A0A087Y1T7_POEFO Loading...

RNA polymerase II subunit J

AlphaFold DB , UniProt , Accession A0A087Y1T7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 118 aa.

						>A0A087Y1T7_POEFO|A0A087Y1T7
KMNAPPAFESFLLFEGEKKISISKDTKVPNACLFTLNKEDHTLGNIIRAQLLKDPQVLFAGYKVPHPLEHKIVIRVQTTPDYSPQEAFTNAITDLISELSLLEERFRVAIKDKQEGIE
					

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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	K	63.7	Low	89.9	Confident	259 Å²	259	112.1 Å²	112.1	100%	1.126	61%	0.607	S	S	*	*				0	134.7	0	-77.9	-177.5	175.1	-179.7	0	107.7
2	M	84.3	Confident	90.5	Very high	172 Å²	172	109.8 Å²	109.8	85%	0.847	59%	0.593	S	S	*	*			trans	-90	127.8	-179.4	-177.2	-178.9	-80.6	0	0	108.7	A4	M2-A4 HydrophobicContact CG-CB 3.95Å; M2-A4 HydrophobicContact SD-CB 4.31Å
3	N	92.5	Very high	90.9	Very high	158 Å²	158	106 Å²	106	85%	0.845	57%	0.572	S	S	*	*			trans	-105.1	15.7	-179.4	-65.2	-12.9	0	0	0	112.2
4	A	92.8	Very high	91.2	Very high	68 Å²	68	104 Å²	104	56%	0.562	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-77.8	133.9	179.1	0	0	0	0	0	109.6	M2	M2-A4 HydrophobicContact CG-CB 3.95Å; M2-A4 HydrophobicContact SD-CB 4.31Å
5	P	93.2	Very high	91.4	Very high	91 Å²	91	110.7 Å²	110.7	59%	0.591	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-65.3	154.7	171.8	28.1	-33.2	0	0	0	110.6	E9	P5-E9 VanDerWaalsContact CB-OE2 3.26Å; P5-E9 WeakPolarHBondContact CB-OE2 3.15Å
6	P	94.3	Very high	91.5	Very high	62 Å²	62	108.6 Å²	108.6	40%	0.403	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-68.4	146.5	174.6	29.8	-34.6	0	0	0	111.5	F8 E9	P6-F8 VanDerWaalsContact C-N 3.28Å; P6-F8 HydrophobicContact CB-CD1 3.85Å; P6-F8 HydrophobicContact CB-CE1 3.42Å; P6-F8 VanDerWaalsContact CB-CE1 3.42Å; P6-F8 HydrophobicContact CB-CE2 4.45Å; P6-F8 HydrophobicContact CB-CZ 3.76Å; P6-F8 HydrophobicContact CG-CD1 4.37Å; P6-F8 HydrophobicContact CG-CE1 3.75Å; P6-F8 HydrophobicContact CG-CE2 3.94Å; P6-F8 HydrophobicContact CG-CZ 3.48Å; P6-F8 VanDerWaalsContact CG-CZ 3.48Å; P6-F8 PolarHBondContact O-N 3.36Å; P6-E9 HydrophobicContact CG-CB 4.33Å; P6-E9 VanDerWaalsContact O-CB 3.26Å; P6-E9 WeakPolarHBondContact O-CB 3.15Å; P6-E9 PolarHBondContact O-N 3.24Å; P6-E9 VanDerWaalsContact O-N 3.11Å
7	A	94.1	Very high	91.7	Very high	85 Å²	85	106.6 Å²	106.6	70%	0.702	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-59.8	-32.9	-174.1	0	0	0	0	0	114.5	E9 S10	A7-E9 PolarHBondContact O-N 3.49Å; A7-S10 WeakPolarHBondContact O-CB 3.32Å; A7-S10 PolarHBondContact O-N 3.02Å; A7-S10 PolarHBondContact O-OG 2.91Å
8	F	94.7	Very high	92	Very high	101 Å²	101	109.2 Å²	109.2	44%	0.443	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-66.7	-20.6	-179.2	64	-105.6	0	0	0	113.4	P6 S10 F11 L12 F14	P6-F8 VanDerWaalsContact C-N 3.28Å; P6-F8 HydrophobicContact CB-CD1 3.85Å; P6-F8 HydrophobicContact CB-CE1 3.42Å; P6-F8 VanDerWaalsContact CB-CE1 3.42Å; P6-F8 HydrophobicContact CB-CE2 4.45Å; P6-F8 HydrophobicContact CB-CZ 3.76Å; P6-F8 HydrophobicContact CG-CD1 4.37Å; P6-F8 HydrophobicContact CG-CE1 3.75Å; P6-F8 HydrophobicContact CG-CE2 3.94Å; P6-F8 HydrophobicContact CG-CZ 3.48Å; P6-F8 VanDerWaalsContact CG-CZ 3.48Å; P6-F8 PolarHBondContact O-N 3.36Å; F8-S10 PolarHBondContact O-N 3.45Å; F8-S10 VanDerWaalsContact O-N 3.08Å; F8-F11 HydrophobicContact CB-CE1 4.31Å; F8-F11 HydrophobicContact CB-CE2 4.37Å; F8-F11 HydrophobicContact CB-CZ 3.86Å; F8-F11 PolarHBondContact O-N 2.88Å; F8-L12 HydrophobicContact CD2-CB 4.34Å; F8-L12 HydrophobicContact CD2-CD2 3.87Å; F8-L12 HydrophobicContact CE2-CD2 4.37Å; F8-L12 WeakPolarHBondContact O-CB 3.43Å; F8-L12 PolarHBondContact O-N 2.97Å; F8-F14 HydrophobicContact CE2-CE1 4.29Å
9	E	93.4	Very high	92.2	Very high	63 Å²	63	107.5 Å²	107.5	29%	0.294	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-60.9	-19.9	178	-179.3	167.5	176.2	0	0	112.1	P5 P6 A7 F14 K38	P5-E9 VanDerWaalsContact CB-OE2 3.26Å; P5-E9 WeakPolarHBondContact CB-OE2 3.15Å; P6-E9 HydrophobicContact CG-CB 4.33Å; P6-E9 VanDerWaalsContact O-CB 3.26Å; P6-E9 WeakPolarHBondContact O-CB 3.15Å; P6-E9 PolarHBondContact O-N 3.24Å; P6-E9 VanDerWaalsContact O-N 3.11Å; A7-E9 PolarHBondContact O-N 3.49Å; E9-F14 HydrophobicContact CB-CZ 4.1Å; E9-F14 HydrophobicContact CG-CE2 3.76Å; E9-F14 HydrophobicContact CG-CZ 3.61Å; E9-K38 VanDerWaalsContact O-CD 3.27Å; E9-K38 WeakPolarHBondContact O-CD 3.49Å; E9-K38 PolarHBondContact O-NZ 3.45Å
10	S	92.1	Very high	92.5	Very high	39 Å²	39	105.8 Å²	105.8	27%	0.273	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-68.1	-31	178.9	61.7	0	0	0	0	115	A7 F8 H70	A7-S10 WeakPolarHBondContact O-CB 3.32Å; A7-S10 PolarHBondContact O-N 3.02Å; A7-S10 PolarHBondContact O-OG 2.91Å; F8-S10 PolarHBondContact O-N 3.45Å; F8-S10 VanDerWaalsContact O-N 3.08Å; S10-H70 VanDerWaalsContact CA-CD2 3.42Å; S10-H70 WeakPolarHBondContact CA-CD2 3.24Å; S10-H70 WeakPolarHBondContact CB-CE1 3.38Å; S10-H70 WeakPolarHBondContact CB-NE2 3.49Å; S10-H70 WeakPolarHBondContact O-CB 3.35Å
11	F	94.3	Very high	92.7	Very high	135 Å²	135	103.1 Å²	103.1	59%	0.592	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	-21.5	-174.8	58.5	-98.7	0	0	0	113.6	F8	F8-F11 HydrophobicContact CB-CE1 4.31Å; F8-F11 HydrophobicContact CB-CE2 4.37Å; F8-F11 HydrophobicContact CB-CZ 3.86Å; F8-F11 PolarHBondContact O-N 2.88Å
12	L	96.7	Very high	94.3	Very high	84 Å²	84	95.2 Å²	95.2	44%	0.44	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-82.8	126.8	-179	-169.8	70.3	0	0	0	110.6	F8 K38	F8-L12 HydrophobicContact CD2-CB 4.34Å; F8-L12 HydrophobicContact CD2-CD2 3.87Å; F8-L12 HydrophobicContact CE2-CD2 4.37Å; F8-L12 WeakPolarHBondContact O-CB 3.43Å; F8-L12 PolarHBondContact O-N 2.97Å; L12-K38 WeakPolarHBondContact O-CD 3.31Å; L12-K38 WeakPolarHBondContact O-CE 3.31Å
13	L	96.5	Very high	94.9	Very high	61 Å²	61	89.9 Å²	89.9	32%	0.319	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-75.6	134.1	169.9	-70.6	168.1	0	0	0	110	E17 K19 N37 K38	L13-E17 HydrophobicContact CB-CB 4.44Å; L13-E17 HydrophobicContact CD2-CB 4Å; L13-K19 HydrophobicContact CD1-CB 3.85Å; L13-K19 HydrophobicContact CD1-CD 3.92Å; L13-K19 HydrophobicContact CD1-CG 4.48Å; L13-K19 HydrophobicContact CD2-CD 4.49Å; L13-K19 HydrophobicContact CG-CD 4.48Å; L13-N37 HydrophobicContact CD2-CB 3.85Å; L13-K38 HydrophobicContact CD2-CB 4.36Å; L13-K38 HydrophobicContact CD2-CG 3.58Å; L13-K38 HydrophobicContact CG-CG 4.08Å
14	F	94.3	Very high	95	Very high	78 Å²	78	90.4 Å²	90.4	34%	0.342	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-80.3	165.1	172.7	-63	-53.3	0	0	0	112	F8 E9 G16 E17	F8-F14 HydrophobicContact CE2-CE1 4.29Å; E9-F14 HydrophobicContact CB-CZ 4.1Å; E9-F14 HydrophobicContact CG-CE2 3.76Å; E9-F14 HydrophobicContact CG-CZ 3.61Å; F14-G16 PolarHBondContact O-N 2.87Å; F14-E17 HydrophobicContact CB-CG 4.12Å; F14-E17 PolarHBondContact N-OE2 3.37Å; F14-E17 WeakPolarHBondContact O-CB 3.39Å; F14-E17 PolarHBondContact O-N 3.34Å
15	E	94.1	Very high	95	Very high	205 Å²	205	88.2 Å²	88.2	96%	0.958	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	125.6	178.3	-166.8	179.3	177.4	0	0	110.6	E17	E15-E17 VanDerWaalsContact C-N 3.34Å
