A0A5K4F7S3_SCHMA Loading...

Secreted protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F7S3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 84 aa.

						>A0A5K4F7S3_SCHMA|A0A5K4F7S3
MMIMMMMRSFNLVKMISLLLFSNLLIISIQGVVIPEANPIDYQSKRWTDFKRAIRWSEYPFTFTPEIKRHYLYEQRPYYNDILV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	56.6	Low	59.2	Low	194 Å²	194	138.3 Å²	138.3	96%	0.956	67%	0.672	S	S	*	*				0	-37.1	0	-152.3	152.9	104.8	0	0	113.4	I3 M4 M5	M1-I3 PolarHBondContact O-N 3.12Å; M1-M4 PolarHBondContact O-N 3.18Å; M1-M5 PolarHBondContact O-N 3.1Å
2	M	61.5	Low	60.8	Low	145 Å²	145	135.3 Å²	135.3	71%	0.714	66%	0.661	S	S	*	*	H	α-helix	trans	-63.7	-37.6	-177.9	-150.6	166.3	77.2	0	0	114.8	M4 M5 M6	M2-M4 PolarHBondContact O-N 3.21Å; M2-M5 PolarHBondContact O-N 3.04Å; M2-M6 PolarHBondContact O-N 3.22Å
3	I	60.9	Low	62.3	Low	139 Å²	139	132.4 Å²	132.4	71%	0.713	66%	0.656	S	S	*	*	H	α-helix	trans	-64.2	-39.2	179.6	-63.4	167	0	0	0	111.6	M1 M6 M7	M1-I3 PolarHBondContact O-N 3.12Å; I3-M6 PolarHBondContact O-N 3.42Å; I3-M7 WeakPolarHBondContact O-CG 3.45Å; I3-M7 PolarHBondContact O-N 3.15Å
4	M	55.9	Low	63.7	Low	144 Å²	144	131.5 Å²	131.5	71%	0.709	65%	0.646	S	S	*	*	H	α-helix	trans	-71.3	-32.4	-179.7	-156	177.6	68.1	0	0	112.2	M1 M2 R8	M1-M4 PolarHBondContact O-N 3.18Å; M2-M4 PolarHBondContact O-N 3.21Å; M4-R8 PolarHBondContact O-N 2.91Å
5	M	56.7	Low	65.2	Low	133 Å²	133	131.4 Å²	131.4	66%	0.655	65%	0.646	S	S	*	*	H	α-helix	trans	-68.3	-41.5	171.2	-86.2	178.5	156	0	0	112.1	M1 M2 R8 S9	M1-M5 PolarHBondContact O-N 3.1Å; M2-M5 PolarHBondContact O-N 3.04Å; M5-R8 PolarHBondContact O-N 3.45Å; M5-S9 PolarHBondContact O-N 3.16Å; M5-S9 PolarHBondContact O-OG 3Å
6	M	57.1	Low	66.5	Low	124 Å²	124	128.8 Å²	128.8	61%	0.611	63%	0.634	S	S	*	*	H	α-helix	trans	-62.5	-40.4	174.4	-83.6	-164.4	-173.9	0	0	112.5	M2 I3 R8 S9 F10	M2-M6 PolarHBondContact O-N 3.22Å; I3-M6 PolarHBondContact O-N 3.42Å; M6-R8 VanDerWaalsContact C-N 3.33Å; M6-R8 PolarHBondContact O-N 3.23Å; M6-S9 PolarHBondContact O-N 3.39Å; M6-S9 PolarHBondContact O-OG 3.48Å; M6-S9 VanDerWaalsContact O-OG 3.07Å; M6-F10 VanDerWaalsContact O-CB 3.27Å; M6-F10 WeakPolarHBondContact O-CB 3.31Å; M6-F10 PolarHBondContact O-N 3.1Å
7	M	58.2	Low	67.8	Low	133 Å²	133	125.2 Å²	125.2	66%	0.655	63%	0.625	S	S	*	*	H	α-helix	trans	-64.7	-37.4	177.9	-71	-175.4	82.3	0	0	112.4	I3 N11	I3-M7 WeakPolarHBondContact O-CG 3.45Å; I3-M7 PolarHBondContact O-N 3.15Å; M7-N11 PolarHBondContact O-N 3.27Å
8	R	55.3	Low	68.9	Low	205 Å²	205	125.5 Å²	125.5	77%	0.774	63%	0.628	S	S	*	*	H	α-helix	trans	-68.9	-43.2	176.3	-105.8	-176.2	172.1	-178.2	-1.6	112.5	M4 M5 M6 F10 N11 L12	M4-R8 PolarHBondContact O-N 2.91Å; M5-R8 PolarHBondContact O-N 3.45Å; M6-R8 VanDerWaalsContact C-N 3.33Å; M6-R8 PolarHBondContact O-N 3.23Å; R8-F10 VanDerWaalsContact C-N 3.34Å; R8-N11 PolarHBondContact O-N 2.76Å; R8-L12 PolarHBondContact O-N 3.13Å
9	S	57.4	Low	69.8	Low	66 Å²	66	124.5 Å²	124.5	46%	0.462	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-35.6	177.9	64.9	0	0	0	0	112	M5 M6 N11 L12 V13	M5-S9 PolarHBondContact O-N 3.16Å; M5-S9 PolarHBondContact O-OG 3Å; M6-S9 PolarHBondContact O-N 3.39Å; M6-S9 PolarHBondContact O-OG 3.48Å; M6-S9 VanDerWaalsContact O-OG 3.07Å; S9-N11 VanDerWaalsContact C-N 3.33Å; S9-N11 PolarHBondContact O-N 2.91Å; S9-L12 PolarHBondContact O-N 3.38Å; S9-V13 WeakPolarHBondContact O-CG2 3.49Å; S9-V13 PolarHBondContact O-N 3.41Å
10	F	59.2	Low	70.7	Confident	129 Å²	129	123.7 Å²	123.7	57%	0.566	62%	0.621	S	S	*	*	H	α-helix	trans	-63	-38.2	177.5	-156.8	-103.8	0	0	0	112.5	M6 R8 K14	M6-F10 VanDerWaalsContact O-CB 3.27Å; M6-F10 WeakPolarHBondContact O-CB 3.31Å; M6-F10 PolarHBondContact O-N 3.1Å; R8-F10 VanDerWaalsContact C-N 3.34Å; F10-K14 HydrophobicContact CD1-CD 4.34Å; F10-K14 HydrophobicContact CE1-CD 4.28Å; F10-K14 WeakPolarHBondContact O-CG 3.34Å; F10-K14 PolarHBondContact O-N 3.49Å
11	N	72.9	Confident	71.3	Confident	109 Å²	109	124.3 Å²	124.3	58%	0.583	62%	0.62	S	S	*	*	H	α-helix	trans	-69.1	-36.8	174.6	-88.2	-15.1	0	0	0	112.7	M7 R8 S9 K14 M15	M7-N11 PolarHBondContact O-N 3.27Å; R8-N11 PolarHBondContact O-N 2.76Å; S9-N11 VanDerWaalsContact C-N 3.33Å; S9-N11 PolarHBondContact O-N 2.91Å; N11-K14 PolarHBondContact O-N 2.65Å; N11-M15 PolarHBondContact O-N 3.31Å
12	L	78.3	Confident	72.6	Confident	102 Å²	102	117.4 Å²	117.4	53%	0.534	59%	0.591	S	S	.	*	H	α-helix	trans	-70	-41.7	-178.6	-151.9	150.4	0	0	0	111.1	R8 S9 K14 M15 I16	R8-L12 PolarHBondContact O-N 3.13Å; S9-L12 PolarHBondContact O-N 3.38Å; L12-K14 PolarHBondContact O-N 3.08Å; L12-M15 PolarHBondContact O-N 3.33Å; L12-I16 HydrophobicContact CD2-CD1 3.5Å; L12-I16 HydrophobicContact CD2-CG1 4.17Å; L12-I16 WeakPolarHBondContact O-CG1 3.19Å; L12-I16 PolarHBondContact O-N 3.23Å
