G4VRA5_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VRA5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 134 aa.

						>G4VRA5_SCHMA|G4VRA5
MTPNTYDIHLVPNMVILVAFGSLAQSGFVLRLQRFWSGPLRTQPSDSGYKPLWCSMLIQTINTVRSFWYRSTSKTFGGNSRINDHFLFCQRLRPTIARFAISPTNETATYRKCKPFLAGGSCSDRPVSIRTRLE
					

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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	32.2	Very low	31.7	Very low	242 Å²	242	78.1 Å²	78.1	100%	1.192	42%	0.421	S	S	*	.				0	123.9	0	-87.3	168.4	167.2	0	0	107.4
2	T	30.9	Very low	31.4	Very low	125 Å²	125	78.2 Å²	78.2	77%	0.767	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-74.8	127.4	174.9	17	0	0	0	0	109	N4	T2-N4 PolarHBondContact O-N 3.41Å
3	P	32.6	Very low	31.3	Very low	73 Å²	73	81.6 Å²	81.6	47%	0.474	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-63.7	123.1	-178.7	22.2	-29.9	0	0	0	109.9	T5 L133	P3-T5 PolarHBondContact O-N 3.26Å; P3-T5 PolarHBondContact O-OG1 3.31Å; P3-L133 WeakPolarHBondContact CB-O 2.97Å
4	N	33.8	Very low	31.3	Very low	50 Å²	50	79.8 Å²	79.8	27%	0.267	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-69.5	123	178.3	-68	-45.1	0	0	0	108.3	T2 Y6 L133	T2-N4 PolarHBondContact O-N 3.41Å; N4-Y6 HydrophobicContact CB-CE1 4.45Å; N4-Y6 HydrophobicContact CB-CE2 3.7Å; N4-Y6 VanDerWaalsContact CB-OH 3.29Å; N4-Y6 WeakPolarHBondContact CB-OH 3.46Å; N4-Y6 WeakPolarHBondContact O-CE2 3.05Å; N4-L133 WeakPolarHBondContact O-CB 3.35Å
5	T	28.8	Very low	31.5	Very low	62 Å²	62	76.5 Å²	76.5	38%	0.38	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.5	-179	-45.3	0	0	0	0	108.3	P3 F20	P3-T5 PolarHBondContact O-N 3.26Å; P3-T5 PolarHBondContact O-OG1 3.31Å; T5-F20 PolarHBondContact O-N 3.01Å; T5-F20 VanDerWaalsContact O-N 3.1Å
6	Y	35.1	Very low	31.6	Very low	45 Å²	45	75.8 Å²	75.8	18%	0.176	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.2	179.1	-45.3	-94.2	0	0	0	107.7	N4 A19 L133	N4-Y6 HydrophobicContact CB-CE1 4.45Å; N4-Y6 HydrophobicContact CB-CE2 3.7Å; N4-Y6 VanDerWaalsContact CB-OH 3.29Å; N4-Y6 WeakPolarHBondContact CB-OH 3.46Å; N4-Y6 WeakPolarHBondContact O-CE2 3.05Å; Y6-A19 HydrophobicContact CD1-CB 4.02Å; Y6-A19 HydrophobicContact CE1-CB 4.29Å; Y6-L133 HydrophobicContact CD2-CD1 3.65Å; Y6-L133 HydrophobicContact CE2-CB 4Å; Y6-L133 HydrophobicContact CE2-CD1 3.2Å; Y6-L133 HydrophobicContact CE2-CG 4.19Å
7	D	31.1	Very low	32	Very low	21 Å²	21	73.2 Å²	73.2	11%	0.112	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.5	171.3	-127.2	-26.7	0	0	0	108	V18 R130	D7-V18 PolarHBondContact N-O 3.46Å; D7-V18 VanDerWaalsContact N-O 3.08Å; D7-V18 PolarHBondContact O-N 3.44Å; D7-V18 VanDerWaalsContact O-N 3.13Å; D7-R130 WeakPolarHBondContact OD1-CG 3.41Å; D7-R130 IonicContact OD1-NE 3.64Å; D7-R130 IonicContact OD2-CZ 3.27Å; D7-R130 IonicContact OD2-NE 2.97Å; D7-R130 PolarHBondContact OD2-NE 2.91Å; D7-R130 IonicContact OD2-NH2 3.91Å; D7-R130 PolarHBondContact OD2-NH2 2.94Å
8	I	34.8	Very low	32.1	Very low	22 Å²	22	72.2 Å²	72.2	11%	0.113	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	104.5	-179.4	-51.3	-173.9	0	0	0	107.6	V15 L17 I129	I8-V15 HydrophobicContact CG2-CG1 4.03Å; I8-L17 HydrophobicContact CD1-CD1 4.01Å; I8-L17 HydrophobicContact CG1-CD1 3.77Å; I8-I129 WeakPolarHBondContact CB-O 3.29Å; I8-I129 PolarHBondContact N-O 2.83Å; I8-I129 PolarHBondContact O-N 2.87Å
9	H	30.5	Very low	32.1	Very low	94 Å²	94	69.5 Å²	69.5	44%	0.435	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.6	172.2	-71.1	-88.4	0	0	0	108.9	I16	H9-I16 PolarHBondContact N-O 2.99Å; H9-I16 PolarHBondContact O-N 3.14Å
10	L	31	Very low	32.1	Very low	53 Å²	53	72.8 Å²	72.8	28%	0.277	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.1	167	-72	174.7	0	0	0	108.5	V15 P126 V127	L10-V15 HydrophobicContact CD2-CB 3.78Å; L10-V15 HydrophobicContact CD2-CG1 3.67Å; L10-V15 HydrophobicContact CD2-CG2 3.27Å; L10-P126 HydrophobicContact CB-CB 4.14Å; L10-P126 WeakPolarHBondContact O-CB 3.2Å; L10-V127 WeakPolarHBondContact CB-O 3.39Å; L10-V127 HydrophobicContact CD1-CB 3.43Å; L10-V127 VanDerWaalsContact CD1-CB 3.43Å; L10-V127 HydrophobicContact CD1-CG2 4.12Å; L10-V127 WeakPolarHBondContact CD1-O 3.32Å; L10-V127 WeakPolarHBondContact CG-O 3.45Å
11	V	27.8	Very low	32.3	Very low	72 Å²	72	71.6 Å²	71.6	44%	0.436	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	145.5	170.8	-177.3	0	0	0	0	105.9	N13 M14	V11-N13 PolarHBondContact O-N 3.36Å; V11-M14 PolarHBondContact N-O 3.06Å; V11-M14 PolarHBondContact O-N 2.75Å
12	P	28.4	Very low	32.5	Very low	79 Å²	79	64.7 Å²	64.7	51%	0.513	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	121.4	175.4	17.2	-30.6	0	0	0	110.2
13	N	30.5	Very low	32.7	Very low	123 Å²	123	61.5 Å²	61.5	66%	0.658	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	12.1	-176.6	-56.1	-55.8	0	0	0	118.2	V11	V11-N13 PolarHBondContact O-N 3.36Å
14	M	31.4	Very low	32.8	Very low	56 Å²	56	60.9 Å²	60.9	28%	0.276	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	132.7	176.9	-162.4	174.7	175.1	0	0	112.9	V11 I16	V11-M14 PolarHBondContact N-O 3.06Å; V11-M14 PolarHBondContact O-N 2.75Å; M14-I16 HydrophobicContact CE-CD1 4.18Å; M14-I16 HydrophobicContact CE-CG1 3.99Å; M14-I16 HydrophobicContact CG-CG1 4.06Å; M14-I16 HydrophobicContact SD-CD1 4.15Å; M14-I16 HydrophobicContact SD-CG1 4.16Å
15	V	33.3	Very low	32.7	Very low	31 Å²	31	65.5 Å²	65.5	19%	0.188	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.8	169.9	-171.2	0	0	0	0	108.2	I8 L10 L32	I8-V15 HydrophobicContact CG2-CG1 4.03Å; L10-V15 HydrophobicContact CD2-CB 3.78Å; L10-V15 HydrophobicContact CD2-CG1 3.67Å; L10-V15 HydrophobicContact CD2-CG2 3.27Å; V15-L32 HydrophobicContact CB-CB 4.5Å; V15-L32 HydrophobicContact CG2-CB 3.93Å; V15-L32 HydrophobicContact CG2-CD1 4.37Å; V15-L32 HydrophobicContact CG2-CD2 3.88Å; V15-L32 HydrophobicContact CG2-CG 4.28Å
16	I	34.4	Very low	33.1	Very low	64 Å²	64	63.6 Å²	63.6	33%	0.328	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113.2	175.4	-54.8	179.7	0	0	0	107.5	H9 M14 V18	H9-I16 PolarHBondContact N-O 2.99Å; H9-I16 PolarHBondContact O-N 3.14Å; M14-I16 HydrophobicContact CE-CD1 4.18Å; M14-I16 HydrophobicContact CE-CG1 3.99Å; M14-I16 HydrophobicContact CG-CG1 4.06Å; M14-I16 HydrophobicContact SD-CD1 4.15Å; M14-I16 HydrophobicContact SD-CG1 4.16Å; I16-V18 HydrophobicContact CG2-CG2 3.83Å