16	G	93.9	Very high	95	Very high	77 Å²	77	90.5 Å²	90.5	79%	0.794	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-11.4	-176	0	0	0	0	0	115.4	F14	F14-G16 PolarHBondContact O-N 2.87Å
17	E	94.5	Very high	94.9	Very high	75 Å²	75	96.5 Å²	96.5	35%	0.35	51%	0.507	S	S	.	.			trans	-77.4	129	173.7	-67.2	-172.2	156.3	0	0	111.4	L13 F14 E15 K38	L13-E17 HydrophobicContact CB-CB 4.44Å; L13-E17 HydrophobicContact CD2-CB 4Å; F14-E17 HydrophobicContact CB-CG 4.12Å; F14-E17 PolarHBondContact N-OE2 3.37Å; F14-E17 WeakPolarHBondContact O-CB 3.39Å; F14-E17 PolarHBondContact O-N 3.34Å; E15-E17 VanDerWaalsContact C-N 3.34Å; E17-K38 WeakPolarHBondContact OE2-CE 3.44Å; E17-K38 IonicContact OE2-NZ 2.81Å
18	K	96.6	Very high	94.9	Very high	153 Å²	153	94.4 Å²	94.4	67%	0.665	49%	0.486	S	S	*	.			trans	-88.7	141.3	172.6	-63.3	-177.5	-179.2	-180	0	109.9	I20 N37	K18-I20 VanDerWaalsContact C-N 3.3Å; K18-I20 PolarHBondContact O-N 3.22Å; K18-N37 PolarHBondContact O-ND2 3.19Å
19	K	96.6	Very high	94.9	Very high	77 Å²	77	94.8 Å²	94.8	34%	0.335	50%	0.498	S	S	.	.	S	Bend	trans	-60.4	-42.6	174.5	-172.3	63.6	-179.4	176.6	0	112	L13 L36 N37 K38 E39	L13-K19 HydrophobicContact CD1-CB 3.85Å; L13-K19 HydrophobicContact CD1-CD 3.92Å; L13-K19 HydrophobicContact CD1-CG 4.48Å; L13-K19 HydrophobicContact CD2-CD 4.49Å; L13-K19 HydrophobicContact CG-CD 4.48Å; K19-L36 CarbonylContact O-C 3.55Å; K19-L36 VanDerWaalsContact O-CA 3.28Å; K19-L36 WeakPolarHBondContact O-CA 3.44Å; K19-N37 WeakPolarHBondContact CD-O 3.33Å; K19-N37 WeakPolarHBondContact CE-O 3.45Å; K19-N37 PolarHBondContact NZ-O 2.96Å; K19-N37 PolarHBondContact O-N 3.2Å; K19-K38 PolarHBondContact NZ-O 2.95Å; K19-E39 WeakPolarHBondContact CE-OE1 3.14Å; K19-E39 IonicContact NZ-OE1 2.94Å; K19-E39 PolarHBondContact NZ-OE1 2.86Å
20	I	97.1	Very high	95	Very high	72 Å²	72	94.4 Å²	94.4	37%	0.369	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	142	-179.1	-170.6	169	0	0	0	110.2	K18 F34 T35 L36 F88	K18-I20 VanDerWaalsContact C-N 3.3Å; K18-I20 PolarHBondContact O-N 3.22Å; I20-F34 HydrophobicContact CD1-CD1 4.22Å; I20-T35 CarbonylContact C-O 3.54Å; I20-T35 WeakPolarHBondContact CA-O 3.48Å; I20-L36 HydrophobicContact CD1-CD1 4.28Å; I20-L36 HydrophobicContact CD1-CG 4.29Å; I20-L36 HydrophobicContact CG1-CD1 4.33Å; I20-L36 HydrophobicContact CG1-CG 4.2Å; I20-F88 HydrophobicContact CD1-CE1 4.34Å
21	S	97.2	Very high	95.2	Very high	51 Å²	51	92.7 Å²	92.7	36%	0.357	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.2	169.2	55.5	0	0	0	0	109.7	F34 T35	S21-F34 WeakPolarHBondContact O-CA 3.49Å; S21-T35 PolarHBondContact N-O 2.98Å; S21-T35 PolarHBondContact O-N 3.2Å; S21-T35 WeakPolarHBondContact OG-CB 3.17Å; S21-T35 PolarHBondContact OG-O 3.22Å
22	I	97.1	Very high	95.3	Very high	93 Å²	93	86.5 Å²	86.5	48%	0.477	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.6	-174.1	-50.5	177.8	0	0	0	108	C32 F34	I22-C32 HydrophobicContact CG2-CB 4.48Å; I22-F34 HydrophobicContact CD1-CD1 4.11Å; I22-F34 HydrophobicContact CD1-CE1 3.92Å; I22-F34 HydrophobicContact CG1-CD1 3.81Å; I22-F34 HydrophobicContact CG1-CE1 4.07Å; I22-F34 HydrophobicContact CG2-CD1 4.2Å; I22-F34 HydrophobicContact CG2-CE1 4.03Å
23	S	96.4	Very high	95.4	Very high	59 Å²	59	84.7 Å²	84.7	41%	0.413	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	137.5	173	56.5	0	0	0	0	109.5	C32 L33	S23-C32 CarbonylContact O-C 3.59Å; S23-C32 WeakPolarHBondContact O-CA 3.35Å; S23-L33 PolarHBondContact N-O 3.38Å; S23-L33 PolarHBondContact O-N 3.01Å; S23-L33 PolarHBondContact OG-O 3.04Å
24	K	95.4	Very high	95.5	Very high	169 Å²	169	81.9 Å²	81.9	74%	0.735	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	136.8	174.9	-64.4	-175.8	179	-176.4	0	109	T26	K24-T26 PolarHBondContact O-N 3.49Å
25	D	93.4	Very high	95.6	Very high	23 Å²	23	79.4 Å²	79.4	12%	0.123	43%	0.427	C	S	.	.			trans	-75.6	121.2	171.3	-166.3	-16.1	0	0	0	108.1	K27 A31 L33 R75	D25-K27 VanDerWaalsContact C-N 3.32Å; D25-K27 WeakPolarHBondContact OD1-CB 3.46Å; D25-K27 PolarHBondContact OD1-N 3.33Å; D25-A31 HydrophobicContact CB-CB 3.75Å; D25-A31 PolarHBondContact N-O 3.46Å; D25-L33 HydrophobicContact CB-CD1 3.69Å; D25-R75 IonicContact OD2-CZ 3.22Å; D25-R75 VanDerWaalsContact OD2-CZ 3.31Å; D25-R75 IonicContact OD2-NE 3.31Å; D25-R75 PolarHBondContact OD2-NE 3.43Å; D25-R75 IonicContact OD2-NH2 2.64Å; D25-R75 PolarHBondContact OD2-NH2 2.92Å
26	T	93	Very high	95.8	Very high	139 Å²	139	70.2 Å²	70.2	85%	0.853	38%	0.384	S	S	*	.	S	Bend	trans	-84.2	-10.8	-180	55	0	0	0	0	112.8	K24	K24-T26 PolarHBondContact O-N 3.49Å
27	K	92.7	Very high	96	Very high	187 Å²	187	67.7 Å²	67.7	81%	0.813	35%	0.353	S	S	*	.	S	Bend	trans	-84.9	-30.6	-174.5	-61.1	179	-178.5	179.3	0	113.1	D25	D25-K27 VanDerWaalsContact C-N 3.32Å; D25-K27 WeakPolarHBondContact OD1-CB 3.46Å; D25-K27 PolarHBondContact OD1-N 3.33Å
28	V	93.3	Very high	96.1	Very high	42 Å²	42	65.1 Å²	65.1	26%	0.255	34%	0.34	S	S	.	.	S	Bend	trans	-133.9	144	-178.2	-58.3	0	0	0	0	109.7	A31	V28-A31 HydrophobicContact CG2-CB 3.42Å; V28-A31 VanDerWaalsContact CG2-CB 3.42Å
29	P	94.4	Very high	96.2	Very high	108 Å²	108	60.2 Å²	60.2	70%	0.701	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	149	178.8	28.9	-34.9	0	0	0	110.5	A31 Q77	P29-A31 VanDerWaalsContact C-N 3.27Å; P29-A31 PolarHBondContact O-N 3.48Å; P29-Q77 PolarHBondContact O-NE2 3.38Å
30	N	94.7	Very high	96.2	Very high	55 Å²	55	60.1 Å²	60.1	29%	0.294	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	42.9	172.4	-153.5	47	0	0	0	114.4	Q77 T78 T79 Y82 P84	N30-Q77 WeakPolarHBondContact O-CA 3.19Å; N30-T78 PolarHBondContact ND2-O 2.9Å; N30-T78 VanDerWaalsContact ND2-O 3.11Å; N30-T78 PolarHBondContact ND2-OG1 3.02Å; N30-T78 PolarHBondContact O-N 3.39Å; N30-T79 PolarHBondContact ND2-O 3.11Å; N30-Y82 PolarHBondContact ND2-O 2.98Å; N30-P84 VanDerWaalsContact O-CG 3.23Å; N30-P84 WeakPolarHBondContact O-CG 3.44Å; N30-P84 WeakPolarHBondContact OD1-CD 3.32Å
31	A	96.9	Very high	96.3	Very high	4 Å²	4	61.6 Å²	61.6	3%	0.033	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	147.9	172.6	0	0	0	0	0	111.5	D25 V28 P29 V76 Q77	D25-A31 HydrophobicContact CB-CB 3.75Å; D25-A31 PolarHBondContact N-O 3.46Å; V28-A31 HydrophobicContact CG2-CB 3.42Å; V28-A31 VanDerWaalsContact CG2-CB 3.42Å; P29-A31 VanDerWaalsContact C-N 3.27Å; P29-A31 PolarHBondContact O-N 3.48Å; A31-V76 CarbonylContact C-O 3.53Å; A31-V76 WeakPolarHBondContact CA-O 3.47Å; A31-V76 WeakPolarHBondContact CB-O 3.47Å; A31-Q77 HydrophobicContact CB-CB 3.89Å; A31-Q77 HydrophobicContact CB-CG 3.98Å
32	C	97.2	Very high	96.3	Very high	5 Å²	5	64.3 Å²	64.3	3%	0.034	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	150.4	179	-72.2	0	0	0	0	110.8	I22 S23 F34 R75 V76 P84 Q85	I22-C32 HydrophobicContact CG2-CB 4.48Å; S23-C32 CarbonylContact O-C 3.59Å; S23-C32 WeakPolarHBondContact O-CA 3.35Å; C32-F34 HydrophobicContact CB-CE2 4.03Å; C32-F34 HydrophobicContact CB-CZ 4.17Å; C32-R75 WeakPolarHBondContact O-CA 3.38Å; C32-V76 PolarHBondContact N-O 3.44Å; C32-V76 PolarHBondContact O-N 3.31Å; C32-P84 HydrophobicContact CB-CB 4.07Å; C32-Q85 PolarHBondContact SG-NE2 3.3Å; C32-Q85 VanDerWaalsContact SG-NE2 3.35Å