13	V	80.4	Confident	73.4	Confident	98 Å²	98	114.3 Å²	114.3	59%	0.594	58%	0.578	S	S	*	*	H	α-helix	trans	-61.4	-43.7	174.8	174.2	0	0	0	0	111.3	S9 M15 I16 S17	S9-V13 WeakPolarHBondContact O-CG2 3.49Å; S9-V13 PolarHBondContact O-N 3.41Å; V13-M15 PolarHBondContact O-N 3.16Å; V13-I16 PolarHBondContact O-N 3.49Å; V13-S17 PolarHBondContact O-N 2.91Å
14	K	82.1	Confident	74.2	Confident	120 Å²	120	113.3 Å²	113.3	52%	0.522	57%	0.573	S	S	.	*	H	α-helix	trans	-63.3	-38.7	176.2	-78.6	-175.2	173.8	-176.2	0	113.1	F10 N11 L12 S17 L18	F10-K14 HydrophobicContact CD1-CD 4.34Å; F10-K14 HydrophobicContact CE1-CD 4.28Å; F10-K14 WeakPolarHBondContact O-CG 3.34Å; F10-K14 PolarHBondContact O-N 3.49Å; N11-K14 PolarHBondContact O-N 2.65Å; L12-K14 PolarHBondContact O-N 3.08Å; K14-S17 PolarHBondContact O-N 3.02Å; K14-S17 PolarHBondContact O-OG 3.08Å; K14-L18 WeakPolarHBondContact O-CB 3.07Å; K14-L18 PolarHBondContact O-N 3.19Å
15	M	85	Confident	75.1	Confident	130 Å²	130	110 Å²	110	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-65.4	-44.4	175.2	-82.1	-147.5	-62.9	0	0	111.9	N11 L12 V13 S17 L18 L19	N11-M15 PolarHBondContact O-N 3.31Å; L12-M15 PolarHBondContact O-N 3.33Å; V13-M15 PolarHBondContact O-N 3.16Å; M15-S17 VanDerWaalsContact C-N 3.34Å; M15-S17 PolarHBondContact O-N 3.47Å; M15-L18 PolarHBondContact O-N 3.48Å; M15-L19 PolarHBondContact O-N 3.3Å
16	I	87.1	Confident	75.8	Confident	90 Å²	90	107.7 Å²	107.7	46%	0.462	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-43.3	177	-68	173	0	0	0	110.6	L12 V13 L18 L19 L20	L12-I16 HydrophobicContact CD2-CD1 3.5Å; L12-I16 HydrophobicContact CD2-CG1 4.17Å; L12-I16 WeakPolarHBondContact O-CG1 3.19Å; L12-I16 PolarHBondContact O-N 3.23Å; V13-I16 PolarHBondContact O-N 3.49Å; I16-L18 VanDerWaalsContact C-N 3.31Å; I16-L18 PolarHBondContact O-N 3.38Å; I16-L19 PolarHBondContact O-N 3Å; I16-L20 HydrophobicContact CG2-CD1 3.99Å; I16-L20 PolarHBondContact O-N 3.27Å
17	S	87.4	Confident	76.4	Confident	68 Å²	68	106 Å²	106	48%	0.476	54%	0.54	S	S	.	.	H	α-helix	trans	-63.1	-38.9	178.5	70	0	0	0	0	112.1	V13 K14 M15 L20 F21	V13-S17 PolarHBondContact O-N 2.91Å; K14-S17 PolarHBondContact O-N 3.02Å; K14-S17 PolarHBondContact O-OG 3.08Å; M15-S17 VanDerWaalsContact C-N 3.34Å; M15-S17 PolarHBondContact O-N 3.47Å; S17-L20 PolarHBondContact O-N 3.29Å; S17-F21 WeakPolarHBondContact O-CB 3.39Å; S17-F21 PolarHBondContact O-N 3.44Å
18	L	87.4	Confident	76.7	Confident	130 Å²	130	103.9 Å²	103.9	68%	0.681	54%	0.538	S	S	*	.	H	α-helix	trans	-64.1	-41.6	177	-159.1	96	0	0	0	111.5	K14 M15 I16 F21 S22	K14-L18 WeakPolarHBondContact O-CB 3.07Å; K14-L18 PolarHBondContact O-N 3.19Å; M15-L18 PolarHBondContact O-N 3.48Å; I16-L18 VanDerWaalsContact C-N 3.31Å; I16-L18 PolarHBondContact O-N 3.38Å; L18-F21 PolarHBondContact O-N 2.97Å; L18-S22 PolarHBondContact O-N 3.19Å; L18-S22 PolarHBondContact O-OG 3.16Å
19	L	87.7	Confident	77	Confident	107 Å²	107	100.2 Å²	100.2	56%	0.56	53%	0.533	S	S	*	.	H	α-helix	trans	-65.8	-38.4	177.3	-109.8	153.1	0	0	0	113	M15 I16 S22 N23	M15-L19 PolarHBondContact O-N 3.3Å; I16-L19 PolarHBondContact O-N 3Å; L19-S22 PolarHBondContact O-OG 3.27Å; L19-S22 VanDerWaalsContact O-OG 3.05Å; L19-N23 PolarHBondContact O-N 2.86Å; L19-N23 PolarHBondContact O-ND2 2.88Å
20	L	86.1	Confident	77	Confident	107 Å²	107	103.6 Å²	103.6	56%	0.56	54%	0.541	S	S	*	.	H	α-helix	trans	-69.2	-41.8	174.4	-76.2	168.4	0	0	0	111.2	I16 S17 N23 L24	I16-L20 HydrophobicContact CG2-CD1 3.99Å; I16-L20 PolarHBondContact O-N 3.27Å; S17-L20 PolarHBondContact O-N 3.29Å; L20-N23 PolarHBondContact O-N 3.07Å; L20-L24 PolarHBondContact O-N 2.86Å
21	F	84	Confident	76.6	Confident	137 Å²	137	99.2 Å²	99.2	60%	0.601	53%	0.532	S	S	*	.	H	α-helix	trans	-63.2	-44.4	178.2	-175.2	-97.1	0	0	0	112	S17 L18 N23 L24 L25	S17-F21 WeakPolarHBondContact O-CB 3.39Å; S17-F21 PolarHBondContact O-N 3.44Å; L18-F21 PolarHBondContact O-N 2.97Å; F21-N23 PolarHBondContact O-N 3.13Å; F21-L24 PolarHBondContact O-N 2.95Å; F21-L25 HydrophobicContact CD1-CD1 4.42Å; F21-L25 HydrophobicContact CE1-CD1 3.66Å; F21-L25 HydrophobicContact CZ-CD1 4.09Å; F21-L25 WeakPolarHBondContact O-CB 3.23Å; F21-L25 PolarHBondContact O-N 3.39Å
22	S	83.1	Confident	75.7	Confident	50 Å²	50	99.2 Å²	99.2	35%	0.35	54%	0.536	S	S	.	.	H	α-helix	trans	-64.3	-40.3	177.9	63.9	0	0	0	0	112.4	L18 L19 L25 I26	L18-S22 PolarHBondContact O-N 3.19Å; L18-S22 PolarHBondContact O-OG 3.16Å; L19-S22 PolarHBondContact O-OG 3.27Å; L19-S22 VanDerWaalsContact O-OG 3.05Å; S22-L25 PolarHBondContact O-N 3.42Å; S22-I26 VanDerWaalsContact O-CG1 3.28Å; S22-I26 WeakPolarHBondContact O-CG1 3.06Å; S22-I26 PolarHBondContact O-N 3.19Å
23	N	79.3	Confident	74.3	Confident	79 Å²	79	99.8 Å²	99.8	42%	0.422	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-42.9	175.5	-84.9	-58.7	0	0	0	112.5	L19 L20 F21 L25 I26 I27	L19-N23 PolarHBondContact O-N 2.86Å; L19-N23 PolarHBondContact O-ND2 2.88Å; L20-N23 PolarHBondContact O-N 3.07Å; F21-N23 PolarHBondContact O-N 3.13Å; N23-L25 VanDerWaalsContact C-N 3.25Å; N23-L25 PolarHBondContact O-N 3.02Å; N23-I26 PolarHBondContact O-N 3.43Å; N23-I27 VanDerWaalsContact O-CG1 3.28Å; N23-I27 WeakPolarHBondContact O-CG1 3.4Å; N23-I27 PolarHBondContact O-N 3.33Å