17	L	37.3	Very low	33	Very low	33 Å²	33	64.8 Å²	64.8	17%	0.173	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	108.1	170.5	-165.9	83.9	0	0	0	108.2	I8 L30	I8-L17 HydrophobicContact CD1-CD1 4.01Å; I8-L17 HydrophobicContact CG1-CD1 3.77Å; L17-L30 HydrophobicContact CB-CD1 3.75Å; L17-L30 HydrophobicContact CD2-CD1 3.76Å; L17-L30 HydrophobicContact CG-CD1 4.27Å
18	V	34.1	Very low	33.3	Very low	54 Å²	54	66.8 Å²	66.8	33%	0.327	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	109.3	174.4	-172.9	0	0	0	0	107.9	D7 I16 F20	D7-V18 PolarHBondContact N-O 3.46Å; D7-V18 VanDerWaalsContact N-O 3.08Å; D7-V18 PolarHBondContact O-N 3.44Å; D7-V18 VanDerWaalsContact O-N 3.13Å; I16-V18 HydrophobicContact CG2-CG2 3.83Å; V18-F20 HydrophobicContact CB-CE2 4.39Å; V18-F20 HydrophobicContact CG1-CD2 3.97Å; V18-F20 HydrophobicContact CG1-CE2 3.47Å; V18-F20 VanDerWaalsContact CG1-CE2 3.47Å; V18-F20 HydrophobicContact CG1-CZ 4.12Å
19	A	32.4	Very low	33.4	Very low	21 Å²	21	70.1 Å²	70.1	17%	0.174	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.2	174.4	0	0	0	0	0	109.7	Y6 L23 A24	Y6-A19 HydrophobicContact CD1-CB 4.02Å; Y6-A19 HydrophobicContact CE1-CB 4.29Å; A19-L23 HydrophobicContact CB-CB 4.29Å; A19-A24 WeakPolarHBondContact O-CB 3.29Å
20	F	31.2	Very low	33.7	Very low	135 Å²	135	66.3 Å²	66.3	59%	0.592	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	136.7	172.2	-79.7	-91.4	0	0	0	110.3	T5 V18	T5-F20 PolarHBondContact O-N 3.01Å; T5-F20 VanDerWaalsContact O-N 3.1Å; V18-F20 HydrophobicContact CB-CE2 4.39Å; V18-F20 HydrophobicContact CG1-CD2 3.97Å; V18-F20 HydrophobicContact CG1-CE2 3.47Å; V18-F20 VanDerWaalsContact CG1-CE2 3.47Å; V18-F20 HydrophobicContact CG1-CZ 4.12Å
21	G	36.3	Very low	34	Very low	49 Å²	49	68.1 Å²	68.1	51%	0.505	40%	0.403	S	S	.	.	S	Bend	trans	117.5	-159.2	-178.1	0	0	0	0	0	113.1	L23 A24	G21-L23 PolarHBondContact O-N 3.29Å; G21-L23 VanDerWaalsContact O-N 3.1Å; G21-A24 WeakPolarHBondContact O-CB 3.35Å; G21-A24 PolarHBondContact O-N 2.9Å
22	S	36.1	Very low	34.5	Very low	96 Å²	96	66.5 Å²	66.5	67%	0.671	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-58.8	-23.8	-178.9	51.1	0	0	0	0	113.8	A24	S22-A24 VanDerWaalsContact C-N 3.35Å
23	L	35	Very low	34.9	Very low	58 Å²	58	66.4 Å²	66.4	30%	0.304	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-74.8	-16.3	171.8	-87.4	140.1	0	0	0	114.2	A19 G21 Q25 S26 F28	A19-L23 HydrophobicContact CB-CB 4.29Å; G21-L23 PolarHBondContact O-N 3.29Å; G21-L23 VanDerWaalsContact O-N 3.1Å; L23-Q25 PolarHBondContact O-N 2.82Å; L23-S26 CarbonylContact O-C 3.5Å; L23-S26 WeakPolarHBondContact O-CA 3.44Å; L23-S26 PolarHBondContact O-N 3.28Å; L23-S26 PolarHBondContact O-OG 3.1Å; L23-F28 HydrophobicContact CD2-CE2 4.06Å
24	A	34.7	Very low	35.4	Very low	61 Å²	61	63.8 Å²	63.8	50%	0.504	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-66.1	-20.3	173.5	0	0	0	0	0	112.3	A19 G21 S22 S26	A19-A24 WeakPolarHBondContact O-CB 3.29Å; G21-A24 WeakPolarHBondContact O-CB 3.35Å; G21-A24 PolarHBondContact O-N 2.9Å; S22-A24 VanDerWaalsContact C-N 3.35Å; A24-S26 VanDerWaalsContact C-N 3.26Å
25	Q	33	Very low	35.5	Very low	147 Å²	147	66.5 Å²	66.5	69%	0.687	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-70.9	-21	168.2	-81.7	-179.5	-18.8	0	0	112.7	L23 A97	L23-Q25 PolarHBondContact O-N 2.82Å; Q25-A97 WeakPolarHBondContact O-CB 3.39Å
26	S	36.5	Very low	35.7	Very low	21 Å²	21	71.5 Å²	71.5	15%	0.147	39%	0.391	C	S	.	.	S	Bend	trans	-98	99.8	171.1	66.5	0	0	0	0	109.4	L23 A24 F28	L23-S26 CarbonylContact O-C 3.5Å; L23-S26 WeakPolarHBondContact O-CA 3.44Å; L23-S26 PolarHBondContact O-N 3.28Å; L23-S26 PolarHBondContact O-OG 3.1Å; A24-S26 VanDerWaalsContact C-N 3.26Å; S26-F28 WeakPolarHBondContact O-CD2 3.32Å; S26-F28 PolarHBondContact O-N 2.84Å; S26-F28 WeakPolarHBondContact OG-CD2 3.47Å; S26-F28 VanDerWaalsContact OG-CE2 3.24Å; S26-F28 WeakPolarHBondContact OG-CE2 3.16Å
27	G	33.8	Very low	35.6	Very low	70 Å²	70	71.2 Å²	71.2	72%	0.722	40%	0.395	S	S	*	.			trans	-63.9	96.3	175.5	0	0	0	0	0	111.3
28	F	35.9	Very low	35.1	Very low	63 Å²	63	72 Å²	72	28%	0.276	41%	0.41	S	S	.	.			trans	-89.1	122	169.8	-83.2	-96.3	0	0	0	109.7	L23 S26 I101	L23-F28 HydrophobicContact CD2-CE2 4.06Å; S26-F28 WeakPolarHBondContact O-CD2 3.32Å; S26-F28 PolarHBondContact O-N 2.84Å; S26-F28 WeakPolarHBondContact OG-CD2 3.47Å; S26-F28 VanDerWaalsContact OG-CE2 3.24Å; S26-F28 WeakPolarHBondContact OG-CE2 3.16Å; F28-I101 HydrophobicContact CD1-CD1 3.89Å; F28-I101 HydrophobicContact CE1-CD1 3.06Å; F28-I101 HydrophobicContact CE1-CG1 3.77Å; F28-I101 HydrophobicContact CE1-CG2 4.12Å; F28-I101 HydrophobicContact CE2-CD1 4.01Å; F28-I101 HydrophobicContact CE2-CG1 4.13Å; F28-I101 HydrophobicContact CZ-CB 4.21Å; F28-I101 HydrophobicContact CZ-CD1 3.15Å; F28-I101 HydrophobicContact CZ-CG1 3.32Å; F28-I101 HydrophobicContact CZ-CG2 3.83Å
29	V	37.7	Very low	34.8	Very low	92 Å²	92	75.2 Å²	75.2	56%	0.558	43%	0.432	S	S	*	.			trans	-112.4	100.6	171.1	-179	0	0	0	0	108.2	R31	V29-R31 PolarHBondContact O-N 3.1Å
30	L	37.9	Very low	34.7	Very low	14 Å²	14	80 Å²	80	7%	0.073	45%	0.454	C	S	.	.			trans	-79.6	96.9	171.6	-91	148.2	0	0	0	109.2	L17 L32 M56 I58	L17-L30 HydrophobicContact CB-CD1 3.75Å; L17-L30 HydrophobicContact CD2-CD1 3.76Å; L17-L30 HydrophobicContact CG-CD1 4.27Å; L30-L32 PolarHBondContact O-N 2.81Å; L30-M56 HydrophobicContact CD2-CE 3.65Å; L30-I58 HydrophobicContact CD2-CB 4.08Å; L30-I58 HydrophobicContact CD2-CD1 3.84Å; L30-I58 HydrophobicContact CD2-CG1 3.63Å; L30-I58 HydrophobicContact CD2-CG2 3.65Å
31	R	36.6	Very low	34.5	Very low	92 Å²	92	85 Å²	85	35%	0.347	47%	0.469	S	S	.	.			trans	-91.6	91.5	178.7	-157.2	-179.7	-167.6	-166.7	2.3	111.1	V29 Q33 L57	V29-R31 PolarHBondContact O-N 3.1Å; R31-Q33 PolarHBondContact O-N 2.77Å; R31-L57 CarbonylContact C-O 3.41Å; R31-L57 VanDerWaalsContact C-O 3.3Å; R31-L57 CarbonylContact O-C 3.55Å; R31-L57 WeakPolarHBondContact O-CB 3.21Å