33	L	97.8	Very high	96.3	Very high	45 Å²	45	62.4 Å²	62.4	24%	0.236	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.3	169.5	-64.9	87.9	0	0	0	108.9	S23 D25 V73 I74 R75	S23-L33 PolarHBondContact N-O 3.38Å; S23-L33 PolarHBondContact O-N 3.01Å; S23-L33 PolarHBondContact OG-O 3.04Å; D25-L33 HydrophobicContact CB-CD1 3.69Å; L33-V73 HydrophobicContact CB-CG1 4.29Å; L33-V73 HydrophobicContact CD2-CG1 3.97Å; L33-I74 CarbonylContact C-O 3.57Å; L33-I74 WeakPolarHBondContact CA-O 3.42Å; L33-R75 HydrophobicContact CG-CB 4.35Å; L33-R75 HydrophobicContact CG-CG 4.36Å
34	F	98.1	Very high	96.3	Very high	3 Å²	3	59.6 Å²	59.6	1%	0.013	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.7	172.1	-55.6	-90.8	0	0	0	108.3	I20 S21 I22 C32 L36 V73 I74 V76 Q85 F88	I20-F34 HydrophobicContact CD1-CD1 4.22Å; S21-F34 WeakPolarHBondContact O-CA 3.49Å; I22-F34 HydrophobicContact CD1-CD1 4.11Å; I22-F34 HydrophobicContact CD1-CE1 3.92Å; I22-F34 HydrophobicContact CG1-CD1 3.81Å; I22-F34 HydrophobicContact CG1-CE1 4.07Å; I22-F34 HydrophobicContact CG2-CD1 4.2Å; I22-F34 HydrophobicContact CG2-CE1 4.03Å; C32-F34 HydrophobicContact CB-CE2 4.03Å; C32-F34 HydrophobicContact CB-CZ 4.17Å; F34-L36 HydrophobicContact CB-CD1 3.99Å; F34-V73 CarbonylContact O-C 3.53Å; F34-V73 WeakPolarHBondContact O-CA 3.2Å; F34-I74 HydrophobicContact CB-CB 4.35Å; F34-I74 PolarHBondContact N-O 2.93Å; F34-I74 PolarHBondContact O-N 3.07Å; F34-V76 HydrophobicContact CD2-CG2 4.02Å; F34-V76 HydrophobicContact CE2-CB 4.08Å; F34-V76 HydrophobicContact CE2-CG2 3.81Å; F34-Q85 HydrophobicContact CE1-CG 4.24Å; F34-Q85 HydrophobicContact CZ-CG 4.24Å; F34-F88 HydrophobicContact CD2-CD2 4.02Å; F34-F88 HydrophobicContact CD2-CE2 4.27Å; F34-F88 HydrophobicContact CE1-CB 4.39Å; F34-F88 HydrophobicContact CE1-CG 4.3Å; F34-F88 HydrophobicContact CE2-CB 4.32Å; F34-F88 HydrophobicContact CE2-CD2 4.06Å; F34-F88 HydrophobicContact CE2-CG 4.31Å; F34-F88 HydrophobicContact CG-CD2 4.32Å; F34-F88 HydrophobicContact CG-CE2 4.3Å; F34-F88 HydrophobicContact CZ-CB 3.99Å; F34-F88 HydrophobicContact CZ-CD2 4.4Å; F34-F88 HydrophobicContact CZ-CG 4.19Å
35	T	98	Very high	96.4	Very high	26 Å²	26	55.5 Å²	55.5	16%	0.16	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	116.4	174.2	-58.3	0	0	0	0	108.6	I20 S21 K71 I72 V73	I20-T35 CarbonylContact C-O 3.54Å; I20-T35 WeakPolarHBondContact CA-O 3.48Å; S21-T35 PolarHBondContact N-O 2.98Å; S21-T35 PolarHBondContact O-N 3.2Å; S21-T35 WeakPolarHBondContact OG-CB 3.17Å; S21-T35 PolarHBondContact OG-O 3.22Å; T35-K71 HydrophobicContact CG2-CD 3.67Å; T35-K71 HydrophobicContact CG2-CG 3.73Å; T35-I72 CarbonylContact C-O 3.59Å; T35-I72 WeakPolarHBondContact CA-O 3.48Å; T35-V73 HydrophobicContact CG2-CG2 4.2Å
36	L	98	Very high	96.6	Very high	11 Å²	11	57.6 Å²	57.6	6%	0.058	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.5	177.6	-65.8	75.9	0	0	0	109	K19 I20 F34 E39 L43 K71 I72 I74	K19-L36 CarbonylContact O-C 3.55Å; K19-L36 VanDerWaalsContact O-CA 3.28Å; K19-L36 WeakPolarHBondContact O-CA 3.44Å; I20-L36 HydrophobicContact CD1-CD1 4.28Å; I20-L36 HydrophobicContact CD1-CG 4.29Å; I20-L36 HydrophobicContact CG1-CD1 4.33Å; I20-L36 HydrophobicContact CG1-CG 4.2Å; F34-L36 HydrophobicContact CB-CD1 3.99Å; L36-E39 HydrophobicContact CB-CB 4.23Å; L36-E39 HydrophobicContact CB-CG 4.1Å; L36-E39 HydrophobicContact CD2-CG 4.44Å; L36-L43 HydrophobicContact CD2-CD2 3.71Å; L36-K71 CarbonylContact O-C 3.55Å; L36-K71 WeakPolarHBondContact O-CA 3.3Å; L36-I72 HydrophobicContact CB-CD1 4.27Å; L36-I72 HydrophobicContact CB-CG1 3.74Å; L36-I72 HydrophobicContact CD1-CG1 4.42Å; L36-I72 HydrophobicContact CD2-CD1 4.4Å; L36-I72 PolarHBondContact N-O 3.06Å; L36-I72 PolarHBondContact O-N 3.49Å; L36-I74 HydrophobicContact CD1-CD1 3.94Å; L36-I74 HydrophobicContact CD1-CG1 4.34Å
37	N	97.8	Very high	96.9	Very high	25 Å²	25	51.2 Å²	51.2	13%	0.134	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	149.4	177.3	-70	-43.5	0	0	0	110.5	L13 K18 K19 E39 K71	L13-N37 HydrophobicContact CD2-CB 3.85Å; K18-N37 PolarHBondContact O-ND2 3.19Å; K19-N37 WeakPolarHBondContact CD-O 3.33Å; K19-N37 WeakPolarHBondContact CE-O 3.45Å; K19-N37 PolarHBondContact NZ-O 2.96Å; K19-N37 PolarHBondContact O-N 3.2Å; N37-E39 VanDerWaalsContact C-N 3.26Å; N37-E39 PolarHBondContact O-N 3.46Å; N37-K71 WeakPolarHBondContact OD1-CE 3.36Å
38	K	97.1	Very high	97.1	Very high	20 Å²	20	47.1 Å²	47.1	9%	0.087	25%	0.25	C	S	.	.	S	Bend	trans	57.3	43.4	178	-47.5	-62.1	-179.5	170	0	111.5	E9 L12 L13 E17 K19 H70	E9-K38 VanDerWaalsContact O-CD 3.27Å; E9-K38 WeakPolarHBondContact O-CD 3.49Å; E9-K38 PolarHBondContact O-NZ 3.45Å; L12-K38 WeakPolarHBondContact O-CD 3.31Å; L12-K38 WeakPolarHBondContact O-CE 3.31Å; L13-K38 HydrophobicContact CD2-CB 4.36Å; L13-K38 HydrophobicContact CD2-CG 3.58Å; L13-K38 HydrophobicContact CG-CG 4.08Å; E17-K38 WeakPolarHBondContact OE2-CE 3.44Å; E17-K38 IonicContact OE2-NZ 2.81Å; K19-K38 PolarHBondContact NZ-O 2.95Å; K38-H70 WeakPolarHBondContact CA-O 3.39Å; K38-H70 HydrophobicContact CD-CB 4.25Å; K38-H70 PolarHBondContact N-O 2.94Å
39	E	97.8	Very high	97.3	Very high	51 Å²	51	47.5 Å²	47.5	24%	0.238	26%	0.257	C	S	.	.			trans	-139.4	159.1	179.5	-71.7	-59.4	159.1	0	0	109.1	K19 L36 N37 L43 K71 I72	K19-E39 WeakPolarHBondContact CE-OE1 3.14Å; K19-E39 IonicContact NZ-OE1 2.94Å; K19-E39 PolarHBondContact NZ-OE1 2.86Å; L36-E39 HydrophobicContact CB-CB 4.23Å; L36-E39 HydrophobicContact CB-CG 4.1Å; L36-E39 HydrophobicContact CD2-CG 4.44Å; N37-E39 VanDerWaalsContact C-N 3.26Å; N37-E39 PolarHBondContact O-N 3.46Å; E39-L43 HydrophobicContact CB-CD2 4.41Å; E39-L43 VanDerWaalsContact CD-CD2 3.5Å; E39-L43 HydrophobicContact CG-CD2 3.76Å; E39-L43 WeakPolarHBondContact OE2-CD2 3.49Å; E39-K71 PolarHBondContact O-N 2.91Å; E39-I72 HydrophobicContact CB-CD1 4.02Å; E39-I72 HydrophobicContact CB-CG1 4.02Å
40	D	97.4	Very high	97.5	Very high	75 Å²	75	43.2 Å²	43.2	40%	0.401	23%	0.228	S	C	.	.			trans	-134.6	-164.3	-174.4	73	-2.7	0	0	0	112.3	T42 G44	D40-T42 PolarHBondContact O-N 3.01Å; D40-T42 WeakPolarHBondContact OD1-CA 3.47Å; D40-T42 WeakPolarHBondContact OD1-CB 3.23Å; D40-T42 PolarHBondContact OD1-N 3.35Å; D40-T42 PolarHBondContact OD1-OG1 2.9Å; D40-T42 PolarHBondContact OD2-OG1 3.33Å; D40-G44 PolarHBondContact O-N 2.86Å; D40-G44 VanDerWaalsContact O-N 3.13Å
41	H	97.8	Very high	97.7	Very high	103 Å²	103	40.6 Å²	40.6	48%	0.477	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-21.9	179.4	-65.2	-83.2	0	0	0	113.8	N45 Y62 V64	H41-N45 WeakPolarHBondContact O-CB 3.15Å; H41-N45 PolarHBondContact O-N 3.15Å; H41-Y62 HydrophobicContact CB-CE2 4.26Å; H41-Y62 AromaticContact ND1-CE2 3.26Å; H41-Y62 VanDerWaalsContact ND1-CE2 3.26Å; H41-Y62 WeakPolarHBondContact ND1-CE2 3.46Å; H41-Y62 AromaticContact ND1-CZ 3.53Å; H41-Y62 PolarHBondContact ND1-OH 3.35Å; H41-V64 VanDerWaalsContact NE2-CG2 3.32Å; H41-V64 WeakPolarHBondContact NE2-CG2 3.41Å
42	T	97.3	Very high	97.7	Very high	107 Å²	107	44.6 Å²	44.6	66%	0.656	24%	0.235	S	C	*	.	H	α-helix	trans	-59.3	-53.5	179.8	-50	0	0	0	0	109.9	D40	D40-T42 PolarHBondContact O-N 3.01Å; D40-T42 WeakPolarHBondContact OD1-CA 3.47Å; D40-T42 WeakPolarHBondContact OD1-CB 3.23Å; D40-T42 PolarHBondContact OD1-N 3.35Å; D40-T42 PolarHBondContact OD1-OG1 2.9Å; D40-T42 PolarHBondContact OD2-OG1 3.33Å