24	L	77.7	Confident	73	Confident	118 Å²	118	99.2 Å²	99.2	62%	0.618	54%	0.536	S	S	*	.	H	α-helix	trans	-60.3	-38.4	173.8	-83.9	163.2	0	0	0	112	L20 F21 I27 S28	L20-L24 PolarHBondContact O-N 2.86Å; F21-L24 PolarHBondContact O-N 2.95Å; L24-I27 PolarHBondContact O-N 3.07Å; L24-S28 WeakPolarHBondContact O-CB 3.48Å; L24-S28 PolarHBondContact O-N 3.34Å
25	L	74.6	Confident	71.5	Confident	74 Å²	74	98.6 Å²	98.6	39%	0.387	54%	0.544	S	S	.	.	H	α-helix	trans	-70.7	-37.7	178.8	-158.3	149.1	0	0	0	111.6	F21 S22 N23 S28 I29	F21-L25 HydrophobicContact CD1-CD1 4.42Å; F21-L25 HydrophobicContact CE1-CD1 3.66Å; F21-L25 HydrophobicContact CZ-CD1 4.09Å; F21-L25 WeakPolarHBondContact O-CB 3.23Å; F21-L25 PolarHBondContact O-N 3.39Å; S22-L25 PolarHBondContact O-N 3.42Å; N23-L25 VanDerWaalsContact C-N 3.25Å; N23-L25 PolarHBondContact O-N 3.02Å; L25-S28 PolarHBondContact O-N 3.04Å; L25-S28 PolarHBondContact O-OG 3.43Å; L25-S28 VanDerWaalsContact O-OG 3.11Å; L25-I29 HydrophobicContact CD2-CD1 3.4Å; L25-I29 VanDerWaalsContact CD2-CD1 3.4Å; L25-I29 HydrophobicContact CD2-CG1 4.11Å; L25-I29 WeakPolarHBondContact O-CB 3.42Å; L25-I29 VanDerWaalsContact O-CG1 3.32Å; L25-I29 WeakPolarHBondContact O-CG1 3.21Å; L25-I29 PolarHBondContact O-N 3.46Å
26	I	72.1	Confident	69.8	Low	85 Å²	85	96.9 Å²	96.9	44%	0.436	54%	0.535	S	S	.	.	H	α-helix	trans	-62.4	-45.5	172.1	-68.2	163.1	0	0	0	110.5	S22 N23 S28 I29 Q30	S22-I26 VanDerWaalsContact O-CG1 3.28Å; S22-I26 WeakPolarHBondContact O-CG1 3.06Å; S22-I26 PolarHBondContact O-N 3.19Å; N23-I26 PolarHBondContact O-N 3.43Å; I26-S28 VanDerWaalsContact C-N 3.31Å; I26-S28 PolarHBondContact O-N 3.33Å; I26-I29 PolarHBondContact O-N 3.44Å; I26-Q30 WeakPolarHBondContact O-CB 3.45Å; I26-Q30 WeakPolarHBondContact O-CG 3.13Å; I26-Q30 PolarHBondContact O-N 3.44Å
27	I	68.9	Low	68.2	Low	89 Å²	89	97 Å²	97	46%	0.456	55%	0.549	S	S	.	.	H	α-helix	trans	-64.1	-36.9	177.3	-66.2	164.2	0	0	0	111.2	N23 L24 G31 V32	N23-I27 VanDerWaalsContact O-CG1 3.28Å; N23-I27 WeakPolarHBondContact O-CG1 3.4Å; N23-I27 PolarHBondContact O-N 3.33Å; L24-I27 PolarHBondContact O-N 3.07Å; I27-G31 CarbonylContact O-C 3.33Å; I27-G31 VanDerWaalsContact O-CA 3.28Å; I27-G31 WeakPolarHBondContact O-CA 3.41Å; I27-G31 PolarHBondContact O-N 3.06Å; I27-V32 HydrophobicContact CG2-CG2 4.09Å
28	S	64.8	Low	66.6	Low	89 Å²	89	99.5 Å²	99.5	62%	0.622	56%	0.557	S	S	*	*	H	α-helix	trans	-72.2	-38.9	178.9	85.3	0	0	0	0	112.6	L24 L25 I26	L24-S28 WeakPolarHBondContact O-CB 3.48Å; L24-S28 PolarHBondContact O-N 3.34Å; L25-S28 PolarHBondContact O-N 3.04Å; L25-S28 PolarHBondContact O-OG 3.43Å; L25-S28 VanDerWaalsContact O-OG 3.11Å; I26-S28 VanDerWaalsContact C-N 3.31Å; I26-S28 PolarHBondContact O-N 3.33Å
29	I	60.6	Low	65.1	Low	128 Å²	128	99.6 Å²	99.6	66%	0.656	57%	0.565	S	S	*	*	H	α-helix	trans	-70.3	-46.1	177.7	-69.9	177.6	0	0	0	111.2	L25 I26 G31	L25-I29 HydrophobicContact CD2-CD1 3.4Å; L25-I29 VanDerWaalsContact CD2-CD1 3.4Å; L25-I29 HydrophobicContact CD2-CG1 4.11Å; L25-I29 WeakPolarHBondContact O-CB 3.42Å; L25-I29 VanDerWaalsContact O-CG1 3.32Å; L25-I29 WeakPolarHBondContact O-CG1 3.21Å; L25-I29 PolarHBondContact O-N 3.46Å; I26-I29 PolarHBondContact O-N 3.44Å; I29-G31 PolarHBondContact O-N 3.42Å
30	Q	58.8	Low	63.9	Low	137 Å²	137	98.1 Å²	98.1	64%	0.64	56%	0.557	S	S	*	*	H	α-helix	trans	-73.4	-16.5	-179.7	-68.8	-173.1	-26	0	0	111.9	I26 V33	I26-Q30 WeakPolarHBondContact O-CB 3.45Å; I26-Q30 WeakPolarHBondContact O-CG 3.13Å; I26-Q30 PolarHBondContact O-N 3.44Å; Q30-V33 VanDerWaalsContact O-CG2 3.3Å; Q30-V33 WeakPolarHBondContact O-CG2 3.12Å
31	G	50.7	Low	63.2	Low	36 Å²	36	97.5 Å²	97.5	37%	0.371	55%	0.554	S	S	.	*			trans	63.1	163.2	-160.4	0	0	0	0	0	110.2	I27 I29 V33	I27-G31 CarbonylContact O-C 3.33Å; I27-G31 VanDerWaalsContact O-CA 3.28Å; I27-G31 WeakPolarHBondContact O-CA 3.41Å; I27-G31 PolarHBondContact O-N 3.06Å; I29-G31 PolarHBondContact O-N 3.42Å; G31-V33 PolarHBondContact O-N 2.91Å
32	V	52.8	Low	62.4	Low	110 Å²	110	98 Å²	98	67%	0.667	55%	0.553	S	S	*	*			trans	-70.4	86.6	169.3	-177.1	0	0	0	0	107.5	I27 I34	I27-V32 HydrophobicContact CG2-CG2 4.09Å; V32-I34 HydrophobicContact CG1-CD1 4.45Å; V32-I34 HydrophobicContact CG1-CG1 3.77Å; V32-I34 PolarHBondContact O-N 3.03Å
33	V	49.3	Very low	61.6	Low	113 Å²	113	96.7 Å²	96.7	69%	0.685	54%	0.542	S	S	*	.			trans	-70.5	87.4	168.8	-175.7	0	0	0	0	106.4	Q30 G31 P35	Q30-V33 VanDerWaalsContact O-CG2 3.3Å; Q30-V33 WeakPolarHBondContact O-CG2 3.12Å; G31-V33 PolarHBondContact O-N 2.91Å; V33-P35 VanDerWaalsContact O-CD 3.29Å; V33-P35 WeakPolarHBondContact O-CD 3.32Å
34	I	53.8	Low	61.2	Low	87 Å²	87	94.6 Å²	94.6	45%	0.446	53%	0.533	S	S	.	.			trans	-67.4	117.6	164.4	-55.7	-168.1	0	0	0	105	V32 E36 R52	V32-I34 HydrophobicContact CG1-CD1 4.45Å; V32-I34 HydrophobicContact CG1-CG1 3.77Å; V32-I34 PolarHBondContact O-N 3.03Å; I34-E36 PolarHBondContact O-N 3.46Å; I34-R52 VanDerWaalsContact CD1-NH1 3.27Å
