G4VDV7_SCHMA Loading...

Ovule protein

AlphaFold DB , UniProt , Accession G4VDV7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 101 aa.

						>G4VDV7_SCHMA|G4VDV7
MENSQNIIDTKLLKTIKNLHRSCISKVLYLLSNPPLARTGVVRKLLKVNPSNHKILSCFVFHPNILNHSSEVSPNYGYFSRVLLPSSSHYLLVHTDPSTVP
					

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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	35	Very low	36.9	Very low	240 Å²	240	140.7 Å²	140.7	100%	1.182	72%	0.724	S	S	*	*				0	93.9	0	-79.6	178.1	143.4	0	0	106.7	N3	M1-N3 PolarHBondContact O-N 3.48Å
2	E	32.8	Very low	37.6	Very low	201 Å²	201	133.4 Å²	133.4	94%	0.939	69%	0.687	S	S	*	*			trans	-79.4	121.5	-175.7	-77	179.8	144.5	0	0	110.2	S4	E2-S4 PolarHBondContact O-N 3.39Å
3	N	27.6	Very low	38.2	Very low	142 Å²	142	128.5 Å²	128.5	76%	0.759	66%	0.662	S	S	*	*			trans	-58	123.2	-179.1	-72.9	-35.7	0	0	0	110.9	M1 Q5	M1-N3 PolarHBondContact O-N 3.48Å; N3-Q5 VanDerWaalsContact C-N 3.26Å; N3-Q5 PolarHBondContact O-N 2.94Å
4	S	32.6	Very low	39	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	66%	0.659	S	S	*	*			trans	-62.8	88.8	164.1	58	0	0	0	0	109	E2 N6	E2-S4 PolarHBondContact O-N 3.39Å; S4-N6 PolarHBondContact O-N 2.81Å
5	Q	30.6	Very low	39.5	Very low	164 Å²	164	125.6 Å²	125.6	77%	0.766	64%	0.644	S	S	*	*			trans	-66.4	99.9	171.3	-87.1	158.4	-22.8	0	0	108	N3 I7	N3-Q5 VanDerWaalsContact C-N 3.26Å; N3-Q5 PolarHBondContact O-N 2.94Å; Q5-I7 PolarHBondContact O-N 2.76Å
6	N	35	Very low	40.1	Very low	143 Å²	143	119.7 Å²	119.7	77%	0.765	61%	0.614	S	S	*	*			trans	-58.6	85.8	161.7	-84.3	-33	0	0	0	107.8	S4 I8	S4-N6 PolarHBondContact O-N 2.81Å; N6-I8 HydrophobicContact CB-CG1 4.35Å; N6-I8 PolarHBondContact O-N 2.81Å
7	I	35.2	Very low	40.5	Very low	112 Å²	112	121.6 Å²	121.6	57%	0.574	62%	0.616	S	S	*	*			trans	-69.3	85.3	165.1	-58.5	172.5	0	0	0	105.4	Q5 D9 R43	Q5-I7 PolarHBondContact O-N 2.76Å; I7-D9 HydrophobicContact CG2-CB 4.36Å; I7-D9 PolarHBondContact O-N 2.78Å; I7-R43 PolarHBondContact O-NH1 3.24Å
8	I	40.1	Very low	40.9	Very low	124 Å²	124	122.1 Å²	122.1	64%	0.636	62%	0.621	S	S	*	*			trans	-71.3	83.8	163.8	-57	174.9	0	0	0	104.4	N6 T10	N6-I8 HydrophobicContact CB-CG1 4.35Å; N6-I8 PolarHBondContact O-N 2.81Å; I8-T10 HydrophobicContact CG2-CG2 3.81Å; I8-T10 PolarHBondContact O-N 2.96Å
9	D	47.9	Very low	41.2	Very low	70 Å²	70	120.2 Å²	120.2	37%	0.374	61%	0.612	S	S	.	*			trans	-69.1	83.6	170.4	-167.7	-14	0	0	0	107.4	I7 K11 L12 L13	I7-D9 HydrophobicContact CG2-CB 4.36Å; I7-D9 PolarHBondContact O-N 2.78Å; D9-K11 PolarHBondContact O-N 3.09Å; D9-K11 VanDerWaalsContact O-N 3.16Å; D9-K11 VanDerWaalsContact OD1-CB 3.32Å; D9-K11 WeakPolarHBondContact OD1-CB 3.21Å; D9-K11 PolarHBondContact OD1-N 3.11Å; D9-L12 HydrophobicContact CB-CB 3.89Å; D9-L12 WeakPolarHBondContact O-CB 3.31Å; D9-L12 PolarHBondContact O-N 3.16Å; D9-L12 VanDerWaalsContact O-N 3.11Å; D9-L12 PolarHBondContact OD1-N 3.27Å; D9-L13 PolarHBondContact O-N 3.28Å
10	T	43.9	Very low	41.2	Very low	83 Å²	83	119.5 Å²	119.5	51%	0.509	61%	0.606	S	S	.	*	H	α-helix	trans	-59.1	-23.7	-179.9	55.3	0	0	0	0	111.1	I8 K14	I8-T10 HydrophobicContact CG2-CG2 3.81Å; I8-T10 PolarHBondContact O-N 2.96Å; T10-K14 VanDerWaalsContact O-CB 3.31Å; T10-K14 WeakPolarHBondContact O-CB 3.48Å; T10-K14 WeakPolarHBondContact O-CG 3.32Å; T10-K14 PolarHBondContact O-N 3.08Å
11	K	45.2	Very low	41.1	Very low	160 Å²	160	121 Å²	121	70%	0.696	60%	0.604	S	S	*	*	H	α-helix	trans	-72.1	-48.8	174.9	-163.7	177	-178.9	-178.5	0	110.4	D9 L13 K14 T15	D9-K11 PolarHBondContact O-N 3.09Å; D9-K11 VanDerWaalsContact O-N 3.16Å; D9-K11 VanDerWaalsContact OD1-CB 3.32Å; D9-K11 WeakPolarHBondContact OD1-CB 3.21Å; D9-K11 PolarHBondContact OD1-N 3.11Å; K11-L13 VanDerWaalsContact C-N 3.32Å; K11-L13 PolarHBondContact O-N 2.96Å; K11-K14 PolarHBondContact O-N 3.4Å; K11-T15 PolarHBondContact O-N 3.3Å; K11-T15 PolarHBondContact O-OG1 3.21Å
12	L	45.9	Very low	41.1	Very low	53 Å²	53	113.4 Å²	113.4	28%	0.277	58%	0.575	S	S	.	*	H	α-helix	trans	-57.8	-44.9	172.7	-177.2	66	0	0	0	111.5	D9 K14 T15 I16	D9-L12 HydrophobicContact CB-CB 3.89Å; D9-L12 WeakPolarHBondContact O-CB 3.31Å; D9-L12 PolarHBondContact O-N 3.16Å; D9-L12 VanDerWaalsContact O-N 3.11Å; D9-L12 PolarHBondContact OD1-N 3.27Å; L12-K14 VanDerWaalsContact C-N 3.34Å; L12-K14 PolarHBondContact O-N 2.95Å; L12-T15 PolarHBondContact O-N 3.22Å; L12-I16 HydrophobicContact CD1-CD1 4.04Å; L12-I16 HydrophobicContact CD1-CG1 4.39Å; L12-I16 HydrophobicContact CG-CD1 3.86Å; L12-I16 VanDerWaalsContact O-CG1 3.27Å; L12-I16 WeakPolarHBondContact O-CG1 3.28Å; L12-I16 PolarHBondContact O-N 2.93Å