43	L	97.1	Very high	97.7	Very high	54 Å²	54	50.4 Å²	50.4	28%	0.283	26%	0.259	S	S	.	.	H	α-helix	trans	-75.6	-42.1	177.7	-171.2	65.8	0	0	0	111.9	L36 E39 N45 I46 I47	L36-L43 HydrophobicContact CD2-CD2 3.71Å; E39-L43 HydrophobicContact CB-CD2 4.41Å; E39-L43 VanDerWaalsContact CD-CD2 3.5Å; E39-L43 HydrophobicContact CG-CD2 3.76Å; E39-L43 WeakPolarHBondContact OE2-CD2 3.49Å; L43-N45 PolarHBondContact O-N 2.92Å; L43-I46 WeakPolarHBondContact O-CG2 3.28Å; L43-I47 HydrophobicContact CD1-CD1 3.77Å; L43-I47 HydrophobicContact CD1-CG1 4.23Å; L43-I47 HydrophobicContact CD2-CD1 4.26Å; L43-I47 HydrophobicContact CG-CD1 3.67Å; L43-I47 HydrophobicContact CG-CG1 4.4Å; L43-I47 WeakPolarHBondContact O-CG1 3.47Å; L43-I47 PolarHBondContact O-N 3.49Å
44	G	97.1	Very high	97.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-41.4	-176.9	0	0	0	0	0	113.5	D40 R48 Y62	D40-G44 PolarHBondContact O-N 2.86Å; D40-G44 VanDerWaalsContact O-N 3.13Å; G44-R48 VanDerWaalsContact O-CB 3.31Å; G44-R48 WeakPolarHBondContact O-CB 3.29Å; G44-R48 PolarHBondContact O-N 3.03Å; G44-R48 VanDerWaalsContact O-N 3.08Å; G44-Y62 WeakPolarHBondContact O-CD1 3.42Å
45	N	97.9	Very high	97.6	Very high	82 Å²	82	55.6 Å²	55.6	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-69.9	-44.9	-177	-170.2	50.6	0	0	0	112.2	H41 L43 R48 A49 Y62	H41-N45 WeakPolarHBondContact O-CB 3.15Å; H41-N45 PolarHBondContact O-N 3.15Å; L43-N45 PolarHBondContact O-N 2.92Å; N45-R48 PolarHBondContact O-N 2.97Å; N45-A49 WeakPolarHBondContact O-CB 3.34Å; N45-A49 PolarHBondContact O-N 3.2Å; N45-Y62 HydrophobicContact CB-CE1 4.11Å; N45-Y62 WeakPolarHBondContact CB-OH 3.24Å
46	I	97.9	Very high	97.6	Very high	68 Å²	68	58 Å²	58	35%	0.349	30%	0.303	S	S	.	.	H	α-helix	trans	-69.2	-39.6	-176.8	-161.6	165.8	0	0	0	111.6	L43 A49 Q50 L95	L43-I46 WeakPolarHBondContact O-CG2 3.28Å; I46-A49 PolarHBondContact O-N 3.31Å; I46-Q50 WeakPolarHBondContact O-CB 3.4Å; I46-Q50 PolarHBondContact O-N 3.46Å; I46-L95 HydrophobicContact CB-CD2 4.45Å; I46-L95 HydrophobicContact CD1-CD1 3.69Å; I46-L95 HydrophobicContact CD1-CD2 4.04Å; I46-L95 HydrophobicContact CD1-CG 4.44Å; I46-L95 HydrophobicContact CG1-CD1 3.85Å; I46-L95 HydrophobicContact CG1-CD2 3.85Å; I46-L95 HydrophobicContact CG2-CD2 3.88Å
47	I	97.9	Very high	97.6	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-44.5	174.7	-67.4	177.8	0	0	0	110.6	L43 A49 Q50 L51 I74 F88 I92	L43-I47 HydrophobicContact CD1-CD1 3.77Å; L43-I47 HydrophobicContact CD1-CG1 4.23Å; L43-I47 HydrophobicContact CD2-CD1 4.26Å; L43-I47 HydrophobicContact CG-CD1 3.67Å; L43-I47 HydrophobicContact CG-CG1 4.4Å; L43-I47 WeakPolarHBondContact O-CG1 3.47Å; L43-I47 PolarHBondContact O-N 3.49Å; I47-A49 VanDerWaalsContact C-N 3.32Å; I47-A49 PolarHBondContact O-N 3.06Å; I47-Q50 PolarHBondContact O-N 3.35Å; I47-L51 HydrophobicContact CG2-CD1 3.79Å; I47-L51 HydrophobicContact CG2-CG 4.3Å; I47-L51 WeakPolarHBondContact O-CB 3.47Å; I47-L51 WeakPolarHBondContact O-CG 3.43Å; I47-L51 PolarHBondContact O-N 3.39Å; I47-I74 HydrophobicContact CB-CD1 4.46Å; I47-I74 HydrophobicContact CD1-CD1 4.4Å; I47-I74 HydrophobicContact CG2-CD1 4.12Å; I47-F88 HydrophobicContact CD1-CZ 4.03Å; I47-F88 HydrophobicContact CG2-CD2 4.15Å; I47-F88 HydrophobicContact CG2-CE2 3.54Å; I47-F88 HydrophobicContact CG2-CZ 4.03Å; I47-I92 HydrophobicContact CD1-CD1 4.5Å; I47-I92 HydrophobicContact CD1-CG1 4.49Å
48	R	98.1	Very high	97.6	Very high	101 Å²	101	62.1 Å²	62.1	38%	0.381	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-47.6	175.2	180	-150.5	168.3	-149	-3.5	110.8	G44 N45 Q50 L51 L52 Y62	G44-R48 VanDerWaalsContact O-CB 3.31Å; G44-R48 WeakPolarHBondContact O-CB 3.29Å; G44-R48 PolarHBondContact O-N 3.03Å; G44-R48 VanDerWaalsContact O-N 3.08Å; N45-R48 PolarHBondContact O-N 2.97Å; R48-Q50 VanDerWaalsContact C-N 3.3Å; R48-Q50 PolarHBondContact O-N 2.82Å; R48-L51 PolarHBondContact O-N 3.1Å; R48-L52 HydrophobicContact CG-CD1 4.15Å; R48-L52 VanDerWaalsContact O-CG 3.31Å; R48-L52 WeakPolarHBondContact O-CG 3.3Å; R48-L52 PolarHBondContact O-N 2.88Å; R48-Y62 HydrophobicContact CB-CD1 3.95Å; R48-Y62 HydrophobicContact CG-CD1 4.33Å
49	A	98	Very high	97.6	Very high	49 Å²	49	65.1 Å²	65.1	41%	0.405	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-41.8	179.8	0	0	0	0	0	111.5	N45 I46 I47 L52 K53	N45-A49 WeakPolarHBondContact O-CB 3.34Å; N45-A49 PolarHBondContact O-N 3.2Å; I46-A49 PolarHBondContact O-N 3.31Å; I47-A49 VanDerWaalsContact C-N 3.32Å; I47-A49 PolarHBondContact O-N 3.06Å; A49-L52 PolarHBondContact O-N 2.94Å; A49-K53 PolarHBondContact O-N 2.71Å
50	Q	97.9	Very high	97.7	Very high	18 Å²	18	63.1 Å²	63.1	8%	0.084	33%	0.331	C	S	.	.	H	α-helix	trans	-67.6	-43.1	178.5	-168.7	63.9	20.3	0	0	112.6	I46 I47 R48 L52 K53 A91 L95	I46-Q50 WeakPolarHBondContact O-CB 3.4Å; I46-Q50 PolarHBondContact O-N 3.46Å; I47-Q50 PolarHBondContact O-N 3.35Å; R48-Q50 VanDerWaalsContact C-N 3.3Å; R48-Q50 PolarHBondContact O-N 2.82Å; Q50-L52 VanDerWaalsContact C-N 3.26Å; Q50-L52 PolarHBondContact O-N 3.26Å; Q50-K53 WeakPolarHBondContact O-CB 3.31Å; Q50-K53 PolarHBondContact O-N 3.22Å; Q50-A91 HydrophobicContact CB-CB 4.19Å; Q50-A91 HydrophobicContact CG-CB 3.74Å; Q50-A91 VanDerWaalsContact CG-O 3.29Å; Q50-A91 WeakPolarHBondContact CG-O 3.28Å; Q50-L95 HydrophobicContact CG-CB 4.44Å
51	L	98.1	Very high	97.7	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-37.2	174.9	-76.3	166.4	0	0	0	112.3	I47 R48 K53 D54 V57 A60 I74 V76 A87 F88 A91	I47-L51 HydrophobicContact CG2-CD1 3.79Å; I47-L51 HydrophobicContact CG2-CG 4.3Å; I47-L51 WeakPolarHBondContact O-CB 3.47Å; I47-L51 WeakPolarHBondContact O-CG 3.43Å; I47-L51 PolarHBondContact O-N 3.39Å; R48-L51 PolarHBondContact O-N 3.1Å; L51-K53 PolarHBondContact O-N 2.9Å; L51-D54 PolarHBondContact O-N 2.94Å; L51-V57 HydrophobicContact CD2-CG2 4.39Å; L51-V57 WeakPolarHBondContact O-CB 3.34Å; L51-V57 WeakPolarHBondContact O-CG2 3.49Å; L51-A60 HydrophobicContact CB-CB 3.72Å; L51-A60 HydrophobicContact CD1-CB 4.19Å; L51-I74 HydrophobicContact CD1-CG2 4.37Å; L51-V76 HydrophobicContact CD1-CG2 3.69Å; L51-V76 HydrophobicContact CD2-CG1 4.37Å; L51-A87 HydrophobicContact CD2-CB 4.14Å; L51-F88 HydrophobicContact CD1-CD2 4.11Å; L51-A91 HydrophobicContact CD2-CB 3.87Å; L51-A91 HydrophobicContact CG-CB 4.03Å
52	L	97.8	Very high	97.7	Very high	88 Å²	88	58 Å²	58	46%	0.461	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10	177.9	-69	174	0	0	0	113.8	R48 A49 Q50 D54 A60	R48-L52 HydrophobicContact CG-CD1 4.15Å; R48-L52 VanDerWaalsContact O-CG 3.31Å; R48-L52 WeakPolarHBondContact O-CG 3.3Å; R48-L52 PolarHBondContact O-N 2.88Å; A49-L52 PolarHBondContact O-N 2.94Å; Q50-L52 VanDerWaalsContact C-N 3.26Å; Q50-L52 PolarHBondContact O-N 3.26Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-A60 HydrophobicContact CD2-CB 3.89Å; L52-A60 HydrophobicContact CG-CB 4.09Å
53	K	97.3	Very high	97.7	Very high	126 Å²	126	59.4 Å²	59.4	55%	0.548	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.8	170.9	-62.7	177.6	-175.7	169.7	0	112	A49 Q50 L51 E98	A49-K53 PolarHBondContact O-N 2.71Å; Q50-K53 WeakPolarHBondContact O-CB 3.31Å; Q50-K53 PolarHBondContact O-N 3.22Å; L51-K53 PolarHBondContact O-N 2.9Å; K53-E98 IonicContact NZ-OE2 3.19Å; K53-E98 PolarHBondContact NZ-OE2 2.81Å
