AromaticContact CZ-ND1 3.74Å; Y9-H33 PolarHBondContact OH-ND1 2.97Å; Y13-H33 AromaticContact CD1-CE1 3.61Å; Y13-H33 AromaticContact CG-CE1 3.71Å; L15-H33 HydrophobicContact CD1-CB 4Å; L15-H33 HydrophobicContact CD2-CB 4.25Å; L15-H33 VanDerWaalsContact CD2-CD2 3.48Å; L15-H33 WeakPolarHBondContact CD2-CD2 3.42Å; L29-H33 WeakPolarHBondContact O-CB 3.47Å; L29-H33 PolarHBondContact O-N 2.89Å; M30-H33 PolarHBondContact O-N 3.02Å; V31-H33 VanDerWaalsContact C-N 3.28Å; V31-H33 PolarHBondContact O-N 3.37Å; H33-L35 VanDerWaalsContact C-N 3.27Å; H33-L35 PolarHBondContact O-N 2.91Å; H33-S36 PolarHBondContact O-N 3.2Å; H33-S36 VanDerWaalsContact O-N 3.16Å; H33-S36 PolarHBondContact O-OG 3.34Å; H33-Q37 PolarHBondContact CE1-NE2 3.39Å; H33-Q37 PolarHBondContact NE2-NE2 3.14Å; H33-Q37 WeakPolarHBondContact O-CG 3.33Å; H33-Q37 PolarHBondContact O-N 2.83Å; H33-Q37 VanDerWaalsContact O-N 3.11Å
34	C	71.5	Confident	72.6	Confident	59 Å²	59	78.5 Å²	78.5	40%	0.399	42%	0.418	S	S	.	.	H	α-helix	trans	-55.3	-44.2	173.8	-76	0	0	0	0	111.7	Y9 M30 V31 S36 Q37	Y9-C34 PolarHBondContact OH-N 3.4Å; Y9-C34 PolarHBondContact OH-SG 3.02Å; M30-C34 PolarHBondContact O-N 2.95Å; M30-C34 PolarHBondContact O-SG 3.38Å; M30-C34 VanDerWaalsContact O-SG 3.41Å; V31-C34 WeakPolarHBondContact O-CB 3.47Å; V31-C34 PolarHBondContact O-N 3.29Å; C34-S36 VanDerWaalsContact C-N 3.31Å; C34-S36 PolarHBondContact O-N 3.32Å; C34-Q37 PolarHBondContact O-N 3.46Å
35	L	69.7	Low	71.7	Confident	110 Å²	110	74.5 Å²	74.5	58%	0.576	40%	0.401	S	S	*	.	H	α-helix	trans	-73.3	-22.1	-179	-66.6	174.7	0	0	0	113.4	V31 K32 H33	V31-L35 HydrophobicContact CG1-CD1 3.9Å; V31-L35 HydrophobicContact CG1-CG 4.38Å; V31-L35 VanDerWaalsContact O-CG 3.3Å; V31-L35 WeakPolarHBondContact O-CG 3.46Å; V31-L35 PolarHBondContact O-N 2.89Å; K32-L35 PolarHBondContact O-N 3.33Å; H33-L35 VanDerWaalsContact C-N 3.27Å; H33-L35 PolarHBondContact O-N 2.91Å
36	S	75.6	Confident	70.9	Confident	85 Å²	85	77.8 Å²	77.8	59%	0.594	41%	0.409	S	S	*	.	H	α-helix	trans	-84.8	-19.7	176	73.3	0	0	0	0	113.1	K32 H33 C34 S38	K32-S36 WeakPolarHBondContact O-CB 3.41Å; K32-S36 PolarHBondContact O-N 3Å; K32-S36 PolarHBondContact O-OG 3.5Å; H33-S36 PolarHBondContact O-N 3.2Å; H33-S36 VanDerWaalsContact O-N 3.16Å; H33-S36 PolarHBondContact O-OG 3.34Å; C34-S36 VanDerWaalsContact C-N 3.31Å; C34-S36 PolarHBondContact O-N 3.32Å; S36-S38 PolarHBondContact O-N 3.23Å; S36-S38 VanDerWaalsContact O-N 3.16Å
37	Q	68.9	Low	70.3	Confident	82 Å²	82	81.3 Å²	81.3	38%	0.383	43%	0.428	S	S	.	.	S	Bend	trans	-63.3	117.4	168.6	-63	-54	-51.8	0	0	108.1	H33 C34 E39	H33-Q37 PolarHBondContact CE1-NE2 3.39Å; H33-Q37 PolarHBondContact NE2-NE2 3.14Å; H33-Q37 WeakPolarHBondContact O-CG 3.33Å; H33-Q37 PolarHBondContact O-N 2.83Å; H33-Q37 VanDerWaalsContact O-N 3.11Å; C34-Q37 PolarHBondContact O-N 3.46Å; Q37-E39 HydrophobicContact CB-CG 3.86Å; Q37-E39 PolarHBondContact O-N 2.97Å
38	S	61.4	Low	69.7	Low	118 Å²	118	82.3 Å²	82.3	83%	0.825	44%	0.438	S	S	*	.			trans	-73.8	77.4	171.4	65.4	0	0	0	0	108.2	S36	S36-S38 PolarHBondContact O-N 3.23Å; S36-S38 VanDerWaalsContact O-N 3.16Å
39	E	64	Low	68.9	Low	100 Å²	100	80.5 Å²	80.5	47%	0.467	43%	0.428	S	S	.	.			trans	-83	118.9	175.2	-63.4	-174.4	165.2	0	0	107.8	Q37 P41 I44	Q37-E39 HydrophobicContact CB-CG 3.86Å; Q37-E39 PolarHBondContact O-N 2.97Å; E39-P41 VanDerWaalsContact O-CD 3.24Å; E39-P41 WeakPolarHBondContact O-CD 3.02Å; E39-I44 HydrophobicContact CB-CD1 3.5Å; E39-I44 HydrophobicContact CB-CG1 3.62Å; E39-I44 HydrophobicContact CG-CD1 4.33Å; E39-I44 HydrophobicContact CG-CG1 4.31Å; E39-I44 WeakPolarHBondContact OE2-CD1 3.16Å; E39-I44 WeakPolarHBondContact OE2-CG1 3.44Å