13	L	44.9	Very low	41.3	Very low	70 Å²	70	107.1 Å²	107.1	37%	0.366	55%	0.552	S	S	.	*	H	α-helix	trans	-63.1	-39.2	177.9	-168.3	70.5	0	0	0	112.1	D9 K11 K17 L45	D9-L13 PolarHBondContact O-N 3.28Å; K11-L13 VanDerWaalsContact C-N 3.32Å; K11-L13 PolarHBondContact O-N 2.96Å; L13-K17 HydrophobicContact CG-CD 4.5Å; L13-K17 WeakPolarHBondContact O-CB 3.19Å; L13-K17 VanDerWaalsContact O-CG 3.25Å; L13-K17 WeakPolarHBondContact O-CG 3.3Å; L13-K17 PolarHBondContact O-N 3.36Å; L13-L45 HydrophobicContact CD1-CD1 4.34Å
14	K	49.4	Very low	41.8	Very low	142 Å²	142	104 Å²	104	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-65.3	-45.5	173.9	-81.4	175.5	180	-178.1	0	111.7	T10 K11 L12 I16 K17 N18	T10-K14 VanDerWaalsContact O-CB 3.31Å; T10-K14 WeakPolarHBondContact O-CB 3.48Å; T10-K14 WeakPolarHBondContact O-CG 3.32Å; T10-K14 PolarHBondContact O-N 3.08Å; K11-K14 PolarHBondContact O-N 3.4Å; L12-K14 VanDerWaalsContact C-N 3.34Å; L12-K14 PolarHBondContact O-N 2.95Å; K14-I16 VanDerWaalsContact C-N 3.31Å; K14-I16 PolarHBondContact O-N 3.21Å; K14-K17 PolarHBondContact O-N 2.86Å; K14-N18 WeakPolarHBondContact O-CB 3.46Å; K14-N18 PolarHBondContact O-N 3.16Å
15	T	46.9	Very low	41.7	Very low	71 Å²	71	103.6 Å²	103.6	44%	0.436	53%	0.532	S	S	.	.	H	α-helix	trans	-59.5	-43.1	177.3	-56.9	0	0	0	0	111.1	K11 L12 N18 L19	K11-T15 PolarHBondContact O-N 3.3Å; K11-T15 PolarHBondContact O-OG1 3.21Å; L12-T15 PolarHBondContact O-N 3.22Å; T15-N18 PolarHBondContact O-N 3.17Å; T15-L19 PolarHBondContact O-N 3.43Å
16	I	48.6	Very low	41.6	Very low	31 Å²	31	104.9 Å²	104.9	16%	0.159	54%	0.535	C	S	.	.	H	α-helix	trans	-72.1	-35.5	178.6	-58.7	164.8	0	0	0	112.1	L12 K14 N18 L19 L45	L12-I16 HydrophobicContact CD1-CD1 4.04Å; L12-I16 HydrophobicContact CD1-CG1 4.39Å; L12-I16 HydrophobicContact CG-CD1 3.86Å; L12-I16 VanDerWaalsContact O-CG1 3.27Å; L12-I16 WeakPolarHBondContact O-CG1 3.28Å; L12-I16 PolarHBondContact O-N 2.93Å; K14-I16 VanDerWaalsContact C-N 3.31Å; K14-I16 PolarHBondContact O-N 3.21Å; I16-N18 PolarHBondContact O-N 3.28Å; I16-L19 HydrophobicContact CG2-CD1 4.37Å; I16-L19 WeakPolarHBondContact O-CB 3.49Å; I16-L19 PolarHBondContact O-N 3.19Å; I16-L45 HydrophobicContact CB-CD2 4.09Å; I16-L45 HydrophobicContact CD1-CD2 4.02Å; I16-L45 HydrophobicContact CG2-CD2 3.19Å
17	K	47.5	Very low	41.4	Very low	152 Å²	152	102 Å²	102	66%	0.661	52%	0.523	S	S	*	.	H	α-helix	trans	-62.1	-31.6	172.6	-80.1	178.3	176.3	-173.7	0	112.4	L13 K14	L13-K17 HydrophobicContact CG-CD 4.5Å; L13-K17 WeakPolarHBondContact O-CB 3.19Å; L13-K17 VanDerWaalsContact O-CG 3.25Å; L13-K17 WeakPolarHBondContact O-CG 3.3Å; L13-K17 PolarHBondContact O-N 3.36Å; K14-K17 PolarHBondContact O-N 2.86Å
18	N	47.5	Very low	41.2	Very low	130 Å²	130	102.6 Å²	102.6	70%	0.695	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.6	179	-71.6	-7.6	0	0	0	114.3	K14 T15 I16 H20	K14-N18 WeakPolarHBondContact O-CB 3.46Å; K14-N18 PolarHBondContact O-N 3.16Å; T15-N18 PolarHBondContact O-N 3.17Å; I16-N18 PolarHBondContact O-N 3.28Å; N18-H20 PolarHBondContact O-N 2.94Å
19	L	46.4	Very low	40.6	Very low	86 Å²	86	106 Å²	106	45%	0.45	53%	0.533	S	S	.	.			trans	-67.1	104.2	169.9	-81.5	161.8	0	0	0	109.3	T15 I16	T15-L19 PolarHBondContact O-N 3.43Å; I16-L19 HydrophobicContact CG2-CD1 4.37Å; I16-L19 WeakPolarHBondContact O-CB 3.49Å; I16-L19 PolarHBondContact O-N 3.19Å
20	H	41.3	Very low	39.7	Very low	106 Å²	106	110.6 Å²	110.6	49%	0.491	56%	0.556	S	S	.	*			trans	-72.3	142.1	-179.4	-170.2	-103.8	0	0	0	111.7	N18 S22 C23 F79	N18-H20 PolarHBondContact O-N 2.94Å; H20-S22 PolarHBondContact CE1-OG 3.41Å; H20-S22 WeakPolarHBondContact ND1-CB 3.42Å; H20-S22 PolarHBondContact ND1-OG 3Å; H20-S22 PolarHBondContact O-N 2.92Å; H20-C23 PolarHBondContact O-N 3.3Å; H20-F79 HydrophobicContact CB-CD1 3.88Å; H20-F79 HydrophobicContact CB-CE1 3.02Å; H20-F79 HydrophobicContact CB-CE2 3.94Å; H20-F79 HydrophobicContact CB-CZ 3.05Å; H20-F79 AromaticContact CD2-CZ 3.9Å; H20-F79 AromaticContact CG-CE1 3.76Å; H20-F79 AromaticContact CG-CE2 3.89Å; H20-F79 AromaticContact CG-CZ 3.2Å; H20-F79 AromaticContact ND1-CE2 3.53Å; H20-F79 AromaticContact ND1-CZ 3.36Å; H20-F79 WeakPolarHBondContact ND1-CZ 3.41Å
