A0A087YJ98_POEFO Loading...

Serine/arginine-rich splicing factor 3

Splicing factor, which binds the consensus motif 5'-C[ACU][AU]C[ACU][AC]C-3' within pre-mRNA and promotes specific exons inclusion during alternative splicing. Interaction with YTHDC1, a RNA-binding protein that recognizes and binds N6-methyladenosine (m6A)-containing RNAs, promotes recruitment of SRSF3 to its mRNA-binding elements adjacent to m6A sites within exons. Also functions as an adapter involved in mRNA nuclear export. Binds mRNA which is thought to be transferred to the NXF1-NXT1 heterodimer for export (TAP/NXF1 pathway); enhances NXF1-NXT1 RNA-binding activity. Involved in nuclear export of m6A-containing mRNAs via interaction with YTHDC1: interaction with YTHDC1 facilitates m6A-containing mRNA-binding to both SRSF3 and NXF1, promoting mRNA nuclear export.

AlphaFold DB , UniProt , Accession A0A087YJ98, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 168 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.1	Very low	49.2	Very low	245 Å²	245	129.5 Å²	129.5	100%	1.207	71%	0.709	S	S	*	*				0	88.7	0	-67.8	172.2	179.1	0	0	106.3
2	G	47.6	Very low	49.5	Very low	69 Å²	69	125.8 Å²	125.8	71%	0.711	69%	0.687	S	S	*	*			trans	-84.9	119.5	177.1	0	0	0	0	0	108.3	P4	G2-P4 VanDerWaalsContact O-CD 3.29Å; G2-P4 WeakPolarHBondContact O-CD 3.45Å
3	D	48.3	Very low	50.3	Low	117 Å²	117	120.8 Å²	120.8	63%	0.626	66%	0.659	S	S	*	*			trans	-55.9	114.2	173.1	38.3	-69.1	0	0	0	111.3	A5	D3-A5 VanDerWaalsContact C-N 3.32Å; D3-A5 PolarHBondContact O-N 3.06Å
4	P	52.2	Low	51.9	Low	133 Å²	133	112.6 Å²	112.6	86%	0.864	62%	0.615	S	S	*	*			trans	-94.2	66.7	175.9	36.5	-27.6	0	0	0	108.7	G2	G2-P4 VanDerWaalsContact O-CD 3.29Å; G2-P4 WeakPolarHBondContact O-CD 3.45Å
5	A	45.9	Very low	53.9	Low	76 Å²	76	110.8 Å²	110.8	63%	0.628	60%	0.599	S	S	*	*			trans	-137.2	38	-176.2	0	0	0	0	0	113.4	D3	D3-A5 VanDerWaalsContact C-N 3.32Å; D3-A5 PolarHBondContact O-N 3.06Å
6	F	46.8	Very low	55.8	Low	147 Å²	147	103.9 Å²	103.9	65%	0.645	56%	0.562	S	S	*	*	S	Bend	trans	-130.1	136.8	168.5	-67.5	-81.9	0	0	0	108.1
7	H	55	Low	57.5	Low	136 Å²	136	100.9 Å²	100.9	63%	0.63	54%	0.541	S	S	*	.	S	Bend	trans	94.3	27.5	-171.5	-55.2	-82.8	0	0	0	118.2	D59	H7-D59 IonicContact CE1-OD1 3.7Å
8	R	47.5	Very low	58.9	Low	237 Å²	237	95.3 Å²	95.3	89%	0.894	51%	0.511	S	S	*	.	S	Bend	trans	-117.2	1	165.2	-71.7	179.2	89.9	168.2	4.7	116.3
9	D	46.8	Very low	60	Low	117 Å²	117	90.4 Å²	90.4	63%	0.626	49%	0.485	S	S	*	.			trans	-141.7	64.5	176.8	-66.4	-75.8	0	0	0	112.6	P11 K89	D9-P11 WeakPolarHBondContact O-CD 3.49Å; D9-K89 PolarHBondContact O-NZ 2.83Å
10	C	51.3	Low	60.8	Low	53 Å²	53	90 Å²	90	36%	0.358	48%	0.483	S	S	.	.			trans	-111.7	63.4	163.6	-61.6	0	0	0	0	112.2
11	P	55.6	Low	61.2	Low	94 Å²	94	86.8 Å²	86.8	61%	0.61	47%	0.465	S	S	*	.	S	Bend	trans	-93.8	-13.8	179.2	2.1	20.2	0	0	0	113.3	D9	D9-P11 WeakPolarHBondContact O-CD 3.49Å
12	L	52.7	Low	62.2	Low	85 Å²	85	76.4 Å²	76.4	45%	0.445	42%	0.421	S	S	.	.	S	Bend	trans	-147.6	-14.7	-167	-63.7	168.8	0	0	0	116	G87	L12-G87 WeakPolarHBondContact CB-O 3.25Å; L12-G87 VanDerWaalsContact CD1-O 3.26Å; L12-G87 WeakPolarHBondContact CD1-O 3.48Å
13	D	59.8	Low	62.9	Low	61 Å²	61	81.5 Å²	81.5	33%	0.326	43%	0.432	S	S	.	.	S	Bend	trans	-92.1	-14.7	-173.7	-149.7	-117.1	0	0	0	113.4	P60	D13-P60 HydrophobicContact CB-CB 4Å; D13-P60 WeakPolarHBondContact OD1-CB 3.38Å
14	C	72.8	Confident	63.5	Low	6 Å²	6	80.3 Å²	80.3	4%	0.041	43%	0.426	C	S	.	.	S	Bend	trans	-91.2	-0.9	-179.2	-45.1	0	0	0	0	113.3	F57 P60	C14-F57 HydrophobicContact CB-CB 4.17Å; C14-F57 WeakPolarHBondContact CB-O 3.27Å; C14-F57 PolarHBondContact O-N 3.39Å; C14-P60 VanDerWaalsContact SG-CD 3.55Å
15	K	81.8	Confident	64.1	Low	86 Å²	86	74.9 Å²	74.9	37%	0.374	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127.1	-178.7	-169.8	174.1	-172.4	173.2	0	109.7	F54 V55 S85	K15-F54 HydrophobicContact CD-CD1 4.47Å; K15-V55 CarbonylContact C-O 3.45Å; K15-V55 WeakPolarHBondContact CA-O 3.41Å; K15-S85 WeakPolarHBondContact O-CA 3.49Å; K15-S85 VanDerWaalsContact O-CB 3.28Å; K15-S85 WeakPolarHBondContact O-CB 3.48Å; K15-S85 PolarHBondContact O-N 3.29Å
16	V	84.6	Confident	65.2	Low	0 Å²	0	74.5 Å²	74.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.7	-180	176.3	0	0	0	0	108.1	V18 F34 F54 V55 F57 A63 V67 V82 L84	V16-V18 HydrophobicContact CG1-CG2 4.12Å; V16-F34 HydrophobicContact CG1-CE1 3.94Å; V16-F34 HydrophobicContact CG1-CZ 4.44Å; V16-F54 CarbonylContact O-C 3.52Å; V16-F54 VanDerWaalsContact O-CA 3.25Å; V16-F54 WeakPolarHBondContact O-CA 3.29Å; V16-V55 HydrophobicContact CB-CB 4.29Å; V16-V55 PolarHBondContact N-O 3.24Å; V16-V55 PolarHBondContact O-N 3.46Å; V16-F57 HydrophobicContact CB-CE2 4.5Å; V16-F57 HydrophobicContact CG2-CD2 3.84Å; V16-F57 HydrophobicContact CG2-CE2 3.86Å; V16-A63 HydrophobicContact CG2-CB 3.78Å; V16-V67 HydrophobicContact CB-CG2 4.16Å; V16-V67 HydrophobicContact CG1-CG2 3.51Å; V16-V67 HydrophobicContact CG2-CG2 3.61Å; V16-V82 HydrophobicContact CG1-CG1 3.27Å; V16-L84 HydrophobicContact CG2-CD2 4.16Å
17	Y	84.9	Confident	66.8	Low	54 Å²	54	72.3 Å²	72.3	21%	0.212	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	134.9	168.9	168.7	-105.5	0	0	0	109.5	F52 F54 V82 E83 S85	Y17-F52 HydrophobicContact CE2-CB 4.12Å; Y17-F52 AromaticContact CE2-CD1 3.65Å; Y17-F52 HydrophobicContact CE2-CD1 3.65Å; Y17-F52 HydrophobicContact CE2-CE1 4.44Å; Y17-F52 HydrophobicContact CE2-CG 4.11Å; Y17-F52 AromaticContact CZ-CD1 3.45Å; Y17-F52 VanDerWaalsContact CZ-CD1 3.45Å; Y17-F52 AromaticContact CZ-CE1 3.84Å; Y17-F52 WeakPolarHBondContact OH-CD1 3.41Å; Y17-F52 WeakPolarHBondContact OH-CE1 3.3Å; Y17-F54 HydrophobicContact CD2-CD1 4.04Å; Y17-F54 HydrophobicContact CD2-CD2 4.4Å; Y17-F54 AromaticContact CD2-CE1 3.48Å; Y17-F54 HydrophobicContact CD2-CE1 3.48Å; Y17-F54 VanDerWaalsContact CD2-CE1 3.48Å; Y17-F54 AromaticContact CD2-CE2 3.91Å; Y17-F54 HydrophobicContact CD2-CE2 3.91Å; Y17-F54 AromaticContact CD2-CZ 3.43Å; Y17-F54 HydrophobicContact CD2-CZ 3.43Å; Y17-F54 VanDerWaalsContact CD2-CZ 3.43Å; Y17-F54 HydrophobicContact CE2-CE1 4.38Å; Y17-F54 HydrophobicContact CE2-CE2 4.22Å; Y17-F54 AromaticContact CE2-CZ 3.91Å; Y17-F54 HydrophobicContact CE2-CZ 3.91Å; Y17-F54 HydrophobicContact CG-CE1 4.15Å; Y17-F54 HydrophobicContact CG-CZ 4.48Å; Y17-V82 CarbonylContact O-C 3.59Å; Y17-V82 WeakPolarHBondContact O-CA 3.48Å; Y17-E83 WeakPolarHBondContact CA-O 3.33Å; Y17-E83 HydrophobicContact CD1-CB 4.17Å; Y17-E83 PolarHBondContact N-O 3.16Å; Y17-E83 PolarHBondContact O-N 2.74Å; Y17-S85 PolarHBondContact N-OG 2.82Å
18	V	82.6	Confident	68.1	Low	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	111.2	178.2	-169.9	0	0	0	0	107	V16 L21 L30 F34 F52 A53 V55 V80 R81 V82	V16-V18 HydrophobicContact CG1-CG2 4.12Å; V18-L21 HydrophobicContact CB-CD1 4.05Å; V18-L21 HydrophobicContact CG1-CD1 3.63Å; V18-L21 HydrophobicContact CG1-CD2 3.58Å; V18-L21 HydrophobicContact CG1-CG 3.65Å; V18-L30 HydrophobicContact CB-CD2 4.26Å; V18-L30 HydrophobicContact CG1-CD2 4.49Å; V18-L30 HydrophobicContact CG2-CD2 4.1Å; V18-F34 HydrophobicContact CG2-CE1 4.31Å; V18-F34 HydrophobicContact CG2-CE2 3.83Å; V18-F34 HydrophobicContact CG2-CZ 3.45Å; V18-F34 VanDerWaalsContact CG2-CZ 3.45Å; V18-F52 CarbonylContact O-C 3.52Å; V18-F52 WeakPolarHBondContact O-CA 2.98Å; V18-A53 HydrophobicContact CB-CB 4.28Å; V18-A53 PolarHBondContact N-O 2.82Å; V18-A53 PolarHBondContact O-N 3.35Å; V18-V55 HydrophobicContact CG2-CG2 4.3Å; V18-V80 HydrophobicContact CG1-CG1 3.43Å; V18-V80 VanDerWaalsContact CG1-CG1 3.43Å; V18-R81 CarbonylContact C-O 3.52Å; V18-R81 WeakPolarHBondContact CA-O 3.27Å; V18-V82 HydrophobicContact CG1-CG2 4.21Å; V18-V82 HydrophobicContact CG2-CG1 4.32Å