54	D	97.1	Very high	97.7	Very high	35 Å²	35	58.4 Å²	58.4	19%	0.187	30%	0.3	C	S	.	.			trans	-82.5	119.3	-178.9	-176.5	-11.3	0	0	0	110.9	L51 L52 Q56 V57 Y82	L51-D54 PolarHBondContact O-N 2.94Å; L52-D54 VanDerWaalsContact C-N 3.33Å; D54-Q56 PolarHBondContact O-N 3Å; D54-Q56 WeakPolarHBondContact OD1-CB 3.49Å; D54-Q56 PolarHBondContact OD1-N 3.27Å; D54-V57 HydrophobicContact CB-CB 4.37Å; D54-V57 HydrophobicContact CB-CG2 3.78Å; D54-V57 PolarHBondContact O-N 2.96Å; D54-V57 VanDerWaalsContact O-N 3.1Å; D54-Y82 VanDerWaalsContact OD2-CE1 3.24Å; D54-Y82 WeakPolarHBondContact OD2-CE1 3.32Å
55	P	97.1	Very high	97.7	Very high	123 Å²	123	61.4 Å²	61.4	80%	0.799	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.2	-179.8	28.3	-36.3	0	0	0	114	V57	P55-V57 VanDerWaalsContact C-N 3.31Å
56	Q	97.3	Very high	97.6	Very high	76 Å²	76	61.7 Å²	61.7	36%	0.355	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-8.4	177	-63.2	176.8	96.2	0	0	112.6	D54 L58 T78 T79 Y82	D54-Q56 PolarHBondContact O-N 3Å; D54-Q56 WeakPolarHBondContact OD1-CB 3.49Å; D54-Q56 PolarHBondContact OD1-N 3.27Å; Q56-L58 PolarHBondContact O-N 3.49Å; Q56-T78 CarbonylContact O-C 3.54Å; Q56-T78 VanDerWaalsContact O-CA 3.23Å; Q56-T78 WeakPolarHBondContact O-CA 3.12Å; Q56-T78 WeakPolarHBondContact O-CB 3.48Å; Q56-T79 PolarHBondContact O-N 3.08Å; Q56-Y82 HydrophobicContact CB-CD1 3.59Å; Q56-Y82 HydrophobicContact CB-CE1 4.16Å; Q56-Y82 HydrophobicContact CB-CG 4.29Å; Q56-Y82 HydrophobicContact CG-CD1 4.48Å
57	V	98	Very high	97.5	Very high	16 Å²	16	63.8 Å²	63.8	10%	0.097	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	109.9	174.4	176.5	0	0	0	0	109.5	L51 D54 P55 A60 V76 T78 A87	L51-V57 HydrophobicContact CD2-CG2 4.39Å; L51-V57 WeakPolarHBondContact O-CB 3.34Å; L51-V57 WeakPolarHBondContact O-CG2 3.49Å; D54-V57 HydrophobicContact CB-CB 4.37Å; D54-V57 HydrophobicContact CB-CG2 3.78Å; D54-V57 PolarHBondContact O-N 2.96Å; D54-V57 VanDerWaalsContact O-N 3.1Å; P55-V57 VanDerWaalsContact C-N 3.31Å; V57-A60 HydrophobicContact CG1-CB 3.96Å; V57-V76 HydrophobicContact CG1-CG1 4.34Å; V57-T78 HydrophobicContact CB-CG2 4.48Å; V57-T78 HydrophobicContact CG2-CG2 3.86Å; V57-A87 HydrophobicContact CG2-CB 3.95Å
58	L	97.6	Very high	97.3	Very high	107 Å²	107	70.4 Å²	70.4	56%	0.56	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	-32.2	178.9	-58.5	179.2	0	0	0	112.2	Q56 Q77 T79	Q56-L58 PolarHBondContact O-N 3.49Å; L58-Q77 HydrophobicContact CB-CG 4.42Å; L58-Q77 PolarHBondContact N-O 3.42Å; L58-T79 HydrophobicContact CD2-CG2 4.09Å; L58-T79 HydrophobicContact CG-CG2 4.35Å
59	F	97.9	Very high	97.1	Very high	83 Å²	83	69.9 Å²	69.9	36%	0.364	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	132.8	177.9	179.5	-91.7	0	0	0	110.7	R75 V76 Q77	F59-R75 HydrophobicContact CD1-CG 4.1Å; F59-R75 HydrophobicContact CE1-CB 4.01Å; F59-R75 HydrophobicContact CE1-CG 3.86Å; F59-V76 CarbonylContact O-C 3.52Å; F59-V76 VanDerWaalsContact O-CA 3.3Å; F59-V76 WeakPolarHBondContact O-CA 3.34Å; F59-Q77 HydrophobicContact CB-CB 3.91Å; F59-Q77 PolarHBondContact N-O 3.32Å; F59-Q77 PolarHBondContact O-N 2.87Å
60	A	98.1	Very high	96.9	Very high	8 Å²	8	71.1 Å²	71.1	7%	0.066	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	124.5	166.5	0	0	0	0	0	110	L51 L52 V57 R75	L51-A60 HydrophobicContact CB-CB 3.72Å; L51-A60 HydrophobicContact CD1-CB 4.19Å; L52-A60 HydrophobicContact CD2-CB 3.89Å; L52-A60 HydrophobicContact CG-CB 4.09Å; V57-A60 HydrophobicContact CG1-CB 3.96Å; A60-R75 WeakPolarHBondContact CA-O 3.46Å
61	G	98.1	Very high	96.9	Very high	15 Å²	15	73.1 Å²	73.1	16%	0.155	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	154.5	176.6	0	0	0	0	0	111	I74 R75	G61-I74 CarbonylContact O-C 3.54Å; G61-I74 WeakPolarHBondContact O-CA 3.36Å; G61-R75 PolarHBondContact N-O 3.1Å; G61-R75 PolarHBondContact O-N 3.39Å
62	Y	98.2	Very high	96.9	Very high	56 Å²	56	73 Å²	73	22%	0.22	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	157.8	174.3	83.1	-75.2	0	0	0	111.2	H41 G44 N45 R48 I72 V73	H41-Y62 HydrophobicContact CB-CE2 4.26Å; H41-Y62 AromaticContact ND1-CE2 3.26Å; H41-Y62 VanDerWaalsContact ND1-CE2 3.26Å; H41-Y62 WeakPolarHBondContact ND1-CE2 3.46Å; H41-Y62 AromaticContact ND1-CZ 3.53Å; H41-Y62 PolarHBondContact ND1-OH 3.35Å; G44-Y62 WeakPolarHBondContact O-CD1 3.42Å; N45-Y62 HydrophobicContact CB-CE1 4.11Å; N45-Y62 WeakPolarHBondContact CB-OH 3.24Å; R48-Y62 HydrophobicContact CB-CD1 3.95Å; R48-Y62 HydrophobicContact CG-CD1 4.33Å; Y62-I72 HydrophobicContact CD2-CG2 4.47Å; Y62-V73 CarbonylContact C-O 3.55Å; Y62-V73 WeakPolarHBondContact CA-O 3.44Å
63	K	97.4	Very high	96.9	Very high	137 Å²	137	69.8 Å²	69.8	60%	0.596	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	150.9	172.1	64.1	178.6	-177.4	175.4	0	111	I72 V73	K63-I72 WeakPolarHBondContact O-CA 3.43Å; K63-V73 HydrophobicContact CG-CB 4.36Å; K63-V73 PolarHBondContact N-O 3.01Å; K63-V73 PolarHBondContact O-N 2.85Å
64	V	97.4	Very high	97	Very high	33 Å²	33	63.8 Å²	63.8	20%	0.2	34%	0.335	C	S	.	.			trans	-89.5	119.3	160.9	172.6	0	0	0	0	106.8	H41 H66 I72	H41-V64 VanDerWaalsContact NE2-CG2 3.32Å; H41-V64 WeakPolarHBondContact NE2-CG2 3.41Å; V64-H66 VanDerWaalsContact C-N 3.27Å; V64-H66 WeakPolarHBondContact CG1-O 3.44Å; V64-H66 PolarHBondContact O-N 3.2Å; V64-I72 HydrophobicContact CG2-CG2 3.7Å
65	P	96.3	Very high	97	Very high	63 Å²	63	65.7 Å²	65.7	41%	0.409	34%	0.34	S	S	.	.	S	Bend	trans	-59	-38.2	-178.5	-25.6	35.7	0	0	0	113.3	K71 V73	P65-K71 WeakPolarHBondContact CD-O 3.26Å; P65-K71 HydrophobicContact CG-CD 4.43Å; P65-V73 HydrophobicContact CG-CG2 3.95Å
66	H	96.9	Very high	97.1	Very high	88 Å²	88	59.8 Å²	59.8	41%	0.407	30%	0.302	S	S	.	.			trans	-153.2	137.1	176.6	-171	-89.9	0	0	0	110.1	V64 L68 E69	V64-H66 VanDerWaalsContact C-N 3.27Å; V64-H66 WeakPolarHBondContact CG1-O 3.44Å; V64-H66 PolarHBondContact O-N 3.2Å; H66-L68 WeakPolarHBondContact ND1-CB 3.26Å; H66-L68 PolarHBondContact ND1-N 2.98Å; H66-L68 VanDerWaalsContact ND1-N 3.14Å; H66-L68 PolarHBondContact O-N 3.44Å; H66-L68 VanDerWaalsContact O-N 3.15Å; H66-E69 HydrophobicContact CB-CB 4.29Å; H66-E69 HydrophobicContact CB-CG 4.21Å; H66-E69 PolarHBondContact O-N 3.07Å; H66-E69 VanDerWaalsContact O-O 3.13Å
67	P	94.9	Very high	97.1	Very high	112 Å²	112	58.1 Å²	58.1	73%	0.727	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-27	-176.1	-26	34.8	0	0	0	115.4	E69	P67-E69 VanDerWaalsContact C-N 3.32Å
68	L	94.4	Very high	97.1	Very high	144 Å²	144	57.5 Å²	57.5	75%	0.754	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.1	175.5	-57.3	178.9	0	0	0	113.4	H66	H66-L68 WeakPolarHBondContact ND1-CB 3.26Å; H66-L68 PolarHBondContact ND1-N 2.98Å; H66-L68 VanDerWaalsContact ND1-N 3.14Å; H66-L68 PolarHBondContact O-N 3.44Å; H66-L68 VanDerWaalsContact O-N 3.15Å