21	R	39.5	Very low	39.2	Very low	152 Å²	152	112 Å²	112	57%	0.574	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-61.6	-16.8	-173	-75.5	176.3	160.8	165	-5.5	114.6	C23	R21-C23 VanDerWaalsContact C-N 3.33Å; R21-C23 PolarHBondContact O-N 2.75Å
22	S	35.3	Very low	38.4	Very low	80 Å²	80	109 Å²	109	56%	0.559	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-80.5	-4.3	-175.2	64.7	0	0	0	0	115.3	H20	H20-S22 PolarHBondContact CE1-OG 3.41Å; H20-S22 WeakPolarHBondContact ND1-CB 3.42Å; H20-S22 PolarHBondContact ND1-OG 3Å; H20-S22 PolarHBondContact O-N 2.92Å
23	C	36.8	Very low	37.8	Very low	70 Å²	70	111 Å²	111	47%	0.473	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-112.5	10.3	-171.5	-66.9	0	0	0	0	114.9	H20 R21 S25 F79	H20-C23 PolarHBondContact O-N 3.3Å; R21-C23 VanDerWaalsContact C-N 3.33Å; R21-C23 PolarHBondContact O-N 2.75Å; C23-S25 PolarHBondContact O-N 3Å; C23-S25 VanDerWaalsContact O-N 3.13Å; C23-F79 HydrophobicContact CB-CB 4.39Å; C23-F79 WeakPolarHBondContact SG-CB 3.36Å; C23-F79 WeakPolarHBondContact SG-CD2 3.33Å; C23-F79 WeakPolarHBondContact SG-CG 3.28Å
24	I	37.2	Very low	37.5	Very low	75 Å²	75	113.2 Å²	113.2	39%	0.385	59%	0.588	S	S	.	*			trans	-85.9	84.3	175.4	-54.3	175.8	0	0	0	107.9	K26 T95	I24-K26 PolarHBondContact O-N 3.18Å; I24-T95 HydrophobicContact CD1-CG2 3.77Å; I24-T95 HydrophobicContact CG2-CG2 4.15Å
25	S	31.5	Very low	36.9	Very low	102 Å²	102	110.4 Å²	110.4	71%	0.713	59%	0.585	S	S	*	*			trans	-63	125.2	167	-93.5	0	0	0	0	109.5	C23 V27	C23-S25 PolarHBondContact O-N 3Å; C23-S25 VanDerWaalsContact O-N 3.13Å; S25-V27 PolarHBondContact O-N 3.13Å
26	K	28.8	Very low	36.3	Very low	191 Å²	191	111.5 Å²	111.5	83%	0.83	59%	0.588	S	S	*	*			trans	-57.5	95.6	172.5	-68.3	175.6	177.5	176.8	0	109.8	I24	I24-K26 PolarHBondContact O-N 3.18Å
27	V	30	Very low	35.7	Very low	83 Å²	83	114.1 Å²	114.1	50%	0.503	61%	0.614	S	S	.	*			trans	-135.6	93.6	169.5	-179.6	0	0	0	0	108.1	S25 Y29	S25-V27 PolarHBondContact O-N 3.13Å; V27-Y29 HydrophobicContact CG1-CD2 3.6Å; V27-Y29 HydrophobicContact CG1-CE2 3.98Å
28	L	30.4	Very low	35	Very low	124 Å²	124	117.9 Å²	117.9	65%	0.649	62%	0.624	S	S	*	*			trans	-72.7	127.3	161.1	-85.9	100.6	0	0	0	108.2	H94	L28-H94 WeakPolarHBondContact CD2-NE2 3.08Å; L28-H94 WeakPolarHBondContact CG-NE2 3.47Å
29	Y	28.9	Very low	34.4	Very low	195 Å²	195	116.5 Å²	116.5	77%	0.765	62%	0.62	S	S	*	*			trans	-132.8	133.7	158.4	-100.1	-89.5	0	0	0	109.7	V27 L91	V27-Y29 HydrophobicContact CG1-CD2 3.6Å; V27-Y29 HydrophobicContact CG1-CE2 3.98Å; Y29-L91 WeakPolarHBondContact O-CD1 3Å
30	L	28.2	Very low	33.9	Very low	167 Å²	167	113.6 Å²	113.6	87%	0.874	61%	0.611	S	S	*	*			trans	-57.8	131.5	174.4	-102	82.1	0	0	0	110.9	S32	L30-S32 PolarHBondContact O-N 3.46Å
31	L	33.8	Very low	33.9	Very low	113 Å²	113	113.8 Å²	113.8	59%	0.592	62%	0.62	S	S	*	*			trans	-81	108.2	168.9	-93.7	164.9	0	0	0	110.4	L91	L31-L91 HydrophobicContact CB-CD1 4.27Å; L31-L91 HydrophobicContact CD1-CB 3.74Å; L31-L91 HydrophobicContact CD1-CD1 3.65Å; L31-L91 HydrophobicContact CD1-CD2 3.89Å; L31-L91 HydrophobicContact CD1-CG 3.95Å; L31-L91 HydrophobicContact CG-CB 4.04Å; L31-L91 HydrophobicContact CG-CD1 3.56Å; L31-L91 HydrophobicContact CG-CG 4.29Å
32	S	28.7	Very low	34.1	Very low	95 Å²	95	110 Å²	110	66%	0.664	61%	0.613	S	S	*	*			trans	-99.8	76.7	162.8	31.8	0	0	0	0	109.5	L30	L30-S32 PolarHBondContact O-N 3.46Å
33	N	32.8	Very low	34.5	Very low	96 Å²	96	112.2 Å²	112.2	51%	0.513	61%	0.609	S	S	.	*			trans	-172.5	103.9	152.1	-110.3	-39.5	0	0	0	113.7
34	P	38.7	Very low	35	Very low	116 Å²	116	115.1 Å²	115.1	75%	0.753	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-70.9	-18	175.8	26.1	-31.5	0	0	0	118.4	L36	P34-L36 PolarHBondContact O-N 2.85Å
35	P	35.8	Very low	35.5	Very low	83 Å²	83	114.1 Å²	114.1	54%	0.539	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-77.8	-18.6	-173.4	4.9	4.5	0	0	0	115.4	A37	P35-A37 VanDerWaalsContact C-N 3.29Å; P35-A37 PolarHBondContact O-N 2.89Å
36	L	35.7	Very low	36.4	Very low	95 Å²	95	113 Å²	113	50%	0.497	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-79.1	-8.1	-176.9	-84.1	147.6	0	0	0	114.2	P34 R38	P34-L36 PolarHBondContact O-N 2.85Å; L36-R38 PolarHBondContact O-N 2.84Å
37	A	35.7	Very low	37.3	Very low	85 Å²	85	108.1 Å²	108.1	70%	0.702	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-72.1	-13	174	0	0	0	0	0	113.4	P35	P35-A37 VanDerWaalsContact C-N 3.29Å; P35-A37 PolarHBondContact O-N 2.89Å