32	L	38.3	Very low	34.1	Very low	37 Å²	37	87.1 Å²	87.1	19%	0.194	47%	0.472	C	S	.	.			trans	-69.1	88.5	176.7	-155.6	93	0	0	0	111.4	V15 L30 M56	V15-L32 HydrophobicContact CB-CB 4.5Å; V15-L32 HydrophobicContact CG2-CB 3.93Å; V15-L32 HydrophobicContact CG2-CD1 4.37Å; V15-L32 HydrophobicContact CG2-CD2 3.88Å; V15-L32 HydrophobicContact CG2-CG 4.28Å; L30-L32 PolarHBondContact O-N 2.81Å; L32-M56 HydrophobicContact CD1-CB 3.6Å; L32-M56 HydrophobicContact CD1-CE 3.54Å; L32-M56 HydrophobicContact CD1-CG 3.26Å; L32-M56 HydrophobicContact CD1-SD 3.3Å; L32-M56 WeakPolarHBondContact CD1-SD 3.42Å; L32-M56 HydrophobicContact CG-CB 4.45Å; L32-M56 HydrophobicContact CG-CG 4.43Å
33	Q	36.2	Very low	33.7	Very low	78 Å²	78	90.1 Å²	90.1	36%	0.364	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-86	121	169.2	-90.9	179.1	-42.4	0	0	110.9	R31 F35 S55 L57	R31-Q33 PolarHBondContact O-N 2.77Å; Q33-F35 HydrophobicContact CB-CE2 4.22Å; Q33-S55 PolarHBondContact O-OG 3.23Å; Q33-S55 VanDerWaalsContact O-OG 3.13Å; Q33-L57 HydrophobicContact CB-CB 3.82Å; Q33-L57 HydrophobicContact CB-CD1 4.5Å; Q33-L57 HydrophobicContact CB-CD2 4.41Å; Q33-L57 HydrophobicContact CB-CG 4.49Å
34	R	42.3	Very low	33.5	Very low	67 Å²	67	93.9 Å²	93.9	25%	0.253	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-88.3	116.5	178.5	-133.2	-172.3	-149	171.6	18	109.2	C122	R34-C122 VanDerWaalsContact CZ-O 3.23Å; R34-C122 PolarHBondContact NH1-O 2.92Å; R34-C122 PolarHBondContact NH2-O 3.45Å; R34-C122 VanDerWaalsContact NH2-O 3.09Å
35	F	32.2	Very low	33.3	Very low	113 Å²	113	94.1 Å²	94.1	50%	0.496	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-102.7	124.3	167.3	-74.3	-89.9	0	0	0	108.5	Q33 S55 L57 W68	Q33-F35 HydrophobicContact CB-CE2 4.22Å; F35-S55 WeakPolarHBondContact CB-OG 3.29Å; F35-S55 PolarHBondContact N-OG 3.01Å; F35-L57 HydrophobicContact CE2-CD1 4.16Å; F35-W68 HydrophobicContact CB-CH2 3.87Å
36	W	37.2	Very low	33.2	Very low	137 Å²	137	95.2 Å²	95.2	52%	0.519	51%	0.513	S	S	.	.	B	Isolated β-bridge	trans	-76.3	122.5	163.7	-82.6	65.9	0	0	0	108.1	G38 F76	W36-G38 PolarHBondContact O-N 3.41Å; W36-F76 AromaticContact CH2-CD1 3.78Å; W36-F76 HydrophobicContact CH2-CD1 3.78Å; W36-F76 AromaticContact CH2-CE1 3.83Å; W36-F76 HydrophobicContact CH2-CE1 3.83Å; W36-F76 AromaticContact CZ2-CD1 3.8Å; W36-F76 HydrophobicContact CZ2-CD1 3.8Å; W36-F76 AromaticContact CZ2-CE1 3.4Å; W36-F76 HydrophobicContact CZ2-CE1 3.4Å; W36-F76 HydrophobicContact CZ2-CZ 4.19Å
37	S	31.9	Very low	33	Very low	58 Å²	58	99.7 Å²	99.7	41%	0.406	54%	0.544	S	S	.	.			trans	-73.4	115.7	149.6	56.8	0	0	0	0	106.1
38	G	27.4	Very low	32.8	Very low	48 Å²	48	99.8 Å²	99.8	50%	0.495	54%	0.544	S	S	.	.			trans	-53	173.5	-173.1	0	0	0	0	0	115	W36 L40	W36-G38 PolarHBondContact O-N 3.41Å; G38-L40 PolarHBondContact O-N 2.93Å
39	P	28.1	Very low	32.8	Very low	122 Å²	122	105.6 Å²	105.6	79%	0.792	57%	0.566	S	S	*	*			trans	-59.8	111.1	-172.8	25.7	-31.9	0	0	0	109.2	R41	P39-R41 PolarHBondContact O-N 3.46Å
40	L	30.7	Very low	32.8	Very low	121 Å²	121	106.9 Å²	106.9	63%	0.634	56%	0.564	S	S	*	*			trans	-63.2	94	158.8	-89.9	154.8	0	0	0	105.1	G38 T42 K50	G38-L40 PolarHBondContact O-N 2.93Å; L40-T42 PolarHBondContact O-N 2.89Å; L40-K50 HydrophobicContact CD1-CD 4.32Å
41	R	25.9	Very low	32.8	Very low	241 Å²	241	108.6 Å²	108.6	91%	0.909	58%	0.576	S	S	*	*			trans	-45.8	108.4	166.9	-82.4	-178.1	169.7	-178.5	-2.9	107.2	P39	P39-R41 PolarHBondContact O-N 3.46Å
42	T	29.5	Very low	33.1	Very low	93 Å²	93	108 Å²	108	57%	0.571	58%	0.579	S	S	*	*			trans	-120.5	126.1	157	45.7	0	0	0	0	105.7	L40 K50	L40-T42 PolarHBondContact O-N 2.89Å; T42-K50 HydrophobicContact CG2-CD 4.19Å
43	Q	26.1	Very low	33.2	Very low	159 Å²	159	112.3 Å²	112.3	74%	0.743	59%	0.593	S	S	*	*			trans	-43.4	152.5	170.7	-93.8	-178	-2.9	0	0	111.4	S45	Q43-S45 PolarHBondContact O-N 3.22Å
44	P	31	Very low	33.7	Very low	138 Å²	138	109 Å²	109	90%	0.896	58%	0.578	S	S	*	*	S	Bend	trans	-75.8	80.1	171.2	33.5	-29.9	0	0	0	108.2
45	S	31.3	Very low	33.8	Very low	65 Å²	65	105.9 Å²	105.9	46%	0.455	57%	0.567	S	S	.	*	S	Bend	trans	-154.4	100.5	173.3	32.7	0	0	0	0	109	Q43 S47	Q43-S45 PolarHBondContact O-N 3.22Å; S45-S47 PolarHBondContact O-N 3.34Å; S45-S47 VanDerWaalsContact O-N 3.11Å
46	D	30.9	Very low	34.6	Very low	171 Å²	171	101 Å²	101	91%	0.914	55%	0.546	S	S	*	.	S	Bend	trans	21.7	78.8	152.1	-64.8	-36.1	0	0	0	116.5
47	S	32.1	Very low	35	Very low	115 Å²	115	95 Å²	95	80%	0.804	52%	0.524	S	S	*	.			trans	-177.3	120.4	152.5	45.9	0	0	0	0	112.2	S45	S45-S47 PolarHBondContact O-N 3.34Å; S45-S47 VanDerWaalsContact O-N 3.11Å
48	G	30.4	Very low	35.6	Very low	71 Å²	71	93 Å²	93	73%	0.732	51%	0.509	S	S	*	.			trans	55.1	103.6	154.4	0	0	0	0	0	118.1	K50	G48-K50 PolarHBondContact O-N 3.18Å
49	Y	35.4	Very low	36.3	Very low	185 Å²	185	94.7 Å²	94.7	73%	0.725	50%	0.503	S	S	*	.			trans	-46.7	109.9	165.9	-85.4	-95.5	0	0	0	111.4
50	K	36.6	Very low	37	Very low	120 Å²	120	89.7 Å²	89.7	52%	0.522	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-66.5	131.6	168	-79.6	-174.3	-179.6	178.5	0	108.6	L40 T42 G48 L52	L40-K50 HydrophobicContact CD1-CD 4.32Å; T42-K50 HydrophobicContact CG2-CD 4.19Å; G48-K50 PolarHBondContact O-N 3.18Å; K50-L52 PolarHBondContact O-N 2.95Å
51	P	38.7	Very low	37.2	Very low	50 Å²	50	89.7 Å²	89.7	33%	0.325	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-69.5	123.9	-178.2	26.9	-33.2	0	0	0	111.9	R70	P51-R70 HydrophobicContact CB-CG 3.81Å
52	L	42.8	Very low	37.5	Very low	80 Å²	80	85.5 Å²	85.5	42%	0.419	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-73.5	134.9	172.1	-71.4	161.4	0	0	0	109.4	K50 S71 F76	K50-L52 PolarHBondContact O-N 2.95Å; L52-S71 WeakPolarHBondContact O-CB 3.14Å; L52-S71 PolarHBondContact O-N 2.92Å; L52-F76 HydrophobicContact CD1-CD2 3.9Å; L52-F76 HydrophobicContact CD1-CE2 4.41Å
53	W	41.4	Very low	37.9	Very low	126 Å²	126	84.4 Å²	84.4	48%	0.477	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.1	177.3	-66.6	78.3	0	0	0	109.1	W68 Y69	W53-W68 HydrophobicContact CB-CE3 4.27Å; W53-W68 HydrophobicContact CE3-CB 4.03Å; W53-Y69 CarbonylContact C-O 3.3Å; W53-Y69 WeakPolarHBondContact CA-O 3.33Å
