A0A077Z5W0_TRITR Loading...

Collagenase NC10 and Endostatin family protein

AlphaFold DB , UniProt , Accession A0A077Z5W0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 123 aa.

						>A0A077Z5W0_TRITR|A0A077Z5W0
MSNMMTCLWWLLVTLIVGGGLAGQGAAAENGNTTEPEVVPIQEGALQELKIFANPAEAETQCDDVATDAAGSGDDEVCYWAIRFRDLELYTFSIGAAAGVGDDGLFSLRFLERAEKCSRYSFR
					

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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	33.6	Very low	34.7	Very low	247 Å²	247	141.3 Å²	141.3	100%	1.217	71%	0.71	S	S	*	*				0	44.3	0	-80.2	144.9	164.2	0	0	112.2
2	S	34.2	Very low	34.7	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	70%	0.695	S	S	*	*			trans	-134.4	-0.1	-174.6	-65	0	0	0	0	116
3	N	38.7	Very low	35.2	Very low	134 Å²	134	132.6 Å²	132.6	72%	0.717	67%	0.673	S	S	*	*	S	Bend	trans	-96.2	-13.2	-175	-80.4	-5.9	0	0	0	115.3	T6	N3-T6 PolarHBondContact O-OG1 2.76Å
4	M	33.4	Very low	35.7	Very low	174 Å²	174	129.5 Å²	129.5	86%	0.857	66%	0.664	S	S	*	*	H	α-helix	trans	-75	-32.1	-179.8	-92.1	174.3	83.7	0	0	112.9
5	M	31.5	Very low	35.6	Very low	147 Å²	147	130.3 Å²	130.3	72%	0.724	67%	0.669	S	S	*	*	H	α-helix	trans	-76.7	-27.4	-175.6	-131.5	73.6	141.7	0	0	112.8
6	T	36.5	Very low	35.8	Very low	75 Å²	75	129.9 Å²	129.9	46%	0.46	67%	0.667	S	S	.	*	H	α-helix	trans	-75.9	-34.9	-179.9	34.3	0	0	0	0	112.5	N3 L8 W9 W10	N3-T6 PolarHBondContact O-OG1 2.76Å; T6-L8 VanDerWaalsContact C-N 3.32Å; T6-L8 PolarHBondContact O-N 2.84Å; T6-W9 PolarHBondContact O-N 2.96Å; T6-W10 PolarHBondContact O-N 2.88Å
7	C	33	Very low	35.9	Very low	82 Å²	82	128.2 Å²	128.2	55%	0.554	66%	0.664	S	S	*	*	H	α-helix	trans	-65.5	-35.7	174.8	-68.4	0	0	0	0	112.6	W9 W10 L11	C7-W9 VanDerWaalsContact C-N 3.26Å; C7-W9 PolarHBondContact O-N 3.48Å; C7-W10 PolarHBondContact O-N 2.79Å; C7-L11 PolarHBondContact O-N 3.22Å
8	L	34.4	Very low	35.9	Very low	119 Å²	119	125.1 Å²	125.1	62%	0.623	67%	0.668	S	S	*	*	H	α-helix	trans	-63.6	-34.4	178.2	-149.4	81.5	0	0	0	111.9	T6 L12	T6-L8 VanDerWaalsContact C-N 3.32Å; T6-L8 PolarHBondContact O-N 2.84Å; L8-L12 PolarHBondContact O-N 2.93Å
9	W	33	Very low	36	Very low	187 Å²	187	122.4 Å²	122.4	71%	0.708	67%	0.673	S	S	*	*	H	α-helix	trans	-71.8	-39	177.1	-94.1	71.5	0	0	0	112.9	T6 C7 L12 V13	T6-W9 PolarHBondContact O-N 2.96Å; C7-W9 VanDerWaalsContact C-N 3.26Å; C7-W9 PolarHBondContact O-N 3.48Å; W9-L12 PolarHBondContact O-N 2.74Å; W9-V13 WeakPolarHBondContact O-CG2 3.24Å; W9-V13 PolarHBondContact O-N 3.16Å; W9-V13 VanDerWaalsContact O-N 3.08Å
10	W	36.1	Very low	35.6	Very low	187 Å²	187	118.5 Å²	118.5	71%	0.708	66%	0.662	S	S	*	*	H	α-helix	trans	-69.3	-33	177.4	-81.7	98.3	0	0	0	113	T6 C7 V13 T14	T6-W10 PolarHBondContact O-N 2.88Å; C7-W10 PolarHBondContact O-N 2.79Å; W10-V13 PolarHBondContact O-N 3.26Å; W10-T14 PolarHBondContact O-N 3.46Å; W10-T14 PolarHBondContact O-OG1 3.38Å
11	L	37.3	Very low	35.4	Very low	100 Å²	100	121 Å²	121	52%	0.524	67%	0.673	S	S	.	*	H	α-helix	trans	-63.8	-40.4	171.3	-102.7	154.2	0	0	0	112.1	C7 T14 L15	C7-L11 PolarHBondContact O-N 3.22Å; L11-T14 PolarHBondContact O-OG1 3.29Å; L11-L15 WeakPolarHBondContact O-CB 3.39Å; L11-L15 PolarHBondContact O-N 3.38Å; L11-L15 VanDerWaalsContact O-N 3.16Å
12	L	35.2	Very low	35.3	Very low	103 Å²	103	114.1 Å²	114.1	54%	0.539	66%	0.656	S	S	.	*	H	α-helix	trans	-68.7	-38.6	177.3	-154.7	87.2	0	0	0	112	L8 W9 I16	L8-L12 PolarHBondContact O-N 2.93Å; W9-L12 PolarHBondContact O-N 2.74Å; L12-I16 HydrophobicContact CD2-CD1 4.28Å; L12-I16 HydrophobicContact CG-CD1 4.09Å; L12-I16 WeakPolarHBondContact O-CD1 3.45Å; L12-I16 WeakPolarHBondContact O-CG1 3.22Å; L12-I16 PolarHBondContact O-N 3.28Å; L12-I16 VanDerWaalsContact O-N 3.17Å
13	V	40.3	Very low	34.9	Very low	67 Å²	67	112.5 Å²	112.5	41%	0.406	66%	0.656	S	S	.	*	H	α-helix	trans	-71.5	-37.4	-179.8	172.9	0	0	0	0	111.9	W9 W10 I16 V17	W9-V13 WeakPolarHBondContact O-CG2 3.24Å; W9-V13 PolarHBondContact O-N 3.16Å; W9-V13 VanDerWaalsContact O-N 3.08Å; W10-V13 PolarHBondContact O-N 3.26Å; V13-I16 PolarHBondContact O-N 2.76Å; V13-V17 HydrophobicContact CG1-CG2 4.15Å; V13-V17 VanDerWaalsContact O-CB 3.29Å; V13-V17 WeakPolarHBondContact O-CB 3.39Å; V13-V17 WeakPolarHBondContact O-CG2 3.48Å; V13-V17 PolarHBondContact O-N 3.04Å
14	T	42.4	Very low	34.4	Very low	89 Å²	89	115.8 Å²	115.8	55%	0.546	67%	0.667	S	S	.	*	H	α-helix	trans	-73.8	-30.5	176.9	40.2	0	0	0	0	112.9	W10 L11 G18	W10-T14 PolarHBondContact O-N 3.46Å; W10-T14 PolarHBondContact O-OG1 3.38Å; L11-T14 PolarHBondContact O-OG1 3.29Å; T14-G18 PolarHBondContact O-N 3.02Å
15	L	34.6	Very low	33.9	Very low	142 Å²	142	111.1 Å²	111.1	74%	0.743	66%	0.664	S	S	*	*	H	α-helix	trans	-67.2	-34.3	171.9	-160.3	90.4	0	0	0	112.6	L11	L11-L15 WeakPolarHBondContact O-CB 3.39Å; L11-L15 PolarHBondContact O-N 3.38Å; L11-L15 VanDerWaalsContact O-N 3.16Å
16	I	38.5	Very low	33.7	Very low	123 Å²	123	109.2 Å²	109.2	63%	0.631	67%	0.671	S	S	*	*	H	α-helix	trans	-85.6	-31.7	-179.4	-64.3	166.6	0	0	0	111.8	L12 V13	L12-I16 HydrophobicContact CD2-CD1 4.28Å; L12-I16 HydrophobicContact CG-CD1 4.09Å; L12-I16 WeakPolarHBondContact O-CD1 3.45Å; L12-I16 WeakPolarHBondContact O-CG1 3.22Å; L12-I16 PolarHBondContact O-N 3.28Å; L12-I16 VanDerWaalsContact O-N 3.17Å; V13-I16 PolarHBondContact O-N 2.76Å