38	R	32.6	Very low	38.1	Very low	232 Å²	232	107.3 Å²	107.3	88%	0.875	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-93.5	-5.6	-171.4	-78.5	-174.8	175	174.8	-1.4	115.9	L36	L36-R38 PolarHBondContact O-N 2.84Å
39	T	35.5	Very low	38.8	Very low	100 Å²	100	102.5 Å²	102.5	61%	0.613	54%	0.543	S	S	*	.	S	Bend	trans	-127.7	11	-162.3	50.6	0	0	0	0	118.1
40	G	35.4	Very low	40	Very low	26 Å²	26	98.4 Å²	98.4	27%	0.268	54%	0.541	S	S	.	.	S	Bend	trans	-179.1	129.9	174.4	0	0	0	0	0	115.3	V42	G40-V42 PolarHBondContact O-N 2.74Å
41	V	40.9	Very low	41.2	Very low	110 Å²	110	95.6 Å²	95.6	67%	0.667	54%	0.535	S	S	*	.			trans	-32.8	97.1	-178.4	-175.9	0	0	0	0	112.8	R43 P63	V41-R43 PolarHBondContact O-N 3.28Å; V41-R43 VanDerWaalsContact O-N 3.16Å; V41-P63 HydrophobicContact CB-CG 4.3Å; V41-P63 WeakPolarHBondContact O-CD 3.36Å; V41-P63 WeakPolarHBondContact O-CG 3.25Å
42	V	43.2	Very low	42.2	Very low	72 Å²	72	93.8 Å²	93.8	44%	0.436	53%	0.526	S	S	.	.			trans	-64.7	115.2	171.3	166.2	0	0	0	0	108.4	G40 V60	G40-V42 PolarHBondContact O-N 2.74Å; V42-V60 HydrophobicContact CG1-CB 4.29Å; V42-V60 HydrophobicContact CG1-CG1 3.5Å; V42-V60 HydrophobicContact CG1-CG2 4.2Å; V42-V60 HydrophobicContact CG2-CG1 4.48Å
43	R	44.5	Very low	43.4	Very low	126 Å²	126	96.7 Å²	96.7	48%	0.475	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117	168.9	-72.5	-167.2	177.3	-149.6	0.7	108.8	I7 V41 F61	I7-R43 PolarHBondContact O-NH1 3.24Å; V41-R43 PolarHBondContact O-N 3.28Å; V41-R43 VanDerWaalsContact O-N 3.16Å; R43-F61 PolarHBondContact N-O 3.26Å; R43-F61 PolarHBondContact O-N 3.32Å
44	K	46.7	Very low	44	Very low	132 Å²	132	98 Å²	98	57%	0.574	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	115.4	174.4	-170.9	-178.4	-174.4	-177.4	0	109.1	L46 C58 F59	K44-L46 HydrophobicContact CD-CD1 4.05Å; K44-L46 HydrophobicContact CD-CG 4.2Å; K44-L46 HydrophobicContact CG-CD1 4.46Å; K44-L46 HydrophobicContact CG-CG 4.2Å; K44-C58 WeakPolarHBondContact CE-SG 3.47Å; K44-F59 CarbonylContact C-O 3.57Å; K44-F59 VanDerWaalsContact CA-O 3.28Å; K44-F59 WeakPolarHBondContact CA-O 3.27Å
45	L	48.5	Very low	44.5	Very low	54 Å²	54	97 Å²	97	28%	0.283	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	109.4	168.5	-167.9	80.2	0	0	0	109.6	L13 I16 C58 F59	L13-L45 HydrophobicContact CD1-CD1 4.34Å; I16-L45 HydrophobicContact CB-CD2 4.09Å; I16-L45 HydrophobicContact CD1-CD2 4.02Å; I16-L45 HydrophobicContact CG2-CD2 3.19Å; L45-C58 CarbonylContact O-C 3.51Å; L45-C58 WeakPolarHBondContact O-CA 3.49Å; L45-F59 HydrophobicContact CB-CB 4.3Å; L45-F59 HydrophobicContact CD2-CD2 4.48Å; L45-F59 PolarHBondContact N-O 3.36Å; L45-F59 PolarHBondContact O-N 3.33Å
46	L	49.2	Very low	44.9	Very low	79 Å²	79	93.7 Å²	93.7	41%	0.414	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118.7	173.1	-75.8	156.1	0	0	0	109	K44 I55 C58	K44-L46 HydrophobicContact CD-CD1 4.05Å; K44-L46 HydrophobicContact CD-CG 4.2Å; K44-L46 HydrophobicContact CG-CD1 4.46Å; K44-L46 HydrophobicContact CG-CG 4.2Å; L46-I55 HydrophobicContact CD2-CD1 3.86Å; L46-I55 HydrophobicContact CD2-CG1 4.13Å; L46-I55 HydrophobicContact CD2-CG2 3.74Å; L46-C58 HydrophobicContact CD2-CB 4.17Å
47	K	48.6	Very low	45.3	Very low	87 Å²	87	89.7 Å²	89.7	38%	0.378	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.5	164.4	-166.7	169.8	-175.9	168.3	0	107.7	I55 L56 S57	K47-I55 CarbonylContact O-C 3.57Å; K47-L56 HydrophobicContact CB-CB 4.25Å; K47-L56 HydrophobicContact CD-CD1 4.39Å; K47-L56 HydrophobicContact CG-CB 4.26Å; K47-L56 HydrophobicContact CG-CD1 4.04Å; K47-L56 WeakPolarHBondContact O-CB 3.2Å; K47-L56 PolarHBondContact O-N 2.9Å; K47-S57 PolarHBondContact N-O 3.41Å; K47-S57 PolarHBondContact O-N 2.77Å
48	V	46	Very low	45.7	Very low	66 Å²	66	87.4 Å²	87.4	40%	0.4	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.9	179	-179.7	0	0	0	0	108.6	P50 H53 K54	V48-P50 WeakPolarHBondContact O-CD 3.44Å; V48-H53 VanDerWaalsContact CG1-C 3.47Å; V48-H53 HydrophobicContact CG1-CB 4.37Å; V48-H53 WeakPolarHBondContact CG1-O 3.5Å; V48-K54 CarbonylContact C-O 3.53Å; V48-K54 WeakPolarHBondContact CA-O 3.4Å
49	N	46	Very low	46.4	Very low	23 Å²	23	78 Å²	78	12%	0.123	42%	0.419	C	S	.	.			trans	-71.8	118.2	171.2	-178.2	-15.1	0	0	0	108.2	S51 N52 H53 K54 L56	N49-S51 PolarHBondContact O-N 3.29Å; N49-S51 WeakPolarHBondContact OD1-CB 3.38Å; N49-S51 PolarHBondContact OD1-N 3.31Å; N49-S51 PolarHBondContact OD1-OG 3.13Å; N49-N52 WeakPolarHBondContact CB-OD1 3.28Å; N49-N52 PolarHBondContact ND2-OD1 2.94Å; N49-N52 PolarHBondContact O-N 3.42Å; N49-H53 VanDerWaalsContact O-CA 3.26Å; N49-H53 WeakPolarHBondContact O-CA 3.09Å; N49-H53 PolarHBondContact O-N 2.99Å; N49-K54 PolarHBondContact N-O 3.46Å; N49-L56 HydrophobicContact CB-CD1 3.9Å; N49-L56 HydrophobicContact CB-CD2 3.95Å; N49-L56 HydrophobicContact CB-CG 3.76Å