35	P	50	Low	61	Low	106 Å²	106	92.8 Å²	92.8	69%	0.688	52%	0.52	S	S	*	.			trans	-59.9	112.5	176.3	23.2	-29.8	0	0	0	107.4	V33 A37	V33-P35 VanDerWaalsContact O-CD 3.29Å; V33-P35 WeakPolarHBondContact O-CD 3.32Å; P35-A37 PolarHBondContact O-N 2.97Å
36	E	50.4	Low	60.8	Low	95 Å²	95	93.1 Å²	93.1	44%	0.444	52%	0.516	S	S	.	.			trans	-64.3	93.2	168.7	-75.7	-179.6	-166.2	0	0	106.2	I34 N38 K45	I34-E36 PolarHBondContact O-N 3.46Å; E36-N38 PolarHBondContact O-N 3.4Å; E36-K45 WeakPolarHBondContact OE1-CD 3.41Å; E36-K45 WeakPolarHBondContact OE1-CE 3.38Å; E36-K45 IonicContact OE1-NZ 2.75Å; E36-K45 PolarHBondContact OE1-NZ 3.06Å; E36-K45 IonicContact OE2-NZ 3.71Å
37	A	53.5	Low	60.8	Low	91 Å²	91	93.2 Å²	93.2	75%	0.752	51%	0.511	S	S	*	.	S	Bend	trans	-65.5	-7	-176.1	0	0	0	0	0	112.9	P35	P35-A37 PolarHBondContact O-N 2.97Å
38	N	52.6	Low	61	Low	121 Å²	121	91.9 Å²	91.9	65%	0.647	51%	0.508	S	S	*	.	S	Bend	trans	-146.3	147.3	174.7	-72.4	-44.1	0	0	0	109.6	E36 I40	E36-N38 PolarHBondContact O-N 3.4Å; N38-I40 PolarHBondContact O-N 3.35Å
39	P	56	Low	61.2	Low	132 Å²	132	91.2 Å²	91.2	86%	0.857	50%	0.497	S	S	*	.			trans	-62.4	103.4	171	25.7	-30.9	0	0	0	108.8
40	I	63.4	Low	61.8	Low	76 Å²	76	86.7 Å²	86.7	39%	0.39	47%	0.472	S	S	.	.			trans	-83.5	129.2	171.7	-79.1	177.4	0	0	0	106.1	N38 S44 K45	N38-I40 PolarHBondContact O-N 3.35Å; I40-S44 WeakPolarHBondContact CG2-OG 3.43Å; I40-K45 HydrophobicContact CG2-CB 3.83Å; I40-K45 VanDerWaalsContact CG2-N 3.26Å
41	D	70.5	Confident	62.3	Low	94 Å²	94	85.8 Å²	85.8	50%	0.503	47%	0.467	S	S	.	.			trans	-61.1	148.1	176.9	67.5	-70.7	0	0	0	110.4	Q43 S44 K45	D41-Q43 PolarHBondContact O-N 2.71Å; D41-S44 PolarHBondContact N-OG 2.83Å; D41-S44 PolarHBondContact O-N 3.21Å; D41-S44 PolarHBondContact O-OG 3.05Å; D41-S44 VanDerWaalsContact OD1-CB 3.31Å; D41-S44 WeakPolarHBondContact OD1-CB 3.37Å; D41-S44 PolarHBondContact OD1-OG 3.5Å; D41-S44 PolarHBondContact OD2-N 3.02Å; D41-K45 PolarHBondContact O-N 3.02Å
42	Y	67.5	Low	63.2	Low	149 Å²	149	88.8 Å²	88.8	58%	0.584	47%	0.467	S	S	*	.	H	α-helix	trans	-51.9	-34.4	-171.1	176.3	-96.7	0	0	0	113.6	K45 R46 I82	Y42-K45 PolarHBondContact O-N 2.89Å; Y42-R46 HydrophobicContact CE1-CG 4.32Å; Y42-R46 PolarHBondContact O-N 3.09Å; Y42-I82 HydrophobicContact CD1-CD1 4.44Å
43	Q	66.1	Low	64	Low	22 Å²	22	86.5 Å²	86.5	10%	0.103	46%	0.459	C	S	.	.	H	α-helix	trans	-68.8	-46.9	177.8	-73.4	-72.3	7.7	0	0	112.2	D41 K45 R46 W47 Y79 I82	D41-Q43 PolarHBondContact O-N 2.71Å; Q43-K45 VanDerWaalsContact C-N 3.27Å; Q43-K45 PolarHBondContact O-N 2.99Å; Q43-R46 PolarHBondContact O-N 3.08Å; Q43-W47 PolarHBondContact O-N 3.45Å; Q43-Y79 HydrophobicContact CB-CE1 3.97Å; Q43-Y79 HydrophobicContact CG-CD1 3.94Å; Q43-Y79 HydrophobicContact CG-CE1 3.82Å; Q43-Y79 PolarHBondContact NE2-O 3.36Å; Q43-I82 HydrophobicContact CG-CD1 4.33Å; Q43-I82 VanDerWaalsContact NE2-CD1 3.32Å
44	S	70.9	Confident	64.8	Low	35 Å²	35	82.6 Å²	82.6	25%	0.245	43%	0.434	C	S	.	.	H	α-helix	trans	-67.8	-28.6	177.3	57.7	0	0	0	0	112.2	I40 D41 W47 T48	I40-S44 WeakPolarHBondContact CG2-OG 3.43Å; D41-S44 PolarHBondContact N-OG 2.83Å; D41-S44 PolarHBondContact O-N 3.21Å; D41-S44 PolarHBondContact O-OG 3.05Å; D41-S44 VanDerWaalsContact OD1-CB 3.31Å; D41-S44 WeakPolarHBondContact OD1-CB 3.37Å; D41-S44 PolarHBondContact OD1-OG 3.5Å; D41-S44 PolarHBondContact OD2-N 3.02Å; S44-W47 PolarHBondContact O-N 3.15Å; S44-T48 WeakPolarHBondContact O-CB 3.49Å; S44-T48 PolarHBondContact O-N 2.89Å; S44-T48 PolarHBondContact O-OG1 3.33Å
45	K	74	Confident	65.3	Low	80 Å²	80	87.1 Å²	87.1	35%	0.348	45%	0.445	S	S	.	.	H	α-helix	trans	-63.8	-53.5	170.1	-177.5	172	-179.8	143.7	0	112	E36 I40 D41 Y42 Q43 W47 T48 D49	E36-K45 WeakPolarHBondContact OE1-CD 3.41Å; E36-K45 WeakPolarHBondContact OE1-CE 3.38Å; E36-K45 IonicContact OE1-NZ 2.75Å; E36-K45 PolarHBondContact OE1-NZ 3.06Å; E36-K45 IonicContact OE2-NZ 3.71Å; I40-K45 HydrophobicContact CG2-CB 3.83Å; I40-K45 VanDerWaalsContact CG2-N 3.26Å; D41-K45 PolarHBondContact O-N 3.02Å; Y42-K45 PolarHBondContact O-N 2.89Å; Q43-K45 VanDerWaalsContact C-N 3.27Å; Q43-K45 PolarHBondContact O-N 2.99Å; K45-W47 PolarHBondContact O-N 3.05Å; K45-T48 PolarHBondContact O-N 3.45Å; K45-T48 VanDerWaalsContact O-N 3.08Å; K45-D49 PolarHBondContact O-N 3.43Å
46	R	70.2	Confident	65.6	Low	80 Å²	80	92 Å²	92	30%	0.302	45%	0.451	S	S	.	.	H	α-helix	trans	-54.2	-40	175.5	-90.1	-175.8	97.8	179.9	5.2	111.7	Y42 Q43 D49 F50 P77	Y42-R46 HydrophobicContact CE1-CG 4.32Å; Y42-R46 PolarHBondContact O-N 3.09Å; Q43-R46 PolarHBondContact O-N 3.08Å; R46-D49 PolarHBondContact O-N 3.39Å; R46-F50 VanDerWaalsContact O-CB 3.25Å; R46-F50 WeakPolarHBondContact O-CB 3.46Å; R46-F50 PolarHBondContact O-N 3.23Å; R46-P77 HydrophobicContact CB-CG 4.2Å