54	C	45.9	Very low	38.7	Very low	9 Å²	9	80.6 Å²	80.6	6%	0.061	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135.1	173	-70.4	0	0	0	0	108	Y69 C122	C54-Y69 HydrophobicContact CB-CD2 4.4Å; C54-Y69 HydrophobicContact CB-CE1 4.01Å; C54-Y69 HydrophobicContact CB-CE2 3.82Å; C54-Y69 PolarHBondContact N-O 3Å; C54-Y69 VanDerWaalsContact O-CD1 3.25Å; C54-Y69 WeakPolarHBondContact O-CD1 3.4Å; C54-Y69 PolarHBondContact O-N 2.85Å; C54-C122 WeakPolarHBondContact CB-SG 3.41Å; C54-C122 WeakPolarHBondContact SG-CB 3.49Å; C54-C122 CovalentContact SG-SG 2.09Å; C54-C122 PolarHBondContact SG-SG 3.35Å
55	S	44.4	Very low	39.4	Very low	1 Å²	1	79.5 Å²	79.5	1%	0.007	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	141.9	174.3	77.1	0	0	0	0	111.5	Q33 F35 F67	Q33-S55 PolarHBondContact O-OG 3.23Å; Q33-S55 VanDerWaalsContact O-OG 3.13Å; F35-S55 WeakPolarHBondContact CB-OG 3.29Å; F35-S55 PolarHBondContact N-OG 3.01Å; S55-F67 CarbonylContact C-O 3.51Å; S55-F67 WeakPolarHBondContact CA-O 3.24Å
56	M	49.6	Very low	40	Very low	11 Å²	11	79.6 Å²	79.6	5%	0.054	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	114.7	170.4	161.3	152	-160.8	0	0	107.5	L30 L32 I58 F67 Y69 L117	L30-M56 HydrophobicContact CD2-CE 3.65Å; L32-M56 HydrophobicContact CD1-CB 3.6Å; L32-M56 HydrophobicContact CD1-CE 3.54Å; L32-M56 HydrophobicContact CD1-CG 3.26Å; L32-M56 HydrophobicContact CD1-SD 3.3Å; L32-M56 WeakPolarHBondContact CD1-SD 3.42Å; L32-M56 HydrophobicContact CG-CB 4.45Å; L32-M56 HydrophobicContact CG-CG 4.43Å; M56-I58 HydrophobicContact CE-CD1 3.87Å; M56-I58 HydrophobicContact CE-CG1 3.81Å; M56-I58 HydrophobicContact CG-CD1 4.45Å; M56-I58 HydrophobicContact CG-CG1 3.95Å; M56-F67 HydrophobicContact CB-CB 4.3Å; M56-F67 PolarHBondContact N-O 3.19Å; M56-F67 PolarHBondContact O-N 2.73Å; M56-Y69 HydrophobicContact CB-CD1 4.39Å; M56-Y69 HydrophobicContact CB-CE1 4.09Å; M56-L117 HydrophobicContact SD-CD1 3.65Å; M56-L117 HydrophobicContact SD-CD2 4.16Å
57	L	44.6	Very low	40.7	Very low	11 Å²	11	73.8 Å²	73.8	6%	0.058	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.1	168.9	-150.4	111.2	0	0	0	108.7	R31 Q33 F35 V64	R31-L57 CarbonylContact C-O 3.41Å; R31-L57 VanDerWaalsContact C-O 3.3Å; R31-L57 CarbonylContact O-C 3.55Å; R31-L57 WeakPolarHBondContact O-CB 3.21Å; Q33-L57 HydrophobicContact CB-CB 3.82Å; Q33-L57 HydrophobicContact CB-CD1 4.5Å; Q33-L57 HydrophobicContact CB-CD2 4.41Å; Q33-L57 HydrophobicContact CB-CG 4.49Å; F35-L57 HydrophobicContact CE2-CD1 4.16Å; L57-V64 HydrophobicContact CD1-CG1 3.7Å; L57-V64 HydrophobicContact CD2-CG1 3.43Å; L57-V64 VanDerWaalsContact CD2-CG1 3.43Å; L57-V64 HydrophobicContact CG-CG1 3.54Å
58	I	46.1	Very low	41.3	Very low	17 Å²	17	74 Å²	74	9%	0.087	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118	169.8	-58.2	-172.6	0	0	0	105.5	L30 M56 R65 F67	L30-I58 HydrophobicContact CD2-CB 4.08Å; L30-I58 HydrophobicContact CD2-CD1 3.84Å; L30-I58 HydrophobicContact CD2-CG1 3.63Å; L30-I58 HydrophobicContact CD2-CG2 3.65Å; M56-I58 HydrophobicContact CE-CD1 3.87Å; M56-I58 HydrophobicContact CE-CG1 3.81Å; M56-I58 HydrophobicContact CG-CD1 4.45Å; M56-I58 HydrophobicContact CG-CG1 3.95Å; I58-R65 PolarHBondContact N-O 2.97Å; I58-R65 PolarHBondContact O-N 3.08Å; I58-F67 HydrophobicContact CB-CD2 4.43Å; I58-F67 HydrophobicContact CB-CE2 4.18Å; I58-F67 HydrophobicContact CD1-CD2 3.7Å; I58-F67 HydrophobicContact CD1-CE2 3.55Å; I58-F67 HydrophobicContact CD1-CZ 4.48Å; I58-F67 HydrophobicContact CG1-CD2 3.84Å; I58-F67 HydrophobicContact CG1-CE2 3.92Å
59	Q	41.6	Very low	42.1	Very low	83 Å²	83	72 Å²	72	39%	0.388	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	111.4	178.9	-174.9	167.5	9.8	0	0	109.2	V64	Q59-V64 HydrophobicContact CB-CG2 4.38Å; Q59-V64 HydrophobicContact CG-CG2 3.86Å
60	T	41.6	Very low	42.4	Very low	17 Å²	17	70.5 Å²	70.5	10%	0.104	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	166.1	162.7	47.9	0	0	0	0	109	N62 T63 I101 E106	T60-N62 PolarHBondContact O-N 2.88Å; T60-T63 PolarHBondContact N-O 2.9Å; T60-T63 PolarHBondContact O-N 3.31Å; T60-T63 WeakPolarHBondContact OG1-CB 3.25Å; T60-T63 PolarHBondContact OG1-O 2.83Å; T60-T63 PolarHBondContact OG1-OG1 2.89Å; T60-I101 HydrophobicContact CG2-CD1 3.77Å; T60-E106 PolarHBondContact OG1-OE1 2.84Å
61	I	34.6	Very low	42.7	Very low	120 Å²	120	65.2 Å²	65.2	62%	0.615	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44	-41	-165.2	-62.8	172	0	0	0	114
62	N	33.9	Very low	42.8	Very low	153 Å²	153	67.5 Å²	67.5	82%	0.818	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	7.3	-179.7	-63.1	-30.3	0	0	0	113.7	T60	T60-N62 PolarHBondContact O-N 2.88Å
63	T	36.5	Very low	42.7	Very low	70 Å²	70	64.7 Å²	64.7	43%	0.429	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	115.3	-169	15.8	0	0	0	0	110.1	T60	T60-T63 PolarHBondContact N-O 2.9Å; T60-T63 PolarHBondContact O-N 3.31Å; T60-T63 WeakPolarHBondContact OG1-CB 3.25Å; T60-T63 PolarHBondContact OG1-O 2.83Å; T60-T63 PolarHBondContact OG1-OG1 2.89Å
64	V	43.8	Very low	42.6	Very low	80 Å²	80	66.3 Å²	66.3	49%	0.485	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	118.1	167.8	176.5	0	0	0	0	107.2	L57 Q59	L57-V64 HydrophobicContact CD1-CG1 3.7Å; L57-V64 HydrophobicContact CD2-CG1 3.43Å; L57-V64 VanDerWaalsContact CD2-CG1 3.43Å; L57-V64 HydrophobicContact CG-CG1 3.54Å; Q59-V64 HydrophobicContact CB-CG2 4.38Å; Q59-V64 HydrophobicContact CG-CG2 3.86Å
65	R	44.7	Very low	42	Very low	115 Å²	115	71.3 Å²	71.3	43%	0.434	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.5	173.5	-81.6	-177.3	166.1	-177.7	-8.1	110.6	I58 F67 E106	I58-R65 PolarHBondContact N-O 2.97Å; I58-R65 PolarHBondContact O-N 3.08Å; R65-F67 HydrophobicContact CB-CD2 4.44Å; R65-F67 HydrophobicContact CB-CE2 3.71Å; R65-F67 HydrophobicContact CB-CZ 4.24Å; R65-E106 IonicContact CZ-OE2 3.66Å; R65-E106 IonicContact NE-OE2 3.59Å; R65-E106 IonicContact NH1-OE2 2.81Å; R65-E106 PolarHBondContact NH1-OE2 3.27Å
66	S	45.4	Very low	41.5	Very low	66 Å²	66	74.6 Å²	74.6	46%	0.462	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.4	177.8	-43.8	0	0	0	0	109.3