50	P	53.8	Low	46.8	Very low	109 Å²	109	76.4 Å²	76.4	71%	0.708	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.7	-179	27.2	-34.8	0	0	0	112.6	V48	V48-P50 WeakPolarHBondContact O-CD 3.44Å
51	S	53.5	Low	47.5	Very low	109 Å²	109	79.2 Å²	79.2	76%	0.762	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-27.3	-175.4	-51.3	0	0	0	0	114	N49	N49-S51 PolarHBondContact O-N 3.29Å; N49-S51 WeakPolarHBondContact OD1-CB 3.38Å; N49-S51 PolarHBondContact OD1-N 3.31Å; N49-S51 PolarHBondContact OD1-OG 3.13Å
52	N	55.6	Low	47.6	Very low	74 Å²	74	76.5 Å²	76.5	40%	0.396	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	8.7	-175.6	67.8	13.9	0	0	0	114.1	N49 K54	N49-N52 WeakPolarHBondContact CB-OD1 3.28Å; N49-N52 PolarHBondContact ND2-OD1 2.94Å; N49-N52 PolarHBondContact O-N 3.42Å; N52-K54 HydrophobicContact CB-CG 4.46Å; N52-K54 PolarHBondContact O-N 3.21Å; N52-K54 WeakPolarHBondContact OD1-CB 3.26Å; N52-K54 WeakPolarHBondContact OD1-CG 3.46Å; N52-K54 PolarHBondContact OD1-N 2.87Å
53	H	53.2	Low	47.6	Very low	156 Å²	156	75.2 Å²	75.2	72%	0.722	39%	0.387	S	S	*	.			trans	54.5	13.6	-177.5	-59.1	-79	0	0	0	115.4	V48 N49	V48-H53 VanDerWaalsContact CG1-C 3.47Å; V48-H53 HydrophobicContact CG1-CB 4.37Å; V48-H53 WeakPolarHBondContact CG1-O 3.5Å; N49-H53 VanDerWaalsContact O-CA 3.26Å; N49-H53 WeakPolarHBondContact O-CA 3.09Å; N49-H53 PolarHBondContact O-N 2.99Å
54	K	44.6	Very low	47.4	Very low	123 Å²	123	74.4 Å²	74.4	54%	0.535	39%	0.392	S	S	.	.			trans	-77.2	145.7	175.8	-64	-173.5	178.3	-176.6	0	110.8	V48 N49 N52 L56	V48-K54 CarbonylContact C-O 3.53Å; V48-K54 WeakPolarHBondContact CA-O 3.4Å; N49-K54 PolarHBondContact N-O 3.46Å; N52-K54 HydrophobicContact CB-CG 4.46Å; N52-K54 PolarHBondContact O-N 3.21Å; N52-K54 WeakPolarHBondContact OD1-CB 3.26Å; N52-K54 WeakPolarHBondContact OD1-CG 3.46Å; N52-K54 PolarHBondContact OD1-N 2.87Å; K54-L56 PolarHBondContact O-N 3.21Å
55	I	49.5	Very low	47.2	Very low	95 Å²	95	69.5 Å²	69.5	49%	0.487	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	119.7	177.1	-60.3	168	0	0	0	108.6	L46 K47	L46-I55 HydrophobicContact CD2-CD1 3.86Å; L46-I55 HydrophobicContact CD2-CG1 4.13Å; L46-I55 HydrophobicContact CD2-CG2 3.74Å; K47-I55 CarbonylContact O-C 3.57Å
56	L	43.8	Very low	46.8	Very low	15 Å²	15	72.1 Å²	72.1	8%	0.079	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-36.6	177.1	-72	168.6	0	0	0	112.3	K47 N49 K54 T99	K47-L56 HydrophobicContact CB-CB 4.25Å; K47-L56 HydrophobicContact CD-CD1 4.39Å; K47-L56 HydrophobicContact CG-CB 4.26Å; K47-L56 HydrophobicContact CG-CD1 4.04Å; K47-L56 WeakPolarHBondContact O-CB 3.2Å; K47-L56 PolarHBondContact O-N 2.9Å; N49-L56 HydrophobicContact CB-CD1 3.9Å; N49-L56 HydrophobicContact CB-CD2 3.95Å; N49-L56 HydrophobicContact CB-CG 3.76Å; K54-L56 PolarHBondContact O-N 3.21Å; L56-T99 WeakPolarHBondContact CD2-O 3.24Å
57	S	43.8	Very low	46.3	Very low	11 Å²	11	75 Å²	75	8%	0.077	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	151.3	177.9	54.6	0	0	0	0	111.1	K47 F59	K47-S57 PolarHBondContact N-O 3.41Å; K47-S57 PolarHBondContact O-N 2.77Å; S57-F59 WeakPolarHBondContact OG-CE2 3.48Å
58	C	43.9	Very low	45.8	Very low	37 Å²	37	77.3 Å²	77.3	25%	0.25	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	94.7	-178.9	172.5	0	0	0	0	110.7	K44 L45 L46 V93	K44-C58 WeakPolarHBondContact CE-SG 3.47Å; L45-C58 CarbonylContact O-C 3.51Å; L45-C58 WeakPolarHBondContact O-CA 3.49Å; L46-C58 HydrophobicContact CD2-CB 4.17Å; C58-V93 VanDerWaalsContact C-CG1 3.44Å; C58-V93 WeakPolarHBondContact O-CG1 3.34Å; C58-V93 WeakPolarHBondContact O-CG2 3.24Å
59	F	48.6	Very low	45.2	Very low	35 Å²	35	79.8 Å²	79.8	15%	0.154	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.9	178.8	-58	-89.4	0	0	0	112.7	K44 L45 S57 F61 V93	K44-F59 CarbonylContact C-O 3.57Å; K44-F59 VanDerWaalsContact CA-O 3.28Å; K44-F59 WeakPolarHBondContact CA-O 3.27Å; L45-F59 HydrophobicContact CB-CB 4.3Å; L45-F59 HydrophobicContact CD2-CD2 4.48Å; L45-F59 PolarHBondContact N-O 3.36Å; L45-F59 PolarHBondContact O-N 3.33Å; S57-F59 WeakPolarHBondContact OG-CE2 3.48Å; F59-F61 HydrophobicContact CB-CD2 4.11Å; F59-F61 HydrophobicContact CB-CE2 3.34Å; F59-F61 HydrophobicContact CB-CZ 3.79Å; F59-F61 HydrophobicContact CD1-CE2 4.34Å; F59-F61 AromaticContact CD1-CZ 3.95Å; F59-F61 HydrophobicContact CD1-CZ 3.95Å; F59-F61 HydrophobicContact CG-CE2 4.08Å; F59-F61 HydrophobicContact CG-CZ 4.16Å; F59-V93 HydrophobicContact CB-CG2 4.45Å; F59-V93 HydrophobicContact CD1-CB 4.1Å; F59-V93 HydrophobicContact CD1-CG2 4.06Å; F59-V93 HydrophobicContact CE1-CB 4.4Å