47	W	72.9	Confident	66	Low	88 Å²	88	90 Å²	90	33%	0.333	45%	0.447	S	S	.	.	H	α-helix	trans	-69.4	-36.7	-179.6	-155.3	-142.1	0	0	0	113.4	Q43 S44 K45 F50 K51 R76 P77	Q43-W47 PolarHBondContact O-N 3.45Å; S44-W47 PolarHBondContact O-N 3.15Å; K45-W47 PolarHBondContact O-N 3.05Å; W47-F50 HydrophobicContact CE3-CB 4.1Å; W47-F50 AromaticContact CE3-CD1 3.72Å; W47-F50 HydrophobicContact CE3-CD1 3.72Å; W47-F50 HydrophobicContact CE3-CG 4.17Å; W47-F50 AromaticContact CH2-CD1 3.83Å; W47-F50 HydrophobicContact CH2-CD1 3.83Å; W47-F50 AromaticContact CH2-CE1 3.87Å; W47-F50 HydrophobicContact CH2-CE1 3.87Å; W47-F50 HydrophobicContact CZ3-CB 4.33Å; W47-F50 AromaticContact CZ3-CD1 3.14Å; W47-F50 HydrophobicContact CZ3-CD1 3.14Å; W47-F50 AromaticContact CZ3-CE1 3.54Å; W47-F50 HydrophobicContact CZ3-CE1 3.54Å; W47-F50 AromaticContact CZ3-CG 3.88Å; W47-F50 HydrophobicContact CZ3-CG 3.88Å; W47-K51 WeakPolarHBondContact O-CG 3.27Å; W47-K51 PolarHBondContact O-N 3.03Å; W47-K51 VanDerWaalsContact O-N 3.07Å; W47-R76 HydrophobicContact CE3-CB 4.47Å; W47-R76 HydrophobicContact CH2-CB 3.34Å; W47-R76 HydrophobicContact CH2-CG 4.26Å; W47-R76 HydrophobicContact CZ3-CB 3.27Å; W47-R76 HydrophobicContact CZ3-CG 4.44Å; W47-P77 HydrophobicContact CE3-CG 4Å; W47-P77 HydrophobicContact CZ3-CG 4.34Å
48	T	71.4	Confident	66	Low	61 Å²	61	92.2 Å²	92.2	37%	0.374	44%	0.442	S	S	.	.	H	α-helix	trans	-69.2	-43.5	175.5	-52	0	0	0	0	111.2	S44 K45 K51 R52	S44-T48 WeakPolarHBondContact O-CB 3.49Å; S44-T48 PolarHBondContact O-N 2.89Å; S44-T48 PolarHBondContact O-OG1 3.33Å; K45-T48 PolarHBondContact O-N 3.45Å; K45-T48 VanDerWaalsContact O-N 3.08Å; T48-K51 PolarHBondContact O-N 3.36Å; T48-R52 WeakPolarHBondContact O-CB 3.25Å; T48-R52 PolarHBondContact O-N 2.96Å
49	D	70.9	Confident	65.7	Low	74 Å²	74	96 Å²	96	40%	0.396	45%	0.448	S	S	.	.	H	α-helix	trans	-65.6	-41	177.1	-73	-20.4	0	0	0	111.7	K45 R46 R52 A53	K45-D49 PolarHBondContact O-N 3.43Å; R46-D49 PolarHBondContact O-N 3.39Å; D49-R52 WeakPolarHBondContact O-CB 3.5Å; D49-R52 PolarHBondContact O-N 3.38Å; D49-A53 PolarHBondContact O-N 2.96Å
50	F	72.5	Confident	65.4	Low	33 Å²	33	94.9 Å²	94.9	15%	0.145	44%	0.441	C	S	.	.	H	α-helix	trans	-57.5	-55.3	173.2	179.9	-106.5	0	0	0	111.4	R46 W47 R52 A53 I54 L72 Q75 R76 P77	R46-F50 VanDerWaalsContact O-CB 3.25Å; R46-F50 WeakPolarHBondContact O-CB 3.46Å; R46-F50 PolarHBondContact O-N 3.23Å; W47-F50 HydrophobicContact CE3-CB 4.1Å; W47-F50 AromaticContact CE3-CD1 3.72Å; W47-F50 HydrophobicContact CE3-CD1 3.72Å; W47-F50 HydrophobicContact CE3-CG 4.17Å; W47-F50 AromaticContact CH2-CD1 3.83Å; W47-F50 HydrophobicContact CH2-CD1 3.83Å; W47-F50 AromaticContact CH2-CE1 3.87Å; W47-F50 HydrophobicContact CH2-CE1 3.87Å; W47-F50 HydrophobicContact CZ3-CB 4.33Å; W47-F50 AromaticContact CZ3-CD1 3.14Å; W47-F50 HydrophobicContact CZ3-CD1 3.14Å; W47-F50 AromaticContact CZ3-CE1 3.54Å; W47-F50 HydrophobicContact CZ3-CE1 3.54Å; W47-F50 AromaticContact CZ3-CG 3.88Å; W47-F50 HydrophobicContact CZ3-CG 3.88Å; F50-R52 PolarHBondContact O-N 3.43Å; F50-R52 VanDerWaalsContact O-N 3.16Å; F50-A53 PolarHBondContact O-N 2.99Å; F50-A53 VanDerWaalsContact O-N 3.13Å; F50-I54 HydrophobicContact CD1-CD1 3.66Å; F50-I54 HydrophobicContact CD1-CG1 4.41Å; F50-I54 HydrophobicContact CE1-CD1 3.1Å; F50-I54 HydrophobicContact CE1-CG1 4.14Å; F50-I54 HydrophobicContact CE2-CD1 4.03Å; F50-I54 HydrophobicContact CE2-CG1 4.32Å; F50-I54 HydrophobicContact CG-CD1 4.34Å; F50-I54 HydrophobicContact CZ-CD1 3.31Å; F50-I54 HydrophobicContact CZ-CG1 4.07Å; F50-I54 WeakPolarHBondContact O-CG1 3.44Å; F50-I54 PolarHBondContact O-N 3.03Å; F50-L72 WeakPolarHBondContact CZ-O 3.21Å; F50-Q75 HydrophobicContact CE2-CB 4.17Å; F50-Q75 WeakPolarHBondContact CE2-O 3.38Å; F50-Q75 HydrophobicContact CZ-CB 4.42Å; F50-R76 HydrophobicContact CE1-CB 4.16Å; F50-R76 HydrophobicContact CZ-CB 4.34Å; F50-P77 HydrophobicContact CB-CG 4.42Å
51	K	69.8	Low	65	Low	119 Å²	119	97.7 Å²	97.7	52%	0.517	45%	0.451	S	S	.	.	H	α-helix	trans	-56.6	-34.9	177	-75.6	-175.3	-179.4	-177.5	0	112.4	W47 T48 R55	W47-K51 WeakPolarHBondContact O-CG 3.27Å; W47-K51 PolarHBondContact O-N 3.03Å; W47-K51 VanDerWaalsContact O-N 3.07Å; T48-K51 PolarHBondContact O-N 3.36Å; K51-R55 PolarHBondContact O-N 3.41Å
52	R	68.8	Low	64.5	Low	99 Å²	99	99.9 Å²	99.9	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-68.1	-50.9	177.6	-159	177.5	-73.2	177	1.2	110	I34 T48 D49 F50 I54 R55 W56	I34-R52 VanDerWaalsContact CD1-NH1 3.27Å; T48-R52 WeakPolarHBondContact O-CB 3.25Å; T48-R52 PolarHBondContact O-N 2.96Å; D49-R52 WeakPolarHBondContact O-CB 3.5Å; D49-R52 PolarHBondContact O-N 3.38Å; F50-R52 PolarHBondContact O-N 3.43Å; F50-R52 VanDerWaalsContact O-N 3.16Å; R52-I54 VanDerWaalsContact C-N 3.28Å; R52-I54 PolarHBondContact O-N 3.47Å; R52-R55 WeakPolarHBondContact O-CB 3.5Å; R52-R55 PolarHBondContact O-N 3.49Å; R52-R55 VanDerWaalsContact O-N 3.08Å; R52-W56 PolarHBondContact O-N 3.34Å