69	E	92.5	Very high	97.1	Very high	90 Å²	90	53.8 Å²	53.8	42%	0.421	27%	0.272	S	S	.	.	S	Bend	trans	-102.1	122.7	172.9	-73.8	-171.5	-148.5	0	0	110	H66 P67 K71	H66-E69 HydrophobicContact CB-CB 4.29Å; H66-E69 HydrophobicContact CB-CG 4.21Å; H66-E69 PolarHBondContact O-N 3.07Å; H66-E69 VanDerWaalsContact O-O 3.13Å; P67-E69 VanDerWaalsContact C-N 3.32Å; E69-K71 VanDerWaalsContact C-N 3.26Å; E69-K71 PolarHBondContact O-N 2.64Å; E69-K71 IonicContact OE2-NZ 3.85Å; E69-K71 PolarHBondContact OE2-NZ 2.72Å
70	H	95.6	Very high	96.9	Very high	75 Å²	75	55.6 Å²	55.6	35%	0.347	29%	0.292	S	S	.	.			trans	-79.6	78.1	175.3	-58.5	-76.1	0	0	0	109.8	S10 K38	S10-H70 VanDerWaalsContact CA-CD2 3.42Å; S10-H70 WeakPolarHBondContact CA-CD2 3.24Å; S10-H70 WeakPolarHBondContact CB-CE1 3.38Å; S10-H70 WeakPolarHBondContact CB-NE2 3.49Å; S10-H70 WeakPolarHBondContact O-CB 3.35Å; K38-H70 WeakPolarHBondContact CA-O 3.39Å; K38-H70 HydrophobicContact CD-CB 4.25Å; K38-H70 PolarHBondContact N-O 2.94Å
71	K	96.9	Very high	96.8	Very high	59 Å²	59	61.6 Å²	61.6	26%	0.257	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	139.1	-176.8	-173.2	-175.7	-63.8	139.3	0	110.2	T35 L36 N37 E39 P65 E69	T35-K71 HydrophobicContact CG2-CD 3.67Å; T35-K71 HydrophobicContact CG2-CG 3.73Å; L36-K71 CarbonylContact O-C 3.55Å; L36-K71 WeakPolarHBondContact O-CA 3.3Å; N37-K71 WeakPolarHBondContact OD1-CE 3.36Å; E39-K71 PolarHBondContact O-N 2.91Å; P65-K71 WeakPolarHBondContact CD-O 3.26Å; P65-K71 HydrophobicContact CG-CD 4.43Å; E69-K71 VanDerWaalsContact C-N 3.26Å; E69-K71 PolarHBondContact O-N 2.64Å; E69-K71 IonicContact OE2-NZ 3.85Å; E69-K71 PolarHBondContact OE2-NZ 2.72Å
72	I	98	Very high	96.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	148	169.4	60.2	174.8	0	0	0	110.6	T35 L36 E39 Y62 K63 V64 I74	T35-I72 CarbonylContact C-O 3.59Å; T35-I72 WeakPolarHBondContact CA-O 3.48Å; L36-I72 HydrophobicContact CB-CD1 4.27Å; L36-I72 HydrophobicContact CB-CG1 3.74Å; L36-I72 HydrophobicContact CD1-CG1 4.42Å; L36-I72 HydrophobicContact CD2-CD1 4.4Å; L36-I72 PolarHBondContact N-O 3.06Å; L36-I72 PolarHBondContact O-N 3.49Å; E39-I72 HydrophobicContact CB-CD1 4.02Å; E39-I72 HydrophobicContact CB-CG1 4.02Å; Y62-I72 HydrophobicContact CD2-CG2 4.47Å; K63-I72 WeakPolarHBondContact O-CA 3.43Å; V64-I72 HydrophobicContact CG2-CG2 3.7Å; I72-I74 HydrophobicContact CD1-CD1 4.18Å; I72-I74 HydrophobicContact CD1-CG1 4.39Å
73	V	98.3	Very high	96.6	Very high	20 Å²	20	60.7 Å²	60.7	12%	0.121	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	116.9	173.3	-176.9	0	0	0	0	108.2	L33 F34 T35 Y62 K63 P65	L33-V73 HydrophobicContact CB-CG1 4.29Å; L33-V73 HydrophobicContact CD2-CG1 3.97Å; F34-V73 CarbonylContact O-C 3.53Å; F34-V73 WeakPolarHBondContact O-CA 3.2Å; T35-V73 HydrophobicContact CG2-CG2 4.2Å; Y62-V73 CarbonylContact C-O 3.55Å; Y62-V73 WeakPolarHBondContact CA-O 3.44Å; K63-V73 HydrophobicContact CG-CB 4.36Å; K63-V73 PolarHBondContact N-O 3.01Å; K63-V73 PolarHBondContact O-N 2.85Å; P65-V73 HydrophobicContact CG-CG2 3.95Å
74	I	98.3	Very high	96.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.1	177.8	-52.3	174.6	0	0	0	107.9	L33 F34 L36 I47 L51 G61 I72 V76 F88	L33-I74 CarbonylContact C-O 3.57Å; L33-I74 WeakPolarHBondContact CA-O 3.42Å; F34-I74 HydrophobicContact CB-CB 4.35Å; F34-I74 PolarHBondContact N-O 2.93Å; F34-I74 PolarHBondContact O-N 3.07Å; L36-I74 HydrophobicContact CD1-CD1 3.94Å; L36-I74 HydrophobicContact CD1-CG1 4.34Å; I47-I74 HydrophobicContact CB-CD1 4.46Å; I47-I74 HydrophobicContact CD1-CD1 4.4Å; I47-I74 HydrophobicContact CG2-CD1 4.12Å; L51-I74 HydrophobicContact CD1-CG2 4.37Å; G61-I74 CarbonylContact O-C 3.54Å; G61-I74 WeakPolarHBondContact O-CA 3.36Å; I72-I74 HydrophobicContact CD1-CD1 4.18Å; I72-I74 HydrophobicContact CD1-CG1 4.39Å; I74-V76 HydrophobicContact CG2-CG2 3.92Å; I74-F88 HydrophobicContact CD1-CE2 3.79Å; I74-F88 HydrophobicContact CD1-CZ 4.05Å; I74-F88 HydrophobicContact CG2-CE2 4.29Å
75	R	98.1	Very high	96.6	Very high	74 Å²	74	55.5 Å²	55.5	28%	0.279	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.1	174.5	179.1	178.9	-174	-124.6	4.1	108.9	D25 C32 L33 F59 A60 G61	D25-R75 IonicContact OD2-CZ 3.22Å; D25-R75 VanDerWaalsContact OD2-CZ 3.31Å; D25-R75 IonicContact OD2-NE 3.31Å; D25-R75 PolarHBondContact OD2-NE 3.43Å; D25-R75 IonicContact OD2-NH2 2.64Å; D25-R75 PolarHBondContact OD2-NH2 2.92Å; C32-R75 WeakPolarHBondContact O-CA 3.38Å; L33-R75 HydrophobicContact CG-CB 4.35Å; L33-R75 HydrophobicContact CG-CG 4.36Å; F59-R75 HydrophobicContact CD1-CG 4.1Å; F59-R75 HydrophobicContact CE1-CB 4.01Å; F59-R75 HydrophobicContact CE1-CG 3.86Å; A60-R75 WeakPolarHBondContact CA-O 3.46Å; G61-R75 PolarHBondContact N-O 3.1Å; G61-R75 PolarHBondContact O-N 3.39Å
76	V	98.2	Very high	96.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.9	-179.3	-172.2	0	0	0	0	109.2	A31 C32 F34 L51 V57 F59 I74 T78 P84 F88	A31-V76 CarbonylContact C-O 3.53Å; A31-V76 WeakPolarHBondContact CA-O 3.47Å; A31-V76 WeakPolarHBondContact CB-O 3.47Å; C32-V76 PolarHBondContact N-O 3.44Å; C32-V76 PolarHBondContact O-N 3.31Å; F34-V76 HydrophobicContact CD2-CG2 4.02Å; F34-V76 HydrophobicContact CE2-CB 4.08Å; F34-V76 HydrophobicContact CE2-CG2 3.81Å; L51-V76 HydrophobicContact CD1-CG2 3.69Å; L51-V76 HydrophobicContact CD2-CG1 4.37Å; V57-V76 HydrophobicContact CG1-CG1 4.34Å; F59-V76 CarbonylContact O-C 3.52Å; F59-V76 VanDerWaalsContact O-CA 3.3Å; F59-V76 WeakPolarHBondContact O-CA 3.34Å; I74-V76 HydrophobicContact CG2-CG2 3.92Å; V76-T78 HydrophobicContact CG1-CG2 4.3Å; V76-P84 HydrophobicContact CB-CB 4.3Å; V76-P84 HydrophobicContact CG1-CB 4.23Å; V76-F88 HydrophobicContact CG2-CD2 4.43Å
77	Q	98.1	Very high	96.7	Very high	41 Å²	41	53.1 Å²	53.1	19%	0.192	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.5	171.1	-174.2	178.7	5	0	0	108.7	P29 N30 A31 L58 F59	P29-Q77 PolarHBondContact O-NE2 3.38Å; N30-Q77 WeakPolarHBondContact O-CA 3.19Å; A31-Q77 HydrophobicContact CB-CB 3.89Å; A31-Q77 HydrophobicContact CB-CG 3.98Å; L58-Q77 HydrophobicContact CB-CG 4.42Å; L58-Q77 PolarHBondContact N-O 3.42Å; F59-Q77 HydrophobicContact CB-CB 3.91Å; F59-Q77 PolarHBondContact N-O 3.32Å; F59-Q77 PolarHBondContact O-N 2.87Å
78	T	98.2	Very high	96.8	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	170.4	-177.4	44.5	0	0	0	0	111.1	N30 Q56 V57 V76 Y82 P84 A87	N30-T78 PolarHBondContact ND2-O 2.9Å; N30-T78 VanDerWaalsContact ND2-O 3.11Å; N30-T78 PolarHBondContact ND2-OG1 3.02Å; N30-T78 PolarHBondContact O-N 3.39Å; Q56-T78 CarbonylContact O-C 3.54Å; Q56-T78 VanDerWaalsContact O-CA 3.23Å; Q56-T78 WeakPolarHBondContact O-CA 3.12Å; Q56-T78 WeakPolarHBondContact O-CB 3.48Å; V57-T78 HydrophobicContact CB-CG2 4.48Å; V57-T78 HydrophobicContact CG2-CG2 3.86Å; V76-T78 HydrophobicContact CG1-CG2 4.3Å; T78-Y82 WeakPolarHBondContact CB-O 3.23Å; T78-Y82 HydrophobicContact CG2-CD1 3.82Å; T78-Y82 HydrophobicContact CG2-CE1 4.28Å; T78-Y82 PolarHBondContact OG1-O 3.05Å; T78-P84 VanDerWaalsContact OG1-CD 3.26Å; T78-P84 WeakPolarHBondContact OG1-CD 3.44Å; T78-P84 WeakPolarHBondContact OG1-CG 3.04Å; T78-A87 HydrophobicContact CG2-CB 3.7Å
79	T	97.3	Very high	96.9	Very high	30 Å²	30	45.4 Å²	45.4	18%	0.184	24%	0.235	C	C	.	.			trans	-59.2	150.1	172	56.6	0	0	0	0	111.6	N30 Q56 L58 D81 Y82	N30-T79 PolarHBondContact ND2-O 3.11Å; Q56-T79 PolarHBondContact O-N 3.08Å; L58-T79 HydrophobicContact CD2-CG2 4.09Å; L58-T79 HydrophobicContact CG-CG2 4.35Å; T79-D81 WeakPolarHBondContact CB-OD1 3.2Å; T79-D81 PolarHBondContact O-N 3.27Å; T79-D81 PolarHBondContact OG1-OD1 3.19Å; T79-Y82 PolarHBondContact O-N 2.94Å