60	V	44.2	Very low	44.7	Very low	66 Å²	66	81.9 Å²	81.9	40%	0.4	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.3	176.3	163.5	0	0	0	0	107.6	V42	V42-V60 HydrophobicContact CG1-CB 4.29Å; V42-V60 HydrophobicContact CG1-CG1 3.5Å; V42-V60 HydrophobicContact CG1-CG2 4.2Å; V42-V60 HydrophobicContact CG2-CG1 4.48Å
61	F	48.6	Very low	43.6	Very low	84 Å²	84	85.8 Å²	85.8	37%	0.368	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.1	176.4	-56.1	-79.2	0	0	0	111.1	R43 F59	R43-F61 PolarHBondContact N-O 3.26Å; R43-F61 PolarHBondContact O-N 3.32Å; F59-F61 HydrophobicContact CB-CD2 4.11Å; F59-F61 HydrophobicContact CB-CE2 3.34Å; F59-F61 HydrophobicContact CB-CZ 3.79Å; F59-F61 HydrophobicContact CD1-CE2 4.34Å; F59-F61 AromaticContact CD1-CZ 3.95Å; F59-F61 HydrophobicContact CD1-CZ 3.95Å; F59-F61 HydrophobicContact CG-CE2 4.08Å; F59-F61 HydrophobicContact CG-CZ 4.16Å
62	H	44.6	Very low	42.6	Very low	54 Å²	54	85.8 Å²	85.8	25%	0.25	45%	0.454	C	S	.	.			trans	-89	136	171.2	-72.3	-78.3	0	0	0	110.4	N64 I65	H62-N64 PolarHBondContact O-N 3.43Å; H62-I65 HydrophobicContact CB-CD1 4.38Å; H62-I65 WeakPolarHBondContact O-CB 3.13Å; H62-I65 WeakPolarHBondContact O-CD1 3.33Å; H62-I65 VanDerWaalsContact O-CG1 3.3Å; H62-I65 WeakPolarHBondContact O-CG1 2.88Å; H62-I65 PolarHBondContact O-N 2.73Å
63	P	42.1	Very low	41.3	Very low	44 Å²	44	85.9 Å²	85.9	29%	0.286	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-69.1	-19.9	-173	24.7	-29.1	0	0	0	112.6	V41 I65 L66	V41-P63 HydrophobicContact CB-CG 4.3Å; V41-P63 WeakPolarHBondContact O-CD 3.36Å; V41-P63 WeakPolarHBondContact O-CG 3.25Å; P63-I65 PolarHBondContact O-N 2.85Å; P63-I65 VanDerWaalsContact O-N 3.09Å; P63-L66 PolarHBondContact O-N 3.43Å; P63-L66 VanDerWaalsContact O-N 3.08Å
64	N	40.4	Very low	40.1	Very low	110 Å²	110	83.6 Å²	83.6	59%	0.588	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-64.6	-10.8	174.6	-72.6	-1.5	0	0	0	113.8	H62 L66	H62-N64 PolarHBondContact O-N 3.43Å; N64-L66 VanDerWaalsContact C-N 3.31Å
65	I	42.2	Very low	39.3	Very low	28 Å²	28	83.7 Å²	83.7	14%	0.144	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-75.2	-23.1	175	-57.7	168.4	0	0	0	111.2	H62 P63 L84	H62-I65 HydrophobicContact CB-CD1 4.38Å; H62-I65 WeakPolarHBondContact O-CB 3.13Å; H62-I65 WeakPolarHBondContact O-CD1 3.33Å; H62-I65 VanDerWaalsContact O-CG1 3.3Å; H62-I65 WeakPolarHBondContact O-CG1 2.88Å; H62-I65 PolarHBondContact O-N 2.73Å; P63-I65 PolarHBondContact O-N 2.85Å; P63-I65 VanDerWaalsContact O-N 3.09Å; I65-L84 HydrophobicContact CD1-CD2 4.34Å; I65-L84 HydrophobicContact CG2-CD2 3.95Å
66	L	41.5	Very low	38.2	Very low	110 Å²	110	89.7 Å²	89.7	58%	0.576	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.6	-172.7	-66.3	168.9	0	0	0	114.4	P63 N64 H68	P63-L66 PolarHBondContact O-N 3.43Å; P63-L66 VanDerWaalsContact O-N 3.08Å; N64-L66 VanDerWaalsContact C-N 3.31Å; L66-H68 VanDerWaalsContact C-N 3.29Å
67	N	37.7	Very low	37.4	Very low	139 Å²	139	92.6 Å²	92.6	74%	0.743	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-3.8	177.9	-80.5	-6.4	0	0	0	113.8
68	H	37.3	Very low	36.6	Very low	136 Å²	136	102.2 Å²	102.2	63%	0.63	55%	0.553	S	S	*	*	S	Bend	trans	-108.5	124.4	168.3	-75.7	-75.9	0	0	0	109.1	L66 S70	L66-H68 VanDerWaalsContact C-N 3.29Å; H68-S70 VanDerWaalsContact C-N 3.3Å; H68-S70 PolarHBondContact O-N 3.14Å; H68-S70 PolarHBondContact O-OG 3.02Å
69	S	34.7	Very low	35.8	Very low	118 Å²	118	105.6 Å²	105.6	83%	0.825	56%	0.564	S	S	*	*			trans	-50.4	89	174.4	49.5	0	0	0	0	110.8	E71	S69-E71 PolarHBondContact O-N 3.29Å
70	S	35.7	Very low	34.8	Very low	66 Å²	66	107 Å²	107	46%	0.462	58%	0.578	S	S	.	*			trans	-78	101.1	172.6	-60.5	0	0	0	0	106.7	H68 V72	H68-S70 VanDerWaalsContact C-N 3.3Å; H68-S70 PolarHBondContact O-N 3.14Å; H68-S70 PolarHBondContact O-OG 3.02Å; S70-V72 PolarHBondContact O-N 3.35Å; S70-V72 VanDerWaalsContact O-N 3.13Å
71	E	30.4	Very low	34	Very low	191 Å²	191	114.9 Å²	114.9	89%	0.893	60%	0.601	S	S	*	*			trans	-64.3	109.9	173.7	-75.9	-175.3	157.1	0	0	109.4	S69 S73	S69-E71 PolarHBondContact O-N 3.29Å; E71-S73 PolarHBondContact O-N 3.26Å