19	G	80.3	Confident	69.6	Low	1 Å²	1	63.2 Å²	63.2	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	166.8	176.1	0	0	0	0	0	112.9	L21 R81	G19-L21 VanDerWaalsContact C-N 3.3Å; G19-L21 PolarHBondContact O-N 2.87Å; G19-R81 PolarHBondContact N-O 3.11Å; G19-R81 PolarHBondContact O-N 2.83Å
20	N	74.8	Confident	71.2	Confident	83 Å²	83	58 Å²	58	44%	0.444	32%	0.317	S	S	.	.			trans	61.6	37.3	178.1	-154.7	21.2	0	0	0	113.4	G22 G51 R79	N20-G22 PolarHBondContact O-N 3.19Å; N20-G51 PolarHBondContact N-O 3.2Å; N20-G51 VanDerWaalsContact N-O 3.14Å; N20-R79 WeakPolarHBondContact CB-O 3.43Å; N20-R79 VanDerWaalsContact CG-O 3.3Å; N20-R79 PolarHBondContact ND2-O 3.11Å
21	L	70.3	Confident	72.8	Confident	22 Å²	22	60 Å²	60	12%	0.115	32%	0.321	C	S	.	.			trans	-76.2	1.1	176.2	-70.6	164.7	0	0	0	113.7	V18 G19 G25 L30 G51 A53 V80	V18-L21 HydrophobicContact CB-CD1 4.05Å; V18-L21 HydrophobicContact CG1-CD1 3.63Å; V18-L21 HydrophobicContact CG1-CD2 3.58Å; V18-L21 HydrophobicContact CG1-CG 3.65Å; G19-L21 VanDerWaalsContact C-N 3.3Å; G19-L21 PolarHBondContact O-N 2.87Å; L21-G25 PolarHBondContact O-N 3.08Å; L21-L30 HydrophobicContact CD1-CD1 3.85Å; L21-L30 HydrophobicContact CD1-CD2 4.15Å; L21-L30 HydrophobicContact CD2-CD1 3.76Å; L21-L30 HydrophobicContact CG-CD1 4.47Å; L21-G51 WeakPolarHBondContact CB-O 3.26Å; L21-G51 PolarHBondContact N-O 3.21Å; L21-A53 HydrophobicContact CD1-CB 3.59Å; L21-V80 HydrophobicContact CD2-CG1 3.73Å; L21-V80 HydrophobicContact CD2-CG2 4Å; L21-V80 HydrophobicContact CG-CG1 4.33Å
22	G	65.1	Low	74.1	Confident	27 Å²	27	64.4 Å²	64.4	28%	0.278	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	57.4	-162.6	-176	0	0	0	0	0	113	N20 N24	N20-G22 PolarHBondContact O-N 3.19Å; G22-N24 PolarHBondContact O-N 3.21Å
23	N	62.4	Low	75.4	Confident	177 Å²	177	61.6 Å²	61.6	95%	0.947	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-78.5	-6.9	176.4	-121.9	76.9	0	0	0	113.2
24	N	60.8	Low	76.4	Confident	92 Å²	92	59 Å²	59	49%	0.492	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-102.2	2.5	-177.4	-149	83.6	0	0	0	113	G22 N26 C76	G22-N24 PolarHBondContact O-N 3.21Å; N24-N26 PolarHBondContact O-N 3.17Å; N24-N26 PolarHBondContact O-OD1 3.21Å; N24-C76 HydrophobicContact CB-CB 4.25Å; N24-C76 PolarHBondContact ND2-SG 2.99Å
25	G	63.6	Low	76.8	Confident	19 Å²	19	60.6 Å²	60.6	20%	0.196	32%	0.318	C	S	.	.			trans	-71.5	91.4	176.6	0	0	0	0	0	112.6	L21	L21-G25 PolarHBondContact O-N 3.08Å
26	N	70.4	Confident	76.8	Confident	67 Å²	67	65.7 Å²	65.7	36%	0.358	34%	0.336	S	S	.	.			trans	-96.7	147.1	175.2	6.1	54.1	0	0	0	110.9	N24 T28 E29 L30	N24-N26 PolarHBondContact O-N 3.17Å; N24-N26 PolarHBondContact O-OD1 3.21Å; N26-T28 PolarHBondContact O-N 2.96Å; N26-E29 PolarHBondContact O-N 3.25Å; N26-E29 VanDerWaalsContact O-N 3.16Å; N26-L30 PolarHBondContact O-N 3.44Å
27	K	80.7	Confident	76.6	Confident	101 Å²	101	68.5 Å²	68.5	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-52.4	-42.4	174.3	-175.8	-168.6	170.8	-159.4	0	111.3	E29 L30 E31 V43 V45	K27-E29 VanDerWaalsContact C-N 3.29Å; K27-E29 PolarHBondContact O-N 3.26Å; K27-L30 WeakPolarHBondContact O-CB 3.44Å; K27-L30 PolarHBondContact O-N 2.82Å; K27-E31 IonicContact NZ-OE2 3.73Å; K27-E31 WeakPolarHBondContact O-CB 3.04Å; K27-E31 PolarHBondContact O-N 3.18Å; K27-V43 WeakPolarHBondContact CE-O 3.49Å; K27-V43 HydrophobicContact CG-CB 4.16Å; K27-V43 HydrophobicContact CG-CG1 3.73Å; K27-V45 HydrophobicContact CB-CG2 3.63Å; K27-V45 HydrophobicContact CG-CG2 4.1Å
28	T	81.8	Confident	76.4	Confident	83 Å²	83	66.4 Å²	66.4	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-38.6	-178.2	-48.1	0	0	0	0	112.6	N26 E31 R32	N26-T28 PolarHBondContact O-N 2.96Å; T28-E31 PolarHBondContact O-N 3.03Å; T28-R32 WeakPolarHBondContact O-CG 3.43Å; T28-R32 PolarHBondContact O-N 3.41Å; T28-R32 VanDerWaalsContact O-N 3.08Å
29	E	79.4	Confident	76.3	Confident	99 Å²	99	69.5 Å²	69.5	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-71.3	-41.2	178.9	-168.5	63.8	-171.5	0	0	110.8	N26 K27 R32 A33	N26-E29 PolarHBondContact O-N 3.25Å; N26-E29 VanDerWaalsContact O-N 3.16Å; K27-E29 VanDerWaalsContact C-N 3.29Å; K27-E29 PolarHBondContact O-N 3.26Å; E29-R32 PolarHBondContact O-N 3.48Å; E29-A33 WeakPolarHBondContact O-CB 3.21Å; E29-A33 PolarHBondContact O-N 2.89Å
30	L	80.4	Confident	76.5	Confident	8 Å²	8	71.5 Å²	71.5	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-61.2	-45.1	172.8	-98.4	69.8	0	0	0	111.8	V18 L21 N26 K27 R32 A33 F34 V43 A53 V55	V18-L30 HydrophobicContact CB-CD2 4.26Å; V18-L30 HydrophobicContact CG1-CD2 4.49Å; V18-L30 HydrophobicContact CG2-CD2 4.1Å; L21-L30 HydrophobicContact CD1-CD1 3.85Å; L21-L30 HydrophobicContact CD1-CD2 4.15Å; L21-L30 HydrophobicContact CD2-CD1 3.76Å; L21-L30 HydrophobicContact CG-CD1 4.47Å; N26-L30 PolarHBondContact O-N 3.44Å; K27-L30 WeakPolarHBondContact O-CB 3.44Å; K27-L30 PolarHBondContact O-N 2.82Å; L30-R32 VanDerWaalsContact C-N 3.27Å; L30-R32 PolarHBondContact O-N 3.39Å; L30-A33 PolarHBondContact O-N 3.44Å; L30-F34 HydrophobicContact CB-CD2 4.13Å; L30-F34 HydrophobicContact CD2-CE2 4.33Å; L30-F34 HydrophobicContact CG-CD2 3.9Å; L30-F34 HydrophobicContact CG-CE2 3.78Å; L30-F34 VanDerWaalsContact O-CB 3.26Å; L30-F34 WeakPolarHBondContact O-CB 3.12Å; L30-F34 VanDerWaalsContact O-CD2 3.27Å; L30-F34 WeakPolarHBondContact O-CD2 3.19Å; L30-F34 PolarHBondContact O-N 3.09Å; L30-V43 HydrophobicContact CB-CG1 4.26Å; L30-A53 HydrophobicContact CD2-CB 3.2Å; L30-V55 HydrophobicContact CD2-CG2 3.8Å; L30-V55 HydrophobicContact CG-CG2 4.44Å
31	E	83.7	Confident	76.9	Confident	95 Å²	95	75.8 Å²	75.8	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-39.4	179.9	-164.2	175.1	95.4	0	0	111.4	K27 T28 G35 L40	K27-E31 IonicContact NZ-OE2 3.73Å; K27-E31 WeakPolarHBondContact O-CB 3.04Å; K27-E31 PolarHBondContact O-N 3.18Å; T28-E31 PolarHBondContact O-N 3.03Å; E31-G35 VanDerWaalsContact O-CA 3.24Å; E31-G35 WeakPolarHBondContact O-CA 3.19Å; E31-G35 PolarHBondContact O-N 2.97Å; E31-L40 HydrophobicContact CB-CD1 4.42Å; E31-L40 HydrophobicContact CG-CD1 4.02Å; E31-L40 WeakPolarHBondContact O-CD1 3.47Å
32	R	82.3	Confident	77.5	Confident	187 Å²	187	77.8 Å²	77.8	71%	0.706	40%	0.398	S	S	*	.	H	α-helix	trans	-71.3	-46.8	175	-71.9	175.5	178.9	-117	-0.9	112.8	T28 E29 L30 Y36	T28-R32 WeakPolarHBondContact O-CG 3.43Å; T28-R32 PolarHBondContact O-N 3.41Å; T28-R32 VanDerWaalsContact O-N 3.08Å; E29-R32 PolarHBondContact O-N 3.48Å; L30-R32 VanDerWaalsContact C-N 3.27Å; L30-R32 PolarHBondContact O-N 3.39Å; R32-Y36 PolarHBondContact O-N 2.91Å
33	A	80.6	Confident	78.4	Confident	25 Å²	25	77.4 Å²	77.4	21%	0.207	39%	0.39	C	S	.	.	H	α-helix	trans	-68	-45.8	-176.4	0	0	0	0	0	111.8	E29 L30 Y37	E29-A33 WeakPolarHBondContact O-CB 3.21Å; E29-A33 PolarHBondContact O-N 2.89Å; L30-A33 PolarHBondContact O-N 3.44Å; A33-Y37 WeakPolarHBondContact O-CD2 3.14Å; A33-Y37 WeakPolarHBondContact O-CE2 3.45Å