40	D	65.4	Low	68.4	Low	71 Å²	71	84.7 Å²	84.7	38%	0.38	44%	0.439	S	S	.	.			trans	-63.1	118.8	163.8	179.1	-5.3	0	0	0	106.2	N42 E43 I44	D40-N42 PolarHBondContact O-N 3.4Å; D40-N42 WeakPolarHBondContact OD1-CB 3.45Å; D40-N42 PolarHBondContact OD1-N 2.85Å; D40-N42 PolarHBondContact OD1-ND2 2.88Å; D40-E43 HydrophobicContact CB-CB 4.12Å; D40-E43 HydrophobicContact CB-CG 3.92Å; D40-E43 WeakPolarHBondContact O-CA 3.4Å; D40-E43 WeakPolarHBondContact O-CB 3.49Å; D40-E43 PolarHBondContact O-N 2.96Å; D40-I44 PolarHBondContact O-N 2.92Å; D40-I44 VanDerWaalsContact O-N 3.12Å
41	P	63.1	Low	67.9	Low	63 Å²	63	89.6 Å²	89.6	41%	0.409	46%	0.464	S	S	.	.	H	α-helix	trans	-52	-30.9	178.9	-25.7	34.1	0	0	0	112.1	E39 I45	E39-P41 VanDerWaalsContact O-CD 3.24Å; E39-P41 WeakPolarHBondContact O-CD 3.02Å; P41-I45 WeakPolarHBondContact O-CB 3.35Å; P41-I45 WeakPolarHBondContact O-CD1 3.24Å; P41-I45 WeakPolarHBondContact O-CG1 3.37Å; P41-I45 PolarHBondContact O-N 3.26Å
42	N	61.7	Low	67.2	Low	89 Å²	89	91.4 Å²	91.4	48%	0.476	47%	0.471	S	S	.	.	H	α-helix	trans	-69.4	-34.1	176.4	-59.2	-66.7	0	0	0	112.9	D40 R46	D40-N42 PolarHBondContact O-N 3.4Å; D40-N42 WeakPolarHBondContact OD1-CB 3.45Å; D40-N42 PolarHBondContact OD1-N 2.85Å; D40-N42 PolarHBondContact OD1-ND2 2.88Å; N42-R46 VanDerWaalsContact O-CB 3.31Å; N42-R46 WeakPolarHBondContact O-CB 3.26Å; N42-R46 WeakPolarHBondContact O-CG 3.48Å; N42-R46 PolarHBondContact O-N 3.17Å
43	E	65.9	Low	66.4	Low	118 Å²	118	93.4 Å²	93.4	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-70.6	-43.9	175	-71.9	-172.4	163.2	0	0	110.9	D40 I45 R46 D47	D40-E43 HydrophobicContact CB-CB 4.12Å; D40-E43 HydrophobicContact CB-CG 3.92Å; D40-E43 WeakPolarHBondContact O-CA 3.4Å; D40-E43 WeakPolarHBondContact O-CB 3.49Å; D40-E43 PolarHBondContact O-N 2.96Å; E43-I45 VanDerWaalsContact C-N 3.32Å; E43-I45 PolarHBondContact O-N 3.48Å; E43-R46 PolarHBondContact O-N 3.11Å; E43-D47 WeakPolarHBondContact O-CB 3.4Å; E43-D47 PolarHBondContact O-N 3.31Å
44	I	67.2	Low	65.3	Low	68 Å²	68	96.4 Å²	96.4	35%	0.349	50%	0.499	S	S	.	.	H	α-helix	trans	-56.8	-48.6	174.4	-52.7	171.3	0	0	0	110.4	E39 D40 D47 S48	E39-I44 HydrophobicContact CB-CD1 3.5Å; E39-I44 HydrophobicContact CB-CG1 3.62Å; E39-I44 HydrophobicContact CG-CD1 4.33Å; E39-I44 HydrophobicContact CG-CG1 4.31Å; E39-I44 WeakPolarHBondContact OE2-CD1 3.16Å; E39-I44 WeakPolarHBondContact OE2-CG1 3.44Å; D40-I44 PolarHBondContact O-N 2.92Å; D40-I44 VanDerWaalsContact O-N 3.12Å; I44-D47 PolarHBondContact O-N 2.89Å; I44-S48 WeakPolarHBondContact O-CB 3.31Å; I44-S48 PolarHBondContact O-N 3.09Å; I44-S48 PolarHBondContact O-OG 3.04Å
45	I	62.9	Low	64.3	Low	55 Å²	55	97.1 Å²	97.1	28%	0.282	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-45.6	-179.4	-69.2	165.5	0	0	0	109.8	P41 E43 S48 L49 L74	P41-I45 WeakPolarHBondContact O-CB 3.35Å; P41-I45 WeakPolarHBondContact O-CD1 3.24Å; P41-I45 WeakPolarHBondContact O-CG1 3.37Å; P41-I45 PolarHBondContact O-N 3.26Å; E43-I45 VanDerWaalsContact C-N 3.32Å; E43-I45 PolarHBondContact O-N 3.48Å; I45-S48 PolarHBondContact O-N 2.78Å; I45-L49 HydrophobicContact CG2-CD1 3.8Å; I45-L49 HydrophobicContact CG2-CG 4.3Å; I45-L49 VanDerWaalsContact O-CB 3.31Å; I45-L49 WeakPolarHBondContact O-CB 3.16Å; I45-L49 WeakPolarHBondContact O-CG 3.25Å; I45-L49 PolarHBondContact O-N 3.34Å; I45-L74 HydrophobicContact CG2-CD1 4.4Å
46	R	64.7	Low	63.2	Low	168 Å²	168	96.1 Å²	96.1	63%	0.634	50%	0.503	S	S	*	.	H	α-helix	trans	-62.2	-44.5	178.2	-78.5	174.6	-170.4	-176.5	5.8	112.4	N42 E43 L49 R50	N42-R46 VanDerWaalsContact O-CB 3.31Å; N42-R46 WeakPolarHBondContact O-CB 3.26Å; N42-R46 WeakPolarHBondContact O-CG 3.48Å; N42-R46 PolarHBondContact O-N 3.17Å; E43-R46 PolarHBondContact O-N 3.11Å; R46-L49 PolarHBondContact O-N 3Å; R46-R50 WeakPolarHBondContact O-CB 3.49Å; R46-R50 PolarHBondContact O-N 3.49Å