17	V	38.3	Very low	33.2	Very low	102 Å²	102	110.3 Å²	110.3	62%	0.618	69%	0.688	S	S	*	*	H	α-helix	trans	-84.9	-25.5	179.7	176.2	0	0	0	0	112.4	V13 G19	V13-V17 HydrophobicContact CG1-CG2 4.15Å; V13-V17 VanDerWaalsContact O-CB 3.29Å; V13-V17 WeakPolarHBondContact O-CB 3.39Å; V13-V17 WeakPolarHBondContact O-CG2 3.48Å; V13-V17 PolarHBondContact O-N 3.04Å; V17-G19 VanDerWaalsContact C-N 3.26Å; V17-G19 PolarHBondContact O-N 3.27Å
18	G	34.9	Very low	33	Very low	71 Å²	71	111.4 Å²	111.4	73%	0.732	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-2.8	179.3	0	0	0	0	0	115.9	T14	T14-G18 PolarHBondContact O-N 3.02Å
19	G	37.5	Very low	32.9	Very low	74 Å²	74	115 Å²	115	76%	0.763	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	7.2	-177	0	0	0	0	0	115.6	V17	V17-G19 VanDerWaalsContact C-N 3.26Å; V17-G19 PolarHBondContact O-N 3.27Å
20	G	28.6	Very low	32.5	Very low	45 Å²	45	114.6 Å²	114.6	46%	0.464	73%	0.728	S	S	.	*	S	Bend	trans	-153.3	143.8	179.2	0	0	0	0	0	111.9
21	L	32.3	Very low	32.3	Very low	170 Å²	170	107.9 Å²	107.9	89%	0.89	72%	0.717	S	S	*	*			trans	82.9	87.5	179.1	-49.8	156.8	0	0	0	112
22	A	29.9	Very low	31.9	Very low	103 Å²	103	111.2 Å²	111.2	85%	0.851	74%	0.735	S	S	*	*				35.9	93.6	71.1	0	0	0	0	0	112.9
23	G	26.9	Very low	31.7	Very low	69 Å²	69	112 Å²	112	71%	0.711	74%	0.744	S	S	*	*			trans	112.6	135.7	153.5	0	0	0	0	0	117
24	Q	27	Very low	31.3	Very low	202 Å²	202	115.2 Å²	115.2	94%	0.944	76%	0.764	S	S	*	*			trans	81.9	96.5	153.2	-58.6	177.4	16.2	0	0	118.1
25	G	24.4	Very low	30.7	Very low	77 Å²	77	119.6 Å²	119.6	79%	0.794	78%	0.778	S	S	*	*				90.8	116	105.5	0	0	0	0	0	118.4
26	A	25.7	Very low	30.8	Very low	107 Å²	107	115.7 Å²	115.7	88%	0.884	76%	0.762	S	S	*	*			trans	66.2	114	140.8	0	0	0	0	0	119.5
27	A	27.5	Very low	30.5	Very low	98 Å²	98	118.1 Å²	118.1	81%	0.81	77%	0.77	S	S	*	*				-171.9	131.4	103.3	0	0	0	0	0	109.3
28	A	27.3	Very low	30.5	Very low	104 Å²	104	116.2 Å²	116.2	86%	0.86	76%	0.759	S	S	*	*			trans	-74	128.4	175.6	0	0	0	0	0	110.4
29	E	32.3	Very low	30.6	Very low	194 Å²	194	115.2 Å²	115.2	91%	0.907	74%	0.738	S	S	*	*			trans	-122.3	120.8	157.7	-78.1	-169.3	127.4	0	0	108.9	G31	E29-G31 PolarHBondContact O-N 3.01Å
30	N	26.5	Very low	30.5	Very low	180 Å²	180	116.6 Å²	116.6	96%	0.963	73%	0.734	S	S	*	*			trans	-86.6	84	-170.6	-151.2	2.2	0	0	0	108.1
31	G	31.9	Very low	31.1	Very low	46 Å²	46	116.6 Å²	116.6	47%	0.474	72%	0.723	S	S	.	*			trans	-114.7	119.1	173.9	0	0	0	0	0	108.8	E29 T33	E29-G31 PolarHBondContact O-N 3.01Å; G31-T33 PolarHBondContact O-N 3.29Å; G31-T33 PolarHBondContact O-OG1 3.35Å
32	N	28.9	Very low	31.3	Very low	170 Å²	170	116.2 Å²	116.2	91%	0.909	72%	0.717	S	S	*	*			trans	-52	88.1	173.4	-173.3	24.2	0	0	0	109.9
33	T	31	Very low	31.7	Very low	118 Å²	118	118.3 Å²	118.3	72%	0.724	71%	0.709	S	S	*	*			trans	-108.9	107.7	-179.3	24.1	0	0	0	0	104.5	G31 E35	G31-T33 PolarHBondContact O-N 3.29Å; G31-T33 PolarHBondContact O-OG1 3.35Å; T33-E35 PolarHBondContact O-N 3.48Å
34	T	30.6	Very low	32.2	Very low	135 Å²	135	118.1 Å²	118.1	83%	0.828	71%	0.707	S	S	*	*			trans	-48.2	115.7	163.3	-37.7	0	0	0	0	106.2
35	E	31	Very low	32.7	Very low	181 Å²	181	110.8 Å²	110.8	85%	0.846	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-50.9	127.2	-179.8	-99.1	173.6	104.3	0	0	108.3	T33 E37	T33-E35 PolarHBondContact O-N 3.48Å; E35-E37 PolarHBondContact O-N 3.27Å
36	P	36.2	Very low	33.6	Very low	61 Å²	61	111 Å²	111	40%	0.396	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-60.4	129.3	176.6	23.9	-30.9	0	0	0	108.3	V38 Y120	P36-V38 WeakPolarHBondContact O-CG2 3.24Å; P36-V38 PolarHBondContact O-N 3.24Å; P36-V38 VanDerWaalsContact O-N 3.16Å; P36-Y120 HydrophobicContact CB-CD1 4.3Å
37	E	31.5	Very low	34.2	Very low	173 Å²	173	111.8 Å²	111.8	81%	0.808	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-61.8	119	171.5	-175.5	175.7	178.6	0	0	108.1	E35	E35-E37 PolarHBondContact O-N 3.27Å
38	V	37.8	Very low	34.9	Very low	63 Å²	63	111.7 Å²	111.7	38%	0.382	63%	0.631	S	S	.	*			trans	-96.5	110.6	-178	-177.5	0	0	0	0	108.7	P36 P40 R123	P36-V38 WeakPolarHBondContact O-CG2 3.24Å; P36-V38 PolarHBondContact O-N 3.24Å; P36-V38 VanDerWaalsContact O-N 3.16Å; V38-P40 WeakPolarHBondContact O-CD 3.31Å; V38-R123 HydrophobicContact CB-CB 4.45Å; V38-R123 HydrophobicContact CG1-CB 3.23Å
39	V	37.3	Very low	36	Very low	49 Å²	49	110 Å²	110	30%	0.297	61%	0.608	S	S	.	*			trans	-96.2	112.5	175.6	-176.1	0	0	0	0	108.6	I41 W80	V39-I41 PolarHBondContact O-N 3.43Å; V39-W80 HydrophobicContact CG1-CH2 3.76Å; V39-W80 HydrophobicContact CG1-CZ2 3.86Å; V39-W80 HydrophobicContact CG2-CH2 4.38Å
40	P	36.5	Very low	36.5	Very low	103 Å²	103	104.9 Å²	104.9	67%	0.669	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-66.3	122.8	175	27.1	-32.3	0	0	0	109.3	V38 R123	V38-P40 WeakPolarHBondContact O-CD 3.31Å; P40-R123 WeakPolarHBondContact CA-O 3.35Å
41	I	41.7	Very low	37.6	Very low	45 Å²	45	100.6 Å²	100.6	23%	0.231	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-98.3	127.3	172.6	-57.2	-171.5	0	0	0	107	V39 A45 L46 F106	V39-I41 PolarHBondContact O-N 3.43Å; I41-A45 HydrophobicContact CG2-CB 3.57Å; I41-L46 HydrophobicContact CD1-CD1 4.18Å; I41-L46 HydrophobicContact CG2-CB 4.32Å; I41-F106 HydrophobicContact CB-CE1 4.46Å; I41-F106 HydrophobicContact CD1-CE1 3.76Å; I41-F106 HydrophobicContact CD1-CZ 3.59Å; I41-F106 HydrophobicContact CG1-CE1 4.24Å; I41-F106 HydrophobicContact CG1-CZ 4.37Å
42	Q	36.6	Very low	38.3	Very low	163 Å²	163	101.1 Å²	101.1	76%	0.762	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-59	145.4	174.8	-68.3	-176.1	21.1	0	0	110	G44 A45	Q42-G44 PolarHBondContact O-N 3.46Å; Q42-A45 HydrophobicContact CB-CB 4.12Å; Q42-A45 VanDerWaalsContact O-CB 3.24Å; Q42-A45 WeakPolarHBondContact O-CB 3.42Å; Q42-A45 PolarHBondContact O-N 3.14Å