53	A	68.7	Low	64.1	Low	62 Å²	62	98.4 Å²	98.4	51%	0.512	47%	0.465	S	S	.	.	H	α-helix	trans	-56.3	-40.6	177.3	0	0	0	0	0	112.8	D49 F50 R55 W56 S57	D49-A53 PolarHBondContact O-N 2.96Å; F50-A53 PolarHBondContact O-N 2.99Å; F50-A53 VanDerWaalsContact O-N 3.13Å; A53-R55 PolarHBondContact O-N 3.41Å; A53-W56 PolarHBondContact O-N 3.26Å; A53-S57 PolarHBondContact O-N 3Å
54	I	66.7	Low	64	Low	30 Å²	30	101 Å²	101	15%	0.154	48%	0.482	C	S	.	.	H	α-helix	trans	-59.6	-47.5	175.1	-63.9	-176.7	0	0	0	111.5	F50 R52 W56 S57 E58 L72	F50-I54 HydrophobicContact CD1-CD1 3.66Å; F50-I54 HydrophobicContact CD1-CG1 4.41Å; F50-I54 HydrophobicContact CE1-CD1 3.1Å; F50-I54 HydrophobicContact CE1-CG1 4.14Å; F50-I54 HydrophobicContact CE2-CD1 4.03Å; F50-I54 HydrophobicContact CE2-CG1 4.32Å; F50-I54 HydrophobicContact CG-CD1 4.34Å; F50-I54 HydrophobicContact CZ-CD1 3.31Å; F50-I54 HydrophobicContact CZ-CG1 4.07Å; F50-I54 WeakPolarHBondContact O-CG1 3.44Å; F50-I54 PolarHBondContact O-N 3.03Å; R52-I54 VanDerWaalsContact C-N 3.28Å; R52-I54 PolarHBondContact O-N 3.47Å; I54-W56 PolarHBondContact O-N 2.92Å; I54-S57 WeakPolarHBondContact CA-OG 3.41Å; I54-S57 WeakPolarHBondContact O-CA 3.28Å; I54-S57 WeakPolarHBondContact O-CB 3.46Å; I54-S57 PolarHBondContact O-N 3.28Å; I54-S57 PolarHBondContact O-OG 3.28Å; I54-E58 PolarHBondContact O-N 3.03Å; I54-L72 HydrophobicContact CB-CD2 4.15Å; I54-L72 HydrophobicContact CD1-CB 3.91Å; I54-L72 HydrophobicContact CD1-CD1 4.37Å; I54-L72 HydrophobicContact CD1-CD2 3.53Å; I54-L72 HydrophobicContact CD1-CG 4.13Å; I54-L72 HydrophobicContact CG1-CD2 3.51Å; I54-L72 HydrophobicContact CG2-CD1 3.64Å; I54-L72 HydrophobicContact CG2-CD2 3.75Å; I54-L72 HydrophobicContact CG2-CG 4.31Å
55	R	65.4	Low	63.7	Low	182 Å²	182	103.3 Å²	103.3	69%	0.687	50%	0.496	S	S	*	.	H	α-helix	trans	-60.3	-31	-177.3	-159.2	-175.9	-64.2	-173.8	-1.9	111.8	K51 R52 A53	K51-R55 PolarHBondContact O-N 3.41Å; R52-R55 WeakPolarHBondContact O-CB 3.5Å; R52-R55 PolarHBondContact O-N 3.49Å; R52-R55 VanDerWaalsContact O-N 3.08Å; A53-R55 PolarHBondContact O-N 3.41Å
56	W	54.9	Low	63.1	Low	210 Å²	210	105.6 Å²	105.6	80%	0.795	51%	0.508	S	S	*	.	H	α-helix	trans	-80.6	-25.8	173.4	-71.1	94	0	0	0	113.3	R52 A53 I54 E58	R52-W56 PolarHBondContact O-N 3.34Å; A53-W56 PolarHBondContact O-N 3.26Å; I54-W56 PolarHBondContact O-N 2.92Å; W56-E58 PolarHBondContact O-N 3.48Å
57	S	58.8	Low	62.9	Low	53 Å²	53	105.2 Å²	105.2	37%	0.371	51%	0.511	S	S	.	.	H	α-helix	trans	-73.7	-3.9	173.9	77.5	0	0	0	0	114.3	A53 I54 Y59	A53-S57 PolarHBondContact O-N 3Å; I54-S57 WeakPolarHBondContact CA-OG 3.41Å; I54-S57 WeakPolarHBondContact O-CA 3.28Å; I54-S57 WeakPolarHBondContact O-CB 3.46Å; I54-S57 PolarHBondContact O-N 3.28Å; I54-S57 PolarHBondContact O-OG 3.28Å; S57-Y59 PolarHBondContact O-N 3.48Å; S57-Y59 VanDerWaalsContact O-N 3.08Å
58	E	54.4	Low	62.4	Low	137 Å²	137	104.3 Å²	104.3	64%	0.64	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-1.2	175.1	-68.1	-177.1	-179.3	0	0	113.9	I54 W56	I54-E58 PolarHBondContact O-N 3.03Å; W56-E58 PolarHBondContact O-N 3.48Å
59	Y	45.5	Very low	62.1	Low	199 Å²	199	108.3 Å²	108.3	78%	0.78	52%	0.518	S	S	*	.	S	Bend	trans	-57.3	145.3	162.6	-119.3	-105.7	0	0	0	110.9	S57 F61	S57-Y59 PolarHBondContact O-N 3.48Å; S57-Y59 VanDerWaalsContact O-N 3.08Å; Y59-F61 WeakPolarHBondContact O-CD2 3.28Å; Y59-F61 PolarHBondContact O-N 3.46Å
60	P	50.9	Low	61.9	Low	110 Å²	110	111.1 Å²	111.1	71%	0.714	53%	0.528	S	S	*	.			trans	-76.3	82.1	-136.1	33.2	-35.9	0	0	0	112.8
61	F	53.7	Low	61.5	Low	134 Å²	134	116.3 Å²	116.3	59%	0.588	55%	0.548	S	S	*	.			trans	-71.4	127.3	161	-80.5	-82	0	0	0	109.2	Y59 F63 K68	Y59-F61 WeakPolarHBondContact O-CD2 3.28Å; Y59-F61 PolarHBondContact O-N 3.46Å; F61-F63 HydrophobicContact CB-CD2 4.29Å; F61-F63 HydrophobicContact CD1-CD2 4.41Å; F61-F63 HydrophobicContact CD1-CE2 4.37Å; F61-F63 PolarHBondContact O-N 3.25Å; F61-F63 VanDerWaalsContact O-N 3.1Å; F61-K68 WeakPolarHBondContact O-CE 3.01Å; F61-K68 PolarHBondContact O-NZ 2.5Å
62	T	61.3	Low	61.3	Low	141 Å²	141	112.8 Å²	112.8	87%	0.865	54%	0.535	S	S	*	.			trans	-71.5	8.2	-175.7	43.4	0	0	0	0	114.9
63	F	58.4	Low	61.1	Low	118 Å²	118	114.7 Å²	114.7	52%	0.518	54%	0.543	S	S	.	.	S	Bend	trans	-84.1	146.8	-178.8	-63.8	-74.1	0	0	0	112.7	F61 I67 K68	F61-F63 HydrophobicContact CB-CD2 4.29Å; F61-F63 HydrophobicContact CD1-CD2 4.41Å; F61-F63 HydrophobicContact CD1-CE2 4.37Å; F61-F63 PolarHBondContact O-N 3.25Å; F61-F63 VanDerWaalsContact O-N 3.1Å; F63-I67 HydrophobicContact CB-CB 4.38Å; F63-I67 HydrophobicContact CB-CG2 4.27Å; F63-I67 HydrophobicContact CD1-CG2 4.3Å; F63-I67 HydrophobicContact CG-CG2 4.43Å; F63-K68 HydrophobicContact CB-CG 4.35Å; F63-K68 WeakPolarHBondContact O-CE 3.46Å
64	T	64.1	Low	61	Low	76 Å²	76	117.6 Å²	117.6	47%	0.466	55%	0.546	S	S	.	.			trans	-59.4	151.4	174.7	45.7	0	0	0	0	111.7	E66 I67 K68	T64-E66 VanDerWaalsContact C-N 3.26Å; T64-E66 PolarHBondContact O-N 3.27Å; T64-I67 PolarHBondContact O-N 3.25Å; T64-I67 VanDerWaalsContact O-N 3.12Å; T64-I67 VanDerWaalsContact OG1-CD1 3.31Å; T64-I67 WeakPolarHBondContact OG1-CD1 3.45Å; T64-I67 WeakPolarHBondContact OG1-CG1 3.37Å; T64-K68 PolarHBondContact O-N 3.46Å