80	P	94.3	Very high	97.2	Very high	121 Å²	121	44.7 Å²	44.7	79%	0.786	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-23.3	-170.5	-26.1	35.3	0	0	0	116.3
81	D	94.8	Very high	97.3	Very high	134 Å²	134	41.5 Å²	41.5	72%	0.717	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.6	178.8	56.6	-26	0	0	0	113.7	T79	T79-D81 WeakPolarHBondContact CB-OD1 3.2Å; T79-D81 PolarHBondContact O-N 3.27Å; T79-D81 PolarHBondContact OG1-OD1 3.19Å
82	Y	96.6	Very high	97.3	Very high	20 Å²	20	41.4 Å²	41.4	8%	0.078	22%	0.222	C	C	.	.	S	Bend	trans	-127.1	127.4	-176.2	-172.6	-132.2	0	0	0	111.9	N30 D54 Q56 T78 T79 E86 A87 N90	N30-Y82 PolarHBondContact ND2-O 2.98Å; D54-Y82 VanDerWaalsContact OD2-CE1 3.24Å; D54-Y82 WeakPolarHBondContact OD2-CE1 3.32Å; Q56-Y82 HydrophobicContact CB-CD1 3.59Å; Q56-Y82 HydrophobicContact CB-CE1 4.16Å; Q56-Y82 HydrophobicContact CB-CG 4.29Å; Q56-Y82 HydrophobicContact CG-CD1 4.48Å; T78-Y82 WeakPolarHBondContact CB-O 3.23Å; T78-Y82 HydrophobicContact CG2-CD1 3.82Å; T78-Y82 HydrophobicContact CG2-CE1 4.28Å; T78-Y82 PolarHBondContact OG1-O 3.05Å; T79-Y82 PolarHBondContact O-N 2.94Å; Y82-E86 HydrophobicContact CD2-CB 4.36Å; Y82-E86 HydrophobicContact CE2-CB 3.69Å; Y82-A87 HydrophobicContact CD1-CB 4.22Å; Y82-A87 HydrophobicContact CE1-CB 3.44Å; Y82-A87 VanDerWaalsContact CE1-CB 3.44Å; Y82-A87 WeakPolarHBondContact OH-CA 3.38Å; Y82-A87 PolarHBondContact OH-N 2.73Å; Y82-N90 PolarHBondContact OH-ND2 2.78Å
83	S	96.6	Very high	97.3	Very high	32 Å²	32	44.8 Å²	44.8	22%	0.224	24%	0.243	C	C	.	.			trans	-78.9	135.3	-174.2	176.5	0	0	0	0	112.1	Q85 E86 A87	S83-Q85 PolarHBondContact O-N 3.18Å; S83-Q85 PolarHBondContact OG-N 3.47Å; S83-Q85 PolarHBondContact OG-OE1 3.5Å; S83-E86 PolarHBondContact N-OE2 2.91Å; S83-E86 WeakPolarHBondContact O-CB 3.38Å; S83-E86 PolarHBondContact O-N 3Å; S83-A87 PolarHBondContact O-N 2.99Å
84	P	97.2	Very high	97.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-58.4	-30.1	173.9	-24.8	33.3	0	0	0	113.3	N30 C32 V76 T78 F88	N30-P84 VanDerWaalsContact O-CG 3.23Å; N30-P84 WeakPolarHBondContact O-CG 3.44Å; N30-P84 WeakPolarHBondContact OD1-CD 3.32Å; C32-P84 HydrophobicContact CB-CB 4.07Å; V76-P84 HydrophobicContact CB-CB 4.3Å; V76-P84 HydrophobicContact CG1-CB 4.23Å; T78-P84 VanDerWaalsContact OG1-CD 3.26Å; T78-P84 WeakPolarHBondContact OG1-CD 3.44Å; T78-P84 WeakPolarHBondContact OG1-CG 3.04Å; P84-F88 WeakPolarHBondContact O-CB 3.44Å; P84-F88 PolarHBondContact O-N 3.29Å; P84-F88 VanDerWaalsContact O-N 3.07Å
85	Q	96.7	Very high	97.2	Very high	59 Å²	59	49 Å²	49	28%	0.276	27%	0.265	S	S	.	.	H	α-helix	trans	-69	-37.4	175.3	-68.2	84.8	-13.6	0	0	112	C32 F34 S83 F88 T89	C32-Q85 PolarHBondContact SG-NE2 3.3Å; C32-Q85 VanDerWaalsContact SG-NE2 3.35Å; F34-Q85 HydrophobicContact CE1-CG 4.24Å; F34-Q85 HydrophobicContact CZ-CG 4.24Å; S83-Q85 PolarHBondContact O-N 3.18Å; S83-Q85 PolarHBondContact OG-N 3.47Å; S83-Q85 PolarHBondContact OG-OE1 3.5Å; Q85-F88 PolarHBondContact O-N 2.83Å; Q85-T89 WeakPolarHBondContact O-CB 3.41Å; Q85-T89 PolarHBondContact O-N 2.62Å; Q85-T89 PolarHBondContact O-OG1 3.07Å
86	E	97.1	Very high	97.2	Very high	101 Å²	101	50.1 Å²	50.1	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-68.9	-45.9	176.3	-69.8	167.9	-179.3	0	0	110.1	Y82 S83 F88 T89 N90	Y82-E86 HydrophobicContact CD2-CB 4.36Å; Y82-E86 HydrophobicContact CE2-CB 3.69Å; S83-E86 PolarHBondContact N-OE2 2.91Å; S83-E86 WeakPolarHBondContact O-CB 3.38Å; S83-E86 PolarHBondContact O-N 3Å; E86-F88 VanDerWaalsContact C-N 3.27Å; E86-F88 PolarHBondContact O-N 3.1Å; E86-T89 PolarHBondContact O-N 3.16Å; E86-T89 VanDerWaalsContact O-N 3.1Å; E86-N90 WeakPolarHBondContact O-CB 3.42Å; E86-N90 VanDerWaalsContact O-CG 3.3Å; E86-N90 PolarHBondContact O-N 3.35Å
87	A	97.8	Very high	97.2	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-53	-45.5	173.1	0	0	0	0	0	112.3	L51 V57 T78 Y82 S83 A91	L51-A87 HydrophobicContact CD2-CB 4.14Å; V57-A87 HydrophobicContact CG2-CB 3.95Å; T78-A87 HydrophobicContact CG2-CB 3.7Å; Y82-A87 HydrophobicContact CD1-CB 4.22Å; Y82-A87 HydrophobicContact CE1-CB 3.44Å; Y82-A87 VanDerWaalsContact CE1-CB 3.44Å; Y82-A87 WeakPolarHBondContact OH-CA 3.38Å; Y82-A87 PolarHBondContact OH-N 2.73Å; S83-A87 PolarHBondContact O-N 2.99Å; A87-A91 VanDerWaalsContact O-CB 3.24Å; A87-A91 WeakPolarHBondContact O-CB 3.5Å; A87-A91 PolarHBondContact O-N 3.06Å
88	F	97.4	Very high	97.2	Very high	13 Å²	13	56.2 Å²	56.2	6%	0.057	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-41.4	178.4	-162.5	-93.5	0	0	0	112.7	I20 F34 I47 L51 I74 V76 P84 Q85 E86 I92	I20-F88 HydrophobicContact CD1-CE1 4.34Å; F34-F88 HydrophobicContact CD2-CD2 4.02Å; F34-F88 HydrophobicContact CD2-CE2 4.27Å; F34-F88 HydrophobicContact CE1-CB 4.39Å; F34-F88 HydrophobicContact CE1-CG 4.3Å; F34-F88 HydrophobicContact CE2-CB 4.32Å; F34-F88 HydrophobicContact CE2-CD2 4.06Å; F34-F88 HydrophobicContact CE2-CG 4.31Å; F34-F88 HydrophobicContact CG-CD2 4.32Å; F34-F88 HydrophobicContact CG-CE2 4.3Å; F34-F88 HydrophobicContact CZ-CB 3.99Å; F34-F88 HydrophobicContact CZ-CD2 4.4Å; F34-F88 HydrophobicContact CZ-CG 4.19Å; I47-F88 HydrophobicContact CD1-CZ 4.03Å; I47-F88 HydrophobicContact CG2-CD2 4.15Å; I47-F88 HydrophobicContact CG2-CE2 3.54Å; I47-F88 HydrophobicContact CG2-CZ 4.03Å; L51-F88 HydrophobicContact CD1-CD2 4.11Å; I74-F88 HydrophobicContact CD1-CE2 3.79Å; I74-F88 HydrophobicContact CD1-CZ 4.05Å; I74-F88 HydrophobicContact CG2-CE2 4.29Å; V76-F88 HydrophobicContact CG2-CD2 4.43Å; P84-F88 WeakPolarHBondContact O-CB 3.44Å; P84-F88 PolarHBondContact O-N 3.29Å; P84-F88 VanDerWaalsContact O-N 3.07Å; Q85-F88 PolarHBondContact O-N 2.83Å; E86-F88 VanDerWaalsContact C-N 3.27Å; E86-F88 PolarHBondContact O-N 3.1Å; F88-I92 HydrophobicContact CD1-CD1 3.66Å; F88-I92 HydrophobicContact CE1-CD1 3.35Å; F88-I92 HydrophobicContact CE1-CG1 4.43Å; F88-I92 HydrophobicContact CZ-CD1 4.14Å; F88-I92 WeakPolarHBondContact O-CG1 3.33Å; F88-I92 PolarHBondContact O-N 2.81Å; F88-I92 VanDerWaalsContact O-N 3.16Å
89	T	97.5	Very high	97.2	Very high	81 Å²	81	60.3 Å²	60.3	50%	0.497	33%	0.333	S	S	.	.	H	α-helix	trans	-70.2	-42.6	179.9	-55.4	0	0	0	0	111.6	Q85 E86 I92 T93	Q85-T89 WeakPolarHBondContact O-CB 3.41Å; Q85-T89 PolarHBondContact O-N 2.62Å; Q85-T89 PolarHBondContact O-OG1 3.07Å; E86-T89 PolarHBondContact O-N 3.16Å; E86-T89 VanDerWaalsContact O-N 3.1Å; T89-I92 PolarHBondContact O-N 2.81Å; T89-T93 WeakPolarHBondContact O-CB 3.35Å; T89-T93 PolarHBondContact O-N 2.79Å; T89-T93 PolarHBondContact O-OG1 3.13Å
90	N	97.7	Very high	97.2	Very high	75 Å²	75	62 Å²	62	40%	0.401	35%	0.345	S	S	.	.	H	α-helix	trans	-62.8	-48	176.5	-71.5	-2.2	0	0	0	110.6	Y82 E86 I92 T93 D94	Y82-N90 PolarHBondContact OH-ND2 2.78Å; E86-N90 WeakPolarHBondContact O-CB 3.42Å; E86-N90 VanDerWaalsContact O-CG 3.3Å; E86-N90 PolarHBondContact O-N 3.35Å; N90-I92 VanDerWaalsContact C-N 3.3Å; N90-I92 PolarHBondContact O-N 2.92Å; N90-T93 PolarHBondContact O-N 3.03Å; N90-T93 VanDerWaalsContact O-N 3.1Å; N90-D94 WeakPolarHBondContact O-CB 2.97Å; N90-D94 VanDerWaalsContact O-CG 3.26Å; N90-D94 PolarHBondContact O-N 2.82Å