34	F	81.8	Confident	79.4	Confident	7 Å²	7	76.2 Å²	76.2	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-79.8	-30.1	179	-71.6	-89.9	0	0	0	111.8	V16 V18 L30 Y36 Y37 G38 L40 V55 F57 A66 L70 V82	V16-F34 HydrophobicContact CG1-CE1 3.94Å; V16-F34 HydrophobicContact CG1-CZ 4.44Å; V18-F34 HydrophobicContact CG2-CE1 4.31Å; V18-F34 HydrophobicContact CG2-CE2 3.83Å; V18-F34 HydrophobicContact CG2-CZ 3.45Å; V18-F34 VanDerWaalsContact CG2-CZ 3.45Å; L30-F34 HydrophobicContact CB-CD2 4.13Å; L30-F34 HydrophobicContact CD2-CE2 4.33Å; L30-F34 HydrophobicContact CG-CD2 3.9Å; L30-F34 HydrophobicContact CG-CE2 3.78Å; L30-F34 VanDerWaalsContact O-CB 3.26Å; L30-F34 WeakPolarHBondContact O-CB 3.12Å; L30-F34 VanDerWaalsContact O-CD2 3.27Å; L30-F34 WeakPolarHBondContact O-CD2 3.19Å; L30-F34 PolarHBondContact O-N 3.09Å; F34-Y36 PolarHBondContact O-N 3.07Å; F34-Y37 PolarHBondContact O-N 3.05Å; F34-Y37 VanDerWaalsContact O-N 3.11Å; F34-G38 PolarHBondContact O-N 3.37Å; F34-L40 HydrophobicContact CB-CD1 4.25Å; F34-L40 HydrophobicContact CB-CD2 3.56Å; F34-V55 HydrophobicContact CB-CG1 4.11Å; F34-V55 HydrophobicContact CD1-CG1 4.35Å; F34-V55 HydrophobicContact CD1-CG2 4.49Å; F34-V55 HydrophobicContact CD2-CG2 4.03Å; F34-V55 HydrophobicContact CE2-CG2 4.31Å; F34-V55 HydrophobicContact CG-CG1 4.2Å; F34-V55 HydrophobicContact CG-CG2 4.14Å; F34-F57 HydrophobicContact CB-CE2 4.33Å; F34-F57 HydrophobicContact CB-CZ 3.73Å; F34-F57 AromaticContact CD1-CE2 3.66Å; F34-F57 HydrophobicContact CD1-CE2 3.66Å; F34-F57 AromaticContact CD1-CZ 3.62Å; F34-F57 HydrophobicContact CD1-CZ 3.62Å; F34-F57 HydrophobicContact CE1-CE2 4.47Å; F34-F57 HydrophobicContact CG-CE2 4.41Å; F34-F57 HydrophobicContact CG-CZ 4.16Å; F34-A66 HydrophobicContact CD1-CB 4.07Å; F34-A66 HydrophobicContact CE1-CB 4.34Å; F34-L70 HydrophobicContact CD1-CD1 3.67Å; F34-L70 HydrophobicContact CD2-CD1 4.21Å; F34-L70 HydrophobicContact CE1-CD1 3.4Å; F34-L70 HydrophobicContact CE2-CD1 3.95Å; F34-L70 HydrophobicContact CG-CD1 4.09Å; F34-L70 HydrophobicContact CZ-CD1 3.55Å; F34-V82 HydrophobicContact CE1-CG1 4.12Å; F34-V82 HydrophobicContact CZ-CG1 4.08Å; F34-V82 HydrophobicContact CZ-CG2 4.33Å
35	G	81.1	Confident	80.5	Confident	39 Å²	39	73.5 Å²	73.5	40%	0.402	36%	0.359	S	S	.	.	H	α-helix	trans	-67.8	-17.8	174.8	0	0	0	0	0	113.9	E31 Y37	E31-G35 VanDerWaalsContact O-CA 3.24Å; E31-G35 WeakPolarHBondContact O-CA 3.19Å; E31-G35 PolarHBondContact O-N 2.97Å; G35-Y37 VanDerWaalsContact C-N 3.31Å
36	Y	81.9	Confident	81.2	Confident	194 Å²	194	73.1 Å²	73.1	76%	0.761	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-33.2	170.4	-179.4	-101.1	0	0	0	112.6	R32 F34	R32-Y36 PolarHBondContact O-N 2.91Å; F34-Y36 PolarHBondContact O-N 3.07Å
37	Y	80.6	Confident	81.1	Confident	58 Å²	58	80.3 Å²	80.3	23%	0.227	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-30.6	-176.2	-62	-85.6	0	0	0	112.8	A33 F34 G35 A66 E69 L70	A33-Y37 WeakPolarHBondContact O-CD2 3.14Å; A33-Y37 WeakPolarHBondContact O-CE2 3.45Å; F34-Y37 PolarHBondContact O-N 3.05Å; F34-Y37 VanDerWaalsContact O-N 3.11Å; G35-Y37 VanDerWaalsContact C-N 3.31Å; Y37-A66 HydrophobicContact CD1-CB 4.47Å; Y37-A66 HydrophobicContact CD2-CB 4Å; Y37-A66 HydrophobicContact CG-CB 3.89Å; Y37-E69 HydrophobicContact CE1-CB 4.25Å; Y37-E69 HydrophobicContact CE1-CG 4.31Å; Y37-L70 HydrophobicContact CD2-CD1 4.14Å; Y37-L70 HydrophobicContact CE2-CD1 3.66Å; Y37-L70 HydrophobicContact CE2-CD2 3.99Å; Y37-L70 HydrophobicContact CE2-CG 3.9Å
38	G	79.6	Confident	79.9	Confident	11 Å²	11	82.5 Å²	82.5	11%	0.113	39%	0.393	C	S	.	.	S	Bend	trans	-179.1	171.1	179.5	0	0	0	0	0	114.1	F34 L40	F34-G38 PolarHBondContact O-N 3.37Å; G38-L40 PolarHBondContact O-N 2.87Å
39	P	81.2	Confident	78.7	Confident	64 Å²	64	82.5 Å²	82.5	42%	0.416	39%	0.394	S	S	.	.			trans	-63.2	125.8	177.3	24.7	-31.2	0	0	0	111.3	E58	P39-E58 HydrophobicContact CB-CB 4.35Å; P39-E58 HydrophobicContact CG-CB 3.97Å; P39-E58 PolarHBondContact O-N 2.79Å
40	L	83.8	Confident	77.6	Confident	44 Å²	44	82.6 Å²	82.6	23%	0.23	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.1	179.4	-54.2	168.5	0	0	0	109.2	E31 F34 G38 V43 V55 E56 F57	E31-L40 HydrophobicContact CB-CD1 4.42Å; E31-L40 HydrophobicContact CG-CD1 4.02Å; E31-L40 WeakPolarHBondContact O-CD1 3.47Å; F34-L40 HydrophobicContact CB-CD1 4.25Å; F34-L40 HydrophobicContact CB-CD2 3.56Å; G38-L40 PolarHBondContact O-N 2.87Å; L40-V43 HydrophobicContact CB-CG2 4.43Å; L40-V43 HydrophobicContact CD1-CG2 4.09Å; L40-V55 HydrophobicContact CD2-CG1 3.42Å; L40-V55 VanDerWaalsContact CD2-CG1 3.42Å; L40-E56 CarbonylContact C-O 3.51Å; L40-F57 HydrophobicContact CD2-CD1 3.88Å; L40-F57 HydrophobicContact CD2-CD2 4.42Å; L40-F57 HydrophobicContact CD2-CE1 3.48Å; L40-F57 VanDerWaalsContact CD2-CE1 3.48Å; L40-F57 HydrophobicContact CD2-CE2 4.07Å; L40-F57 HydrophobicContact CD2-CG 4.34Å; L40-F57 HydrophobicContact CD2-CZ 3.6Å
41	R	84.2	Confident	77	Confident	173 Å²	173	82.8 Å²	82.8	65%	0.653	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	-42.5	175.2	179.1	163.3	140.5	157.3	-9.7	112.2	E56	R41-E56 WeakPolarHBondContact CA-O 3.4Å; R41-E56 HydrophobicContact CB-CB 4.41Å; R41-E56 HydrophobicContact CB-CG 4.26Å; R41-E56 WeakPolarHBondContact CB-O 3.34Å; R41-E56 WeakPolarHBondContact CD-OE1 3.47Å; R41-E56 HydrophobicContact CG-CG 4.48Å; R41-E56 IonicContact CZ-OE1 3.21Å; R41-E56 PolarHBondContact N-O 2.97Å; R41-E56 IonicContact NE-OE1 2.65Å; R41-E56 PolarHBondContact NE-OE1 3.27Å; R41-E56 IonicContact NH2-OE1 3.11Å; R41-E56 PolarHBondContact NH2-OE1 2.89Å; R41-E56 VanDerWaalsContact NH2-OE1 3.11Å
42	S	81.3	Confident	76.7	Confident	64 Å²	64	80.6 Å²	80.6	45%	0.448	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	143.9	177.5	-169.4	0	0	0	0	112.2	V55 E56	S42-V55 CarbonylContact O-C 3.51Å; S42-E56 PolarHBondContact N-O 3.09Å; S42-E56 VanDerWaalsContact N-O 3.16Å; S42-E56 PolarHBondContact O-N 2.78Å
43	V	85	Confident	76.8	Confident	19 Å²	19	71.7 Å²	71.7	12%	0.115	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.8	175.8	-174.5	0	0	0	0	109.4	K27 L30 L40 V45 V55	K27-V43 WeakPolarHBondContact CE-O 3.49Å; K27-V43 HydrophobicContact CG-CB 4.16Å; K27-V43 HydrophobicContact CG-CG1 3.73Å; L30-V43 HydrophobicContact CB-CG1 4.26Å; L40-V43 HydrophobicContact CB-CG2 4.43Å; L40-V43 HydrophobicContact CD1-CG2 4.09Å; V43-V45 HydrophobicContact CG1-CG2 4.48Å; V43-V55 HydrophobicContact CG1-CG2 4.22Å; V43-V55 HydrophobicContact CG2-CG1 4.43Å
44	W	84	Confident	77.1	Confident	151 Å²	151	73 Å²	73	57%	0.572	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.2	178.1	-172.8	81.6	0	0	0	110.4	A46 A53 F54	W44-A46 HydrophobicContact CE3-CB 4.12Å; W44-A46 HydrophobicContact CH2-CB 3.37Å; W44-A46 HydrophobicContact CZ2-CB 4.3Å; W44-A46 HydrophobicContact CZ3-CB 3.27Å; W44-A53 CarbonylContact O-C 3.47Å; W44-A53 VanDerWaalsContact O-CA 3.25Å; W44-A53 WeakPolarHBondContact O-CA 3.37Å; W44-A53 WeakPolarHBondContact O-CB 3.49Å; W44-F54 HydrophobicContact CE3-CB 4.45Å; W44-F54 AromaticContact CE3-CD2 3.52Å; W44-F54 HydrophobicContact CE3-CD2 3.52Å; W44-F54 HydrophobicContact CE3-CE2 4.18Å; W44-F54 HydrophobicContact CE3-CG 4.38Å; W44-F54 AromaticContact CZ3-CD2 3.68Å; W44-F54 HydrophobicContact CZ3-CD2 3.68Å; W44-F54 AromaticContact CZ3-CE2 3.85Å; W44-F54 HydrophobicContact CZ3-CE2 3.85Å; W44-F54 PolarHBondContact N-O 3.41Å; W44-F54 PolarHBondContact O-N 3.4Å
45	V	82.6	Confident	77.3	Confident	35 Å²	35	72.7 Å²	72.7	21%	0.212	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.5	-179.3	-177.8	0	0	0	0	109.5	K27 V43 A53	K27-V45 HydrophobicContact CB-CG2 3.63Å; K27-V45 HydrophobicContact CG-CG2 4.1Å; V43-V45 HydrophobicContact CG1-CG2 4.48Å; V45-A53 HydrophobicContact CB-CB 4.35Å; V45-A53 HydrophobicContact CG1-CB 4.35Å; V45-A53 HydrophobicContact CG2-CB 3.94Å