67	F	44.2	Very low	40.6	Very low	49 Å²	49	78.1 Å²	78.1	22%	0.215	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.4	175.1	-66.5	-88.6	0	0	0	109.4	S55 M56 I58 R65 Y110	S55-F67 CarbonylContact C-O 3.51Å; S55-F67 WeakPolarHBondContact CA-O 3.24Å; M56-F67 HydrophobicContact CB-CB 4.3Å; M56-F67 PolarHBondContact N-O 3.19Å; M56-F67 PolarHBondContact O-N 2.73Å; I58-F67 HydrophobicContact CB-CD2 4.43Å; I58-F67 HydrophobicContact CB-CE2 4.18Å; I58-F67 HydrophobicContact CD1-CD2 3.7Å; I58-F67 HydrophobicContact CD1-CE2 3.55Å; I58-F67 HydrophobicContact CD1-CZ 4.48Å; I58-F67 HydrophobicContact CG1-CD2 3.84Å; I58-F67 HydrophobicContact CG1-CE2 3.92Å; R65-F67 HydrophobicContact CB-CD2 4.44Å; R65-F67 HydrophobicContact CB-CE2 3.71Å; R65-F67 HydrophobicContact CB-CZ 4.24Å; F67-Y110 HydrophobicContact CB-CD2 4.35Å; F67-Y110 HydrophobicContact CB-CE2 3.85Å; F67-Y110 AromaticContact CD1-CD2 3.64Å; F67-Y110 HydrophobicContact CD1-CD2 3.64Å; F67-Y110 AromaticContact CD1-CE2 3.55Å; F67-Y110 HydrophobicContact CD1-CE2 3.55Å; F67-Y110 HydrophobicContact CD1-CG 4.26Å; F67-Y110 HydrophobicContact CD2-CD2 4.45Å; F67-Y110 AromaticContact CE1-CD2 3.99Å; F67-Y110 HydrophobicContact CE1-CD2 3.99Å; F67-Y110 HydrophobicContact CE1-CE2 4.3Å; F67-Y110 HydrophobicContact CE1-CG 4.21Å; F67-Y110 AromaticContact CG-CD2 3.89Å; F67-Y110 HydrophobicContact CG-CD2 3.89Å; F67-Y110 AromaticContact CG-CE2 3.81Å; F67-Y110 HydrophobicContact CG-CE2 3.81Å
68	W	44.8	Very low	40	Very low	120 Å²	120	79.5 Å²	79.5	46%	0.455	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.3	174.3	-62.4	89.8	0	0	0	109.2	F35 W53	F35-W68 HydrophobicContact CB-CH2 3.87Å; W53-W68 HydrophobicContact CB-CE3 4.27Å; W53-W68 HydrophobicContact CE3-CB 4.03Å
69	Y	47.1	Very low	39.3	Very low	28 Å²	28	86.9 Å²	86.9	11%	0.11	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.8	174.1	64.5	-85.7	0	0	0	111	W53 C54 M56 S71 L117	W53-Y69 CarbonylContact C-O 3.3Å; W53-Y69 WeakPolarHBondContact CA-O 3.33Å; C54-Y69 HydrophobicContact CB-CD2 4.4Å; C54-Y69 HydrophobicContact CB-CE1 4.01Å; C54-Y69 HydrophobicContact CB-CE2 3.82Å; C54-Y69 PolarHBondContact N-O 3Å; C54-Y69 VanDerWaalsContact O-CD1 3.25Å; C54-Y69 WeakPolarHBondContact O-CD1 3.4Å; C54-Y69 PolarHBondContact O-N 2.85Å; M56-Y69 HydrophobicContact CB-CD1 4.39Å; M56-Y69 HydrophobicContact CB-CE1 4.09Å; Y69-S71 PolarHBondContact O-N 3.34Å; Y69-L117 HydrophobicContact CD1-CD1 4.41Å; Y69-L117 HydrophobicContact CD2-CB 4.2Å; Y69-L117 HydrophobicContact CE1-CD1 4.47Å; Y69-L117 HydrophobicContact CE1-CD2 4.15Å; Y69-L117 HydrophobicContact CE2-CB 4.12Å; Y69-L117 HydrophobicContact CG-CB 4.46Å
70	R	42	Very low	38.8	Very low	154 Å²	154	84.8 Å²	84.8	58%	0.581	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.1	178.7	-170.3	175.8	-175.6	169.4	9.7	109	P51	P51-R70 HydrophobicContact CB-CG 3.81Å
71	S	43.3	Very low	38.2	Very low	10 Å²	10	94.2 Å²	94.2	7%	0.07	50%	0.496	C	S	.	.			trans	-71	132.7	171.9	-179.3	0	0	0	0	109.6	L52 Y69 S73	L52-S71 WeakPolarHBondContact O-CB 3.14Å; L52-S71 PolarHBondContact O-N 2.92Å; Y69-S71 PolarHBondContact O-N 3.34Å; S71-S73 PolarHBondContact OG-N 3.05Å
72	T	40.5	Very low	38.1	Very low	98 Å²	98	94 Å²	94	60%	0.601	50%	0.495	S	S	*	.			trans	-89.3	-7.5	175.2	51.2	0	0	0	0	112.4	A118	T72-A118 WeakPolarHBondContact CG2-O 2.95Å; T72-A118 PolarHBondContact OG1-O 3.28Å
73	S	41.7	Very low	37.7	Very low	21 Å²	21	92.1 Å²	92.1	15%	0.147	48%	0.484	C	S	.	.			trans	-78.3	128	-178.8	-179.7	0	0	0	0	112.4	S71 T75 S121	S71-S73 PolarHBondContact OG-N 3.05Å; S73-T75 PolarHBondContact OG-N 3.08Å; S73-T75 PolarHBondContact OG-O 3.12Å; S73-S121 WeakPolarHBondContact CB-OG 3.46Å; S73-S121 PolarHBondContact OG-OG 3.48Å; S73-S121 VanDerWaalsContact OG-OG 3.07Å
74	K	38.2	Very low	37.3	Very low	159 Å²	159	95.7 Å²	95.7	69%	0.691	50%	0.501	S	S	*	.	S	Bend	trans	-85	-12.3	173	-68.7	-172.2	179.2	179.5	0	113.7
75	T	33	Very low	36.4	Very low	114 Å²	114	99.8 Å²	99.8	70%	0.699	51%	0.514	S	S	*	.			trans	-116.8	101.7	-175.2	39.6	0	0	0	0	110.2	S73	S73-T75 PolarHBondContact OG-N 3.08Å; S73-T75 PolarHBondContact OG-O 3.12Å
76	F	35.2	Very low	35.4	Very low	71 Å²	71	101.9 Å²	101.9	31%	0.311	53%	0.527	S	S	.	.			trans	-101.4	104.5	161.2	-113.8	-83.4	0	0	0	107.4	W36 L52 C122	W36-F76 AromaticContact CH2-CD1 3.78Å; W36-F76 HydrophobicContact CH2-CD1 3.78Å; W36-F76 AromaticContact CH2-CE1 3.83Å; W36-F76 HydrophobicContact CH2-CE1 3.83Å; W36-F76 AromaticContact CZ2-CD1 3.8Å; W36-F76 HydrophobicContact CZ2-CD1 3.8Å; W36-F76 AromaticContact CZ2-CE1 3.4Å; W36-F76 HydrophobicContact CZ2-CE1 3.4Å; W36-F76 HydrophobicContact CZ2-CZ 4.19Å; L52-F76 HydrophobicContact CD1-CD2 3.9Å; L52-F76 HydrophobicContact CD1-CE2 4.41Å; F76-C122 HydrophobicContact CE1-CB 4.34Å; F76-C122 HydrophobicContact CE2-CB 3.49Å; F76-C122 VanDerWaalsContact CE2-CB 3.49Å; F76-C122 HydrophobicContact CZ-CB 3.29Å
77	G	30.6	Very low	34.4	Very low	84 Å²	84	105.8 Å²	105.8	87%	0.866	54%	0.542	S	S	*	.			trans	-139.7	72.1	-179.9	0	0	0	0	0	109.4
78	G	31.6	Very low	33.4	Very low	40 Å²	40	110.3 Å²	110.3	41%	0.412	56%	0.562	S	S	.	*			trans	-167.5	121.9	176	0	0	0	0	0	110.7	S80	G78-S80 PolarHBondContact O-N 3.24Å
79	N	30.3	Very low	32.4	Very low	173 Å²	173	109.5 Å²	109.5	93%	0.925	57%	0.573	S	S	*	*			trans	-72	76.6	169.1	-76.6	-22.7	0	0	0	109	R81	N79-R81 PolarHBondContact O-N 2.94Å
80	S	32.1	Very low	31.3	Very low	38 Å²	38	114.9 Å²	114.9	27%	0.266	60%	0.599	S	S	.	*			trans	-80.3	88.6	175.3	-45.6	0	0	0	0	108.4	G78 I82 D124	G78-S80 PolarHBondContact O-N 3.24Å; S80-I82 PolarHBondContact O-N 3.29Å; S80-D124 PolarHBondContact OG-OD2 2.81Å
81	R	28.2	Very low	30.3	Very low	216 Å²	216	119.4 Å²	119.4	82%	0.815	62%	0.616	S	S	*	*			trans	-60.4	122.1	163.3	-85.6	-177.9	171.9	169.3	-2.3	107.4	N79 N83	N79-R81 PolarHBondContact O-N 2.94Å; R81-N83 VanDerWaalsContact C-N 3.29Å; R81-N83 PolarHBondContact O-N 3.21Å
82	I	32.2	Very low	29.4	Very low	116 Å²	116	126.3 Å²	126.3	60%	0.595	65%	0.651	S	S	*	*			trans	-65	98.1	165.2	-61.7	172.5	0	0	0	105.5	S80 D84	S80-I82 PolarHBondContact O-N 3.29Å; I82-D84 PolarHBondContact O-N 3.42Å
83	N	26	Very low	28.6	Very low	113 Å²	113	132.8 Å²	132.8	60%	0.604	67%	0.665	S	S	*	*			trans	-74.7	104.3	164	-79	-27.2	0	0	0	106.1	R81 H85	R81-N83 VanDerWaalsContact C-N 3.29Å; R81-N83 PolarHBondContact O-N 3.21Å; N83-H85 PolarHBondContact O-N 3.32Å
84	D	28.5	Very low	27.9	Very low	144 Å²	144	137 Å²	137	77%	0.77	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	11.7	172.3	-88	-26.5	0	0	0	114	I82	I82-D84 PolarHBondContact O-N 3.42Å