47	D	66.3	Low	61.7	Low	76 Å²	76	97.4 Å²	97.4	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-69.5	-39.8	179.9	-80.3	-7	0	0	0	111.3	E43 I44 R50 I51	E43-D47 WeakPolarHBondContact O-CB 3.4Å; E43-D47 PolarHBondContact O-N 3.31Å; I44-D47 PolarHBondContact O-N 2.89Å; D47-R50 PolarHBondContact O-N 2.95Å; D47-R50 IonicContact OD1-CZ 3.48Å; D47-R50 IonicContact OD1-NH1 2.72Å; D47-R50 PolarHBondContact OD1-NH1 2.86Å; D47-R50 IonicContact OD1-NH2 3.78Å; D47-I51 VanDerWaalsContact O-CG1 3.26Å; D47-I51 WeakPolarHBondContact O-CG1 3.3Å; D47-I51 PolarHBondContact O-N 3.4Å
48	S	65.5	Low	60.4	Low	57 Å²	57	100.7 Å²	100.7	40%	0.399	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-45.2	172.9	-60	0	0	0	0	111.5	I44 I45 I51 L52	I44-S48 WeakPolarHBondContact O-CB 3.31Å; I44-S48 PolarHBondContact O-N 3.09Å; I44-S48 PolarHBondContact O-OG 3.04Å; I45-S48 PolarHBondContact O-N 2.78Å; S48-I51 PolarHBondContact O-N 2.97Å; S48-L52 WeakPolarHBondContact O-CB 3.2Å; S48-L52 WeakPolarHBondContact O-CG 3.33Å; S48-L52 PolarHBondContact O-N 3.12Å
49	L	64.3	Low	59.3	Low	57 Å²	57	101.3 Å²	101.3	30%	0.298	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-39	175.4	-73.8	172.4	0	0	0	112	I45 R46 R53	I45-L49 HydrophobicContact CG2-CD1 3.8Å; I45-L49 HydrophobicContact CG2-CG 4.3Å; I45-L49 VanDerWaalsContact O-CB 3.31Å; I45-L49 WeakPolarHBondContact O-CB 3.16Å; I45-L49 WeakPolarHBondContact O-CG 3.25Å; I45-L49 PolarHBondContact O-N 3.34Å; R46-L49 PolarHBondContact O-N 3Å; L49-R53 WeakPolarHBondContact O-CB 3.43Å; L49-R53 WeakPolarHBondContact O-CG 3.37Å; L49-R53 PolarHBondContact O-N 3.22Å
50	R	67.4	Low	58	Low	159 Å²	159	101.6 Å²	101.6	60%	0.6	54%	0.542	S	S	*	.	H	α-helix	trans	-63.8	-46.5	175.7	-172.9	-171.5	-65.9	134	4.2	110.9	R46 D47 R53 S54	R46-R50 WeakPolarHBondContact O-CB 3.49Å; R46-R50 PolarHBondContact O-N 3.49Å; D47-R50 PolarHBondContact O-N 2.95Å; D47-R50 IonicContact OD1-CZ 3.48Å; D47-R50 IonicContact OD1-NH1 2.72Å; D47-R50 PolarHBondContact OD1-NH1 2.86Å; D47-R50 IonicContact OD1-NH2 3.78Å; R50-R53 PolarHBondContact O-N 3.23Å; R50-S54 WeakPolarHBondContact O-CB 3.46Å; R50-S54 PolarHBondContact O-N 3.48Å; R50-S54 PolarHBondContact O-OG 3.32Å
51	I	68.2	Low	56.5	Low	107 Å²	107	102.5 Å²	102.5	55%	0.549	57%	0.568	S	S	.	*	H	α-helix	trans	-60.4	-50.6	177.8	-69.2	164.9	0	0	0	109.4	D47 S48 R53 S54 S55	D47-I51 VanDerWaalsContact O-CG1 3.26Å; D47-I51 WeakPolarHBondContact O-CG1 3.3Å; D47-I51 PolarHBondContact O-N 3.4Å; S48-I51 PolarHBondContact O-N 2.97Å; I51-R53 PolarHBondContact O-N 2.98Å; I51-S54 WeakPolarHBondContact CA-OG 3.45Å; I51-S54 CarbonylContact O-C 3.56Å; I51-S54 PolarHBondContact O-N 3.41Å; I51-S54 PolarHBondContact O-OG 3.49Å; I51-S55 WeakPolarHBondContact O-CB 3.42Å; I51-S55 PolarHBondContact O-N 2.95Å; I51-S55 PolarHBondContact O-OG 3.34Å
52	L	60.9	Low	55.2	Low	108 Å²	108	102.6 Å²	102.6	57%	0.565	58%	0.581	S	S	*	*	H	α-helix	trans	-55.4	-47.9	178.3	-77	167.4	0	0	0	112.1	S48 S54 S55 T56	S48-L52 WeakPolarHBondContact O-CB 3.2Å; S48-L52 WeakPolarHBondContact O-CG 3.33Å; S48-L52 PolarHBondContact O-N 3.12Å; L52-S54 VanDerWaalsContact C-N 3.28Å; L52-S54 PolarHBondContact O-N 2.98Å; L52-S55 WeakPolarHBondContact CA-OG 3.36Å; L52-S55 PolarHBondContact O-N 3.09Å; L52-S55 PolarHBondContact O-OG 3.17Å; L52-T56 PolarHBondContact O-N 2.72Å
53	R	60.7	Low	54	Low	181 Å²	181	107.7 Å²	107.7	68%	0.683	60%	0.602	S	S	*	*	H	α-helix	trans	-64.1	-28	175.9	-75.8	-178.4	177	-172.7	-1.5	113.8	L49 R50 I51 T56	L49-R53 WeakPolarHBondContact O-CB 3.43Å; L49-R53 WeakPolarHBondContact O-CG 3.37Å; L49-R53 PolarHBondContact O-N 3.22Å; R50-R53 PolarHBondContact O-N 3.23Å; I51-R53 PolarHBondContact O-N 2.98Å; R53-T56 PolarHBondContact O-OG1 2.96Å
54	S	55.3	Low	52.8	Low	94 Å²	94	110.8 Å²	110.8	66%	0.657	62%	0.616	S	S	*	*	H	α-helix	trans	-85.7	-22.4	177.3	71.2	0	0	0	0	113.3	R50 I51 L52	R50-S54 WeakPolarHBondContact O-CB 3.46Å; R50-S54 PolarHBondContact O-N 3.48Å; R50-S54 PolarHBondContact O-OG 3.32Å; I51-S54 WeakPolarHBondContact CA-OG 3.45Å; I51-S54 CarbonylContact O-C 3.56Å; I51-S54 PolarHBondContact O-N 3.41Å; I51-S54 PolarHBondContact O-OG 3.49Å; L52-S54 VanDerWaalsContact C-N 3.28Å; L52-S54 PolarHBondContact O-N 2.98Å