43	E	36.8	Very low	38.8	Very low	147 Å²	147	98.3 Å²	98.3	69%	0.687	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	129.2	172	-66.5	-167.6	148.3	0	0	109.8	A45	E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 2.69Å
44	G	38.8	Very low	39.4	Very low	65 Å²	65	95.8 Å²	95.8	67%	0.67	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-8.1	-175	0	0	0	0	0	115.9	Q42	Q42-G44 PolarHBondContact O-N 3.46Å
45	A	37.2	Very low	40	Very low	48 Å²	48	92.8 Å²	92.8	40%	0.397	51%	0.513	S	S	.	.			trans	-78.2	-23.1	179.8	0	0	0	0	0	113.6	I41 Q42 E43 Q47	I41-A45 HydrophobicContact CG2-CB 3.57Å; Q42-A45 HydrophobicContact CB-CB 4.12Å; Q42-A45 VanDerWaalsContact O-CB 3.24Å; Q42-A45 WeakPolarHBondContact O-CB 3.42Å; Q42-A45 PolarHBondContact O-N 3.14Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 2.69Å; A45-Q47 PolarHBondContact O-N 3.04Å
46	L	42.2	Very low	40.8	Very low	80 Å²	80	86.6 Å²	86.6	42%	0.419	49%	0.493	S	S	.	.			trans	-87.6	88.6	168.4	-163.4	88.9	0	0	0	109.9	I41	I41-L46 HydrophobicContact CD1-CD1 4.18Å; I41-L46 HydrophobicContact CG2-CB 4.32Å
47	Q	39.5	Very low	41.3	Very low	124 Å²	124	88.4 Å²	88.4	58%	0.579	50%	0.496	S	S	*	.			trans	-82.4	-35.2	178.5	-61.8	-174.2	27	0	0	112.5	A45	A45-Q47 PolarHBondContact O-N 3.04Å
48	E	41.3	Very low	41.8	Very low	96 Å²	96	80.9 Å²	80.9	45%	0.449	46%	0.464	S	S	.	.			trans	-152.6	133.2	-178.3	-164.3	178.3	-168.9	0	0	111.1	K50	E48-K50 HydrophobicContact CG-CG 4.12Å; E48-K50 WeakPolarHBondContact OE1-CE 3.18Å; E48-K50 IonicContact OE1-NZ 3.59Å; E48-K50 WeakPolarHBondContact OE2-CE 3.49Å; E48-K50 IonicContact OE2-NZ 3.9Å
49	L	50.5	Low	41.9	Very low	70 Å²	70	82.8 Å²	82.8	37%	0.366	47%	0.468	S	S	.	.			trans	-111	105.4	170.1	178.7	66.8	0	0	0	108.8	I94 L108	L49-I94 HydrophobicContact CD2-CD1 4.44Å; L49-L108 HydrophobicContact CD2-CD2 4.45Å
50	K	43.7	Very low	42.3	Very low	85 Å²	85	84.5 Å²	84.5	37%	0.37	48%	0.479	S	S	.	.			trans	-98.8	129.7	172.4	-68.6	-177.3	-176.8	163.4	0	110.2	E48 F52	E48-K50 HydrophobicContact CG-CG 4.12Å; E48-K50 WeakPolarHBondContact OE1-CE 3.18Å; E48-K50 IonicContact OE1-NZ 3.59Å; E48-K50 WeakPolarHBondContact OE2-CE 3.49Å; E48-K50 IonicContact OE2-NZ 3.9Å; K50-F52 HydrophobicContact CB-CD2 4.43Å; K50-F52 HydrophobicContact CB-CE2 3.62Å; K50-F52 HydrophobicContact CB-CZ 3.8Å; K50-F52 HydrophobicContact CD-CE2 4.46Å; K50-F52 HydrophobicContact CD-CZ 3.89Å
51	I	49.2	Very low	42.5	Very low	90 Å²	90	83.1 Å²	83.1	46%	0.462	46%	0.464	S	S	.	.			trans	-108.3	119.5	175.2	-60.9	171.4	0	0	0	107.7	F92	I51-F92 HydrophobicContact CB-CE1 4.4Å; I51-F92 HydrophobicContact CD1-CB 4.29Å; I51-F92 HydrophobicContact CD1-CD1 3.46Å; I51-F92 VanDerWaalsContact CD1-CD1 3.46Å; I51-F92 HydrophobicContact CD1-CD2 3.75Å; I51-F92 HydrophobicContact CD1-CE1 3.58Å; I51-F92 HydrophobicContact CD1-CE2 3.85Å; I51-F92 HydrophobicContact CD1-CG 3.56Å; I51-F92 HydrophobicContact CD1-CZ 3.77Å; I51-F92 HydrophobicContact CG2-CE1 4.39Å
52	F	45.6	Very low	42.4	Very low	57 Å²	57	83.3 Å²	83.3	25%	0.25	47%	0.468	C	S	.	.			trans	-99.7	132.2	178.8	-62.9	-83.5	0	0	0	110.1	K50 N54 E57 A58 Q61	K50-F52 HydrophobicContact CB-CD2 4.43Å; K50-F52 HydrophobicContact CB-CE2 3.62Å; K50-F52 HydrophobicContact CB-CZ 3.8Å; K50-F52 HydrophobicContact CD-CE2 4.46Å; K50-F52 HydrophobicContact CD-CZ 3.89Å; F52-N54 VanDerWaalsContact C-N 3.26Å; F52-E57 HydrophobicContact CD1-CB 3.93Å; F52-A58 HydrophobicContact CB-CB 3.95Å; F52-A58 HydrophobicContact CD2-CB 3.46Å; F52-A58 VanDerWaalsContact CD2-CB 3.46Å; F52-A58 HydrophobicContact CE2-CB 4.16Å; F52-A58 HydrophobicContact CG-CB 3.79Å; F52-Q61 HydrophobicContact CE1-CG 4.04Å; F52-Q61 VanDerWaalsContact CE1-NE2 3.28Å; F52-Q61 HydrophobicContact CZ-CB 3.89Å; F52-Q61 VanDerWaalsContact CZ-CD 3.43Å; F52-Q61 HydrophobicContact CZ-CG 3.88Å
53	A	40.4	Very low	42.4	Very low	111 Å²	111	81.8 Å²	81.8	92%	0.917	47%	0.465	S	S	*	.	S	Bend	trans	-71.1	-28	172.2	0	0	0	0	0	111.6
54	N	43	Very low	42.4	Very low	66 Å²	66	81.5 Å²	81.5	35%	0.353	47%	0.469	S	S	.	.	S	Bend	trans	-111	119.7	178.8	-177.6	1.5	0	0	0	109.8	F52 A56 E57 A58	F52-N54 VanDerWaalsContact C-N 3.26Å; N54-A56 PolarHBondContact O-N 2.7Å; N54-A56 WeakPolarHBondContact OD1-CB 3.45Å; N54-A56 PolarHBondContact OD1-N 2.8Å; N54-A56 VanDerWaalsContact OD1-N 3.08Å; N54-E57 HydrophobicContact CB-CB 4.28Å; N54-E57 HydrophobicContact CB-CG 3.98Å; N54-E57 PolarHBondContact O-N 3.21Å; N54-E57 VanDerWaalsContact O-N 3.08Å; N54-A58 PolarHBondContact O-N 3.27Å
55	P	42.8	Very low	42.3	Very low	72 Å²	72	81.7 Å²	81.7	47%	0.468	46%	0.457	S	S	.	.	H	α-helix	trans	-60.8	-26.9	178.3	24.8	-34.1	0	0	0	113	E57 A58 E59	P55-E57 VanDerWaalsContact C-N 3.34Å; P55-A58 WeakPolarHBondContact O-CB 3.37Å; P55-A58 PolarHBondContact O-N 3.36Å; P55-E59 PolarHBondContact O-N 3.44Å
56	A	47.4	Very low	42.1	Very low	51 Å²	51	83 Å²	83	42%	0.421	47%	0.467	S	S	.	.	H	α-helix	trans	-68.8	-31.2	176.8	0	0	0	0	0	112.8	N54 A58 T60	N54-A56 PolarHBondContact O-N 2.7Å; N54-A56 WeakPolarHBondContact OD1-CB 3.45Å; N54-A56 PolarHBondContact OD1-N 2.8Å; N54-A56 VanDerWaalsContact OD1-N 3.08Å; A56-A58 VanDerWaalsContact C-N 3.35Å; A56-T60 PolarHBondContact O-N 3.41Å