72	V	31.7	Very low	33.2	Very low	110 Å²	110	115.8 Å²	115.8	67%	0.667	61%	0.613	S	S	*	*			trans	-85	102	168.4	178.7	0	0	0	0	106.5	S70 P74	S70-V72 PolarHBondContact O-N 3.35Å; S70-V72 VanDerWaalsContact O-N 3.13Å; V72-P74 WeakPolarHBondContact O-CD 3.32Å
73	S	28.1	Very low	32.6	Very low	75 Å²	75	120.3 Å²	120.3	52%	0.524	64%	0.638	S	S	.	*			trans	-83.4	122.3	170.8	85.2	0	0	0	0	109.9	E71 N75	E71-S73 PolarHBondContact O-N 3.26Å; S73-N75 PolarHBondContact O-N 3.23Å
74	P	28.3	Very low	32.4	Very low	109 Å²	109	121.2 Å²	121.2	71%	0.708	64%	0.64	S	S	*	*			trans	-87	81	174.9	33.6	-29	0	0	0	108.2	V72	V72-P74 WeakPolarHBondContact O-CD 3.32Å
75	N	27.2	Very low	32	Very low	125 Å²	125	118.7 Å²	118.7	67%	0.668	63%	0.63	S	S	*	*			trans	-96	119.4	170.2	-97.4	-13.9	0	0	0	111.2	S73	S73-N75 PolarHBondContact O-N 3.23Å
76	Y	27.3	Very low	31.5	Very low	221 Å²	221	123.6 Å²	123.6	87%	0.867	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-15.1	124	164.7	-69.5	-96.6	0	0	0	116	Y78	Y76-Y78 PolarHBondContact O-N 3.41Å
77	G	27.8	Very low	31.1	Very low	76 Å²	76	121 Å²	121	78%	0.784	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.1	-16.2	152	0	0	0	0	0	118.1
78	Y	27	Very low	31	Very low	212 Å²	212	119.4 Å²	119.4	83%	0.831	66%	0.657	S	S	*	*	S	Bend	trans	-143.1	131.1	-180	-68.2	-85.9	0	0	0	110.6	Y76 S80	Y76-Y78 PolarHBondContact O-N 3.41Å; Y78-S80 PolarHBondContact O-N 2.78Å
79	F	26.4	Very low	31.1	Very low	109 Å²	109	118.2 Å²	118.2	48%	0.478	65%	0.652	S	S	.	*			trans	-49.1	129.4	-173.1	-73.5	-78.5	0	0	0	114.4	H20 C23 R81	H20-F79 HydrophobicContact CB-CD1 3.88Å; H20-F79 HydrophobicContact CB-CE1 3.02Å; H20-F79 HydrophobicContact CB-CE2 3.94Å; H20-F79 HydrophobicContact CB-CZ 3.05Å; H20-F79 AromaticContact CD2-CZ 3.9Å; H20-F79 AromaticContact CG-CE1 3.76Å; H20-F79 AromaticContact CG-CE2 3.89Å; H20-F79 AromaticContact CG-CZ 3.2Å; H20-F79 AromaticContact ND1-CE2 3.53Å; H20-F79 AromaticContact ND1-CZ 3.36Å; H20-F79 WeakPolarHBondContact ND1-CZ 3.41Å; C23-F79 HydrophobicContact CB-CB 4.39Å; C23-F79 WeakPolarHBondContact SG-CB 3.36Å; C23-F79 WeakPolarHBondContact SG-CD2 3.33Å; C23-F79 WeakPolarHBondContact SG-CG 3.28Å; F79-R81 PolarHBondContact O-N 3.35Å
80	S	27.3	Very low	31.4	Very low	64 Å²	64	117.4 Å²	117.4	45%	0.448	63%	0.631	S	S	.	*			trans	-58.7	114.6	172.1	-46.8	0	0	0	0	110.6	Y78 V82	Y78-S80 PolarHBondContact O-N 2.78Å; S80-V82 PolarHBondContact O-N 3.3Å
81	R	27.5	Very low	31.5	Very low	232 Å²	232	118.6 Å²	118.6	88%	0.875	63%	0.632	S	S	*	*			trans	-59.6	122	161.1	-71.5	-179.8	179.9	-179.9	0.5	107.7	F79 L83	F79-R81 PolarHBondContact O-N 3.35Å; R81-L83 PolarHBondContact O-N 3.42Å; R81-L83 VanDerWaalsContact O-N 3.14Å
82	V	31.4	Very low	32.1	Very low	103 Å²	103	115 Å²	115	62%	0.624	62%	0.618	S	S	*	*			trans	-74.5	101.2	162.8	178.2	0	0	0	0	106	S80 L84	S80-V82 PolarHBondContact O-N 3.3Å; V82-L84 PolarHBondContact O-N 3.47Å; V82-L84 VanDerWaalsContact O-N 3.13Å
83	L	32.3	Very low	32.4	Very low	149 Å²	149	111 Å²	111	78%	0.78	59%	0.594	S	S	*	*			trans	-68.7	102.8	168.9	-89.8	145.8	0	0	0	107.5	R81	R81-L83 PolarHBondContact O-N 3.42Å; R81-L83 VanDerWaalsContact O-N 3.14Å
84	L	38	Very low	32.8	Very low	62 Å²	62	113.7 Å²	113.7	33%	0.325	60%	0.598	S	S	.	*			trans	-66	139.7	162.2	-72.1	165.8	0	0	0	107.8	I65 V82 S86	I65-L84 HydrophobicContact CD1-CD2 4.34Å; I65-L84 HydrophobicContact CG2-CD2 3.95Å; V82-L84 PolarHBondContact O-N 3.47Å; V82-L84 VanDerWaalsContact O-N 3.13Å; L84-S86 PolarHBondContact O-N 3.07Å
85	P	32.9	Very low	33.2	Very low	57 Å²	57	110.8 Å²	110.8	37%	0.37	58%	0.579	S	S	.	*			trans	-53	134.6	177.4	19.6	-29.5	0	0	0	109.6	S87	P85-S87 VanDerWaalsContact C-N 3.3Å; P85-S87 PolarHBondContact O-N 3.13Å
86	S	31	Very low	33.6	Very low	132 Å²	132	108.7 Å²	108.7	92%	0.923	57%	0.567	S	S	*	*	S	Bend	trans	-52.8	81.5	-174.8	50.1	0	0	0	0	113	L84	L84-S86 PolarHBondContact O-N 3.07Å
87	S	33.1	Very low	34.1	Very low	54 Å²	54	102.7 Å²	102.7	38%	0.378	56%	0.555	S	S	.	*			trans	-145.5	131.4	157.7	97.6	0	0	0	0	108	P85 H89 Y90	P85-S87 VanDerWaalsContact C-N 3.3Å; P85-S87 PolarHBondContact O-N 3.13Å; S87-H89 PolarHBondContact O-N 3.42Å; S87-Y90 WeakPolarHBondContact OG-CE2 3.22Å; S87-Y90 PolarHBondContact OG-OH 2.74Å
88	S	35.3	Very low	34.4	Very low	106 Å²	106	103.5 Å²	103.5	74%	0.741	55%	0.549	S	S	*	.	S	Bend	trans	-71.4	32.7	-164.9	36.7	0	0	0	0	115.5