55	S	51.9	Low	51.5	Low	73 Å²	73	116.4 Å²	116.4	51%	0.51	64%	0.641	S	S	.	*	H	α-helix	trans	-93.9	-3.1	-178.7	58.6	0	0	0	0	114	I51 L52 P57	I51-S55 WeakPolarHBondContact O-CB 3.42Å; I51-S55 PolarHBondContact O-N 2.95Å; I51-S55 PolarHBondContact O-OG 3.34Å; L52-S55 WeakPolarHBondContact CA-OG 3.36Å; L52-S55 PolarHBondContact O-N 3.09Å; L52-S55 PolarHBondContact O-OG 3.17Å; S55-P57 WeakPolarHBondContact O-CD 3.19Å
56	T	46.6	Very low	50.6	Low	89 Å²	89	120 Å²	120	55%	0.546	67%	0.67	S	S	.	*	S	Bend	trans	-64.8	113.8	166.7	43.2	0	0	0	0	107.7	L52 R53 V58	L52-T56 PolarHBondContact O-N 2.72Å; R53-T56 PolarHBondContact O-OG1 2.96Å; T56-V58 PolarHBondContact O-N 2.8Å
57	P	43.2	Very low	49.4	Very low	112 Å²	112	116.8 Å²	116.8	73%	0.727	67%	0.673	S	S	*	*			trans	-60.3	117.9	175	25.4	-30.5	0	0	0	106.9	S55 D59	S55-P57 WeakPolarHBondContact O-CD 3.19Å; P57-D59 PolarHBondContact O-N 3.44Å
58	V	41.4	Very low	48.2	Very low	152 Å²	152	120.4 Å²	120.4	92%	0.921	69%	0.692	S	S	*	*			trans	-69.6	79.7	168.1	-176.1	0	0	0	0	105.6	T56	T56-V58 PolarHBondContact O-N 2.8Å
59	D	39.6	Very low	47.3	Very low	130 Å²	130	122.7 Å²	122.7	70%	0.695	70%	0.699	S	S	*	*			trans	-128.8	101.5	173.7	-154	-2.5	0	0	0	108.6	P57	P57-D59 PolarHBondContact O-N 3.44Å
60	S	37.1	Very low	46.2	Very low	106 Å²	106	125.1 Å²	125.1	74%	0.741	71%	0.712	S	S	*	*	S	Bend	trans	68.3	95.9	148.1	-58.3	0	0	0	0	119
61	G	32.4	Very low	45.1	Very low	90 Å²	90	122.4 Å²	122.4	93%	0.928	71%	0.713	S	S	*	*			trans	66.1	84.7	137.5	0	0	0	0	0	117.1
62	G	36.1	Very low	43.8	Very low	66 Å²	66	120.4 Å²	120.4	68%	0.68	71%	0.709	S	S	*	*			trans	-178.3	100	170.3	0	0	0	0	0	109.8	E64	G62-E64 VanDerWaalsContact C-N 3.34Å; G62-E64 PolarHBondContact O-N 2.83Å
63	E	35.9	Very low	43	Very low	196 Å²	196	119.6 Å²	119.6	92%	0.916	71%	0.708	S	S	*	*			trans	-63.4	84.8	173.5	51.5	-133.2	122.1	0	0	111.8
64	E	42.4	Very low	42.2	Very low	183 Å²	183	114.2 Å²	114.2	86%	0.855	69%	0.692	S	S	*	*			trans	-120.2	97.8	163.8	-70.2	-164.4	-177.2	0	0	110.1	G62 C66	G62-E64 VanDerWaalsContact C-N 3.34Å; G62-E64 PolarHBondContact O-N 2.83Å; E64-C66 PolarHBondContact O-N 3.25Å
65	E	38.6	Very low	41.7	Very low	185 Å²	185	116.2 Å²	116.2	86%	0.864	70%	0.696	S	S	*	*			trans	-54.7	102.6	171.7	-162.1	170	-152.9	0	0	109.5	S67	E65-S67 PolarHBondContact O-N 3.44Å
66	C	43.7	Very low	41.2	Very low	132 Å²	132	115.2 Å²	115.2	89%	0.892	69%	0.688	S	S	*	*			trans	-66.6	79.4	166.2	-91.5	0	0	0	0	109	E64 D68	E64-C66 PolarHBondContact O-N 3.25Å; C66-D68 PolarHBondContact O-N 2.86Å
67	S	39.6	Very low	41	Very low	99 Å²	99	115.5 Å²	115.5	69%	0.692	69%	0.69	S	S	*	*			trans	-59	121.2	168.1	39.9	0	0	0	0	109.3	E65 I69	E65-S67 PolarHBondContact O-N 3.44Å; S67-I69 PolarHBondContact O-N 3.22Å
68	D	42.3	Very low	41.3	Very low	153 Å²	153	113.6 Å²	113.6	82%	0.818	68%	0.678	S	S	*	*			trans	9.2	98.4	163.7	-60.5	-38.8	0	0	0	116.6	C66 N70	C66-D68 PolarHBondContact O-N 2.86Å; D68-N70 PolarHBondContact O-N 2.82Å
69	I	45.4	Very low	41.4	Very low	104 Å²	104	112.8 Å²	112.8	53%	0.533	66%	0.662	S	S	.	*			trans	-62.9	97.9	158.5	-60.1	171.8	0	0	0	106.5	S67 V71 L74	S67-I69 PolarHBondContact O-N 3.22Å; I69-V71 PolarHBondContact O-N 2.73Å; I69-V71 VanDerWaalsContact O-N 3.1Å; I69-L74 HydrophobicContact CG2-CD1 4.35Å
70	N	41.4	Very low	41.8	Very low	108 Å²	108	111.5 Å²	111.5	58%	0.578	66%	0.655	S	S	*	*			trans	-57.7	115.2	177.3	-151.7	-15.4	0	0	0	107.5	D68 S72 V73	D68-N70 PolarHBondContact O-N 2.82Å; N70-S72 WeakPolarHBondContact CB-OG 3.33Å; N70-S72 PolarHBondContact ND2-OG 3.39Å; N70-S72 PolarHBondContact O-N 3.23Å; N70-S72 PolarHBondContact OD1-OG 3.01Å; N70-S72 VanDerWaalsContact OD1-OG 3.05Å; N70-V73 HydrophobicContact CB-CG2 4.31Å; N70-V73 PolarHBondContact O-N 3.4Å