57	E	46.8	Very low	41.6	Very low	99 Å²	99	84.8 Å²	84.8	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-74.1	-29.3	176	-71.2	169.6	-159.2	0	0	111.8	F52 N54 P55 T60 Q61	F52-E57 HydrophobicContact CD1-CB 3.93Å; N54-E57 HydrophobicContact CB-CB 4.28Å; N54-E57 HydrophobicContact CB-CG 3.98Å; N54-E57 PolarHBondContact O-N 3.21Å; N54-E57 VanDerWaalsContact O-N 3.08Å; P55-E57 VanDerWaalsContact C-N 3.34Å; E57-T60 WeakPolarHBondContact CA-OG1 2.92Å; E57-T60 PolarHBondContact O-OG1 3.42Å; E57-Q61 PolarHBondContact O-N 3.34Å
58	A	43.6	Very low	41.3	Very low	15 Å²	15	84 Å²	84	12%	0.124	48%	0.482	C	S	.	.	H	α-helix	trans	-65.4	-43.9	173.8	0	0	0	0	0	111.4	F52 N54 P55 A56 T60 Q61 C62	F52-A58 HydrophobicContact CB-CB 3.95Å; F52-A58 HydrophobicContact CD2-CB 3.46Å; F52-A58 VanDerWaalsContact CD2-CB 3.46Å; F52-A58 HydrophobicContact CE2-CB 4.16Å; F52-A58 HydrophobicContact CG-CB 3.79Å; N54-A58 PolarHBondContact O-N 3.27Å; P55-A58 WeakPolarHBondContact O-CB 3.37Å; P55-A58 PolarHBondContact O-N 3.36Å; A56-A58 VanDerWaalsContact C-N 3.35Å; A58-T60 VanDerWaalsContact C-N 3.32Å; A58-T60 PolarHBondContact O-N 3.31Å; A58-Q61 PolarHBondContact O-N 2.62Å; A58-C62 PolarHBondContact O-N 3.48Å; A58-C62 PolarHBondContact O-SG 3.31Å
59	E	39.9	Very low	41.2	Very low	103 Å²	103	84.9 Å²	84.9	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-39.6	179.3	-71.7	-178.4	168.2	0	0	111.6	P55 Q61 C62 R83	P55-E59 PolarHBondContact O-N 3.44Å; E59-Q61 PolarHBondContact O-N 3.39Å; E59-C62 PolarHBondContact O-N 2.8Å; E59-R83 IonicContact OE1-CZ 3.42Å; E59-R83 IonicContact OE1-NH1 3.81Å; E59-R83 IonicContact OE1-NH2 2.62Å; E59-R83 PolarHBondContact OE1-NH2 3.42Å
60	T	44.9	Very low	40.5	Very low	85 Å²	85	85 Å²	85	52%	0.521	52%	0.516	S	S	.	.	H	α-helix	trans	-67.2	-32.5	178.4	52.5	0	0	0	0	113.8	A56 E57 A58	A56-T60 PolarHBondContact O-N 3.41Å; E57-T60 WeakPolarHBondContact CA-OG1 2.92Å; E57-T60 PolarHBondContact O-OG1 3.42Å; A58-T60 VanDerWaalsContact C-N 3.32Å; A58-T60 PolarHBondContact O-N 3.31Å
61	Q	40.6	Very low	40.1	Very low	74 Å²	74	84.8 Å²	84.8	35%	0.346	54%	0.538	S	S	.	.	H	α-helix	trans	-82.4	-15.6	179.7	-69.2	-154	29.7	0	0	113.2	F52 E57 A58 E59 V65	F52-Q61 HydrophobicContact CE1-CG 4.04Å; F52-Q61 VanDerWaalsContact CE1-NE2 3.28Å; F52-Q61 HydrophobicContact CZ-CB 3.89Å; F52-Q61 VanDerWaalsContact CZ-CD 3.43Å; F52-Q61 HydrophobicContact CZ-CG 3.88Å; E57-Q61 PolarHBondContact O-N 3.34Å; A58-Q61 PolarHBondContact O-N 2.62Å; E59-Q61 PolarHBondContact O-N 3.39Å; Q61-V65 WeakPolarHBondContact O-CG2 3.5Å
62	C	39.7	Very low	39.5	Very low	49 Å²	49	84.7 Å²	84.7	33%	0.331	55%	0.545	S	S	.	.	H	α-helix	trans	-73.9	-32.2	172.2	-72.7	0	0	0	0	112.4	A58 E59	A58-C62 PolarHBondContact O-N 3.48Å; A58-C62 PolarHBondContact O-SG 3.31Å; E59-C62 PolarHBondContact O-N 2.8Å
63	D	36.8	Very low	38.9	Very low	130 Å²	130	84.6 Å²	84.6	70%	0.695	56%	0.56	S	S	*	*	H	α-helix	trans	-75.5	-33.8	178.4	-90.5	-13.3	0	0	0	112.7	V65 A66	D63-V65 VanDerWaalsContact C-N 3.28Å; D63-V65 PolarHBondContact O-N 3.31Å; D63-A66 PolarHBondContact O-N 3.08Å
64	D	36.4	Very low	38.5	Very low	142 Å²	142	86.6 Å²	86.6	76%	0.759	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-15.2	-175.4	-89.5	-20	0	0	0	114.3
65	V	37.4	Very low	38.2	Very low	69 Å²	69	90 Å²	90	42%	0.418	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.5	-0.4	-178.4	-160.6	0	0	0	0	113.1	Q61 D63 Y79	Q61-V65 WeakPolarHBondContact O-CG2 3.5Å; D63-V65 VanDerWaalsContact C-N 3.28Å; D63-V65 PolarHBondContact O-N 3.31Å; V65-Y79 HydrophobicContact CB-CD2 4.15Å; V65-Y79 HydrophobicContact CB-CE2 3.57Å; V65-Y79 HydrophobicContact CG1-CD2 4.28Å; V65-Y79 HydrophobicContact CG1-CE2 3.3Å; V65-Y79 HydrophobicContact CG2-CD2 4.42Å; V65-Y79 HydrophobicContact CG2-CE2 3.81Å
66	A	33	Very low	37.7	Very low	74 Å²	74	95.5 Å²	95.5	61%	0.612	59%	0.593	S	S	*	*	S	Bend	trans	-90	2.9	-174.2	0	0	0	0	0	115.6	D63	D63-A66 PolarHBondContact O-N 3.08Å
67	T	30.4	Very low	37	Very low	118 Å²	118	95 Å²	95	72%	0.724	59%	0.585	S	S	*	*			trans	-153	85.9	177.6	33.1	0	0	0	0	110.7	A69	T67-A69 PolarHBondContact O-N 3.08Å
68	D	34.1	Very low	36.2	Very low	109 Å²	109	94.2 Å²	94.2	58%	0.583	59%	0.589	S	S	*	*			trans	-63.3	121.4	147.6	76.6	-26.5	0	0	0	106.4	A70	D68-A70 PolarHBondContact O-N 3.19Å
69	A	38.3	Very low	35.6	Very low	114 Å²	114	97.2 Å²	97.2	94%	0.942	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	18.3	-180	0	0	0	0	0	112.5	T67	T67-A69 PolarHBondContact O-N 3.08Å
70	A	37.4	Very low	35.3	Very low	73 Å²	73	99.6 Å²	99.6	60%	0.603	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	13.3	-172.3	0	0	0	0	0	113.3	D68 S72	D68-A70 PolarHBondContact O-N 3.19Å; A70-S72 PolarHBondContact O-N 3.32Å
71	G	33.6	Very low	34.7	Very low	80 Å²	80	98.7 Å²	98.7	83%	0.825	60%	0.604	S	S	*	*			trans	48.6	29.6	155.9	0	0	0	0	0	116.2
72	S	36.6	Very low	34.6	Very low	88 Å²	88	99.3 Å²	99.3	62%	0.615	61%	0.609	S	S	*	*			trans	-105.6	106.5	177.3	-177.6	0	0	0	0	105.9	A70	A70-S72 PolarHBondContact O-N 3.32Å
73	G	33	Very low	34.3	Very low	54 Å²	54	104.8 Å²	104.8	56%	0.557	62%	0.622	S	S	*	*			trans	-54	160.2	164.2	0	0	0	0	0	110.6
74	D	32.4	Very low	34.4	Very low	154 Å²	154	102.7 Å²	102.7	82%	0.824	61%	0.607	S	S	*	*	S	Bend	trans	86	71.4	179.2	-45.4	-30.5	0	0	0	113.2
75	D	36.7	Very low	34.2	Very low	137 Å²	137	106 Å²	106	73%	0.733	61%	0.609	S	S	*	*			trans	171.5	76.6	132.7	-78.9	-24.4	0	0	0	108.5	V77	D75-V77 VanDerWaalsContact C-N 3.3Å; D75-V77 PolarHBondContact O-N 3.17Å