46	A	78.4	Confident	77.5	Confident	12 Å²	12	73.4 Å²	73.4	10%	0.099	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.5	175.8	0	0	0	0	0	110.2	W44 F52	W44-A46 HydrophobicContact CE3-CB 4.12Å; W44-A46 HydrophobicContact CH2-CB 3.37Å; W44-A46 HydrophobicContact CZ2-CB 4.3Å; W44-A46 HydrophobicContact CZ3-CB 3.27Å; A46-F52 CarbonylContact C-O 3.58Å; A46-F52 WeakPolarHBondContact CA-O 3.33Å; A46-F52 HydrophobicContact CB-CB 4.11Å; A46-F52 PolarHBondContact N-O 3.19Å; A46-F52 PolarHBondContact O-N 3.04Å
47	R	69.8	Low	77.6	Confident	218 Å²	218	64.3 Å²	64.3	82%	0.823	32%	0.32	S	S	*	.			trans	-95.2	7.1	177	-63	-175.7	179	-173.3	0.1	113.9
48	N	53.7	Low	77.7	Confident	147 Å²	147	66.9 Å²	66.9	79%	0.786	33%	0.334	S	S	*	.	S	Bend	trans	-146.8	108.9	-176.3	-170.5	38.9	0	0	0	108.5
49	P	56.4	Low	77.7	Confident	82 Å²	82	68.5 Å²	68.5	53%	0.532	34%	0.34	S	S	.	.	S	Bend	cis	-74.8	-172.8	-1.2	-3.6	22.9	0	0	0	113.4	G51 F52	P49-G51 PolarHBondContact O-N 3.41Å; P49-F52 HydrophobicContact CB-CE2 3.88Å; P49-F52 HydrophobicContact CG-CE2 3.96Å
50	P	56.8	Low	77.4	Confident	101 Å²	101	66.8 Å²	66.8	66%	0.656	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	109.4	-160.7	26.5	-34.8	0	0	0	114.2
51	G	67.8	Low	77.3	Confident	12 Å²	12	73.2 Å²	73.2	12%	0.124	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	57.5	158.5	0	0	0	0	0	115.6	N20 L21 P49	N20-G51 PolarHBondContact N-O 3.2Å; N20-G51 VanDerWaalsContact N-O 3.14Å; L21-G51 WeakPolarHBondContact CB-O 3.26Å; L21-G51 PolarHBondContact N-O 3.21Å; P49-G51 PolarHBondContact O-N 3.41Å
52	F	78.7	Confident	77.2	Confident	50 Å²	50	67.2 Å²	67.2	22%	0.219	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	151.1	173.3	-57.6	-64.2	0	0	0	112	Y17 V18 A46 P49	Y17-F52 HydrophobicContact CE2-CB 4.12Å; Y17-F52 AromaticContact CE2-CD1 3.65Å; Y17-F52 HydrophobicContact CE2-CD1 3.65Å; Y17-F52 HydrophobicContact CE2-CE1 4.44Å; Y17-F52 HydrophobicContact CE2-CG 4.11Å; Y17-F52 AromaticContact CZ-CD1 3.45Å; Y17-F52 VanDerWaalsContact CZ-CD1 3.45Å; Y17-F52 AromaticContact CZ-CE1 3.84Å; Y17-F52 WeakPolarHBondContact OH-CD1 3.41Å; Y17-F52 WeakPolarHBondContact OH-CE1 3.3Å; V18-F52 CarbonylContact O-C 3.52Å; V18-F52 WeakPolarHBondContact O-CA 2.98Å; A46-F52 CarbonylContact C-O 3.58Å; A46-F52 WeakPolarHBondContact CA-O 3.33Å; A46-F52 HydrophobicContact CB-CB 4.11Å; A46-F52 PolarHBondContact N-O 3.19Å; A46-F52 PolarHBondContact O-N 3.04Å; P49-F52 HydrophobicContact CB-CE2 3.88Å; P49-F52 HydrophobicContact CG-CE2 3.96Å
53	A	84.5	Confident	77.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	160.8	171.8	0	0	0	0	0	110.6	V18 L21 L30 W44 V45	V18-A53 HydrophobicContact CB-CB 4.28Å; V18-A53 PolarHBondContact N-O 2.82Å; V18-A53 PolarHBondContact O-N 3.35Å; L21-A53 HydrophobicContact CD1-CB 3.59Å; L30-A53 HydrophobicContact CD2-CB 3.2Å; W44-A53 CarbonylContact O-C 3.47Å; W44-A53 VanDerWaalsContact O-CA 3.25Å; W44-A53 WeakPolarHBondContact O-CA 3.37Å; W44-A53 WeakPolarHBondContact O-CB 3.49Å; V45-A53 HydrophobicContact CB-CB 4.35Å; V45-A53 HydrophobicContact CG1-CB 4.35Å; V45-A53 HydrophobicContact CG2-CB 3.94Å
54	F	85.5	Confident	77	Confident	53 Å²	53	65.1 Å²	65.1	23%	0.232	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128	178.2	-68.9	-93.2	0	0	0	107.9	K15 V16 Y17 W44	K15-F54 HydrophobicContact CD-CD1 4.47Å; V16-F54 CarbonylContact O-C 3.52Å; V16-F54 VanDerWaalsContact O-CA 3.25Å; V16-F54 WeakPolarHBondContact O-CA 3.29Å; Y17-F54 HydrophobicContact CD2-CD1 4.04Å; Y17-F54 HydrophobicContact CD2-CD2 4.4Å; Y17-F54 AromaticContact CD2-CE1 3.48Å; Y17-F54 HydrophobicContact CD2-CE1 3.48Å; Y17-F54 VanDerWaalsContact CD2-CE1 3.48Å; Y17-F54 AromaticContact CD2-CE2 3.91Å; Y17-F54 HydrophobicContact CD2-CE2 3.91Å; Y17-F54 AromaticContact CD2-CZ 3.43Å; Y17-F54 HydrophobicContact CD2-CZ 3.43Å; Y17-F54 VanDerWaalsContact CD2-CZ 3.43Å; Y17-F54 HydrophobicContact CE2-CE1 4.38Å; Y17-F54 HydrophobicContact CE2-CE2 4.22Å; Y17-F54 AromaticContact CE2-CZ 3.91Å; Y17-F54 HydrophobicContact CE2-CZ 3.91Å; Y17-F54 HydrophobicContact CG-CE1 4.15Å; Y17-F54 HydrophobicContact CG-CZ 4.48Å; W44-F54 HydrophobicContact CE3-CB 4.45Å; W44-F54 AromaticContact CE3-CD2 3.52Å; W44-F54 HydrophobicContact CE3-CD2 3.52Å; W44-F54 HydrophobicContact CE3-CE2 4.18Å; W44-F54 HydrophobicContact CE3-CG 4.38Å; W44-F54 AromaticContact CZ3-CD2 3.68Å; W44-F54 HydrophobicContact CZ3-CD2 3.68Å; W44-F54 AromaticContact CZ3-CE2 3.85Å; W44-F54 HydrophobicContact CZ3-CE2 3.85Å; W44-F54 PolarHBondContact N-O 3.41Å; W44-F54 PolarHBondContact O-N 3.4Å
55	V	85.7	Confident	76.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.4	178.4	177.8	0	0	0	0	107	K15 V16 V18 L30 F34 L40 S42 V43 F57	K15-V55 CarbonylContact C-O 3.45Å; K15-V55 WeakPolarHBondContact CA-O 3.41Å; V16-V55 HydrophobicContact CB-CB 4.29Å; V16-V55 PolarHBondContact N-O 3.24Å; V16-V55 PolarHBondContact O-N 3.46Å; V18-V55 HydrophobicContact CG2-CG2 4.3Å; L30-V55 HydrophobicContact CD2-CG2 3.8Å; L30-V55 HydrophobicContact CG-CG2 4.44Å; F34-V55 HydrophobicContact CB-CG1 4.11Å; F34-V55 HydrophobicContact CD1-CG1 4.35Å; F34-V55 HydrophobicContact CD1-CG2 4.49Å; F34-V55 HydrophobicContact CD2-CG2 4.03Å; F34-V55 HydrophobicContact CE2-CG2 4.31Å; F34-V55 HydrophobicContact CG-CG1 4.2Å; F34-V55 HydrophobicContact CG-CG2 4.14Å; L40-V55 HydrophobicContact CD2-CG1 3.42Å; L40-V55 VanDerWaalsContact CD2-CG1 3.42Å; S42-V55 CarbonylContact O-C 3.51Å; V43-V55 HydrophobicContact CG1-CG2 4.22Å; V43-V55 HydrophobicContact CG2-CG1 4.43Å; V55-F57 HydrophobicContact CB-CE2 4.46Å; V55-F57 HydrophobicContact CG1-CD2 3.92Å; V55-F57 HydrophobicContact CG1-CE2 3.62Å; V55-F57 HydrophobicContact CG1-CZ 4.27Å
56	E	85.2	Confident	76.8	Confident	54 Å²	54	61 Å²	61	25%	0.252	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	121.9	173.5	-167.5	170.4	133.4	0	0	107.4	L40 R41 S42	L40-E56 CarbonylContact C-O 3.51Å; R41-E56 WeakPolarHBondContact CA-O 3.4Å; R41-E56 HydrophobicContact CB-CB 4.41Å; R41-E56 HydrophobicContact CB-CG 4.26Å; R41-E56 WeakPolarHBondContact CB-O 3.34Å; R41-E56 WeakPolarHBondContact CD-OE1 3.47Å; R41-E56 HydrophobicContact CG-CG 4.48Å; R41-E56 IonicContact CZ-OE1 3.21Å; R41-E56 PolarHBondContact N-O 2.97Å; R41-E56 IonicContact NE-OE1 2.65Å; R41-E56 PolarHBondContact NE-OE1 3.27Å; R41-E56 IonicContact NH2-OE1 3.11Å; R41-E56 PolarHBondContact NH2-OE1 2.89Å; R41-E56 VanDerWaalsContact NH2-OE1 3.11Å; S42-E56 PolarHBondContact N-O 3.09Å; S42-E56 VanDerWaalsContact N-O 3.16Å; S42-E56 PolarHBondContact O-N 2.78Å