65	P	64.3	Low	60.9	Low	83 Å²	83	122.8 Å²	122.8	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-57.8	-31.1	-175.4	-24.4	33.3	0	0	0	114.8	R69	P65-R69 PolarHBondContact O-N 2.89Å
66	E	62.9	Low	61	Low	129 Å²	129	118.9 Å²	118.9	60%	0.603	56%	0.555	S	S	*	*	H	α-helix	trans	-66.2	-45.6	175	-78.4	84.6	-151	0	0	112.6	T64 K68 R69 H70	T64-E66 VanDerWaalsContact C-N 3.26Å; T64-E66 PolarHBondContact O-N 3.27Å; E66-K68 VanDerWaalsContact C-N 3.32Å; E66-K68 PolarHBondContact O-N 3.11Å; E66-R69 PolarHBondContact O-N 2.95Å; E66-R69 VanDerWaalsContact O-N 3.16Å; E66-H70 PolarHBondContact O-N 3.04Å
67	I	64.3	Low	61.3	Low	71 Å²	71	110 Å²	110	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-64.6	-41.4	-178.2	-63.8	175.4	0	0	0	109.8	F63 T64 R69 H70 Y71	F63-I67 HydrophobicContact CB-CB 4.38Å; F63-I67 HydrophobicContact CB-CG2 4.27Å; F63-I67 HydrophobicContact CD1-CG2 4.3Å; F63-I67 HydrophobicContact CG-CG2 4.43Å; T64-I67 PolarHBondContact O-N 3.25Å; T64-I67 VanDerWaalsContact O-N 3.12Å; T64-I67 VanDerWaalsContact OG1-CD1 3.31Å; T64-I67 WeakPolarHBondContact OG1-CD1 3.45Å; T64-I67 WeakPolarHBondContact OG1-CG1 3.37Å; I67-R69 VanDerWaalsContact C-N 3.33Å; I67-R69 PolarHBondContact O-N 3.31Å; I67-H70 PolarHBondContact O-N 3.5Å; I67-Y71 HydrophobicContact CG2-CD2 3.67Å; I67-Y71 HydrophobicContact CG2-CE2 3.53Å; I67-Y71 WeakPolarHBondContact O-CD2 3.35Å; I67-Y71 PolarHBondContact O-N 3.31Å; I67-Y71 VanDerWaalsContact O-N 3.15Å
68	K	62.7	Low	61.4	Low	70 Å²	70	113.2 Å²	113.2	30%	0.304	53%	0.529	S	S	.	.	H	α-helix	trans	-55.6	-48.7	173	-76	-174.2	-178.3	-180	0	111.3	F61 F63 T64 E66 H70 Y71 L72	F61-K68 WeakPolarHBondContact O-CE 3.01Å; F61-K68 PolarHBondContact O-NZ 2.5Å; F63-K68 HydrophobicContact CB-CG 4.35Å; F63-K68 WeakPolarHBondContact O-CE 3.46Å; T64-K68 PolarHBondContact O-N 3.46Å; E66-K68 VanDerWaalsContact C-N 3.32Å; E66-K68 PolarHBondContact O-N 3.11Å; K68-H70 VanDerWaalsContact C-N 3.33Å; K68-H70 PolarHBondContact O-N 2.94Å; K68-Y71 PolarHBondContact O-N 2.75Å; K68-L72 WeakPolarHBondContact O-CB 3.29Å; K68-L72 VanDerWaalsContact O-CD1 3.23Å; K68-L72 WeakPolarHBondContact O-CD1 3.3Å; K68-L72 WeakPolarHBondContact O-CG 3.44Å; K68-L72 PolarHBondContact O-N 2.78Å; K68-L72 VanDerWaalsContact O-N 3.13Å
69	R	65.2	Low	61.5	Low	144 Å²	144	115 Å²	115	54%	0.543	53%	0.531	S	S	.	.	H	α-helix	trans	-59.7	-43.2	179.2	-81.3	-173.1	-95.7	-172.1	-4	111.8	P65 E66 I67 L72 Y73	P65-R69 PolarHBondContact O-N 2.89Å; E66-R69 PolarHBondContact O-N 2.95Å; E66-R69 VanDerWaalsContact O-N 3.16Å; I67-R69 VanDerWaalsContact C-N 3.33Å; I67-R69 PolarHBondContact O-N 3.31Å; R69-L72 PolarHBondContact O-N 2.98Å; R69-Y73 HydrophobicContact CB-CD2 4.34Å; R69-Y73 HydrophobicContact CB-CE2 4.38Å; R69-Y73 WeakPolarHBondContact O-CD2 3.47Å; R69-Y73 PolarHBondContact O-N 2.99Å
70	H	66.3	Low	61.9	Low	133 Å²	133	112.6 Å²	112.6	62%	0.616	53%	0.532	S	S	*	.	H	α-helix	trans	-60.8	-52.1	179.8	-111.8	31.8	0	0	0	113.1	E66 I67 K68 L72 Y73 E74	E66-H70 PolarHBondContact O-N 3.04Å; I67-H70 PolarHBondContact O-N 3.5Å; K68-H70 VanDerWaalsContact C-N 3.33Å; K68-H70 PolarHBondContact O-N 2.94Å; H70-L72 VanDerWaalsContact C-N 3.26Å; H70-L72 PolarHBondContact O-N 2.92Å; H70-Y73 PolarHBondContact O-N 3.08Å; H70-Y73 VanDerWaalsContact O-N 3.1Å; H70-E74 PolarHBondContact O-N 3.36Å
71	Y	64.1	Low	62.2	Low	143 Å²	143	111.2 Å²	111.2	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-60.3	-37	178.7	-80.4	-71.8	0	0	0	112.8	I67 K68 E74 Q75	I67-Y71 HydrophobicContact CG2-CD2 3.67Å; I67-Y71 HydrophobicContact CG2-CE2 3.53Å; I67-Y71 WeakPolarHBondContact O-CD2 3.35Å; I67-Y71 PolarHBondContact O-N 3.31Å; I67-Y71 VanDerWaalsContact O-N 3.15Å; K68-Y71 PolarHBondContact O-N 2.75Å; Y71-E74 PolarHBondContact O-N 2.93Å; Y71-Q75 WeakPolarHBondContact O-CG 3.31Å; Y71-Q75 PolarHBondContact O-N 2.9Å; Y71-Q75 VanDerWaalsContact O-N 3.16Å
72	L	65.1	Low	62	Low	45 Å²	45	108.9 Å²	108.9	24%	0.236	51%	0.511	C	S	.	.	H	α-helix	trans	-69.7	-37.7	177.1	-63.9	167.6	0	0	0	111.6	F50 I54 K68 R69 H70 E74 R76	F50-L72 WeakPolarHBondContact CZ-O 3.21Å; I54-L72 HydrophobicContact CB-CD2 4.15Å; I54-L72 HydrophobicContact CD1-CB 3.91Å; I54-L72 HydrophobicContact CD1-CD1 4.37Å; I54-L72 HydrophobicContact CD1-CD2 3.53Å; I54-L72 HydrophobicContact CD1-CG 4.13Å; I54-L72 HydrophobicContact CG1-CD2 3.51Å; I54-L72 HydrophobicContact CG2-CD1 3.64Å; I54-L72 HydrophobicContact CG2-CD2 3.75Å; I54-L72 HydrophobicContact CG2-CG 4.31Å; K68-L72 WeakPolarHBondContact O-CB 3.29Å; K68-L72 VanDerWaalsContact O-CD1 3.23Å; K68-L72 WeakPolarHBondContact O-CD1 3.3Å; K68-L72 WeakPolarHBondContact O-CG 3.44Å; K68-L72 PolarHBondContact O-N 2.78Å; K68-L72 VanDerWaalsContact O-N 3.13Å; R69-L72 PolarHBondContact O-N 2.98Å; H70-L72 VanDerWaalsContact C-N 3.26Å; H70-L72 PolarHBondContact O-N 2.92Å; L72-E74 VanDerWaalsContact C-N 3.31Å; L72-E74 PolarHBondContact O-N 2.98Å; L72-R76 PolarHBondContact O-N 3.42Å