85	H	24.4	Very low	27.2	Very low	167 Å²	167	135.7 Å²	135.7	77%	0.773	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	5.2	-168.4	-92	-78.1	0	0	0	116.5	N83 L87	N83-H85 PolarHBondContact O-N 3.32Å; H85-L87 PolarHBondContact O-N 3.13Å
86	F	25	Very low	26.9	Very low	158 Å²	158	136 Å²	136	69%	0.693	69%	0.694	S	S	*	*			trans	-99.2	69.2	174.6	-80.3	-84.1	0	0	0	112.8	F88	F86-F88 HydrophobicContact CD1-CB 4.36Å
87	L	23.7	Very low	26.4	Very low	148 Å²	148	134.5 Å²	134.5	78%	0.775	69%	0.694	S	S	*	*			trans	-88.4	80.3	147.7	-89.1	158.6	0	0	0	107.2	H85	H85-L87 PolarHBondContact O-N 3.13Å
88	F	22.7	Very low	26.2	Very low	145 Å²	145	140 Å²	140	64%	0.636	69%	0.688	S	S	*	*			trans	-138.2	78.7	174.3	-133.2	-99.4	0	0	0	110.9	F86 Q90	F86-F88 HydrophobicContact CD1-CB 4.36Å; F88-Q90 HydrophobicContact CD1-CG 4.04Å; F88-Q90 HydrophobicContact CE1-CG 3.52Å; F88-Q90 HydrophobicContact CZ-CG 4.2Å
89	C	23.8	Very low	26	Very low	102 Å²	102	144.2 Å²	144.2	69%	0.689	70%	0.695	S	S	*	*			trans	-108.6	93.9	148.2	-79.9	0	0	0	0	107.1	R91	C89-R91 PolarHBondContact O-N 2.91Å
90	Q	23.5	Very low	25.9	Very low	141 Å²	141	141.1 Å²	141.1	66%	0.659	69%	0.694	S	S	*	*			trans	-48.7	123.3	161.9	-91.4	170.9	-17.5	0	0	110.2	F88 L92	F88-Q90 HydrophobicContact CD1-CG 4.04Å; F88-Q90 HydrophobicContact CE1-CG 3.52Å; F88-Q90 HydrophobicContact CZ-CG 4.2Å; Q90-L92 VanDerWaalsContact C-N 3.28Å; Q90-L92 PolarHBondContact O-N 3.43Å
91	R	22.6	Very low	26.1	Very low	249 Å²	249	141.8 Å²	141.8	94%	0.94	69%	0.694	S	S	*	*	S	Bend	trans	47.3	28.1	140	-70	-173.9	175	177.6	-0.9	119.5	C89 R93	C89-R91 PolarHBondContact O-N 2.91Å; R91-R93 PolarHBondContact O-N 2.88Å
92	L	23.6	Very low	26.3	Very low	155 Å²	155	134 Å²	134	81%	0.812	67%	0.673	S	S	*	*			trans	-86.7	100.3	154.9	-72.9	165.7	0	0	0	106.7	Q90 P94	Q90-L92 VanDerWaalsContact C-N 3.28Å; Q90-L92 PolarHBondContact O-N 3.43Å; L92-P94 WeakPolarHBondContact O-CD 3.43Å
93	R	22.9	Very low	26.5	Very low	235 Å²	235	132.6 Å²	132.6	89%	0.887	67%	0.671	S	S	*	*			trans	-52.7	113.2	161.5	-95.1	-177.5	175	176.9	-1	105.5	R91 T95	R91-R93 PolarHBondContact O-N 2.88Å; R93-T95 VanDerWaalsContact C-N 3.29Å; R93-T95 PolarHBondContact O-N 2.72Å
94	P	27.1	Very low	27.1	Very low	108 Å²	108	132.1 Å²	132.1	70%	0.701	67%	0.673	S	S	*	*			trans	-71	101	170.3	25.9	-19.7	0	0	0	104.4	L92 I96	L92-P94 WeakPolarHBondContact O-CD 3.43Å; P94-I96 PolarHBondContact O-N 2.75Å
95	T	24.8	Very low	27.9	Very low	132 Å²	132	129.7 Å²	129.7	81%	0.81	66%	0.66	S	S	*	*			trans	-62	101.4	157.5	-59.1	0	0	0	0	104.4	R93 A97	R93-T95 VanDerWaalsContact C-N 3.29Å; R93-T95 PolarHBondContact O-N 2.72Å; T95-A97 VanDerWaalsContact C-N 3.33Å; T95-A97 PolarHBondContact O-N 2.79Å
96	I	26.3	Very low	28.8	Very low	122 Å²	122	123 Å²	123	63%	0.626	63%	0.629	S	S	*	*			trans	-58.5	95.2	-176.7	-68.1	165.4	0	0	0	107.8	P94 R98	P94-I96 PolarHBondContact O-N 2.75Å; I96-R98 HydrophobicContact CG2-CG 3.56Å
97	A	25.3	Very low	29.7	Very low	38 Å²	38	118.5 Å²	118.5	31%	0.314	61%	0.614	S	S	.	*			trans	-98.4	96.6	163.2	0	0	0	0	0	106.7	Q25 T95 F99	Q25-A97 WeakPolarHBondContact O-CB 3.39Å; T95-A97 VanDerWaalsContact C-N 3.33Å; T95-A97 PolarHBondContact O-N 2.79Å; A97-F99 HydrophobicContact CB-CD2 4.16Å; A97-F99 HydrophobicContact CB-CE2 3.94Å; A97-F99 PolarHBondContact O-N 2.84Å
98	R	25.8	Very low	30.8	Very low	200 Å²	200	113.7 Å²	113.7	76%	0.755	60%	0.596	S	S	*	*			trans	-75.6	107.5	177.5	-66.3	175	179.1	158.1	-1.9	108.2	I96	I96-R98 HydrophobicContact CG2-CG 3.56Å
99	F	26.7	Very low	32	Very low	128 Å²	128	109.1 Å²	109.1	56%	0.561	58%	0.58	S	S	*	*			trans	-121.7	127.9	166.9	-71.2	-76.1	0	0	0	109.9	A97 I101	A97-F99 HydrophobicContact CB-CD2 4.16Å; A97-F99 HydrophobicContact CB-CE2 3.94Å; A97-F99 PolarHBondContact O-N 2.84Å; F99-I101 PolarHBondContact O-N 2.8Å
100	A	28.6	Very low	33	Very low	109 Å²	109	106.7 Å²	106.7	90%	0.901	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-70.2	117.7	171	0	0	0	0	0	108.4
101	I	35.3	Very low	34.2	Very low	52 Å²	52	108.7 Å²	108.7	27%	0.267	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-88	119.4	176.1	-54.2	148.9	0	0	0	105.6	F28 T60 F99 N105	F28-I101 HydrophobicContact CD1-CD1 3.89Å; F28-I101 HydrophobicContact CE1-CD1 3.06Å; F28-I101 HydrophobicContact CE1-CG1 3.77Å; F28-I101 HydrophobicContact CE1-CG2 4.12Å; F28-I101 HydrophobicContact CE2-CD1 4.01Å; F28-I101 HydrophobicContact CE2-CG1 4.13Å; F28-I101 HydrophobicContact CZ-CB 4.21Å; F28-I101 HydrophobicContact CZ-CD1 3.15Å; F28-I101 HydrophobicContact CZ-CG1 3.32Å; F28-I101 HydrophobicContact CZ-CG2 3.83Å; T60-I101 HydrophobicContact CG2-CD1 3.77Å; F99-I101 PolarHBondContact O-N 2.8Å; I101-N105 HydrophobicContact CG2-CB 3.76Å
102	S	34.2	Very low	35.5	Very low	51 Å²	51	102.1 Å²	102.1	36%	0.357	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-63.9	147.4	177.6	71.7	0	0	0	0	110	T104 N105	S102-T104 PolarHBondContact O-N 3.37Å; S102-N105 PolarHBondContact O-N 3.31Å
103	P	36.1	Very low	36.6	Very low	88 Å²	88	95.9 Å²	95.9	57%	0.571	51%	0.506	S	S	*	.	H	α-helix	trans	-52.3	-27.7	177.7	-25.6	32.4	0	0	0	113.6	T107	P103-T107 PolarHBondContact O-N 3.47Å; P103-T107 VanDerWaalsContact O-N 3.14Å; P103-T107 PolarHBondContact O-OG1 2.09Å
104	T	38.9	Very low	37.5	Very low	103 Å²	103	90.6 Å²	90.6	63%	0.632	49%	0.489	S	S	*	.	H	α-helix	trans	-62.5	-40.6	177.3	-36.4	0	0	0	0	112.1	S102 T107 A108	S102-T104 PolarHBondContact O-N 3.37Å; T104-T107 PolarHBondContact O-N 2.92Å; T104-A108 WeakPolarHBondContact O-CB 3.41Å; T104-A108 PolarHBondContact O-N 3.13Å
105	N	44.2	Very low	38.2	Very low	93 Å²	93	89.5 Å²	89.5	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-75.2	-34.2	-179.2	-77.3	-11.3	0	0	0	112.6	I101 S102 T109	I101-N105 HydrophobicContact CG2-CB 3.76Å; S102-N105 PolarHBondContact O-N 3.31Å; N105-T109 WeakPolarHBondContact O-CB 3.43Å; N105-T109 PolarHBondContact O-N 3.08Å; N105-T109 PolarHBondContact O-OG1 3.17Å