57	F	85	Confident	77	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.009	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	158	175	-80.2	-91.2	0	0	0	111.1	C14 V16 F34 L40 V55 D59 D62 A63 A66	C14-F57 HydrophobicContact CB-CB 4.17Å; C14-F57 WeakPolarHBondContact CB-O 3.27Å; C14-F57 PolarHBondContact O-N 3.39Å; V16-F57 HydrophobicContact CB-CE2 4.5Å; V16-F57 HydrophobicContact CG2-CD2 3.84Å; V16-F57 HydrophobicContact CG2-CE2 3.86Å; F34-F57 HydrophobicContact CB-CE2 4.33Å; F34-F57 HydrophobicContact CB-CZ 3.73Å; F34-F57 AromaticContact CD1-CE2 3.66Å; F34-F57 HydrophobicContact CD1-CE2 3.66Å; F34-F57 AromaticContact CD1-CZ 3.62Å; F34-F57 HydrophobicContact CD1-CZ 3.62Å; F34-F57 HydrophobicContact CE1-CE2 4.47Å; F34-F57 HydrophobicContact CG-CE2 4.41Å; F34-F57 HydrophobicContact CG-CZ 4.16Å; L40-F57 HydrophobicContact CD2-CD1 3.88Å; L40-F57 HydrophobicContact CD2-CD2 4.42Å; L40-F57 HydrophobicContact CD2-CE1 3.48Å; L40-F57 VanDerWaalsContact CD2-CE1 3.48Å; L40-F57 HydrophobicContact CD2-CE2 4.07Å; L40-F57 HydrophobicContact CD2-CG 4.34Å; L40-F57 HydrophobicContact CD2-CZ 3.6Å; V55-F57 HydrophobicContact CB-CE2 4.46Å; V55-F57 HydrophobicContact CG1-CD2 3.92Å; V55-F57 HydrophobicContact CG1-CE2 3.62Å; V55-F57 HydrophobicContact CG1-CZ 4.27Å; F57-D59 WeakPolarHBondContact CB-O 3.47Å; F57-D62 HydrophobicContact CD1-CB 4.19Å; F57-D62 HydrophobicContact CE1-CB 4.45Å; F57-A63 HydrophobicContact CB-CB 3.99Å; F57-A63 HydrophobicContact CD2-CB 3.67Å; F57-A63 HydrophobicContact CE2-CB 4.38Å; F57-A63 HydrophobicContact CG-CB 3.94Å; F57-A66 HydrophobicContact CE2-CB 4.3Å; F57-A66 HydrophobicContact CZ-CB 3.86Å
58	E	82.4	Confident	77.5	Confident	113 Å²	113	60.6 Å²	60.6	53%	0.528	30%	0.303	S	S	.	.	S	Bend	trans	-69.7	-43.9	165.8	-164	163.4	109	0	0	110.3	P39	P39-E58 HydrophobicContact CB-CB 4.35Å; P39-E58 HydrophobicContact CG-CB 3.97Å; P39-E58 PolarHBondContact O-N 2.79Å
59	D	79.1	Confident	78.7	Confident	44 Å²	44	59.5 Å²	59.5	24%	0.235	29%	0.293	C	S	.	.			trans	-108.8	131.3	-177.4	-79	-69.9	0	0	0	113.4	H7 F57 R61 D62 A63	H7-D59 IonicContact CE1-OD1 3.7Å; F57-D59 WeakPolarHBondContact CB-O 3.47Å; D59-R61 VanDerWaalsContact C-N 3.26Å; D59-R61 PolarHBondContact O-N 3.22Å; D59-D62 HydrophobicContact CB-CB 4.33Å; D59-A63 PolarHBondContact O-N 2.73Å
60	P	76.1	Confident	79.7	Confident	28 Å²	28	56 Å²	56	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-73.1	-20.8	178.3	29	-33	0	0	0	112.9	D13 C14 S64	D13-P60 HydrophobicContact CB-CB 4Å; D13-P60 WeakPolarHBondContact OD1-CB 3.38Å; C14-P60 VanDerWaalsContact SG-CD 3.55Å; P60-S64 PolarHBondContact O-N 3.42Å; P60-S64 VanDerWaalsContact O-N 3.07Å
61	R	81.3	Confident	80.8	Confident	180 Å²	180	55.1 Å²	55.1	68%	0.679	26%	0.259	S	S	*	.	H	α-helix	trans	-66.7	-51.7	176.3	-62.5	179.1	-175.7	177.2	3	109.4	D59 A63 S64 D65	D59-R61 VanDerWaalsContact C-N 3.26Å; D59-R61 PolarHBondContact O-N 3.22Å; R61-A63 VanDerWaalsContact C-N 3.3Å; R61-A63 PolarHBondContact O-N 2.79Å; R61-S64 WeakPolarHBondContact O-CB 3.21Å; R61-S64 PolarHBondContact O-N 3.33Å; R61-S64 VanDerWaalsContact O-N 3.09Å; R61-D65 PolarHBondContact O-N 3.24Å
62	D	82	Confident	80.8	Confident	46 Å²	46	56.5 Å²	56.5	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-38.8	177.9	-55.9	-11	0	0	0	111.3	F57 D59 S64 D65 A66	F57-D62 HydrophobicContact CD1-CB 4.19Å; F57-D62 HydrophobicContact CE1-CB 4.45Å; D59-D62 HydrophobicContact CB-CB 4.33Å; D62-S64 VanDerWaalsContact C-N 3.35Å; D62-S64 PolarHBondContact O-N 2.98Å; D62-D65 PolarHBondContact O-N 2.73Å; D62-A66 WeakPolarHBondContact O-CB 3.26Å; D62-A66 PolarHBondContact O-N 2.85Å
63	A	82.8	Confident	80.3	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.2	-44.4	172.9	0	0	0	0	0	112.5	V16 F57 D59 R61 V67 L84	V16-A63 HydrophobicContact CG2-CB 3.78Å; F57-A63 HydrophobicContact CB-CB 3.99Å; F57-A63 HydrophobicContact CD2-CB 3.67Å; F57-A63 HydrophobicContact CE2-CB 4.38Å; F57-A63 HydrophobicContact CG-CB 3.94Å; D59-A63 PolarHBondContact O-N 2.73Å; R61-A63 VanDerWaalsContact C-N 3.3Å; R61-A63 PolarHBondContact O-N 2.79Å; A63-V67 WeakPolarHBondContact O-CB 2.82Å; A63-V67 WeakPolarHBondContact O-CG2 3.08Å; A63-V67 PolarHBondContact O-N 2.71Å; A63-L84 HydrophobicContact CB-CD2 4.08Å
64	S	79.3	Confident	79.1	Confident	39 Å²	39	65.3 Å²	65.3	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-65.6	-45.6	177.8	-91.3	0	0	0	0	112.7	P60 R61 D62 V67 R68 L84	P60-S64 PolarHBondContact O-N 3.42Å; P60-S64 VanDerWaalsContact O-N 3.07Å; R61-S64 WeakPolarHBondContact O-CB 3.21Å; R61-S64 PolarHBondContact O-N 3.33Å; R61-S64 VanDerWaalsContact O-N 3.09Å; D62-S64 VanDerWaalsContact C-N 3.35Å; D62-S64 PolarHBondContact O-N 2.98Å; S64-V67 PolarHBondContact O-N 2.91Å; S64-R68 VanDerWaalsContact O-CG 3.27Å; S64-R68 WeakPolarHBondContact O-CG 2.85Å; S64-R68 PolarHBondContact O-N 3.35Å; S64-L84 WeakPolarHBondContact OG-CD1 3.46Å
65	D	80.9	Confident	77.6	Confident	100 Å²	100	65.3 Å²	65.3	54%	0.535	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-45.4	177.9	-87.1	-74.6	0	0	0	111.1	R61 D62 V67 R68 E69	R61-D65 PolarHBondContact O-N 3.24Å; D62-D65 PolarHBondContact O-N 2.73Å; D65-V67 VanDerWaalsContact C-N 3.34Å; D65-V67 PolarHBondContact O-N 2.9Å; D65-R68 PolarHBondContact O-N 3.38Å; D65-E69 PolarHBondContact O-N 3.11Å
66	A	82.3	Confident	75.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-42.7	175.4	0	0	0	0	0	112.1	F34 Y37 F57 D62 L70	F34-A66 HydrophobicContact CD1-CB 4.07Å; F34-A66 HydrophobicContact CE1-CB 4.34Å; Y37-A66 HydrophobicContact CD1-CB 4.47Å; Y37-A66 HydrophobicContact CD2-CB 4Å; Y37-A66 HydrophobicContact CG-CB 3.89Å; F57-A66 HydrophobicContact CE2-CB 4.3Å; F57-A66 HydrophobicContact CZ-CB 3.86Å; D62-A66 WeakPolarHBondContact O-CB 3.26Å; D62-A66 PolarHBondContact O-N 2.85Å; A66-L70 HydrophobicContact CB-CD1 4.3Å; A66-L70 WeakPolarHBondContact O-CB 3.24Å; A66-L70 WeakPolarHBondContact O-CG 3.37Å; A66-L70 PolarHBondContact O-N 3.28Å
67	V	82.3	Confident	74.3	Confident	14 Å²	14	70.4 Å²	70.4	9%	0.085	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-45.1	176.5	170.8	0	0	0	0	111.1	V16 A63 S64 D65 E69 D71 V82 L84	V16-V67 HydrophobicContact CB-CG2 4.16Å; V16-V67 HydrophobicContact CG1-CG2 3.51Å; V16-V67 HydrophobicContact CG2-CG2 3.61Å; A63-V67 WeakPolarHBondContact O-CB 2.82Å; A63-V67 WeakPolarHBondContact O-CG2 3.08Å; A63-V67 PolarHBondContact O-N 2.71Å; S64-V67 PolarHBondContact O-N 2.91Å; D65-V67 VanDerWaalsContact C-N 3.34Å; D65-V67 PolarHBondContact O-N 2.9Å; V67-E69 VanDerWaalsContact C-N 3.31Å; V67-E69 PolarHBondContact O-N 2.81Å; V67-D71 WeakPolarHBondContact O-CA 3.47Å; V67-D71 WeakPolarHBondContact O-CB 3.33Å; V67-D71 PolarHBondContact O-N 3.05Å; V67-V82 HydrophobicContact CB-CG1 4.05Å; V67-V82 HydrophobicContact CG1-CB 4.39Å; V67-V82 HydrophobicContact CG1-CG1 4.13Å; V67-V82 WeakPolarHBondContact CG1-O 3.49Å; V67-V82 HydrophobicContact CG2-CG1 3.67Å; V67-L84 HydrophobicContact CB-CG 4.28Å; V67-L84 HydrophobicContact CG1-CG 4.33Å; V67-L84 HydrophobicContact CG2-CD2 3.73Å; V67-L84 HydrophobicContact CG2-CG 3.8Å
68	R	80.4	Confident	73.2	Confident	207 Å²	207	73 Å²	73	78%	0.781	39%	0.386	S	S	*	.	H	α-helix	trans	-66.8	-33.6	-176.9	-70.8	174.8	72.3	160.2	2	112.9	S64 D65	S64-R68 VanDerWaalsContact O-CG 3.27Å; S64-R68 WeakPolarHBondContact O-CG 2.85Å; S64-R68 PolarHBondContact O-N 3.35Å; D65-R68 PolarHBondContact O-N 3.38Å
69	E	78.6	Confident	72.7	Confident	125 Å²	125	76.2 Å²	76.2	58%	0.584	39%	0.394	S	S	*	.	H	α-helix	trans	-87.2	-30.4	-178.7	-167.5	131.3	57.7	0	0	113	Y37 D65 V67	Y37-E69 HydrophobicContact CE1-CB 4.25Å; Y37-E69 HydrophobicContact CE1-CG 4.31Å; D65-E69 PolarHBondContact O-N 3.11Å; V67-E69 VanDerWaalsContact C-N 3.31Å; V67-E69 PolarHBondContact O-N 2.81Å