73	Y	65.4	Low	61.4	Low	138 Å²	138	110.2 Å²	110.2	54%	0.541	51%	0.512	S	S	.	.	H	α-helix	trans	-72.6	-24.3	175.7	-81.3	-68	0	0	0	113.2	R69 H70 R76	R69-Y73 HydrophobicContact CB-CD2 4.34Å; R69-Y73 HydrophobicContact CB-CE2 4.38Å; R69-Y73 WeakPolarHBondContact O-CD2 3.47Å; R69-Y73 PolarHBondContact O-N 2.99Å; H70-Y73 PolarHBondContact O-N 3.08Å; H70-Y73 VanDerWaalsContact O-N 3.1Å; Y73-R76 WeakPolarHBondContact O-CD 3.28Å; Y73-R76 WeakPolarHBondContact O-CG 3.38Å; Y73-R76 PolarHBondContact O-NE 2.88Å
74	E	66.6	Low	60.7	Low	124 Å²	124	114.3 Å²	114.3	58%	0.579	55%	0.546	S	S	*	.	H	α-helix	trans	-75.4	-36.3	174.2	-73.6	-177.7	174	0	0	112.7	H70 Y71 L72 R76	H70-E74 PolarHBondContact O-N 3.36Å; Y71-E74 PolarHBondContact O-N 2.93Å; L72-E74 VanDerWaalsContact C-N 3.31Å; L72-E74 PolarHBondContact O-N 2.98Å; E74-R76 VanDerWaalsContact C-N 3.26Å; E74-R76 PolarHBondContact O-N 3.3Å
75	Q	65.8	Low	60.5	Low	139 Å²	139	116.3 Å²	116.3	65%	0.65	55%	0.55	S	S	*	*	S	Bend	trans	-83.6	3.5	-179.4	-68.3	-174	3.3	0	0	114.3	F50 Y71	F50-Q75 HydrophobicContact CE2-CB 4.17Å; F50-Q75 WeakPolarHBondContact CE2-O 3.38Å; F50-Q75 HydrophobicContact CZ-CB 4.42Å; Y71-Q75 WeakPolarHBondContact O-CG 3.31Å; Y71-Q75 PolarHBondContact O-N 2.9Å; Y71-Q75 VanDerWaalsContact O-N 3.16Å
76	R	66.2	Low	60.3	Low	100 Å²	100	118 Å²	118	38%	0.377	55%	0.551	S	S	.	*	S	Bend	trans	-62.3	133.5	178	68.4	-171.8	-179.6	169.4	-1.8	110.7	W47 F50 L72 Y73 E74 Y78	W47-R76 HydrophobicContact CE3-CB 4.47Å; W47-R76 HydrophobicContact CH2-CB 3.34Å; W47-R76 HydrophobicContact CH2-CG 4.26Å; W47-R76 HydrophobicContact CZ3-CB 3.27Å; W47-R76 HydrophobicContact CZ3-CG 4.44Å; F50-R76 HydrophobicContact CE1-CB 4.16Å; F50-R76 HydrophobicContact CZ-CB 4.34Å; L72-R76 PolarHBondContact O-N 3.42Å; Y73-R76 WeakPolarHBondContact O-CD 3.28Å; Y73-R76 WeakPolarHBondContact O-CG 3.38Å; Y73-R76 PolarHBondContact O-NE 2.88Å; E74-R76 VanDerWaalsContact C-N 3.26Å; E74-R76 PolarHBondContact O-N 3.3Å; R76-Y78 HydrophobicContact CG-CE2 4.48Å; R76-Y78 WeakPolarHBondContact O-CD2 3.32Å; R76-Y78 PolarHBondContact O-N 3.49Å
77	P	61.1	Low	60.1	Low	23 Å²	23	117.4 Å²	117.4	15%	0.149	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-58.9	127.8	168.4	20.7	-30.9	0	0	0	110.1	R46 W47 F50	R46-P77 HydrophobicContact CB-CG 4.2Å; W47-P77 HydrophobicContact CE3-CG 4Å; W47-P77 HydrophobicContact CZ3-CG 4.34Å; F50-P77 HydrophobicContact CB-CG 4.42Å
78	Y	62.1	Low	59.9	Low	121 Å²	121	120.1 Å²	120.1	48%	0.475	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-83.9	149	176.1	-75.2	-89.7	0	0	0	110.3	R76 N80 D81	R76-Y78 HydrophobicContact CG-CE2 4.48Å; R76-Y78 WeakPolarHBondContact O-CD2 3.32Å; R76-Y78 PolarHBondContact O-N 3.49Å; Y78-N80 PolarHBondContact O-N 2.95Å; Y78-D81 PolarHBondContact N-OD2 3.25Å; Y78-D81 WeakPolarHBondContact O-CB 3.49Å; Y78-D81 PolarHBondContact O-N 3.05Å
79	Y	54.7	Low	59.7	Low	174 Å²	174	123.3 Å²	123.3	68%	0.682	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-25.1	177	-103.6	-84.9	0	0	0	113.1	Q43	Q43-Y79 HydrophobicContact CB-CE1 3.97Å; Q43-Y79 HydrophobicContact CG-CD1 3.94Å; Q43-Y79 HydrophobicContact CG-CE1 3.82Å; Q43-Y79 PolarHBondContact NE2-O 3.36Å
80	N	55.2	Low	59.3	Low	148 Å²	148	121.9 Å²	121.9	79%	0.791	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	4.1	-177.4	-67.6	-1.2	0	0	0	114.1	Y78 I82	Y78-N80 PolarHBondContact O-N 2.95Å; N80-I82 PolarHBondContact O-N 3.04Å; N80-I82 VanDerWaalsContact O-N 3.09Å
81	D	56.3	Low	58.9	Low	81 Å²	81	121.1 Å²	121.1	43%	0.433	57%	0.574	S	S	.	*			trans	-72.7	2.1	177.1	-66.7	-18.4	0	0	0	112.8	Y78 L83	Y78-D81 PolarHBondContact N-OD2 3.25Å; Y78-D81 WeakPolarHBondContact O-CB 3.49Å; Y78-D81 PolarHBondContact O-N 3.05Å; D81-L83 PolarHBondContact O-N 2.85Å; D81-L83 VanDerWaalsContact O-N 3.15Å
82	I	51	Low	58.4	Low	86 Å²	86	119.4 Å²	119.4	44%	0.441	58%	0.575	S	S	.	*			trans	-76.3	98.7	167.5	-56.4	175.1	0	0	0	106.3	Y42 Q43 N80 V84	Y42-I82 HydrophobicContact CD1-CD1 4.44Å; Q43-I82 HydrophobicContact CG-CD1 4.33Å; Q43-I82 VanDerWaalsContact NE2-CD1 3.32Å; N80-I82 PolarHBondContact O-N 3.04Å; N80-I82 VanDerWaalsContact O-N 3.09Å; I82-V84 PolarHBondContact O-N 2.9Å; I82-V84 VanDerWaalsContact O-N 3.08Å
83	L	47.1	Very low	57.9	Low	168 Å²	168	125.6 Å²	125.6	88%	0.88	60%	0.603	S	S	*	*			trans	-56.9	111.6	157.2	-69.3	169.3	0	0	0	106.8	D81	D81-L83 PolarHBondContact O-N 2.85Å; D81-L83 VanDerWaalsContact O-N 3.15Å
84	V	43.3	Very low	57.2	Low	205 Å²	205	124.5 Å²	124.5	100%	1.242	61%	0.609	S	S	*	*			trans	-59.7	0	158	176.8	0	0	0	0	108.4	I82	I82-V84 PolarHBondContact O-N 2.9Å; I82-V84 VanDerWaalsContact O-N 3.08Å

Retrieved 84 of 84 residues in 58.6 ms (Link to these results)

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