71	V	45.1	Very low	42.4	Very low	103 Å²	103	112.7 Å²	112.7	62%	0.624	65%	0.648	S	S	*	*	H	α-helix	trans	-56.5	-17.2	179.8	-179.2	0	0	0	0	111.4	I69 V73 L74	I69-V71 PolarHBondContact O-N 2.73Å; I69-V71 VanDerWaalsContact O-N 3.1Å; V71-V73 VanDerWaalsContact C-N 3.34Å; V71-V73 PolarHBondContact O-N 3.2Å; V71-L74 PolarHBondContact O-N 3.37Å
72	S	41	Very low	43.4	Very low	65 Å²	65	112.5 Å²	112.5	46%	0.455	63%	0.625	S	S	.	*	H	α-helix	trans	-64.3	-29.6	170.5	58.3	0	0	0	0	114.5	N70 N75	N70-S72 WeakPolarHBondContact CB-OG 3.33Å; N70-S72 PolarHBondContact ND2-OG 3.39Å; N70-S72 PolarHBondContact O-N 3.23Å; N70-S72 PolarHBondContact OD1-OG 3.01Å; N70-S72 VanDerWaalsContact OD1-OG 3.05Å; S72-N75 PolarHBondContact O-N 3.01Å
73	V	43.3	Very low	44.2	Very low	91 Å²	91	115.8 Å²	115.8	55%	0.552	62%	0.617	S	S	*	*	H	α-helix	trans	-77.1	-26.3	177.6	-178.7	0	0	0	0	111.4	N70 V71 N75 S76	N70-V73 HydrophobicContact CB-CG2 4.31Å; N70-V73 PolarHBondContact O-N 3.4Å; V71-V73 VanDerWaalsContact C-N 3.34Å; V71-V73 PolarHBondContact O-N 3.2Å; V73-N75 VanDerWaalsContact C-N 3.29Å; V73-N75 PolarHBondContact O-N 3.46Å; V73-S76 WeakPolarHBondContact CA-OG 3.38Å; V73-S76 PolarHBondContact O-N 2.99Å; V73-S76 PolarHBondContact O-OG 3.19Å
74	L	44.4	Very low	45.1	Very low	67 Å²	67	112.8 Å²	112.8	35%	0.351	60%	0.603	S	S	.	*	H	α-helix	trans	-73.1	-21.7	175.1	-74.8	162.7	0	0	0	112.9	I45 I69 V71	I45-L74 HydrophobicContact CG2-CD1 4.4Å; I69-L74 HydrophobicContact CG2-CD1 4.35Å; V71-L74 PolarHBondContact O-N 3.37Å
75	N	44.1	Very low	45.8	Very low	137 Å²	137	110.8 Å²	110.8	73%	0.733	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-10.4	172	-77.4	-28.6	0	0	0	113.3	S72 V73	S72-N75 PolarHBondContact O-N 3.01Å; V73-N75 VanDerWaalsContact C-N 3.29Å; V73-N75 PolarHBondContact O-N 3.46Å
76	S	41.9	Very low	46.6	Very low	51 Å²	51	108.9 Å²	108.9	36%	0.357	58%	0.58	S	S	.	*	S	Bend	trans	-106.6	112.6	177	57.2	0	0	0	0	110.2	V73 P78	V73-S76 WeakPolarHBondContact CA-OG 3.38Å; V73-S76 PolarHBondContact O-N 2.99Å; V73-S76 PolarHBondContact O-OG 3.19Å; S76-P78 VanDerWaalsContact C-CD 3.42Å; S76-P78 WeakPolarHBondContact O-CD 3.31Å
77	T	41.8	Very low	47.2	Very low	95 Å²	95	112.3 Å²	112.3	58%	0.583	57%	0.574	S	S	*	*	S	Bend	trans	93.9	-28.5	145.4	42.4	0	0	0	0	123.9
78	P	49.8	Very low	48	Very low	73 Å²	73	110.4 Å²	110.4	47%	0.474	56%	0.564	S	S	.	*	H	α-helix	trans	-87.5	-25.3	177.3	29.8	-31.9	0	0	0	114.5	S76 I82	S76-P78 VanDerWaalsContact C-CD 3.42Å; S76-P78 WeakPolarHBondContact O-CD 3.31Å; P78-I82 VanDerWaalsContact O-CD1 3.25Å; P78-I82 WeakPolarHBondContact O-CD1 3.33Å; P78-I82 WeakPolarHBondContact O-CG1 3.36Å; P78-I82 PolarHBondContact O-N 3.1Å
79	F	44.6	Very low	48.6	Very low	134 Å²	134	109.3 Å²	109.3	59%	0.588	55%	0.552	S	S	*	*	H	α-helix	trans	-83.8	-24	-176.1	-144.8	-93.2	0	0	0	113.4	R83	F79-R83 VanDerWaalsContact O-CB 3.25Å; F79-R83 WeakPolarHBondContact O-CB 3.42Å; F79-R83 PolarHBondContact O-N 3.38Å
80	I	46.4	Very low	49	Very low	104 Å²	104	104.6 Å²	104.6	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-76.7	-43.3	178	-64	173.6	0	0	0	110.1	R83 E84	I80-R83 WeakPolarHBondContact O-CB 3.25Å; I80-R83 PolarHBondContact O-N 2.95Å; I80-E84 PolarHBondContact O-N 2.96Å
81	E	50.4	Low	49.7	Very low	131 Å²	131	103.5 Å²	103.5	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-44.8	177.1	-72.9	-178.6	165	0	0	111.8	R83 E84 E85	E81-R83 VanDerWaalsContact C-N 3.29Å; E81-R83 PolarHBondContact O-N 3.4Å; E81-E84 PolarHBondContact O-N 3.44Å; E81-E85 PolarHBondContact O-N 2.86Å