70	L	77.3	Confident	72.7	Confident	8 Å²	8	74.6 Å²	74.6	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-95.2	-20.2	-178.8	-60.3	170.9	0	0	0	113.4	F34 Y37 A66 G72 R73 M75 V82	F34-L70 HydrophobicContact CD1-CD1 3.67Å; F34-L70 HydrophobicContact CD2-CD1 4.21Å; F34-L70 HydrophobicContact CE1-CD1 3.4Å; F34-L70 HydrophobicContact CE2-CD1 3.95Å; F34-L70 HydrophobicContact CG-CD1 4.09Å; F34-L70 HydrophobicContact CZ-CD1 3.55Å; Y37-L70 HydrophobicContact CD2-CD1 4.14Å; Y37-L70 HydrophobicContact CE2-CD1 3.66Å; Y37-L70 HydrophobicContact CE2-CD2 3.99Å; Y37-L70 HydrophobicContact CE2-CG 3.9Å; A66-L70 HydrophobicContact CB-CD1 4.3Å; A66-L70 WeakPolarHBondContact O-CB 3.24Å; A66-L70 WeakPolarHBondContact O-CG 3.37Å; A66-L70 PolarHBondContact O-N 3.28Å; L70-G72 PolarHBondContact O-N 2.73Å; L70-R73 WeakPolarHBondContact O-CB 3.28Å; L70-R73 PolarHBondContact O-N 2.88Å; L70-M75 HydrophobicContact CD2-CE 3.62Å; L70-V82 HydrophobicContact CB-CG2 3.9Å; L70-V82 WeakPolarHBondContact O-CG2 3.45Å
71	D	79.6	Confident	72.9	Confident	82 Å²	82	79.9 Å²	79.9	44%	0.439	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	128.6	174.7	-178	-123.7	0	0	0	111.4	V67 R73 V82	V67-D71 WeakPolarHBondContact O-CA 3.47Å; V67-D71 WeakPolarHBondContact O-CB 3.33Å; V67-D71 PolarHBondContact O-N 3.05Å; D71-R73 PolarHBondContact O-N 3.43Å; D71-V82 HydrophobicContact CB-CB 3.99Å; D71-V82 WeakPolarHBondContact CB-O 3.46Å; D71-V82 PolarHBondContact OD2-N 3.24Å; D71-V82 VanDerWaalsContact OD2-O 3.13Å
72	G	68.4	Low	73	Confident	42 Å²	42	71.5 Å²	71.5	43%	0.433	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	1	-179	0	0	0	0	0	114.3	L70 T74 V80	L70-G72 PolarHBondContact O-N 2.73Å; G72-T74 PolarHBondContact O-N 3.49Å; G72-V80 VanDerWaalsContact CA-O 3.3Å; G72-V80 WeakPolarHBondContact CA-O 3.43Å; G72-V80 PolarHBondContact N-O 3.14Å
73	R	68.9	Low	73	Confident	143 Å²	143	73.4 Å²	73.4	54%	0.54	38%	0.378	S	S	.	.			trans	-68.5	133.7	177	-156.5	154.6	-165.8	-108.6	3.3	109.7	L70 D71 M75 V80	L70-R73 WeakPolarHBondContact O-CB 3.28Å; L70-R73 PolarHBondContact O-N 2.88Å; D71-R73 PolarHBondContact O-N 3.43Å; R73-M75 HydrophobicContact CB-CE 3.98Å; R73-M75 HydrophobicContact CB-CG 4.39Å; R73-M75 HydrophobicContact CG-CE 3.74Å; R73-M75 HydrophobicContact CG-CG 4.39Å; R73-M75 PolarHBondContact O-N 3.07Å; R73-V80 PolarHBondContact O-N 2.7Å
74	T	58.6	Low	72.9	Confident	92 Å²	92	75.4 Å²	75.4	56%	0.564	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	101.1	178.3	-51.9	0	0	0	0	107.7	G72 C78	G72-T74 PolarHBondContact O-N 3.49Å; T74-C78 CarbonylContact C-O 3.53Å; T74-C78 WeakPolarHBondContact CA-O 3.25Å
75	M	53.9	Low	72.2	Confident	52 Å²	52	74.9 Å²	74.9	26%	0.256	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.3	178	-54.7	-148.8	169.9	0	0	109.1	L70 R73 G77 C78 V80	L70-M75 HydrophobicContact CD2-CE 3.62Å; R73-M75 HydrophobicContact CB-CE 3.98Å; R73-M75 HydrophobicContact CB-CG 4.39Å; R73-M75 HydrophobicContact CG-CE 3.74Å; R73-M75 HydrophobicContact CG-CG 4.39Å; R73-M75 PolarHBondContact O-N 3.07Å; M75-G77 PolarHBondContact O-N 3.42Å; M75-G77 VanDerWaalsContact O-N 3.11Å; M75-C78 PolarHBondContact N-O 2.77Å; M75-C78 PolarHBondContact O-N 3.29Å; M75-C78 VanDerWaalsContact O-N 3.07Å; M75-V80 HydrophobicContact CB-CG2 3.81Å; M75-V80 HydrophobicContact CG-CG2 4.04Å
76	C	45.6	Very low	70.9	Confident	94 Å²	94	75 Å²	75	64%	0.635	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	34.6	-179.5	-61.5	0	0	0	0	114.4	N24 C78	N24-C76 HydrophobicContact CB-CB 4.25Å; N24-C76 PolarHBondContact ND2-SG 2.99Å; C76-C78 VanDerWaalsContact C-N 3.32Å; C76-C78 PolarHBondContact O-N 2.74Å
77	G	56.5	Low	69.3	Low	68 Å²	68	76 Å²	76	70%	0.701	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	2.2	178.2	0	0	0	0	0	115.7	M75	M75-G77 PolarHBondContact O-N 3.42Å; M75-G77 VanDerWaalsContact O-N 3.11Å
78	C	60.5	Low	67.7	Low	55 Å²	55	83.7 Å²	83.7	37%	0.372	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	148	175.6	-69.9	0	0	0	0	111	T74 M75 C76 V80	T74-C78 CarbonylContact C-O 3.53Å; T74-C78 WeakPolarHBondContact CA-O 3.25Å; M75-C78 PolarHBondContact N-O 2.77Å; M75-C78 PolarHBondContact O-N 3.29Å; M75-C78 VanDerWaalsContact O-N 3.07Å; C76-C78 VanDerWaalsContact C-N 3.32Å; C76-C78 PolarHBondContact O-N 2.74Å; C78-V80 PolarHBondContact O-N 2.81Å
79	R	72.3	Confident	66.1	Low	182 Å²	182	79.2 Å²	79.2	69%	0.687	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.3	174.7	-72.7	-176.7	178	-172.5	-1.4	109.6	N20	N20-R79 WeakPolarHBondContact CB-O 3.43Å; N20-R79 VanDerWaalsContact CG-O 3.3Å; N20-R79 PolarHBondContact ND2-O 3.11Å
80	V	79.1	Confident	64.6	Low	9 Å²	9	83.8 Å²	83.8	6%	0.055	43%	0.433	C	S	.	.			trans	-73.2	138.7	174.3	-175.1	0	0	0	0	108.4	V18 L21 G72 R73 M75 C78 V82	V18-V80 HydrophobicContact CG1-CG1 3.43Å; V18-V80 VanDerWaalsContact CG1-CG1 3.43Å; L21-V80 HydrophobicContact CD2-CG1 3.73Å; L21-V80 HydrophobicContact CD2-CG2 4Å; L21-V80 HydrophobicContact CG-CG1 4.33Å; G72-V80 VanDerWaalsContact CA-O 3.3Å; G72-V80 WeakPolarHBondContact CA-O 3.43Å; G72-V80 PolarHBondContact N-O 3.14Å; R73-V80 PolarHBondContact O-N 2.7Å; M75-V80 HydrophobicContact CB-CG2 3.81Å; M75-V80 HydrophobicContact CG-CG2 4.04Å; C78-V80 PolarHBondContact O-N 2.81Å; V80-V82 HydrophobicContact CG1-CG2 3.95Å
81	R	79.9	Confident	63.4	Low	139 Å²	139	87.6 Å²	87.6	53%	0.525	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.5	172.8	-179.2	173.3	174.2	178.4	-5	108	V18 G19 E83	V18-R81 CarbonylContact C-O 3.52Å; V18-R81 WeakPolarHBondContact CA-O 3.27Å; G19-R81 PolarHBondContact N-O 3.11Å; G19-R81 PolarHBondContact O-N 2.83Å; R81-E83 IonicContact CZ-OE2 3.92Å; R81-E83 IonicContact NE-OE2 3.65Å; R81-E83 IonicContact NH2-OE2 2.78Å; R81-E83 PolarHBondContact NH2-OE2 2.72Å
82	V	84.9	Confident	62.1	Low	5 Å²	5	94.8 Å²	94.8	3%	0.03	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.5	179.2	-169.5	0	0	0	0	107.8	V16 Y17 V18 F34 V67 L70 D71 V80	V16-V82 HydrophobicContact CG1-CG1 3.27Å; Y17-V82 CarbonylContact O-C 3.59Å; Y17-V82 WeakPolarHBondContact O-CA 3.48Å; V18-V82 HydrophobicContact CG1-CG2 4.21Å; V18-V82 HydrophobicContact CG2-CG1 4.32Å; F34-V82 HydrophobicContact CE1-CG1 4.12Å; F34-V82 HydrophobicContact CZ-CG1 4.08Å; F34-V82 HydrophobicContact CZ-CG2 4.33Å; V67-V82 HydrophobicContact CB-CG1 4.05Å; V67-V82 HydrophobicContact CG1-CB 4.39Å; V67-V82 HydrophobicContact CG1-CG1 4.13Å; V67-V82 WeakPolarHBondContact CG1-O 3.49Å; V67-V82 HydrophobicContact CG2-CG1 3.67Å; L70-V82 HydrophobicContact CB-CG2 3.9Å; L70-V82 WeakPolarHBondContact O-CG2 3.45Å; D71-V82 HydrophobicContact CB-CB 3.99Å; D71-V82 WeakPolarHBondContact CB-O 3.46Å; D71-V82 PolarHBondContact OD2-N 3.24Å; D71-V82 VanDerWaalsContact OD2-O 3.13Å; V80-V82 HydrophobicContact CG1-CG2 3.95Å
83	E	81.1	Confident	61.5	Low	85 Å²	85	98.5 Å²	98.5	40%	0.397	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.4	-176	-166.7	170.6	93.7	0	0	109.4	Y17 R81 S85	Y17-E83 WeakPolarHBondContact CA-O 3.33Å; Y17-E83 HydrophobicContact CD1-CB 4.17Å; Y17-E83 PolarHBondContact N-O 3.16Å; Y17-E83 PolarHBondContact O-N 2.74Å; R81-E83 IonicContact CZ-OE2 3.92Å; R81-E83 IonicContact NE-OE2 3.65Å; R81-E83 IonicContact NH2-OE2 2.78Å; R81-E83 PolarHBondContact NH2-OE2 2.72Å; E83-S85 PolarHBondContact O-N 3.23Å
84	L	79.9	Confident	60.6	Low	43 Å²	43	102.6 Å²	102.6	23%	0.225	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	121.2	170.2	-69.4	161.8	0	0	0	108.5	V16 A63 S64 V67 T86	V16-L84 HydrophobicContact CG2-CD2 4.16Å; A63-L84 HydrophobicContact CB-CD2 4.08Å; S64-L84 WeakPolarHBondContact OG-CD1 3.46Å; V67-L84 HydrophobicContact CB-CG 4.28Å; V67-L84 HydrophobicContact CG1-CG 4.33Å; V67-L84 HydrophobicContact CG2-CD2 3.73Å; V67-L84 HydrophobicContact CG2-CG 3.8Å; L84-T86 VanDerWaalsContact C-N 3.26Å; L84-T86 PolarHBondContact O-N 3.46Å; L84-T86 PolarHBondContact O-OG1 3.36Å