76	E	32	Very low	34	Very low	187 Å²	187	110.1 Å²	110.1	87%	0.874	63%	0.629	S	S	*	*			trans	-63.8	92.8	169.1	-79	-174.3	157.2	0	0	108.9	C78	E76-C78 VanDerWaalsContact C-N 3.3Å; E76-C78 PolarHBondContact O-N 2.94Å
77	V	33.8	Very low	34.2	Very low	41 Å²	41	110.2 Å²	110.2	25%	0.248	62%	0.618	C	S	.	*			trans	-73.3	90.1	169	-172.7	0	0	0	0	107.6	D75 Y79	D75-V77 VanDerWaalsContact C-N 3.3Å; D75-V77 PolarHBondContact O-N 3.17Å; V77-Y79 HydrophobicContact CB-CD2 4.45Å; V77-Y79 HydrophobicContact CB-CE2 3.86Å; V77-Y79 HydrophobicContact CG1-CD2 4.02Å; V77-Y79 HydrophobicContact CG1-CE1 4.31Å; V77-Y79 HydrophobicContact CG1-CE2 3.45Å; V77-Y79 VanDerWaalsContact CG1-CE2 3.45Å; V77-Y79 VanDerWaalsContact O-CD2 3.24Å; V77-Y79 WeakPolarHBondContact O-CD2 3.45Å; V77-Y79 PolarHBondContact O-N 3.42Å
78	C	28.9	Very low	34.4	Very low	82 Å²	82	110.9 Å²	110.9	55%	0.554	61%	0.613	S	S	*	*			trans	-67.5	99.5	171	-79.6	0	0	0	0	109.7	E76 W80	E76-C78 VanDerWaalsContact C-N 3.3Å; E76-C78 PolarHBondContact O-N 2.94Å; C78-W80 PolarHBondContact O-N 3.16Å
79	Y	32.3	Very low	34.1	Very low	78 Å²	78	113.4 Å²	113.4	31%	0.306	63%	0.626	S	S	.	*			trans	-73.7	116.1	168	-69.5	-88.7	0	0	0	109.8	V65 V77 A81	V65-Y79 HydrophobicContact CB-CD2 4.15Å; V65-Y79 HydrophobicContact CB-CE2 3.57Å; V65-Y79 HydrophobicContact CG1-CD2 4.28Å; V65-Y79 HydrophobicContact CG1-CE2 3.3Å; V65-Y79 HydrophobicContact CG2-CD2 4.42Å; V65-Y79 HydrophobicContact CG2-CE2 3.81Å; V77-Y79 HydrophobicContact CB-CD2 4.45Å; V77-Y79 HydrophobicContact CB-CE2 3.86Å; V77-Y79 HydrophobicContact CG1-CD2 4.02Å; V77-Y79 HydrophobicContact CG1-CE1 4.31Å; V77-Y79 HydrophobicContact CG1-CE2 3.45Å; V77-Y79 VanDerWaalsContact CG1-CE2 3.45Å; V77-Y79 VanDerWaalsContact O-CD2 3.24Å; V77-Y79 WeakPolarHBondContact O-CD2 3.45Å; V77-Y79 PolarHBondContact O-N 3.42Å; Y79-A81 PolarHBondContact O-N 3.01Å
80	W	32	Very low	33.8	Very low	153 Å²	153	111.2 Å²	111.2	58%	0.58	59%	0.594	S	S	*	*			trans	-83.8	105.3	172.7	-62.7	83.9	0	0	0	109.5	V39 C78 I82	V39-W80 HydrophobicContact CG1-CH2 3.76Å; V39-W80 HydrophobicContact CG1-CZ2 3.86Å; V39-W80 HydrophobicContact CG2-CH2 4.38Å; C78-W80 PolarHBondContact O-N 3.16Å; W80-I82 PolarHBondContact O-N 3.49Å
81	A	33	Very low	33.4	Very low	66 Å²	66	112.4 Å²	112.4	55%	0.545	59%	0.593	S	S	.	*			trans	-83.3	106.4	170.6	0	0	0	0	0	110	Y79 R83	Y79-A81 PolarHBondContact O-N 3.01Å; A81-R83 PolarHBondContact O-N 3.4Å
82	I	39.2	Very low	33.4	Very low	88 Å²	88	114.3 Å²	114.3	45%	0.451	58%	0.579	S	S	.	*			trans	-81.7	102.5	171.8	-54.6	175.8	0	0	0	108.1	W80 F84 L108	W80-I82 PolarHBondContact O-N 3.49Å; I82-F84 HydrophobicContact CB-CE2 4.21Å; I82-F84 HydrophobicContact CB-CZ 4.1Å; I82-F84 HydrophobicContact CG2-CD1 4.19Å; I82-F84 HydrophobicContact CG2-CD2 4.46Å; I82-F84 HydrophobicContact CG2-CE1 3.57Å; I82-F84 HydrophobicContact CG2-CE2 3.83Å; I82-F84 HydrophobicContact CG2-CZ 3.32Å; I82-F84 PolarHBondContact O-N 3.05Å; I82-L108 HydrophobicContact CD1-CD1 4.2Å
83	R	33	Very low	33.1	Very low	164 Å²	164	113.6 Å²	113.6	62%	0.619	57%	0.574	S	S	*	*			trans	-80.2	112.1	175.1	-171.7	-174.2	-62.1	-148.3	-1.7	110.3	E59 A81 R85	E59-R83 IonicContact OE1-CZ 3.42Å; E59-R83 IonicContact OE1-NH1 3.81Å; E59-R83 IonicContact OE1-NH2 2.62Å; E59-R83 PolarHBondContact OE1-NH2 3.42Å; A81-R83 PolarHBondContact O-N 3.4Å; R83-R85 PolarHBondContact O-N 2.73Å
84	F	38.7	Very low	33.1	Very low	85 Å²	85	116.7 Å²	116.7	37%	0.373	58%	0.577	S	S	.	*			trans	-88.4	102.8	170.8	-70.4	-54	0	0	0	110	I82 D86 L87 F110	I82-F84 HydrophobicContact CB-CE2 4.21Å; I82-F84 HydrophobicContact CB-CZ 4.1Å; I82-F84 HydrophobicContact CG2-CD1 4.19Å; I82-F84 HydrophobicContact CG2-CD2 4.46Å; I82-F84 HydrophobicContact CG2-CE1 3.57Å; I82-F84 HydrophobicContact CG2-CE2 3.83Å; I82-F84 HydrophobicContact CG2-CZ 3.32Å; I82-F84 PolarHBondContact O-N 3.05Å; F84-D86 PolarHBondContact O-N 3.3Å; F84-L87 HydrophobicContact CB-CB 4.02Å; F84-L87 HydrophobicContact CB-CD1 3.23Å; F84-L87 HydrophobicContact CB-CG 3.95Å; F84-L87 HydrophobicContact CD1-CD1 3.01Å; F84-L87 HydrophobicContact CD1-CG 4.44Å; F84-L87 HydrophobicContact CD2-CD1 4.31Å; F84-L87 HydrophobicContact CE1-CD1 3.96Å; F84-L87 HydrophobicContact CG-CD1 3.23Å; F84-L87 HydrophobicContact CG-CG 4.38Å; F84-F110 HydrophobicContact CE1-CD1 4.21Å; F84-F110 AromaticContact CE1-CE1 3.73Å; F84-F110 HydrophobicContact CE1-CE1 3.73Å; F84-F110 HydrophobicContact CE1-CZ 4.28Å; F84-F110 HydrophobicContact CE2-CE1 4.42Å; F84-F110 HydrophobicContact CZ-CD1 4.13Å; F84-F110 AromaticContact CZ-CE1 3.35Å; F84-F110 HydrophobicContact CZ-CE1 3.35Å; F84-F110 HydrophobicContact CZ-CZ 4.01Å
85	R	31.5	Very low	33	Very low	212 Å²	212	112.3 Å²	112.3	80%	0.8	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	116.3	164.7	-66	-170.4	-164.8	-167.3	4.6	106.3	R83	R83-R85 PolarHBondContact O-N 2.73Å
86	D	34.8	Very low	32.7	Very low	156 Å²	156	110.7 Å²	110.7	83%	0.834	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.8	22	166.2	-48.4	-45.5	0	0	0	120.3	F84 E88	F84-D86 PolarHBondContact O-N 3.3Å; D86-E88 PolarHBondContact O-N 3.27Å