82	I	53.7	Low	50.2	Low	86 Å²	86	104.1 Å²	104.1	44%	0.441	54%	0.54	S	S	.	.	H	α-helix	trans	-62	-39.4	175.6	-64.7	168.9	0	0	0	110.6	P78 E84 E85 Y86	P78-I82 VanDerWaalsContact O-CD1 3.25Å; P78-I82 WeakPolarHBondContact O-CD1 3.33Å; P78-I82 WeakPolarHBondContact O-CG1 3.36Å; P78-I82 PolarHBondContact O-N 3.1Å; I82-E84 VanDerWaalsContact C-N 3.34Å; I82-E84 PolarHBondContact O-N 2.98Å; I82-E85 PolarHBondContact O-N 2.74Å; I82-Y86 HydrophobicContact CG2-CD2 3.77Å; I82-Y86 HydrophobicContact CG2-CE2 3.88Å; I82-Y86 VanDerWaalsContact O-CD2 3.3Å; I82-Y86 WeakPolarHBondContact O-CD2 3.4Å; I82-Y86 PolarHBondContact O-N 3.31Å
83	R	53.1	Low	50.7	Low	134 Å²	134	104.4 Å²	104.4	51%	0.506	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-36	177.9	-174.6	-179.6	175.5	-173.9	1.6	112.4	F79 I80 E81 R87	F79-R83 VanDerWaalsContact O-CB 3.25Å; F79-R83 WeakPolarHBondContact O-CB 3.42Å; F79-R83 PolarHBondContact O-N 3.38Å; I80-R83 WeakPolarHBondContact O-CB 3.25Å; I80-R83 PolarHBondContact O-N 2.95Å; E81-R83 VanDerWaalsContact C-N 3.29Å; E81-R83 PolarHBondContact O-N 3.4Å; R83-R87 WeakPolarHBondContact O-CB 3.2Å; R83-R87 PolarHBondContact O-N 2.85Å; R83-R87 VanDerWaalsContact O-N 3.1Å
84	E	55.1	Low	50.7	Low	134 Å²	134	103.2 Å²	103.2	63%	0.626	55%	0.545	S	S	*	.	H	α-helix	trans	-72	-39.5	175.8	-72.1	-169.6	166.4	0	0	112.2	I80 E81 I82 R87 A88	I80-E84 PolarHBondContact O-N 2.96Å; E81-E84 PolarHBondContact O-N 3.44Å; I82-E84 VanDerWaalsContact C-N 3.34Å; I82-E84 PolarHBondContact O-N 2.98Å; E84-R87 PolarHBondContact O-N 2.92Å; E84-A88 WeakPolarHBondContact O-CB 3.4Å; E84-A88 PolarHBondContact O-N 2.93Å
85	E	55.9	Low	50.7	Low	141 Å²	141	103.8 Å²	103.8	66%	0.659	55%	0.551	S	S	*	*	H	α-helix	trans	-61.8	-44.6	173.8	-78	-172	157.7	0	0	112.4	E81 I82 R87 A88 F89	E81-E85 PolarHBondContact O-N 2.86Å; I82-E85 PolarHBondContact O-N 2.74Å; E85-R87 PolarHBondContact O-N 3.25Å; E85-A88 PolarHBondContact O-N 2.86Å; E85-F89 PolarHBondContact O-N 2.95Å
86	Y	55	Low	50.9	Low	145 Å²	145	103.3 Å²	103.3	57%	0.569	55%	0.553	S	S	*	*	H	α-helix	trans	-69.8	-31.4	177.9	-88.6	-93.7	0	0	0	112.9	I82 F89 G90	I82-Y86 HydrophobicContact CG2-CD2 3.77Å; I82-Y86 HydrophobicContact CG2-CE2 3.88Å; I82-Y86 VanDerWaalsContact O-CD2 3.3Å; I82-Y86 WeakPolarHBondContact O-CD2 3.4Å; I82-Y86 PolarHBondContact O-N 3.31Å; Y86-F89 PolarHBondContact O-N 3Å; Y86-G90 PolarHBondContact O-N 3.04Å
87	R	57	Low	51.3	Low	203 Å²	203	104.4 Å²	104.4	77%	0.766	55%	0.554	S	S	*	*	H	α-helix	trans	-67.9	-40.6	172.8	-164.2	-175	-145.8	-170.7	5.3	111.5	R83 E84 E85 F89 G90 A91	R83-R87 WeakPolarHBondContact O-CB 3.2Å; R83-R87 PolarHBondContact O-N 2.85Å; R83-R87 VanDerWaalsContact O-N 3.1Å; E84-R87 PolarHBondContact O-N 2.92Å; E85-R87 PolarHBondContact O-N 3.25Å; R87-F89 VanDerWaalsContact C-N 3.31Å; R87-G90 PolarHBondContact O-N 3.36Å; R87-A91 PolarHBondContact O-N 3.47Å; R87-A91 VanDerWaalsContact O-N 3.09Å
88	A	57.3	Low	51.8	Low	59 Å²	59	106.4 Å²	106.4	49%	0.488	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-37.3	174.3	0	0	0	0	0	111.6	E84 E85 A91 T92	E84-A88 WeakPolarHBondContact O-CB 3.4Å; E84-A88 PolarHBondContact O-N 2.93Å; E85-A88 PolarHBondContact O-N 2.86Å; A88-A91 PolarHBondContact O-N 3Å; A88-T92 WeakPolarHBondContact O-CG2 2.93Å; A88-T92 PolarHBondContact O-N 3.37Å; A88-T92 PolarHBondContact O-OG1 3.22Å
89	F	53.1	Low	51.8	Low	130 Å²	130	107.8 Å²	107.8	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-69.2	-38.5	175	-170.8	-96.6	0	0	0	113.4	E85 Y86 R87 A91 T92 T93	E85-F89 PolarHBondContact O-N 2.95Å; Y86-F89 PolarHBondContact O-N 3Å; R87-F89 VanDerWaalsContact C-N 3.31Å; F89-A91 VanDerWaalsContact C-N 3.34Å; F89-T92 PolarHBondContact O-N 3.37Å; F89-T92 PolarHBondContact O-OG1 3.49Å; F89-T93 HydrophobicContact CD1-CG2 4.38Å; F89-T93 HydrophobicContact CE1-CG2 4Å; F89-T93 HydrophobicContact CE2-CG2 4.41Å; F89-T93 HydrophobicContact CZ-CG2 4.02Å; F89-T93 WeakPolarHBondContact O-CG2 3.47Å; F89-T93 PolarHBondContact O-N 3.1Å; F89-T93 PolarHBondContact O-OG1 3.46Å