106	E	44.2	Very low	39.1	Very low	27 Å²	27	87.7 Å²	87.7	13%	0.126	46%	0.463	C	S	.	.	H	α-helix	trans	-60.7	-46.9	169.7	-83.3	-169.2	161.8	0	0	111.1	T60 R65 A108 T109 Y110	T60-E106 PolarHBondContact OG1-OE1 2.84Å; R65-E106 IonicContact CZ-OE2 3.66Å; R65-E106 IonicContact NE-OE2 3.59Å; R65-E106 IonicContact NH1-OE2 2.81Å; R65-E106 PolarHBondContact NH1-OE2 3.27Å; E106-A108 PolarHBondContact O-N 2.8Å; E106-T109 PolarHBondContact O-N 2.83Å; E106-Y110 PolarHBondContact O-N 3.44Å
107	T	43.9	Very low	39.8	Very low	63 Å²	63	83.3 Å²	83.3	39%	0.387	44%	0.44	S	S	.	.	H	α-helix	trans	-66.2	-39.1	-177.1	-47.7	0	0	0	0	111.5	P103 T104 Y110 R111	P103-T107 PolarHBondContact O-N 3.47Å; P103-T107 VanDerWaalsContact O-N 3.14Å; P103-T107 PolarHBondContact O-OG1 2.09Å; T104-T107 PolarHBondContact O-N 2.92Å; T107-Y110 PolarHBondContact O-N 2.82Å; T107-R111 WeakPolarHBondContact O-CB 3.48Å; T107-R111 WeakPolarHBondContact O-CG 3.48Å; T107-R111 PolarHBondContact O-N 2.76Å
108	A	46.3	Very low	40.4	Very low	46 Å²	46	83.8 Å²	83.8	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-41.2	174.4	0	0	0	0	0	112	T104 E106 R111 K112	T104-A108 WeakPolarHBondContact O-CB 3.41Å; T104-A108 PolarHBondContact O-N 3.13Å; E106-A108 PolarHBondContact O-N 2.8Å; A108-R111 PolarHBondContact O-N 2.92Å; A108-K112 PolarHBondContact O-N 3.3Å
109	T	46.8	Very low	40.8	Very low	50 Å²	50	77.4 Å²	77.4	31%	0.307	44%	0.441	S	S	.	.	H	α-helix	trans	-64.4	-46.7	176.6	-54.6	0	0	0	0	110.8	N105 E106 R111 K112 C113	N105-T109 WeakPolarHBondContact O-CB 3.43Å; N105-T109 PolarHBondContact O-N 3.08Å; N105-T109 PolarHBondContact O-OG1 3.17Å; E106-T109 PolarHBondContact O-N 2.83Å; T109-R111 PolarHBondContact O-N 3.01Å; T109-K112 PolarHBondContact O-N 2.95Å; T109-C113 PolarHBondContact O-N 3.44Å; T109-C113 PolarHBondContact O-SG 3.37Å
110	Y	46.3	Very low	41.3	Very low	50 Å²	50	72.5 Å²	72.5	20%	0.196	43%	0.426	C	S	.	.	H	α-helix	trans	-58.7	-46.9	174.4	175.7	-98.8	0	0	0	112.1	F67 E106 T107 K112 C113 K114	F67-Y110 HydrophobicContact CB-CD2 4.35Å; F67-Y110 HydrophobicContact CB-CE2 3.85Å; F67-Y110 AromaticContact CD1-CD2 3.64Å; F67-Y110 HydrophobicContact CD1-CD2 3.64Å; F67-Y110 AromaticContact CD1-CE2 3.55Å; F67-Y110 HydrophobicContact CD1-CE2 3.55Å; F67-Y110 HydrophobicContact CD1-CG 4.26Å; F67-Y110 HydrophobicContact CD2-CD2 4.45Å; F67-Y110 AromaticContact CE1-CD2 3.99Å; F67-Y110 HydrophobicContact CE1-CD2 3.99Å; F67-Y110 HydrophobicContact CE1-CE2 4.3Å; F67-Y110 HydrophobicContact CE1-CG 4.21Å; F67-Y110 AromaticContact CG-CD2 3.89Å; F67-Y110 HydrophobicContact CG-CD2 3.89Å; F67-Y110 AromaticContact CG-CE2 3.81Å; F67-Y110 HydrophobicContact CG-CE2 3.81Å; E106-Y110 PolarHBondContact O-N 3.44Å; T107-Y110 PolarHBondContact O-N 2.82Å; Y110-K112 VanDerWaalsContact C-N 3.29Å; Y110-K112 PolarHBondContact O-N 3.29Å; Y110-C113 PolarHBondContact O-N 3.23Å; Y110-K114 HydrophobicContact CE1-CD 4.39Å; Y110-K114 WeakPolarHBondContact O-CB 3.45Å; Y110-K114 PolarHBondContact O-N 3.09Å
111	R	47.9	Very low	41.7	Very low	183 Å²	183	69.6 Å²	69.6	69%	0.691	40%	0.399	S	S	*	.	H	α-helix	trans	-59.6	-38.8	177.8	-78.1	-175	-170.4	178.9	3.8	112.3	T107 A108 T109 P115	T107-R111 WeakPolarHBondContact O-CB 3.48Å; T107-R111 WeakPolarHBondContact O-CG 3.48Å; T107-R111 PolarHBondContact O-N 2.76Å; A108-R111 PolarHBondContact O-N 2.92Å; T109-R111 PolarHBondContact O-N 3.01Å; R111-P115 WeakPolarHBondContact O-CD 3.3Å
112	K	49.6	Very low	42.1	Very low	111 Å²	111	67.3 Å²	67.3	48%	0.483	39%	0.388	S	S	.	.	H	α-helix	trans	-69.6	-37.1	175.8	-84.3	-179.2	177.9	169.3	0	112.8	A108 T109 Y110 P115 F116 L133	A108-K112 PolarHBondContact O-N 3.3Å; T109-K112 PolarHBondContact O-N 2.95Å; Y110-K112 VanDerWaalsContact C-N 3.29Å; Y110-K112 PolarHBondContact O-N 3.29Å; K112-P115 VanDerWaalsContact O-CD 3.29Å; K112-P115 WeakPolarHBondContact O-CD 2.93Å; K112-F116 WeakPolarHBondContact O-CD2 3.16Å; K112-F116 VanDerWaalsContact O-CE2 3.25Å; K112-F116 WeakPolarHBondContact O-CE2 3.45Å; K112-L133 HydrophobicContact CD-CD1 4.16Å
113	C	46.4	Very low	42.1	Very low	25 Å²	25	67.7 Å²	67.7	17%	0.169	39%	0.391	C	S	.	.	H	α-helix	trans	-76.6	-26.4	178.5	-64.8	0	0	0	0	113.1	T109 Y110 P115 F116 L117	T109-C113 PolarHBondContact O-N 3.44Å; T109-C113 PolarHBondContact O-SG 3.37Å; Y110-C113 PolarHBondContact O-N 3.23Å; C113-P115 VanDerWaalsContact C-CD 3.46Å; C113-F116 WeakPolarHBondContact O-CB 3.25Å; C113-F116 PolarHBondContact O-N 3.01Å; C113-F116 VanDerWaalsContact O-N 3.08Å; C113-L117 HydrophobicContact CB-CD1 4.41Å; C113-L117 WeakPolarHBondContact O-CG 3.39Å; C113-L117 PolarHBondContact O-N 3.35Å
114	K	43.4	Very low	42.2	Very low	123 Å²	123	66.9 Å²	66.9	54%	0.535	38%	0.382	S	S	.	.	H	α-helix	trans	-51.7	-44.5	-174.9	-169.6	-174.4	180	-169.3	0	115	Y110 F116 L117 A118	Y110-K114 HydrophobicContact CE1-CD 4.39Å; Y110-K114 WeakPolarHBondContact O-CB 3.45Å; Y110-K114 PolarHBondContact O-N 3.09Å; K114-F116 VanDerWaalsContact C-N 3.33Å; K114-F116 PolarHBondContact O-N 3.03Å; K114-L117 PolarHBondContact O-N 3.11Å; K114-A118 WeakPolarHBondContact O-CB 3.09Å; K114-A118 PolarHBondContact O-N 3.33Å
115	P	41.2	Very low	41.8	Very low	86 Å²	86	72 Å²	72	56%	0.558	39%	0.389	S	S	*	.	H	α-helix	trans	-65.2	-37.4	178.7	-18	31.6	0	0	0	112.3	R111 K112 C113 L117 A118 G119	R111-P115 WeakPolarHBondContact O-CD 3.3Å; K112-P115 VanDerWaalsContact O-CD 3.29Å; K112-P115 WeakPolarHBondContact O-CD 2.93Å; C113-P115 VanDerWaalsContact C-CD 3.46Å; P115-L117 VanDerWaalsContact C-N 3.34Å; P115-A118 PolarHBondContact O-N 3.07Å; P115-G119 PolarHBondContact O-N 2.8Å; P115-G119 VanDerWaalsContact O-N 3.12Å
116	F	43.9	Very low	41.2	Very low	94 Å²	94	71.3 Å²	71.3	41%	0.412	39%	0.39	S	S	.	.	H	α-helix	trans	-69.4	-34.8	178.3	-56.3	-73.8	0	0	0	111.7	K112 C113 K114 G120 I129	K112-F116 WeakPolarHBondContact O-CD2 3.16Å; K112-F116 VanDerWaalsContact O-CE2 3.25Å; K112-F116 WeakPolarHBondContact O-CE2 3.45Å; C113-F116 WeakPolarHBondContact O-CB 3.25Å; C113-F116 PolarHBondContact O-N 3.01Å; C113-F116 VanDerWaalsContact O-N 3.08Å; K114-F116 VanDerWaalsContact C-N 3.33Å; K114-F116 PolarHBondContact O-N 3.03Å; F116-G120 PolarHBondContact O-N 2.8Å; F116-G120 VanDerWaalsContact O-N 3.08Å; F116-I129 HydrophobicContact CD1-CD1 3.36Å; F116-I129 HydrophobicContact CE1-CD1 3.76Å; F116-I129 HydrophobicContact CE1-CG2 4.07Å; F116-I129 HydrophobicContact CG-CD1 4.23Å