89	H	40.3	Very low	34.8	Very low	112 Å²	112	94 Å²	94	52%	0.519	51%	0.513	S	S	.	.			trans	-144.6	35.7	-162.4	-63.4	-65.3	0	0	0	116.7	S87	S87-H89 PolarHBondContact O-N 3.42Å
90	Y	40.4	Very low	35.2	Very low	100 Å²	100	93.6 Å²	93.6	39%	0.392	52%	0.519	S	S	.	.			trans	-123.1	126.2	177.9	-55.9	-63.9	0	0	0	113.9	S87	S87-Y90 WeakPolarHBondContact OG-CE2 3.22Å; S87-Y90 PolarHBondContact OG-OH 2.74Å
91	L	37.9	Very low	35.7	Very low	91 Å²	91	98.7 Å²	98.7	48%	0.476	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-74.9	116.2	-173.6	-161.9	94.8	0	0	0	111.4	Y29 L31	Y29-L91 WeakPolarHBondContact O-CD1 3Å; L31-L91 HydrophobicContact CB-CD1 4.27Å; L31-L91 HydrophobicContact CD1-CB 3.74Å; L31-L91 HydrophobicContact CD1-CD1 3.65Å; L31-L91 HydrophobicContact CD1-CD2 3.89Å; L31-L91 HydrophobicContact CD1-CG 3.95Å; L31-L91 HydrophobicContact CG-CB 4.04Å; L31-L91 HydrophobicContact CG-CD1 3.56Å; L31-L91 HydrophobicContact CG-CG 4.29Å
92	L	43.3	Very low	36.1	Very low	116 Å²	116	92 Å²	92	61%	0.607	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-84.9	141.5	164.7	-88	152.4	0	0	0	109.8
93	V	38.4	Very low	36.4	Very low	26 Å²	26	91.4 Å²	91.4	16%	0.158	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-83.4	138.6	-160.7	161.9	0	0	0	0	112.5	C58 F59 T95	C58-V93 VanDerWaalsContact C-CG1 3.44Å; C58-V93 WeakPolarHBondContact O-CG1 3.34Å; C58-V93 WeakPolarHBondContact O-CG2 3.24Å; F59-V93 HydrophobicContact CB-CG2 4.45Å; F59-V93 HydrophobicContact CD1-CB 4.1Å; F59-V93 HydrophobicContact CD1-CG2 4.06Å; F59-V93 HydrophobicContact CE1-CB 4.4Å; V93-T95 PolarHBondContact O-N 3.02Å
94	H	37	Very low	36.6	Very low	132 Å²	132	88.2 Å²	88.2	61%	0.611	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-54.4	119.5	168.2	-103.3	-88.3	0	0	0	112.1	L28	L28-H94 WeakPolarHBondContact CD2-NE2 3.08Å; L28-H94 WeakPolarHBondContact CG-NE2 3.47Å
95	T	35.3	Very low	36.5	Very low	48 Å²	48	89.8 Å²	89.8	29%	0.294	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-89.5	128.7	154.7	39.9	0	0	0	0	108.2	I24 V93 P97	I24-T95 HydrophobicContact CD1-CG2 3.77Å; I24-T95 HydrophobicContact CG2-CG2 4.15Å; V93-T95 PolarHBondContact O-N 3.02Å; T95-P97 VanDerWaalsContact O-CD 3.24Å; T95-P97 WeakPolarHBondContact O-CD 3.4Å
96	D	36.6	Very low	36.8	Very low	80 Å²	80	91.8 Å²	91.8	43%	0.428	54%	0.537	S	S	.	.			trans	-78.1	110.7	168.3	-177.6	-11.7	0	0	0	108.2	S98 T99	D96-S98 PolarHBondContact O-N 3.19Å; D96-S98 VanDerWaalsContact O-N 3.16Å; D96-S98 VanDerWaalsContact OD1-CB 3.27Å; D96-S98 WeakPolarHBondContact OD1-CB 3.27Å; D96-S98 PolarHBondContact OD1-N 3.17Å; D96-S98 PolarHBondContact OD1-OG 2.9Å; D96-S98 PolarHBondContact OD2-OG 3.16Å; D96-T99 HydrophobicContact CB-CG2 4.14Å; D96-T99 PolarHBondContact O-N 3.48Å; D96-T99 VanDerWaalsContact O-N 3.17Å; D96-T99 PolarHBondContact O-OG1 2.93Å
97	P	38	Very low	37.2	Very low	95 Å²	95	89.1 Å²	89.1	62%	0.617	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-63.7	-18.7	-178.4	26	-32.5	0	0	0	112.9	T95 T99 V100	T95-P97 VanDerWaalsContact O-CD 3.24Å; T95-P97 WeakPolarHBondContact O-CD 3.4Å; P97-T99 PolarHBondContact O-N 3.37Å; P97-V100 PolarHBondContact O-N 2.66Å
98	S	34	Very low	37.5	Very low	93 Å²	93	91.6 Å²	91.6	65%	0.65	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-72.2	-3.7	177	74.5	0	0	0	0	114.1	D96	D96-S98 PolarHBondContact O-N 3.19Å; D96-S98 VanDerWaalsContact O-N 3.16Å; D96-S98 VanDerWaalsContact OD1-CB 3.27Å; D96-S98 WeakPolarHBondContact OD1-CB 3.27Å; D96-S98 PolarHBondContact OD1-N 3.17Å; D96-S98 PolarHBondContact OD1-OG 2.9Å; D96-S98 PolarHBondContact OD2-OG 3.16Å
99	T	34.5	Very low	37.6	Very low	12 Å²	12	90.5 Å²	90.5	7%	0.074	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-108.8	3.2	-178.1	67.7	0	0	0	0	114	L56 D96 P97	L56-T99 WeakPolarHBondContact CD2-O 3.24Å; D96-T99 HydrophobicContact CB-CG2 4.14Å; D96-T99 PolarHBondContact O-N 3.48Å; D96-T99 VanDerWaalsContact O-N 3.17Å; D96-T99 PolarHBondContact O-OG1 2.93Å; P97-T99 PolarHBondContact O-N 3.37Å
100	V	34.5	Very low	37.4	Very low	101 Å²	101	88.8 Å²	88.8	61%	0.612	50%	0.503	S	S	*	.			trans	-91	121.6	174.2	-173.8	0	0	0	0	108.4	P97	P97-V100 PolarHBondContact O-N 2.66Å
101	P	39	Very low	37.1	Very low	171 Å²	171	87.7 Å²	87.7	100%	1.11	51%	0.513	S	S	*	.			trans	-69.4	0	171.7	29.6	-32.6	0	0	0	112.2

Retrieved 101 of 101 residues in 254 ms (Link to these results)

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