87	L	37.4	Very low	32.5	Very low	75 Å²	75	105.8 Å²	105.8	39%	0.393	57%	0.565	S	S	.	*			trans	-98.4	100.3	-167.8	-67.7	165.6	0	0	0	115.9	F84 L89 Y90	F84-L87 HydrophobicContact CB-CB 4.02Å; F84-L87 HydrophobicContact CB-CD1 3.23Å; F84-L87 HydrophobicContact CB-CG 3.95Å; F84-L87 HydrophobicContact CD1-CD1 3.01Å; F84-L87 HydrophobicContact CD1-CG 4.44Å; F84-L87 HydrophobicContact CD2-CD1 4.31Å; F84-L87 HydrophobicContact CE1-CD1 3.96Å; F84-L87 HydrophobicContact CG-CD1 3.23Å; F84-L87 HydrophobicContact CG-CG 4.38Å; L87-L89 PolarHBondContact O-N 3.17Å; L87-Y90 HydrophobicContact CB-CD2 4.03Å; L87-Y90 HydrophobicContact CB-CE2 3.82Å; L87-Y90 HydrophobicContact CD1-CE2 4.31Å; L87-Y90 HydrophobicContact CD2-CD2 4.18Å; L87-Y90 HydrophobicContact CD2-CE2 3.18Å; L87-Y90 VanDerWaalsContact CD2-OH 3.24Å; L87-Y90 WeakPolarHBondContact CD2-OH 3.43Å; L87-Y90 HydrophobicContact CG-CD2 4.49Å; L87-Y90 HydrophobicContact CG-CE2 3.91Å
88	E	33.7	Very low	32.4	Very low	132 Å²	132	107.4 Å²	107.4	62%	0.617	58%	0.583	S	S	*	*			trans	-64.8	109	158.1	-67.6	-171.9	152.3	0	0	110.3	D86 R113	D86-E88 PolarHBondContact O-N 3.27Å; E88-R113 IonicContact OE2-CZ 3.22Å; E88-R113 IonicContact OE2-NE 3.13Å; E88-R113 PolarHBondContact OE2-NE 3.3Å; E88-R113 VanDerWaalsContact OE2-NE 3.13Å; E88-R113 IonicContact OE2-NH2 2.7Å; E88-R113 PolarHBondContact OE2-NH2 3.33Å
89	L	28.5	Very low	32.4	Very low	163 Å²	163	108.1 Å²	108.1	85%	0.853	60%	0.604	S	S	*	*			trans	50.8	100.7	159.3	-142.2	106.4	0	0	0	117.7	L87	L87-L89 PolarHBondContact O-N 3.17Å
90	Y	32	Very low	32.4	Very low	68 Å²	68	109 Å²	109	27%	0.267	62%	0.617	S	S	.	*			trans	-116.7	131.5	170.7	-79.2	-105.4	0	0	0	112.1	L87 F110 L111 E112	L87-Y90 HydrophobicContact CB-CD2 4.03Å; L87-Y90 HydrophobicContact CB-CE2 3.82Å; L87-Y90 HydrophobicContact CD1-CE2 4.31Å; L87-Y90 HydrophobicContact CD2-CD2 4.18Å; L87-Y90 HydrophobicContact CD2-CE2 3.18Å; L87-Y90 VanDerWaalsContact CD2-OH 3.24Å; L87-Y90 WeakPolarHBondContact CD2-OH 3.43Å; L87-Y90 HydrophobicContact CG-CD2 4.49Å; L87-Y90 HydrophobicContact CG-CE2 3.91Å; Y90-F110 HydrophobicContact CD1-CB 4.15Å; Y90-F110 HydrophobicContact CE1-CB 3.95Å; Y90-L111 WeakPolarHBondContact CD1-O 3.28Å; Y90-L111 WeakPolarHBondContact CE1-O 3.25Å; Y90-E112 HydrophobicContact CE1-CB 4.31Å; Y90-E112 VanDerWaalsContact OH-CA 3.25Å; Y90-E112 WeakPolarHBondContact OH-CA 3.34Å; Y90-E112 VanDerWaalsContact OH-CB 3.28Å; Y90-E112 WeakPolarHBondContact OH-CB 3.21Å; Y90-E112 VanDerWaalsContact OH-CG 3.28Å; Y90-E112 WeakPolarHBondContact OH-CG 3.24Å
91	T	28.1	Very low	32.3	Very low	97 Å²	97	104.4 Å²	104.4	60%	0.595	62%	0.617	S	S	*	*			trans	-89	126.2	163.9	-54.2	0	0	0	0	108.3
92	F	34.4	Very low	32.4	Very low	120 Å²	120	108.2 Å²	108.2	53%	0.526	63%	0.629	S	S	.	*			trans	-104.1	142.6	176.2	52.6	-87.6	0	0	0	110.9	I51 I94	I51-F92 HydrophobicContact CB-CE1 4.4Å; I51-F92 HydrophobicContact CD1-CB 4.29Å; I51-F92 HydrophobicContact CD1-CD1 3.46Å; I51-F92 VanDerWaalsContact CD1-CD1 3.46Å; I51-F92 HydrophobicContact CD1-CD2 3.75Å; I51-F92 HydrophobicContact CD1-CE1 3.58Å; I51-F92 HydrophobicContact CD1-CE2 3.85Å; I51-F92 HydrophobicContact CD1-CG 3.56Å; I51-F92 HydrophobicContact CD1-CZ 3.77Å; I51-F92 HydrophobicContact CG2-CE1 4.39Å; F92-I94 HydrophobicContact CD2-CD1 4.38Å; F92-I94 HydrophobicContact CD2-CG1 4.34Å
93	S	28.9	Very low	32.2	Very low	73 Å²	73	109.8 Å²	109.8	51%	0.51	64%	0.638	S	S	.	*			trans	-118.7	118.9	167.3	65	0	0	0	0	108.8
94	I	33.9	Very low	32.2	Very low	120 Å²	120	104.7 Å²	104.7	62%	0.615	64%	0.637	S	S	*	*			trans	-92.9	107.5	172.1	-57.5	169.4	0	0	0	106.6	L49 F92	L49-I94 HydrophobicContact CD2-CD1 4.44Å; F92-I94 HydrophobicContact CD2-CD1 4.38Å; F92-I94 HydrophobicContact CD2-CG1 4.34Å
95	G	29.6	Very low	32	Very low	62 Å²	62	104.8 Å²	104.8	64%	0.639	64%	0.641	S	S	*	*			trans	-103.6	102.1	171.5	0	0	0	0	0	109.2	A97	G95-A97 PolarHBondContact O-N 3.08Å
96	A	30.1	Very low	32.2	Very low	103 Å²	103	97.9 Å²	97.9	85%	0.851	62%	0.617	S	S	*	*			trans	-79.5	111.7	165.8	0	0	0	0	0	108.3
97	A	28.5	Very low	32.2	Very low	83 Å²	83	92.8 Å²	92.8	69%	0.686	59%	0.593	S	S	*	*			trans	-108.6	134.7	159.4	0	0	0	0	0	105.5	G95	G95-A97 PolarHBondContact O-N 3.08Å
98	A	31.1	Very low	32.2	Very low	75 Å²	75	90.6 Å²	90.6	62%	0.62	58%	0.582	S	S	*	*			cis	-167.5	-164.2	-0.1	0	0	0	0	0	104.6	V100	A98-V100 HydrophobicContact CB-CG2 3.35Å; A98-V100 PolarHBondContact O-N 3.46Å
99	G	30.5	Very low	32.3	Very low	97 Å²	97	90.2 Å²	90.2	100%	1	57%	0.574	S	S	*	*	S	Bend	trans	-62.9	71.7	153.3	0	0	0	0	0	111.3
100	V	31.6	Very low	32.7	Very low	96 Å²	96	84.2 Å²	84.2	58%	0.582	54%	0.542	S	S	*	.			trans	-119.4	120.5	-176.4	-167.3	0	0	0	0	106.8	A98	A98-V100 HydrophobicContact CB-CG2 3.35Å; A98-V100 PolarHBondContact O-N 3.46Å
101	G	29.4	Very low	32.6	Very low	57 Å²	57	85.1 Å²	85.1	59%	0.588	55%	0.551	S	S	*	*			trans	-62.8	150.6	-174.4	0	0	0	0	0	113.7	D103	G101-D103 PolarHBondContact O-N 2.87Å
102	D	35.1	Very low	32.8	Very low	146 Å²	146	85 Å²	85	78%	0.781	54%	0.543	S	S	*	.	S	Bend	trans	47.3	-11.3	161.5	-58.1	-46.2	0	0	0	120.5
103	D	36	Very low	32.5	Very low	122 Å²	122	88.4 Å²	88.4	65%	0.652	55%	0.553	S	S	*	*			trans	-137.5	81.5	-177.3	-58.2	-45.8	0	0	0	110.7	G101 L105	G101-D103 PolarHBondContact O-N 2.87Å; D103-L105 HydrophobicContact CB-CD1 4.27Å; D103-L105 PolarHBondContact O-N 2.73Å
104	G	33.5	Very low	32.5	Very low	57 Å²	57	90 Å²	90	59%	0.588	57%	0.571	S	S	*	*			trans	-70.5	79.4	-179.3	0	0	0	0	0	115
105	L	33.8	Very low	32.4	Very low	87 Å²	87	93 Å²	93	46%	0.455	58%	0.582	S	S	.	*			trans	-76.1	132.7	173.2	-83	97	0	0	0	113	D103 F122 R123	D103-L105 HydrophobicContact CB-CD1 4.27Å; D103-L105 PolarHBondContact O-N 2.73Å; L105-F122 VanDerWaalsContact CD2-O 3.22Å; L105-F122 WeakPolarHBondContact CD2-O 3.19Å; L105-F122 WeakPolarHBondContact CG-O 3.02Å; L105-R123 HydrophobicContact CD1-CG 4.39Å; L105-R123 HydrophobicContact CD2-CB 4.13Å; L105-R123 HydrophobicContact CD2-CG 4.16Å; L105-R123 HydrophobicContact CG-CG 4.38Å