90	G	54.5	Low	52.1	Low	6 Å²	6	106.1 Å²	106.1	6%	0.062	56%	0.56	C	S	.	*	H	α-helix	trans	-64.3	-38.3	173.6	0	0	0	0	0	112.7	Y86 R87 T93 G94 T95	Y86-G90 PolarHBondContact O-N 3.04Å; R87-G90 PolarHBondContact O-N 3.36Å; G90-T93 PolarHBondContact O-OG1 2.84Å; G90-G94 PolarHBondContact O-N 3.04Å; G90-T95 CarbonylContact C-O 3.57Å; G90-T95 WeakPolarHBondContact CA-O 3.2Å; G90-T95 CarbonylContact O-C 3.41Å; G90-T95 PolarHBondContact O-N 3.25Å; G90-T95 VanDerWaalsContact O-O 3.08Å
91	A	55.6	Low	52.1	Low	84 Å²	84	109.8 Å²	109.8	69%	0.694	58%	0.575	S	S	*	*	H	α-helix	trans	-68.1	-35	178.4	0	0	0	0	0	113.4	R87 A88 F89	R87-A91 PolarHBondContact O-N 3.47Å; R87-A91 VanDerWaalsContact O-N 3.09Å; A88-A91 PolarHBondContact O-N 3Å; F89-A91 VanDerWaalsContact C-N 3.34Å
92	T	56.4	Low	52	Low	117 Å²	117	108.2 Å²	108.2	72%	0.718	58%	0.578	S	S	*	*	H	α-helix	trans	-79.1	-26.5	179.2	48.6	0	0	0	0	113.5	A88 F89	A88-T92 WeakPolarHBondContact O-CG2 2.93Å; A88-T92 PolarHBondContact O-N 3.37Å; A88-T92 PolarHBondContact O-OG1 3.22Å; F89-T92 PolarHBondContact O-N 3.37Å; F89-T92 PolarHBondContact O-OG1 3.49Å
93	T	52.2	Low	51.7	Low	70 Å²	70	111.1 Å²	111.1	43%	0.429	59%	0.587	S	S	.	*	H	α-helix	trans	-92.3	-3.3	-179.3	53.6	0	0	0	0	113.8	F89 G90 T95	F89-T93 HydrophobicContact CD1-CG2 4.38Å; F89-T93 HydrophobicContact CE1-CG2 4Å; F89-T93 HydrophobicContact CE2-CG2 4.41Å; F89-T93 HydrophobicContact CZ-CG2 4.02Å; F89-T93 WeakPolarHBondContact O-CG2 3.47Å; F89-T93 PolarHBondContact O-N 3.1Å; F89-T93 PolarHBondContact O-OG1 3.46Å; G90-T93 PolarHBondContact O-OG1 2.84Å; T93-T95 PolarHBondContact O-N 3.47Å; T93-T95 PolarHBondContact OG1-OG1 2.93Å
94	G	43.2	Very low	51.4	Low	66 Å²	66	112 Å²	112	68%	0.68	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	71	10.2	-172.2	0	0	0	0	0	113.4	G90 V96	G90-G94 PolarHBondContact O-N 3.04Å; G94-V96 PolarHBondContact O-N 3.36Å
95	T	44.3	Very low	50.9	Low	79 Å²	79	117 Å²	117	49%	0.485	62%	0.615	S	S	.	*			trans	-86	98	178.8	-41.9	0	0	0	0	108.6	G90 T93 I97	G90-T95 CarbonylContact C-O 3.57Å; G90-T95 WeakPolarHBondContact CA-O 3.2Å; G90-T95 CarbonylContact O-C 3.41Å; G90-T95 PolarHBondContact O-N 3.25Å; G90-T95 VanDerWaalsContact O-O 3.08Å; T93-T95 PolarHBondContact O-N 3.47Å; T93-T95 PolarHBondContact OG1-OG1 2.93Å; T95-I97 VanDerWaalsContact C-N 3.3Å; T95-I97 HydrophobicContact CG2-CG1 4.09Å; T95-I97 PolarHBondContact O-N 2.81Å
96	V	47.8	Very low	50.4	Low	127 Å²	127	119.2 Å²	119.2	77%	0.77	62%	0.623	S	S	*	*			trans	-70.9	89.1	172.5	-175.3	0	0	0	0	108.5	G94 N98	G94-V96 PolarHBondContact O-N 3.36Å; V96-N98 PolarHBondContact O-N 3.05Å; V96-N98 VanDerWaalsContact O-N 3.13Å
97	I	49.7	Very low	49.9	Very low	74 Å²	74	119.5 Å²	119.5	38%	0.379	63%	0.634	S	S	.	*			trans	-79.3	96.9	171.8	-40.6	179.3	0	0	0	107.5	T95 M99	T95-I97 VanDerWaalsContact C-N 3.3Å; T95-I97 HydrophobicContact CG2-CG1 4.09Å; T95-I97 PolarHBondContact O-N 2.81Å; I97-M99 HydrophobicContact CB-CG 3.96Å; I97-M99 HydrophobicContact CG2-CG 3.24Å; I97-M99 HydrophobicContact CG2-SD 4.11Å; I97-M99 PolarHBondContact O-N 2.81Å
98	N	51.7	Low	49.4	Very low	138 Å²	138	119.7 Å²	119.7	74%	0.738	64%	0.64	S	S	*	*			trans	-68.3	78	165.6	-99.6	-20.8	0	0	0	109	V96 D100	V96-N98 PolarHBondContact O-N 3.05Å; V96-N98 VanDerWaalsContact O-N 3.13Å; N98-D100 PolarHBondContact O-N 3.34Å
99	M	50.9	Low	48.5	Very low	101 Å²	101	126.1 Å²	126.1	50%	0.498	66%	0.658	S	S	.	*			trans	-81.4	23	175.7	-62.1	-165.7	86.2	0	0	113.2	I97 Q101	I97-M99 HydrophobicContact CB-CG 3.96Å; I97-M99 HydrophobicContact CG2-CG 3.24Å; I97-M99 HydrophobicContact CG2-SD 4.11Å; I97-M99 PolarHBondContact O-N 2.81Å; M99-Q101 VanDerWaalsContact C-N 3.35Å; M99-Q101 PolarHBondContact O-N 3.29Å
100	D	50	Low	47.8	Very low	100 Å²	100	125 Å²	125	54%	0.535	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-96.5	29.6	-175.9	-136.1	8.6	0	0	0	113.4	N98 S102	N98-D100 PolarHBondContact O-N 3.34Å; D100-S102 VanDerWaalsContact C-N 3.33Å