85	S	64.6	Low	60.5	Low	27 Å²	27	100.7 Å²	100.7	19%	0.189	51%	0.514	C	S	.	.			trans	-66.4	89.9	175.2	-71.7	0	0	0	0	108.3	K15 Y17 E83 G87	K15-S85 WeakPolarHBondContact O-CA 3.49Å; K15-S85 VanDerWaalsContact O-CB 3.28Å; K15-S85 WeakPolarHBondContact O-CB 3.48Å; K15-S85 PolarHBondContact O-N 3.29Å; Y17-S85 PolarHBondContact N-OG 2.82Å; E83-S85 PolarHBondContact O-N 3.23Å; S85-G87 PolarHBondContact O-N 3.34Å
86	T	54.8	Low	60.7	Low	102 Å²	102	103.7 Å²	103.7	63%	0.626	54%	0.538	S	S	*	.			trans	-76.5	88	-171	-29.1	0	0	0	0	109.3	L84 E88	L84-T86 VanDerWaalsContact C-N 3.26Å; L84-T86 PolarHBondContact O-N 3.46Å; L84-T86 PolarHBondContact O-OG1 3.36Å; T86-E88 VanDerWaalsContact C-N 3.25Å; T86-E88 PolarHBondContact O-N 3.36Å; T86-E88 VanDerWaalsContact O-N 3.09Å
87	G	48.8	Very low	61.3	Low	22 Å²	22	103.9 Å²	103.9	23%	0.227	54%	0.538	C	S	.	.			trans	-75.8	87.3	157.3	0	0	0	0	0	108.6	L12 S85 K89	L12-G87 WeakPolarHBondContact CB-O 3.25Å; L12-G87 VanDerWaalsContact CD1-O 3.26Å; L12-G87 WeakPolarHBondContact CD1-O 3.48Å; S85-G87 PolarHBondContact O-N 3.34Å; G87-K89 PolarHBondContact O-N 3.08Å
88	E	47.7	Very low	61.2	Low	175 Å²	175	104.4 Å²	104.4	82%	0.818	53%	0.529	S	S	*	.	S	Bend	trans	42	65.6	157.9	-166	135.6	82.6	0	0	117.2	T86	T86-E88 VanDerWaalsContact C-N 3.25Å; T86-E88 PolarHBondContact O-N 3.36Å; T86-E88 VanDerWaalsContact O-N 3.09Å
89	K	46.3	Very low	61.1	Low	114 Å²	114	106.5 Å²	106.5	50%	0.496	54%	0.544	S	S	.	.			trans	-121.8	44.9	149.8	-65.8	-173.1	-175.5	179.4	0	111.3	D9 G87 S91	D9-K89 PolarHBondContact O-NZ 2.83Å; G87-K89 PolarHBondContact O-N 3.08Å; K89-S91 PolarHBondContact O-N 3.47Å
90	R	48.4	Very low	60.2	Low	221 Å²	221	107.9 Å²	107.9	83%	0.834	55%	0.55	S	S	*	.			trans	-75.9	54.8	157.5	-167	176.9	176.9	165.5	-1.3	110.1
91	S	51.7	Low	58.9	Low	88 Å²	88	110.9 Å²	110.9	62%	0.615	57%	0.571	S	S	*	*			trans	-169.4	93.4	175	-176.1	0	0	0	0	105.2	K89	K89-S91 PolarHBondContact O-N 3.47Å
92	R	53.2	Low	57.4	Low	233 Å²	233	114.3 Å²	114.3	88%	0.879	58%	0.584	S	S	*	*	S	Bend		-173.6	29.4	94.1	-84.6	167	-171.7	162	2.4	112.8
93	S	54.1	Low	55.6	Low	120 Å²	120	125 Å²	125	84%	0.839	62%	0.624	S	S	*	*	S	Bend	trans	-144.5	-2.1	179.9	-43.8	0	0	0	0	116.6	G95	S93-G95 PolarHBondContact O-N 3.44Å
94	R	51.1	Low	53.9	Low	228 Å²	228	127.1 Å²	127.1	86%	0.86	65%	0.645	S	S	*	*			trans	-84.9	93.4	163.1	-86	-179.7	179.4	170.3	1.1	107.8
95	G	55.6	Low	52.3	Low	52 Å²	52	136.3 Å²	136.3	54%	0.536	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-49.4	169.6	159.9	0	0	0	0	0	111.5	S93	S93-G95 PolarHBondContact O-N 3.44Å
96	P	58.4	Low	51.5	Low	116 Å²	116	140.8 Å²	140.8	75%	0.753	70%	0.699	S	S	*	*	S	Bend	trans	-47.2	139.7	-177.7	19.5	-31.7	0	0	0	110.6
97	P	58.8	Low	51.1	Low	97 Å²	97	142.2 Å²	142.2	63%	0.63	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-53	142.8	-175.4	22.6	-33.7	0	0	0	110.2	S99	P97-S99 PolarHBondContact O-N 3.06Å
98	P	54.6	Low	50.9	Low	80 Å²	80	149.6 Å²	149.6	52%	0.519	73%	0.728	S	S	.	*	P	Polyproline II helix	trans	-54.4	136.3	178	22.7	-33.4	0	0	0	110	W100 S101	P98-W100 HydrophobicContact CG-CZ2 4.4Å; P98-W100 PolarHBondContact O-N 2.76Å; P98-S101 PolarHBondContact O-N 3.22Å
99	S	57.1	Low	51	Low	99 Å²	99	152.7 Å²	152.7	69%	0.692	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-51.4	-19.4	-163.8	-174.6	0	0	0	0	115.4	P97 S101 R102	P97-S99 PolarHBondContact O-N 3.06Å; S99-S101 PolarHBondContact O-N 2.72Å; S99-R102 PolarHBondContact O-N 2.89Å; S99-R102 VanDerWaalsContact O-N 3.08Å
100	W	54.8	Low	51.2	Low	211 Å²	211	158.2 Å²	158.2	80%	0.799	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-66.4	-16.3	179	61.7	-96.5	0	0	0	114.9	P98	P98-W100 HydrophobicContact CG-CZ2 4.4Å; P98-W100 PolarHBondContact O-N 2.76Å
101	S	51.9	Low	51	Low	72 Å²	72	158.9 Å²	158.9	50%	0.503	75%	0.753	S	S	.	*	G	3₁₀ helix	trans	-86.1	-3.3	172.6	-70.1	0	0	0	0	114.1	P98 S99 R103	P98-S101 PolarHBondContact O-N 3.22Å; S99-S101 PolarHBondContact O-N 2.72Å; S101-R103 PolarHBondContact O-N 3.03Å
102	R	47.8	Very low	50.6	Low	210 Å²	210	159.9 Å²	159.9	79%	0.792	76%	0.76	S	S	*	*			trans	-83.4	90.5	167.6	-73.4	-168.9	-172.1	-145.3	3.4	109.1	S99 P104	S99-R102 PolarHBondContact O-N 2.89Å; S99-R102 VanDerWaalsContact O-N 3.08Å; R102-P104 WeakPolarHBondContact O-CD 3.36Å
103	R	47.4	Very low	50.6	Low	229 Å²	229	154.4 Å²	154.4	86%	0.864	75%	0.754	S	S	*	*			trans	-55	125.2	152.9	-78.5	-178	153	-152.1	-6.2	107.4	S101 R105	S101-R103 PolarHBondContact O-N 3.03Å; R103-R105 PolarHBondContact O-N 2.8Å
104	P	44.2	Very low	50.3	Low	130 Å²	130	154 Å²	154	84%	0.844	75%	0.749	S	S	*	*			trans	-67.7	99	178.2	25.8	-30.3	0	0	0	107.8	R102 D106	R102-P104 WeakPolarHBondContact O-CD 3.36Å; P104-D106 VanDerWaalsContact C-N 3.3Å; P104-D106 PolarHBondContact O-N 3.11Å; P104-D106 VanDerWaalsContact O-N 3.11Å
105	R	46.7	Very low	50.1	Low	236 Å²	236	150 Å²	150	89%	0.891	75%	0.75	S	S	*	*			trans	-83.4	85.4	173.4	-163.3	160.4	-154.4	-137.8	0.3	107.6	R103 D107	R103-R105 PolarHBondContact O-N 2.8Å; R105-D107 PolarHBondContact O-N 3.16Å
106	D	47.6	Very low	49.6	Very low	122 Å²	122	158.8 Å²	158.8	65%	0.652	77%	0.767	S	S	*	*			trans	34.9	70.9	150	-141.4	-100.3	0	0	0	115.1	P104 F108	P104-D106 VanDerWaalsContact C-N 3.3Å; P104-D106 PolarHBondContact O-N 3.11Å; P104-D106 VanDerWaalsContact O-N 3.11Å; D106-F108 PolarHBondContact O-N 2.65Å; D106-F108 WeakPolarHBondContact OD1-CD2 3.41Å
107	D	47.1	Very low	48.9	Very low	131 Å²	131	164.8 Å²	164.8	70%	0.701	77%	0.774	S	S	*	*			trans	-87.5	50.5	175.3	-159	-103.1	0	0	0	111.2	R105 R109	R105-D107 PolarHBondContact O-N 3.16Å; D107-R109 VanDerWaalsContact C-N 3.25Å; D107-R109 PolarHBondContact O-N 3.37Å
108	F	45.5	Very low	47.9	Very low	177 Å²	177	172 Å²	172	78%	0.776	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	11.9	173.7	-73.1	-72.5	0	0	0	113.5	D106	D106-F108 PolarHBondContact O-N 2.65Å; D106-F108 WeakPolarHBondContact OD1-CD2 3.41Å
109	R	50.2	Low	47.2	Very low	241 Å²	241	173.5 Å²	173.5	91%	0.909	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	4.9	-175.2	-76	-167.5	179.5	-141.2	1.5	116.6	D107	D107-R109 VanDerWaalsContact C-N 3.25Å; D107-R109 PolarHBondContact O-N 3.37Å
110	R	50.4	Low	46.8	Very low	229 Å²	229	174.2 Å²	174.2	86%	0.864	80%	0.804	S	S	*	*	S	Bend	trans	-136.7	36.1	179	-92.3	-170.5	-177.9	-108.8	2.3	115.8
111	R	42.8	Very low	45.9	Very low	236 Å²	236	173.5 Å²	173.5	89%	0.891	80%	0.801	S	S	*	*			trans	-130.1	106.4	164.8	-145	158	-169.2	-156.4	0.5	111.2
112	S	43.8	Very low	45.2	Very low	108 Å²	108	178.3 Å²	178.3	76%	0.755	81%	0.808	S	S	*	*			trans	-42.2	135.5	167.8	-50	0	0	0	0	110.4
113	P	53.7	Low	44.7	Very low	118 Å²	118	179.4 Å²	179.4	77%	0.766	81%	0.812	S	S	*	*			trans	-64.5	140.7	176.4	25.4	-31.2	0	0	0	109.8	V115	P113-V115 PolarHBondContact O-N 3.26Å
114	P	47.4	Very low	44.3	Very low	112 Å²	112	173.5 Å²	173.5	73%	0.727	81%	0.806	S	S	*	*			trans	-66.6	130.8	177.2	26.4	-31.9	0	0	0	110.3	R116	P114-R116 PolarHBondContact O-N 3.06Å
115	V	47.7	Very low	43.8	Very low	145 Å²	145	175.6 Å²	175.6	88%	0.879	81%	0.809	S	S	*	*			trans	-58.7	104.3	169.8	-89.3	0	0	0	0	110.4	P113	P113-V115 PolarHBondContact O-N 3.26Å
116	R	43.1	Very low	43.3	Very low	236 Å²	236	168.9 Å²	168.9	89%	0.891	80%	0.799	S	S	*	*			trans	-99	103.3	163.1	-75.8	-171.4	178.2	-115.7	1.6	109.6	P114	P114-R116 PolarHBondContact O-N 3.06Å