106	F	35.3	Very low	32.2	Very low	67 Å²	67	97.1 Å²	97.1	29%	0.294	58%	0.582	S	S	.	*			trans	-113.6	151.4	166.3	64.8	-84.7	0	0	0	111.4	I41 F122	I41-F106 HydrophobicContact CB-CE1 4.46Å; I41-F106 HydrophobicContact CD1-CE1 3.76Å; I41-F106 HydrophobicContact CD1-CZ 3.59Å; I41-F106 HydrophobicContact CG1-CE1 4.24Å; I41-F106 HydrophobicContact CG1-CZ 4.37Å; F106-F122 HydrophobicContact CD1-CB 4.38Å; F106-F122 HydrophobicContact CD2-CB 4.06Å; F106-F122 AromaticContact CD2-CD2 3.7Å; F106-F122 HydrophobicContact CD2-CD2 3.7Å; F106-F122 AromaticContact CD2-CG 3.96Å; F106-F122 HydrophobicContact CD2-CG 3.96Å; F106-F122 HydrophobicContact CE1-CB 4.05Å; F106-F122 HydrophobicContact CE2-CB 3.72Å; F106-F122 AromaticContact CE2-CD1 3.97Å; F106-F122 HydrophobicContact CE2-CD1 3.97Å; F106-F122 AromaticContact CE2-CD2 3.51Å; F106-F122 HydrophobicContact CE2-CD2 3.51Å; F106-F122 HydrophobicContact CE2-CE2 4.22Å; F106-F122 AromaticContact CE2-CG 3.42Å; F106-F122 HydrophobicContact CE2-CG 3.42Å; F106-F122 VanDerWaalsContact CE2-CG 3.42Å; F106-F122 HydrophobicContact CG-CB 4.37Å; F106-F122 HydrophobicContact CZ-CB 3.7Å; F106-F122 HydrophobicContact CZ-CD1 4.15Å; F106-F122 HydrophobicContact CZ-CD2 4.33Å; F106-F122 AromaticContact CZ-CG 3.78Å; F106-F122 HydrophobicContact CZ-CG 3.78Å; F106-F122 VanDerWaalsContact O-CB 3.31Å; F106-F122 WeakPolarHBondContact O-CB 3.36Å; F106-F122 WeakPolarHBondContact O-CD2 3.28Å; F106-F122 PolarHBondContact O-N 3.15Å; F106-F122 VanDerWaalsContact O-O 3.08Å
107	S	34.2	Very low	32	Very low	49 Å²	49	96.7 Å²	96.7	34%	0.343	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.6	128.1	177.9	176.6	0	0	0	0	109.9	Y120	S107-Y120 PolarHBondContact OG-O 3.34Å
108	L	38.4	Very low	32.2	Very low	29 Å²	29	94.9 Å²	94.9	15%	0.152	55%	0.554	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.1	126.2	171.8	-59.3	161.4	0	0	0	108.2	L49 I82 F110 Y120 F122	L49-L108 HydrophobicContact CD2-CD2 4.45Å; I82-L108 HydrophobicContact CD1-CD1 4.2Å; L108-F110 HydrophobicContact CB-CE2 3.82Å; L108-F110 HydrophobicContact CB-CZ 3.95Å; L108-F110 HydrophobicContact CD1-CZ 4.31Å; L108-Y120 PolarHBondContact N-O 3.47Å; L108-Y120 VanDerWaalsContact N-O 3.14Å; L108-Y120 CarbonylContact O-C 3.56Å; L108-Y120 WeakPolarHBondContact O-CA 3.17Å; L108-Y120 WeakPolarHBondContact O-CB 3.44Å; L108-Y120 PolarHBondContact O-N 3.13Å; L108-F122 HydrophobicContact CB-CE2 3.52Å; L108-F122 HydrophobicContact CB-CZ 4.14Å; L108-F122 HydrophobicContact CD1-CD2 4.22Å; L108-F122 HydrophobicContact CD1-CE1 4.23Å; L108-F122 HydrophobicContact CD1-CE2 3.3Å; L108-F122 HydrophobicContact CD1-CZ 3.29Å; L108-F122 HydrophobicContact CG-CD2 4.15Å; L108-F122 HydrophobicContact CG-CE2 3.39Å; L108-F122 HydrophobicContact CG-CZ 3.95Å
109	R	34.9	Very low	32.2	Very low	123 Å²	123	100.2 Å²	100.2	46%	0.464	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	122.4	172	-171.2	-176.2	-67.7	-153.9	1.7	108.9
110	F	37.4	Very low	32.3	Very low	38 Å²	38	100.1 Å²	100.1	17%	0.167	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.5	174.8	-57.3	-89.5	0	0	0	108.8	F84 Y90 L108 S118 Y120	F84-F110 HydrophobicContact CE1-CD1 4.21Å; F84-F110 AromaticContact CE1-CE1 3.73Å; F84-F110 HydrophobicContact CE1-CE1 3.73Å; F84-F110 HydrophobicContact CE1-CZ 4.28Å; F84-F110 HydrophobicContact CE2-CE1 4.42Å; F84-F110 HydrophobicContact CZ-CD1 4.13Å; F84-F110 AromaticContact CZ-CE1 3.35Å; F84-F110 HydrophobicContact CZ-CE1 3.35Å; F84-F110 HydrophobicContact CZ-CZ 4.01Å; Y90-F110 HydrophobicContact CD1-CB 4.15Å; Y90-F110 HydrophobicContact CE1-CB 3.95Å; L108-F110 HydrophobicContact CB-CE2 3.82Å; L108-F110 HydrophobicContact CB-CZ 3.95Å; L108-F110 HydrophobicContact CD1-CZ 4.31Å; F110-S118 PolarHBondContact N-O 3.39Å; F110-S118 PolarHBondContact O-N 3.33Å; F110-Y120 HydrophobicContact CB-CE2 4.38Å; F110-Y120 AromaticContact CD2-CD2 3.15Å; F110-Y120 HydrophobicContact CD2-CD2 3.15Å; F110-Y120 AromaticContact CD2-CE2 3.29Å; F110-Y120 HydrophobicContact CD2-CE2 3.29Å; F110-Y120 AromaticContact CD2-CG 3.94Å; F110-Y120 HydrophobicContact CD2-CG 3.94Å; F110-Y120 HydrophobicContact CE2-CD1 4.43Å; F110-Y120 AromaticContact CE2-CD2 3.49Å; F110-Y120 HydrophobicContact CE2-CD2 3.49Å; F110-Y120 VanDerWaalsContact CE2-CD2 3.49Å; F110-Y120 AromaticContact CE2-CE2 3.84Å; F110-Y120 HydrophobicContact CE2-CE2 3.84Å; F110-Y120 AromaticContact CE2-CG 3.77Å; F110-Y120 HydrophobicContact CE2-CG 3.77Å; F110-Y120 HydrophobicContact CG-CD2 4.34Å; F110-Y120 HydrophobicContact CG-CE2 4.17Å
111	L	30.4	Very low	32.1	Very low	87 Å²	87	98.4 Å²	98.4	46%	0.455	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	92	173.4	-79.7	152.4	0	0	0	108.2	Y90	Y90-L111 WeakPolarHBondContact CD1-O 3.28Å; Y90-L111 WeakPolarHBondContact CE1-O 3.25Å
112	E	30.7	Very low	32.3	Very low	95 Å²	95	97.7 Å²	97.7	44%	0.444	50%	0.501	S	S	.	.			trans	-67.5	143.4	169.7	-170.8	170.8	-149.2	0	0	109	Y90 A114 K116	Y90-E112 HydrophobicContact CE1-CB 4.31Å; Y90-E112 VanDerWaalsContact OH-CA 3.25Å; Y90-E112 WeakPolarHBondContact OH-CA 3.34Å; Y90-E112 VanDerWaalsContact OH-CB 3.28Å; Y90-E112 WeakPolarHBondContact OH-CB 3.21Å; Y90-E112 VanDerWaalsContact OH-CG 3.28Å; Y90-E112 WeakPolarHBondContact OH-CG 3.24Å; E112-A114 PolarHBondContact O-N 2.7Å; E112-K116 WeakPolarHBondContact CB-O 3.29Å