117	L	41.5	Very low	40.6	Very low	29 Å²	29	73.6 Å²	73.6	15%	0.152	41%	0.406	C	S	.	.	H	α-helix	trans	-70.6	-32.8	172.2	-62.9	170.7	0	0	0	112.4	M56 Y69 C113 K114 P115 G119 G120	M56-L117 HydrophobicContact SD-CD1 3.65Å; M56-L117 HydrophobicContact SD-CD2 4.16Å; Y69-L117 HydrophobicContact CD1-CD1 4.41Å; Y69-L117 HydrophobicContact CD2-CB 4.2Å; Y69-L117 HydrophobicContact CE1-CD1 4.47Å; Y69-L117 HydrophobicContact CE1-CD2 4.15Å; Y69-L117 HydrophobicContact CE2-CB 4.12Å; Y69-L117 HydrophobicContact CG-CB 4.46Å; C113-L117 HydrophobicContact CB-CD1 4.41Å; C113-L117 WeakPolarHBondContact O-CG 3.39Å; C113-L117 PolarHBondContact O-N 3.35Å; K114-L117 PolarHBondContact O-N 3.11Å; P115-L117 VanDerWaalsContact C-N 3.34Å; L117-G119 VanDerWaalsContact C-N 3.35Å; L117-G120 PolarHBondContact O-N 2.92Å
118	A	37.4	Very low	39.9	Very low	49 Å²	49	75 Å²	75	41%	0.405	42%	0.418	S	S	.	.	H	α-helix	trans	-71.9	-27.8	177.8	0	0	0	0	0	113.1	T72 K114 P115	T72-A118 WeakPolarHBondContact CG2-O 2.95Å; T72-A118 PolarHBondContact OG1-O 3.28Å; K114-A118 WeakPolarHBondContact O-CB 3.09Å; K114-A118 PolarHBondContact O-N 3.33Å; P115-A118 PolarHBondContact O-N 3.07Å
119	G	34.5	Very low	39.1	Very low	66 Å²	66	74.9 Å²	74.9	68%	0.68	41%	0.411	S	S	*	.	H	α-helix	trans	-89.8	-16.4	173.2	0	0	0	0	0	114.6	P115 L117 S121	P115-G119 PolarHBondContact O-N 2.8Å; P115-G119 VanDerWaalsContact O-N 3.12Å; L117-G119 VanDerWaalsContact C-N 3.35Å; G119-S121 PolarHBondContact O-N 3.23Å
120	G	36.8	Very low	38.2	Very low	24 Å²	24	81.9 Å²	81.9	25%	0.247	43%	0.431	C	S	.	.			trans	-75.5	110.2	178.9	0	0	0	0	0	111.8	F116 L117	F116-G120 PolarHBondContact O-N 2.8Å; F116-G120 VanDerWaalsContact O-N 3.08Å; L117-G120 PolarHBondContact O-N 2.92Å
121	S	37.9	Very low	37.5	Very low	48 Å²	48	82 Å²	82	34%	0.336	44%	0.438	S	S	.	.			trans	-60	143.9	159.7	178.1	0	0	0	0	108.6	S73 G119 S123	S73-S121 WeakPolarHBondContact CB-OG 3.46Å; S73-S121 PolarHBondContact OG-OG 3.48Å; S73-S121 VanDerWaalsContact OG-OG 3.07Å; G119-S121 PolarHBondContact O-N 3.23Å; S121-S123 PolarHBondContact O-N 2.92Å
122	C	42.7	Very low	36.4	Very low	4 Å²	4	83.7 Å²	83.7	3%	0.027	44%	0.444	C	S	.	.	S	Bend	trans	-73.1	39.4	177.4	-58.4	0	0	0	0	112	R34 C54 F76	R34-C122 VanDerWaalsContact CZ-O 3.23Å; R34-C122 PolarHBondContact NH1-O 2.92Å; R34-C122 PolarHBondContact NH2-O 3.45Å; R34-C122 VanDerWaalsContact NH2-O 3.09Å; C54-C122 WeakPolarHBondContact CB-SG 3.41Å; C54-C122 WeakPolarHBondContact SG-CB 3.49Å; C54-C122 CovalentContact SG-SG 2.09Å; C54-C122 PolarHBondContact SG-SG 3.35Å; F76-C122 HydrophobicContact CE1-CB 4.34Å; F76-C122 HydrophobicContact CE2-CB 3.49Å; F76-C122 VanDerWaalsContact CE2-CB 3.49Å; F76-C122 HydrophobicContact CZ-CB 3.29Å
123	S	34.8	Very low	35.5	Very low	59 Å²	59	80.6 Å²	80.6	41%	0.413	43%	0.432	S	S	.	.	S	Bend	trans	-94.6	155.6	177.1	83.9	0	0	0	0	112.3	S121 R125	S121-S123 PolarHBondContact O-N 2.92Å; S123-R125 PolarHBondContact O-N 3.07Å
124	D	37.8	Very low	34.6	Very low	71 Å²	71	91.2 Å²	91.2	38%	0.38	48%	0.48	S	S	.	.	S	Bend	trans	-71.5	12.6	-175.5	-62.7	-42.5	0	0	0	114.3	S80	S80-D124 PolarHBondContact OG-OD2 2.81Å
125	R	30.2	Very low	34.1	Very low	210 Å²	210	89.7 Å²	89.7	79%	0.792	48%	0.477	S	S	*	.			trans	-88.8	129.6	-175.6	-79	-172.1	162.3	-173.7	-5	111.9	S123	S123-R125 PolarHBondContact O-N 3.07Å
126	P	32.8	Very low	33.8	Very low	80 Å²	80	89.8 Å²	89.8	52%	0.519	47%	0.472	S	S	.	.			trans	-67.6	135.6	176.2	28.3	-33.8	0	0	0	110.9	L10	L10-P126 HydrophobicContact CB-CB 4.14Å; L10-P126 WeakPolarHBondContact O-CB 3.2Å
127	V	30.2	Very low	33.2	Very low	74 Å²	74	89.6 Å²	89.6	45%	0.448	48%	0.476	S	S	.	.			trans	-112.3	113.8	169.6	-171.6	0	0	0	0	107.9	L10 I129	L10-V127 WeakPolarHBondContact CB-O 3.39Å; L10-V127 HydrophobicContact CD1-CB 3.43Å; L10-V127 VanDerWaalsContact CD1-CB 3.43Å; L10-V127 HydrophobicContact CD1-CG2 4.12Å; L10-V127 WeakPolarHBondContact CD1-O 3.32Å; L10-V127 WeakPolarHBondContact CG-O 3.45Å; V127-I129 HydrophobicContact CG1-CD1 3.96Å; V127-I129 HydrophobicContact CG1-CG1 3.87Å
128	S	29.3	Very low	32.7	Very low	92 Å²	92	93.2 Å²	93.2	64%	0.643	50%	0.495	S	S	*	.			trans	-87.9	126.5	175.6	176.9	0	0	0	0	109.2
129	I	30.6	Very low	32.4	Very low	45 Å²	45	95.9 Å²	95.9	23%	0.231	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.8	177.1	-48.6	-178.6	0	0	0	110.4	I8 F116 V127	I8-I129 WeakPolarHBondContact CB-O 3.29Å; I8-I129 PolarHBondContact N-O 2.83Å; I8-I129 PolarHBondContact O-N 2.87Å; F116-I129 HydrophobicContact CD1-CD1 3.36Å; F116-I129 HydrophobicContact CE1-CD1 3.76Å; F116-I129 HydrophobicContact CE1-CG2 4.07Å; F116-I129 HydrophobicContact CG-CD1 4.23Å; V127-I129 HydrophobicContact CG1-CD1 3.96Å; V127-I129 HydrophobicContact CG1-CG1 3.87Å
130	R	28.1	Very low	32.3	Very low	197 Å²	197	97.9 Å²	97.9	74%	0.743	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	129.2	164.5	-94.3	-176.8	170.9	174.8	-2.9	109.8	D7	D7-R130 WeakPolarHBondContact OD1-CG 3.41Å; D7-R130 IonicContact OD1-NE 3.64Å; D7-R130 IonicContact OD2-CZ 3.27Å; D7-R130 IonicContact OD2-NE 2.97Å; D7-R130 PolarHBondContact OD2-NE 2.91Å; D7-R130 IonicContact OD2-NH2 3.91Å; D7-R130 PolarHBondContact OD2-NH2 2.94Å
131	T	30	Very low	32	Very low	53 Å²	53	103.2 Å²	103.2	33%	0.325	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.1	166	10.9	0	0	0	0	111
132	R	24.8	Very low	31.5	Very low	218 Å²	218	107.5 Å²	107.5	82%	0.823	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	134.6	161.8	-107.6	-176	176.3	-170.4	-0.4	107.9
133	L	30.3	Very low	30.6	Very low	46 Å²	46	116.1 Å²	116.1	24%	0.241	56%	0.56	C	S	.	*			trans	-111.9	113.9	174.7	-114.6	147.5	0	0	0	108.4	P3 N4 Y6 K112	P3-L133 WeakPolarHBondContact CB-O 2.97Å; N4-L133 WeakPolarHBondContact O-CB 3.35Å; Y6-L133 HydrophobicContact CD2-CD1 3.65Å; Y6-L133 HydrophobicContact CE2-CB 4Å; Y6-L133 HydrophobicContact CE2-CD1 3.2Å; Y6-L133 HydrophobicContact CE2-CG 4.19Å; K112-L133 HydrophobicContact CD-CD1 4.16Å
134	E	28.2	Very low	30.2	Very low	248 Å²	248	121.3 Å²	121.3	100%	1.159	57%	0.573	S	S	*	*			trans	-67.3	0	168.6	-65.7	-176	163.8	0	0	111.3

Retrieved 134 of 134 residues in 82.7 ms (Link to these results)

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