101	Q	48.1	Very low	47.4	Very low	181 Å²	181	132.3 Å²	132.3	85%	0.846	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-86.3	-0.3	173.5	-66.7	-164.9	5.8	0	0	113.8	M99	M99-Q101 VanDerWaalsContact C-N 3.35Å; M99-Q101 PolarHBondContact O-N 3.29Å
102	S	47.7	Very low	46.5	Very low	97 Å²	97	138.1 Å²	138.1	68%	0.678	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-95.1	5.3	-178.8	78.4	0	0	0	0	114.9	D100	D100-S102 VanDerWaalsContact C-N 3.33Å
103	K	46.6	Very low	45.9	Very low	147 Å²	147	137.2 Å²	137.2	64%	0.639	71%	0.708	S	S	*	*	S	Bend	trans	-105.9	-10	176.2	-78.2	-176.5	176.5	175.1	0	115	R105	K103-R105 VanDerWaalsContact C-N 3.35Å; K103-R105 PolarHBondContact O-N 3.06Å
104	D	47	Very low	45.6	Very low	152 Å²	152	143.3 Å²	143.3	81%	0.813	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	11.6	-174.3	-110.1	-11.8	0	0	0	115.7
105	R	45.9	Very low	45.6	Very low	241 Å²	241	152.4 Å²	152.4	91%	0.909	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	8.5	-179.9	-102.2	-177.8	176.3	179.5	0.3	115.9	K103	K103-R105 VanDerWaalsContact C-N 3.35Å; K103-R105 PolarHBondContact O-N 3.06Å
106	K	45.1	Very low	45.6	Very low	186 Å²	186	154.5 Å²	154.5	81%	0.809	76%	0.761	S	S	*	*	S	Bend	trans	-118.9	-3	178.4	-88	-178.4	174.4	175.9	0	116.8
107	D	43.3	Very low	45.3	Very low	152 Å²	152	153.9 Å²	153.9	81%	0.813	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	13	177.7	-71.3	-22.5	0	0	0	115.1
108	K	46.5	Very low	45	Very low	206 Å²	206	156 Å²	156	90%	0.896	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	9.7	169.9	-78.7	-167.9	177.5	-179.4	0	114.7
109	F	39.2	Very low	44.6	Very low	195 Å²	195	153.5 Å²	153.5	86%	0.855	78%	0.779	S	S	*	*	S	Bend	trans	-134.8	51.4	-177.1	-120.7	-87.8	0	0	0	111.9
110	C	38.9	Very low	44.4	Very low	105 Å²	105	156.2 Å²	156.2	71%	0.709	80%	0.795	S	S	*	*	S	Bend	trans	-153.2	113.9	164	-111.8	0	0	0	0	111
111	Q	45.2	Very low	43.9	Very low	160 Å²	160	159.4 Å²	159.4	75%	0.748	81%	0.813	S	S	*	*			trans	67.7	96	152.5	-48.8	-171.1	5.1	0	0	115.4	S113	Q111-S113 PolarHBondContact O-N 2.76Å
112	H	37.1	Very low	43.8	Very low	206 Å²	206	162 Å²	162	95%	0.954	83%	0.831	S	S	*	*				29	57.7	66.3	-93.3	-113.7	0	0	0	112.8
113	S	43	Very low	43.6	Very low	98 Å²	98	165.2 Å²	165.2	69%	0.685	84%	0.839	S	S	*	*			trans	-151.4	103.7	149.7	-80.6	0	0	0	0	108	Q111 W115	Q111-S113 PolarHBondContact O-N 2.76Å; S113-W115 PolarHBondContact O-N 2.94Å
114	K	45.4	Very low	43.4	Very low	198 Å²	198	166.2 Å²	166.2	86%	0.861	85%	0.849	S	S	*	*			trans	-46.4	138.9	160.7	-63.9	177	175.7	-178.9	0	107.1
115	W	43.8	Very low	43.2	Very low	257 Å²	257	166.9 Å²	166.9	97%	0.973	85%	0.851	S	S	*	*				-174.5	117.6	128.2	-96.7	35.1	0	0	0	107.3	S113	S113-W115 PolarHBondContact O-N 2.94Å
116	S	45.2	Very low	43.1	Very low	124 Å²	124	162.6 Å²	162.6	87%	0.867	85%	0.848	S	S	*	*			trans	-73.5	125.8	178.1	-53.9	0	0	0	0	109.9
117	S	40.9	Very low	42.9	Very low	113 Å²	113	161.1 Å²	161.1	79%	0.79	85%	0.85	S	S	*	*			trans	-77	164	146.8	-83.6	0	0	0	0	108.4
118	P	42.7	Very low	42.9	Very low	118 Å²	118	161.7 Å²	161.7	77%	0.766	85%	0.852	S	S	*	*			cis	-151.4	-178.7	36.5	38.9	-15.6	0	0	0	117.8
119	A	44.7	Very low	42.6	Very low	87 Å²	87	158.6 Å²	158.6	72%	0.719	85%	0.849	S	S	*	*			trans	78.7	113	150.5	0	0	0	0	0	119.6
120	N	45.9	Very low	42.9	Very low	157 Å²	157	155.8 Å²	155.8	84%	0.84	85%	0.849	S	S	*	*				-158.5	102.9	126.4	-106.7	-3.2	0	0	0	109.3
121	D	38.8	Very low	43.2	Very low	168 Å²	168	160 Å²	160	90%	0.898	86%	0.861	S	S	*	*			trans	-87.3	113.7	150.6	-96.3	-38.1	0	0	0	106.3
122	L	46.2	Very low	43.1	Very low	234 Å²	234	160 Å²	160	100%	1.225	87%	0.871	S	S	*	*			trans	-165.9	0	159.1	-107.6	163.7	0	0	0	109.2

Retrieved 122 of 122 residues in 21.6 ms (Link to these results)

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