113	R	29.5	Very low	32.1	Very low	190 Å²	190	100.5 Å²	100.5	72%	0.717	50%	0.501	S	S	*	.	S	Bend	trans	-30	100.6	173.5	-144.6	-178.5	-149.5	-116.1	12.6	111.6	E88 E115	E88-R113 IonicContact OE2-CZ 3.22Å; E88-R113 IonicContact OE2-NE 3.13Å; E88-R113 PolarHBondContact OE2-NE 3.3Å; E88-R113 VanDerWaalsContact OE2-NE 3.13Å; E88-R113 IonicContact OE2-NH2 2.7Å; E88-R113 PolarHBondContact OE2-NH2 3.33Å; R113-E115 PolarHBondContact O-N 3.32Å
114	A	29	Very low	31.9	Very low	108 Å²	108	99.5 Å²	99.5	89%	0.893	49%	0.494	S	S	*	.	S	Bend	trans	46.8	-5.1	165.4	0	0	0	0	0	121.6	E112	E112-A114 PolarHBondContact O-N 2.7Å
115	E	30.7	Very low	31.8	Very low	181 Å²	181	101.7 Å²	101.7	85%	0.846	49%	0.489	S	S	*	.	S	Bend	trans	-130.6	-16.7	-171.6	-68.4	-168.9	161.7	0	0	116.2	R113	R113-E115 PolarHBondContact O-N 3.32Å
116	K	26.9	Very low	31.7	Very low	150 Å²	150	102.5 Å²	102.5	65%	0.652	49%	0.49	S	S	*	.			trans	-145.5	123.4	177	-67.2	-176	-177.9	172.2	0	112.5	E112	E112-K116 WeakPolarHBondContact CB-O 3.29Å
117	C	25.6	Very low	31.5	Very low	93 Å²	93	104.6 Å²	104.6	63%	0.628	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.7	170.3	-80.9	0	0	0	0	109.2
118	S	31.7	Very low	31.4	Very low	45 Å²	45	108.1 Å²	108.1	32%	0.315	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.6	171.9	-64.4	0	0	0	0	109.4	F110	F110-S118 PolarHBondContact N-O 3.39Å; F110-S118 PolarHBondContact O-N 3.33Å
119	R	30.6	Very low	30.9	Very low	187 Å²	187	113.3 Å²	113.3	71%	0.706	54%	0.536	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	126	178.1	-170.2	-178.2	-159	163.6	4.1	108.8
120	Y	33.4	Very low	30.6	Very low	95 Å²	95	112.6 Å²	112.6	37%	0.373	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.5	173.3	-61.7	-109	0	0	0	108.2	P36 S107 L108 F110	P36-Y120 HydrophobicContact CB-CD1 4.3Å; S107-Y120 PolarHBondContact OG-O 3.34Å; L108-Y120 PolarHBondContact N-O 3.47Å; L108-Y120 VanDerWaalsContact N-O 3.14Å; L108-Y120 CarbonylContact O-C 3.56Å; L108-Y120 WeakPolarHBondContact O-CA 3.17Å; L108-Y120 WeakPolarHBondContact O-CB 3.44Å; L108-Y120 PolarHBondContact O-N 3.13Å; F110-Y120 HydrophobicContact CB-CE2 4.38Å; F110-Y120 AromaticContact CD2-CD2 3.15Å; F110-Y120 HydrophobicContact CD2-CD2 3.15Å; F110-Y120 AromaticContact CD2-CE2 3.29Å; F110-Y120 HydrophobicContact CD2-CE2 3.29Å; F110-Y120 AromaticContact CD2-CG 3.94Å; F110-Y120 HydrophobicContact CD2-CG 3.94Å; F110-Y120 HydrophobicContact CE2-CD1 4.43Å; F110-Y120 AromaticContact CE2-CD2 3.49Å; F110-Y120 HydrophobicContact CE2-CD2 3.49Å; F110-Y120 VanDerWaalsContact CE2-CD2 3.49Å; F110-Y120 AromaticContact CE2-CE2 3.84Å; F110-Y120 HydrophobicContact CE2-CE2 3.84Å; F110-Y120 AromaticContact CE2-CG 3.77Å; F110-Y120 HydrophobicContact CE2-CG 3.77Å; F110-Y120 HydrophobicContact CG-CD2 4.34Å; F110-Y120 HydrophobicContact CG-CE2 4.17Å
121	S	28.6	Very low	30.1	Very low	60 Å²	60	118.4 Å²	118.4	42%	0.42	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	132.6	177.3	-164.2	0	0	0	0	107.8
122	F	33.4	Very low	30.1	Very low	42 Å²	42	121 Å²	121	18%	0.184	58%	0.579	C	S	.	*			trans	-108.2	134	171.8	-52.3	-95.6	0	0	0	106.4	L105 F106 L108	L105-F122 VanDerWaalsContact CD2-O 3.22Å; L105-F122 WeakPolarHBondContact CD2-O 3.19Å; L105-F122 WeakPolarHBondContact CG-O 3.02Å; F106-F122 HydrophobicContact CD1-CB 4.38Å; F106-F122 HydrophobicContact CD2-CB 4.06Å; F106-F122 AromaticContact CD2-CD2 3.7Å; F106-F122 HydrophobicContact CD2-CD2 3.7Å; F106-F122 AromaticContact CD2-CG 3.96Å; F106-F122 HydrophobicContact CD2-CG 3.96Å; F106-F122 HydrophobicContact CE1-CB 4.05Å; F106-F122 HydrophobicContact CE2-CB 3.72Å; F106-F122 AromaticContact CE2-CD1 3.97Å; F106-F122 HydrophobicContact CE2-CD1 3.97Å; F106-F122 AromaticContact CE2-CD2 3.51Å; F106-F122 HydrophobicContact CE2-CD2 3.51Å; F106-F122 HydrophobicContact CE2-CE2 4.22Å; F106-F122 AromaticContact CE2-CG 3.42Å; F106-F122 HydrophobicContact CE2-CG 3.42Å; F106-F122 VanDerWaalsContact CE2-CG 3.42Å; F106-F122 HydrophobicContact CG-CB 4.37Å; F106-F122 HydrophobicContact CZ-CB 3.7Å; F106-F122 HydrophobicContact CZ-CD1 4.15Å; F106-F122 HydrophobicContact CZ-CD2 4.33Å; F106-F122 AromaticContact CZ-CG 3.78Å; F106-F122 HydrophobicContact CZ-CG 3.78Å; F106-F122 VanDerWaalsContact O-CB 3.31Å; F106-F122 WeakPolarHBondContact O-CB 3.36Å; F106-F122 WeakPolarHBondContact O-CD2 3.28Å; F106-F122 PolarHBondContact O-N 3.15Å; F106-F122 VanDerWaalsContact O-O 3.08Å; L108-F122 HydrophobicContact CB-CE2 3.52Å; L108-F122 HydrophobicContact CB-CZ 4.14Å; L108-F122 HydrophobicContact CD1-CD2 4.22Å; L108-F122 HydrophobicContact CD1-CE1 4.23Å; L108-F122 HydrophobicContact CD1-CE2 3.3Å; L108-F122 HydrophobicContact CD1-CZ 3.29Å; L108-F122 HydrophobicContact CG-CD2 4.15Å; L108-F122 HydrophobicContact CG-CE2 3.39Å; L108-F122 HydrophobicContact CG-CZ 3.95Å
123	R	30.6	Very low	30	Very low	206 Å²	206	123.4 Å²	123.4	78%	0.777	59%	0.592	S	S	*	*			trans	-96.9	0	175.6	-170.4	-178.7	-179.4	170.5	0.5	109.1	V38 P40 L105	V38-R123 HydrophobicContact CB-CB 4.45Å; V38-R123 HydrophobicContact CG1-CB 3.23Å; P40-R123 WeakPolarHBondContact CA-O 3.35Å; L105-R123 HydrophobicContact CD1-CG 4.39Å; L105-R123 HydrophobicContact CD2-CB 4.13Å; L105-R123 HydrophobicContact CD2-CG 4.16Å; L105-R123 HydrophobicContact CG-CG 4.38Å

Retrieved 123 of 123 residues in 43.5 ms (Link to these results)

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