117	R	44.9	Very low	42.7	Very low	242 Å²	242	174.2 Å²	174.2	91%	0.913	81%	0.81	S	S	*	*			trans	-61.5	126.6	163.2	-81.7	176.7	160.4	-130.6	-1.1	110.4
118	R	36.5	Very low	42.1	Very low	247 Å²	247	173 Å²	173	93%	0.932	81%	0.811	S	S	*	*				154.2	109.8	127.2	-97.9	176.2	161.8	158.2	-5.9	110.9
119	S	39.9	Very low	41.5	Very low	112 Å²	112	175.9 Å²	175.9	78%	0.783	82%	0.817	S	S	*	*			trans	-75	162.5	155.2	-36.4	0	0	0	0	108.7
120	P	48.8	Very low	40.7	Very low	115 Å²	115	169 Å²	169	75%	0.747	81%	0.806	S	S	*	*				-155.9	165.5	56.6	41.9	-19.8	0	0	0	119.2
121	R	35.9	Very low	40	Very low	195 Å²	195	169.4 Å²	169.4	74%	0.736	81%	0.807	S	S	*	*			trans	88.2	127.2	131.2	-107.3	-176.1	173.4	-172	1.6	122.7
122	R	38.8	Very low	39.6	Very low	173 Å²	173	163.6 Å²	163.6	65%	0.653	80%	0.803	S	S	*	*			trans	79.1	142.3	148.9	-55.8	-170.5	-172.8	-77.4	14.7	114.7
123	R	36.2	Very low	39.3	Very low	233 Å²	233	166.6 Å²	166.6	88%	0.879	81%	0.81	S	S	*	*			cis	-163.8	147.3	26.8	-144.6	166.5	-177.6	157.4	-3.8	108.5
124	S	39	Very low	38.4	Very low	105 Å²	105	166.7 Å²	166.7	73%	0.734	81%	0.814	S	S	*	*			trans	-62.6	149.3	-178	46.3	0	0	0	0	116.6
125	L	33.9	Very low	38.1	Very low	175 Å²	175	173 Å²	173	92%	0.916	82%	0.823	S	S	*	*			trans	-163.6	138	133.1	-141.9	66.5	0	0	0	113.6
126	S	35.3	Very low	37.5	Very low	95 Å²	95	172.7 Å²	172.7	66%	0.664	82%	0.816	S	S	*	*			trans	-88	148	-174.6	38.9	0	0	0	0	113.7
127	R	35.5	Very low	37	Very low	234 Å²	234	171.8 Å²	171.8	88%	0.883	81%	0.813	S	S	*	*			trans	163.7	109	137	-97.6	169.9	159.5	116.3	-5.2	114.7
128	S	33.9	Very low	36.6	Very low	106 Å²	106	171.7 Å²	171.7	74%	0.741	81%	0.812	S	S	*	*			trans	32.5	124.2	131.8	-32.2	0	0	0	0	122.2
129	R	33.9	Very low	36.4	Very low	236 Å²	236	171.9 Å²	171.9	89%	0.891	81%	0.813	S	S	*	*				152.8	101	116.4	-90.1	172.9	162.7	153	-6.1	115.3
130	S	33.8	Very low	36	Very low	98 Å²	98	176.3 Å²	176.3	69%	0.685	81%	0.814	S	S	*	*				58.9	135.7	123	-36.2	0	0	0	0	124.1
131	R	34	Very low	35.3	Very low	236 Å²	236	181.3 Å²	181.3	89%	0.891	82%	0.818	S	S	*	*			trans	97	138.4	147.7	-58.4	164.2	-178.5	161.9	-1.9	117
132	S	34.4	Very low	35.1	Very low	115 Å²	115	176.5 Å²	176.5	80%	0.804	81%	0.814	S	S	*	*			cis	-170	155.4	-19.3	-78.1	0	0	0	0	106.6
133	L	37.8	Very low	35.1	Very low	170 Å²	170	175.8 Å²	175.8	89%	0.89	82%	0.823	S	S	*	*			trans	-63.8	140.7	178	-59.5	160.2	0	0	0	113.3
134	S	34.4	Very low	35.1	Very low	121 Å²	121	169.6 Å²	169.6	85%	0.846	82%	0.815	S	S	*	*			trans	-167.2	114.9	137.5	-6.1	0	0	0	0	113.6
135	R	41.3	Very low	35.3	Very low	244 Å²	244	176.4 Å²	176.4	92%	0.921	82%	0.824	S	S	*	*			trans	-59.2	139.2	145.5	-90.2	167.2	162.9	158.4	-6.1	108.5
136	D	35.6	Very low	35.7	Very low	138 Å²	138	173.6 Å²	173.6	74%	0.738	81%	0.811	S	S	*	*				156.4	163.3	121.6	-149.7	-92.8	0	0	0	112.1
137	R	33.6	Very low	35.9	Very low	218 Å²	218	177.3 Å²	177.3	82%	0.823	82%	0.815	S	S	*	*			trans	90.4	84.7	163	-60.8	-174.5	-178.2	172.3	0.4	119.7
138	R	35.3	Very low	36.1	Very low	239 Å²	239	172.8 Å²	172.8	90%	0.902	81%	0.808	S	S	*	*				20.4	109.2	117.6	-57.8	-161.2	-170.3	-156.1	5.8	115.3
139	R	33.6	Very low	36.2	Very low	251 Å²	251	179.1 Å²	179.1	95%	0.947	82%	0.816	S	S	*	*			trans	-111.7	103.4	158.7	-155.8	170.6	-149.7	177.6	5.4	109.4
140	Y	30.2	Very low	36.3	Very low	206 Å²	206	176.7 Å²	176.7	81%	0.808	81%	0.811	S	S	*	*			trans	-60.9	165.3	166.9	-134.4	-99	0	0	0	110.2
141	R	34.1	Very low	36.2	Very low	220 Å²	220	184.4 Å²	184.4	83%	0.83	83%	0.826	S	S	*	*			trans	104.7	80.9	148.9	-124.1	166.7	-169.1	131.4	-0.2	117.7
142	S	32.8	Very low	36.3	Very low	93 Å²	93	177.5 Å²	177.5	65%	0.65	81%	0.814	S	S	*	*				65.1	126.5	125.3	-37.6	0	0	0	0	120
143	L	38.6	Very low	36.2	Very low	159 Å²	159	183.1 Å²	183.1	83%	0.832	82%	0.817	S	S	*	*				167.3	121.9	100.5	-81	172.3	0	0	0	112.3
144	S	35.4	Very low	36.1	Very low	102 Å²	102	180.4 Å²	180.4	71%	0.713	81%	0.813	S	S	*	*			trans	67.4	97.9	136.1	-52.2	0	0	0	0	121.5
145	R	43.4	Very low	36.1	Very low	248 Å²	248	183 Å²	183	94%	0.936	81%	0.809	S	S	*	*				-178.1	103.1	102.8	-116.2	170.9	170.2	-178.1	-3.9	112.8
146	D	42.2	Very low	35.8	Very low	117 Å²	117	175.3 Å²	175.3	63%	0.626	79%	0.792	S	S	*	*			trans	-26.5	155.8	141.6	-85	-112.6	0	0	0	114.7
147	K	39.9	Very low	35.8	Very low	173 Å²	173	179 Å²	179	75%	0.752	80%	0.796	S	S	*	*			cis	-170	142.6	-1.3	-125.4	177.6	-170.7	120.9	0	106.7
148	N	39.1	Very low	35.9	Very low	139 Å²	139	173.1 Å²	173.1	74%	0.743	79%	0.788	S	S	*	*			trans	-47.2	130.2	153.3	-178	-18.4	0	0	0	111.3
149	R	37.2	Very low	35.9	Very low	238 Å²	238	172.7 Å²	172.7	90%	0.898	79%	0.787	S	S	*	*			trans	-156	119.7	151	-129.8	172.9	-176.7	179.6	-0.5	114.6
150	K	35.4	Very low	36.1	Very low	185 Å²	185	165.6 Å²	165.6	80%	0.804	78%	0.776	S	S	*	*			trans	-43.7	137.7	167	-55.7	-163.2	175.3	-170	0	112.6
151	R	32.1	Very low	36.6	Very low	260 Å²	260	166.9 Å²	166.9	98%	0.981	78%	0.779	S	S	*	*			trans	-97.5	110.5	172.7	-165.6	164.8	-171.8	-144.7	1	109.7
152	S	34.9	Very low	37	Very low	92 Å²	92	161.5 Å²	161.5	64%	0.643	78%	0.775	S	S	*	*			trans	-136	131.9	169.4	46.3	0	0	0	0	110.2
153	R	33.5	Very low	37.2	Very low	233 Å²	233	168.3 Å²	168.3	88%	0.879	79%	0.786	S	S	*	*			trans	73.5	108.3	149.4	-72.2	178.7	174.5	136.6	-1.9	119.9
154	S	35.9	Very low	37.1	Very low	113 Å²	113	165.4 Å²	165.4	79%	0.79	78%	0.779	S	S	*	*				44.8	126.2	127.1	53.4	0	0	0	0	121.6
155	F	33.1	Very low	37.4	Very low	175 Å²	175	168.1 Å²	168.1	77%	0.768	78%	0.78	S	S	*	*				-163.9	146.4	128.2	-162.9	-107.9	0	0	0	113.2
156	S	35.8	Very low	37.1	Very low	82 Å²	82	163.6 Å²	163.6	57%	0.573	77%	0.77	S	S	*	*			trans	-43.6	166.1	177.1	-21.2	0	0	0	0	120.2
157	R	34.7	Very low	37	Very low	216 Å²	216	169 Å²	169	82%	0.815	78%	0.782	S	S	*	*			trans	121.1	107.6	132.5	-94.5	178.6	167.8	157.9	-3.5	117.9
158	S	37.7	Very low	37.1	Very low	94 Å²	94	174.1 Å²	174.1	66%	0.657	80%	0.804	S	S	*	*				101	119	120	-57.6	0	0	0	0	120.6
159	R	33.7	Very low	37	Very low	231 Å²	231	175.9 Å²	175.9	87%	0.872	81%	0.807	S	S	*	*				74.5	110.2	124.3	-91.4	179	173.6	166.6	-2.5	119.8
160	S	38	Very low	37	Very low	102 Å²	102	172.6 Å²	172.6	71%	0.713	80%	0.802	S	S	*	*				148.2	151.8	94.4	-76	0	0	0	0	115
161	R	41.2	Very low	37.1	Very low	232 Å²	232	171.9 Å²	171.9	88%	0.875	80%	0.802	S	S	*	*			trans	95.1	94.5	160.7	-61	175.4	176.7	166.5	-2.4	115
162	S	41.5	Very low	37.4	Very low	107 Å²	107	166.8 Å²	166.8	75%	0.748	79%	0.791	S	S	*	*				90.8	111.4	65.8	-70.4	0	0	0	0	113.4
163	R	37.2	Very low	37.5	Very low	237 Å²	237	171.4 Å²	171.4	89%	0.894	80%	0.801	S	S	*	*			trans	49.6	137.2	137.3	-58.7	178.8	171	168.4	-3.5	118.8
164	S	38.1	Very low	37.8	Very low	98 Å²	98	167.3 Å²	167.3	69%	0.685	80%	0.795	S	S	*	*				179.3	147.9	65.1	-74.1	0	0	0	0	112.1
165	H	40.6	Very low	37.9	Very low	158 Å²	158	171.2 Å²	171.2	73%	0.731	80%	0.796	S	S	*	*			trans	61.1	147.3	141.3	-79.6	-103.3	0	0	0	119.7
166	E	36.9	Very low	38.3	Very low	153 Å²	153	170.9 Å²	170.9	72%	0.715	80%	0.798	S	S	*	*			cis	-167.4	164.1	-5.3	-176.7	140.1	49.7	0	0	107.5
167	R	40.5	Very low	38.5	Very low	231 Å²	231	178.3 Å²	178.3	87%	0.872	82%	0.817	S	S	*	*			trans	-42.2	153.5	175.2	-65.8	164.1	167.2	-105.6	-0	115.9
168	K	41.8	Very low	38.8	Very low	281 Å²	281	174.9 Å²	174.9	100%	1.222	82%	0.817	S	S	*	*				-146.6	0	119.5	-153.3	163.8	176.7	-179	0	109.9

Retrieved 168 of 168 residues in 60.2 ms (Link to these results)

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