91	A	97.8	Very high	97.4	Very high	7 Å²	7	59.8 Å²	59.8	6%	0.058	33%	0.327	C	S	.	.	H	α-helix	trans	-55.1	-44.5	176	0	0	0	0	0	112.3	Q50 L51 A87 L95	Q50-A91 HydrophobicContact CB-CB 4.19Å; Q50-A91 HydrophobicContact CG-CB 3.74Å; Q50-A91 VanDerWaalsContact CG-O 3.29Å; Q50-A91 WeakPolarHBondContact CG-O 3.28Å; L51-A91 HydrophobicContact CD2-CB 3.87Å; L51-A91 HydrophobicContact CG-CB 4.03Å; A87-A91 VanDerWaalsContact O-CB 3.24Å; A87-A91 WeakPolarHBondContact O-CB 3.5Å; A87-A91 PolarHBondContact O-N 3.06Å; A91-L95 VanDerWaalsContact O-CB 3.28Å; A91-L95 WeakPolarHBondContact O-CB 3.4Å; A91-L95 PolarHBondContact O-N 2.92Å
92	I	97.6	Very high	97.6	Very high	57 Å²	57	58.7 Å²	58.7	29%	0.292	32%	0.32	S	S	.	.	H	α-helix	trans	-65.6	-42.8	177.7	-71	171.9	0	0	0	111.5	I47 F88 T89 N90 L95 I96	I47-I92 HydrophobicContact CD1-CD1 4.5Å; I47-I92 HydrophobicContact CD1-CG1 4.49Å; F88-I92 HydrophobicContact CD1-CD1 3.66Å; F88-I92 HydrophobicContact CE1-CD1 3.35Å; F88-I92 HydrophobicContact CE1-CG1 4.43Å; F88-I92 HydrophobicContact CZ-CD1 4.14Å; F88-I92 WeakPolarHBondContact O-CG1 3.33Å; F88-I92 PolarHBondContact O-N 2.81Å; F88-I92 VanDerWaalsContact O-N 3.16Å; T89-I92 PolarHBondContact O-N 2.81Å; N90-I92 VanDerWaalsContact C-N 3.3Å; N90-I92 PolarHBondContact O-N 2.92Å; I92-L95 PolarHBondContact O-N 3.24Å; I92-I96 HydrophobicContact CG2-CD1 3.76Å; I92-I96 HydrophobicContact CG2-CG1 4.37Å; I92-I96 VanDerWaalsContact O-CG1 3.3Å; I92-I96 WeakPolarHBondContact O-CG1 3.47Å; I92-I96 PolarHBondContact O-N 2.87Å
93	T	98.1	Very high	97.6	Very high	72 Å²	72	62.4 Å²	62.4	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-42.5	-178.1	-55.8	0	0	0	0	111.3	T89 N90 L95 I96 S97	T89-T93 WeakPolarHBondContact O-CB 3.35Å; T89-T93 PolarHBondContact O-N 2.79Å; T89-T93 PolarHBondContact O-OG1 3.13Å; N90-T93 PolarHBondContact O-N 3.03Å; N90-T93 VanDerWaalsContact O-N 3.1Å; T93-L95 VanDerWaalsContact C-N 3.35Å; T93-I96 PolarHBondContact O-N 3.24Å; T93-S97 PolarHBondContact O-N 2.87Å; T93-S97 VanDerWaalsContact O-N 3.07Å; T93-S97 PolarHBondContact O-OG 3.01Å
94	D	97.6	Very high	97.7	Very high	89 Å²	89	66.8 Å²	66.8	48%	0.476	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-43	174.5	-67.6	-17.7	0	0	0	111	N90 S97 E98	N90-D94 WeakPolarHBondContact O-CB 2.97Å; N90-D94 VanDerWaalsContact O-CG 3.26Å; N90-D94 PolarHBondContact O-N 2.82Å; D94-S97 WeakPolarHBondContact O-CB 3.39Å; D94-S97 PolarHBondContact O-N 3.27Å; D94-E98 WeakPolarHBondContact O-CB 3.11Å; D94-E98 PolarHBondContact O-N 2.96Å
95	L	97.6	Very high	97.7	Very high	19 Å²	19	74.7 Å²	74.7	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-64.5	-42.2	178.9	-178.7	62.2	0	0	0	112.2	I46 Q50 A91 I92 T93 S97 E98 L99	I46-L95 HydrophobicContact CB-CD2 4.45Å; I46-L95 HydrophobicContact CD1-CD1 3.69Å; I46-L95 HydrophobicContact CD1-CD2 4.04Å; I46-L95 HydrophobicContact CD1-CG 4.44Å; I46-L95 HydrophobicContact CG1-CD1 3.85Å; I46-L95 HydrophobicContact CG1-CD2 3.85Å; I46-L95 HydrophobicContact CG2-CD2 3.88Å; Q50-L95 HydrophobicContact CG-CB 4.44Å; A91-L95 VanDerWaalsContact O-CB 3.28Å; A91-L95 WeakPolarHBondContact O-CB 3.4Å; A91-L95 PolarHBondContact O-N 2.92Å; I92-L95 PolarHBondContact O-N 3.24Å; T93-L95 VanDerWaalsContact C-N 3.35Å; L95-S97 VanDerWaalsContact C-N 3.26Å; L95-S97 PolarHBondContact O-N 2.89Å; L95-E98 PolarHBondContact O-N 2.94Å; L95-L99 HydrophobicContact CD1-CD1 4.47Å; L95-L99 HydrophobicContact CD1-CG 4.4Å; L95-L99 HydrophobicContact CG-CD1 4.3Å; L95-L99 WeakPolarHBondContact O-CG 3.42Å; L95-L99 PolarHBondContact O-N 2.91Å
96	I	98	Very high	97.8	Very high	98 Å²	98	78.1 Å²	78.1	50%	0.503	40%	0.399	S	S	.	.	H	α-helix	trans	-60.8	-40.6	174.8	-69.7	166.6	0	0	0	110.3	I92 T93 L99 S100	I92-I96 HydrophobicContact CG2-CD1 3.76Å; I92-I96 HydrophobicContact CG2-CG1 4.37Å; I92-I96 VanDerWaalsContact O-CG1 3.3Å; I92-I96 WeakPolarHBondContact O-CG1 3.47Å; I92-I96 PolarHBondContact O-N 2.87Å; T93-I96 PolarHBondContact O-N 3.24Å; I96-L99 PolarHBondContact O-N 2.77Å; I96-S100 WeakPolarHBondContact O-CB 3.44Å; I96-S100 PolarHBondContact O-N 3.35Å; I96-S100 PolarHBondContact O-OG 2.9Å
97	S	97.9	Very high	97.8	Very high	69 Å²	69	80.5 Å²	80.5	48%	0.483	40%	0.404	S	S	.	.	H	α-helix	trans	-66.6	-42.7	178.3	-56	0	0	0	0	111.6	T93 D94 L95 S100 L101	T93-S97 PolarHBondContact O-N 2.87Å; T93-S97 VanDerWaalsContact O-N 3.07Å; T93-S97 PolarHBondContact O-OG 3.01Å; D94-S97 WeakPolarHBondContact O-CB 3.39Å; D94-S97 PolarHBondContact O-N 3.27Å; L95-S97 VanDerWaalsContact C-N 3.26Å; L95-S97 PolarHBondContact O-N 2.89Å; S97-S100 PolarHBondContact O-N 3.41Å; S97-L101 PolarHBondContact O-N 3.36Å
98	E	97.4	Very high	97.7	Very high	99 Å²	99	84 Å²	84	46%	0.463	43%	0.425	S	S	.	.	H	α-helix	trans	-60.7	-45.7	176	-170.6	175.9	162.3	0	0	111.3	K53 D94 L95 L101 L102	K53-E98 IonicContact NZ-OE2 3.19Å; K53-E98 PolarHBondContact NZ-OE2 2.81Å; D94-E98 WeakPolarHBondContact O-CB 3.11Å; D94-E98 PolarHBondContact O-N 2.96Å; L95-E98 PolarHBondContact O-N 2.94Å; E98-L101 PolarHBondContact O-N 2.87Å; E98-L102 WeakPolarHBondContact O-CB 3.46Å; E98-L102 PolarHBondContact O-N 3.46Å
99	L	97.6	Very high	97.7	Very high	89 Å²	89	85.9 Å²	85.9	47%	0.466	44%	0.443	S	S	.	.	H	α-helix	trans	-67.4	-37.4	177.8	-69.7	175.6	0	0	0	112.7	L95 I96 L102 E103	L95-L99 HydrophobicContact CD1-CD1 4.47Å; L95-L99 HydrophobicContact CD1-CG 4.4Å; L95-L99 HydrophobicContact CG-CD1 4.3Å; L95-L99 WeakPolarHBondContact O-CG 3.42Å; L95-L99 PolarHBondContact O-N 2.91Å; I96-L99 PolarHBondContact O-N 2.77Å; L99-L102 HydrophobicContact CD2-CD2 4.43Å; L99-L102 WeakPolarHBondContact O-CB 3.33Å; L99-L102 PolarHBondContact O-N 2.83Å; L99-E103 WeakPolarHBondContact O-CB 3.31Å; L99-E103 PolarHBondContact O-N 2.91Å
100	S	98.1	Very high	97.6	Very high	64 Å²	64	85.3 Å²	85.3	45%	0.448	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-43	177.1	-58.7	0	0	0	0	111.3	I96 S97 E103 E104	I96-S100 WeakPolarHBondContact O-CB 3.44Å; I96-S100 PolarHBondContact O-N 3.35Å; I96-S100 PolarHBondContact O-OG 2.9Å; S97-S100 PolarHBondContact O-N 3.41Å; S100-E103 PolarHBondContact O-N 3.4Å; S100-E104 PolarHBondContact O-N 3.37Å
101	L	98.2	Very high	97.5	Very high	76 Å²	76	87.7 Å²	87.7	40%	0.398	44%	0.443	S	S	.	.	H	α-helix	trans	-65.2	-39.7	174.7	-179.4	62.7	0	0	0	111.8	S97 E98 E104 R105	S97-L101 PolarHBondContact O-N 3.36Å; E98-L101 PolarHBondContact O-N 2.87Å; L101-E104 PolarHBondContact O-N 2.78Å; L101-R105 HydrophobicContact CD1-CG 4.31Å; L101-R105 WeakPolarHBondContact O-CB 3.07Å; L101-R105 WeakPolarHBondContact O-CG 3.37Å; L101-R105 PolarHBondContact O-N 2.79Å
102	L	98.2	Very high	97.3	Very high	111 Å²	111	92 Å²	92	58%	0.581	47%	0.465	S	S	*	.	H	α-helix	trans	-60.5	-46.4	174.9	178.2	65.7	0	0	0	110.9	E98 L99 R105 F106	E98-L102 WeakPolarHBondContact O-CB 3.46Å; E98-L102 PolarHBondContact O-N 3.46Å; L99-L102 HydrophobicContact CD2-CD2 4.43Å; L99-L102 WeakPolarHBondContact O-CB 3.33Å; L99-L102 PolarHBondContact O-N 2.83Å; L102-R105 PolarHBondContact O-N 2.85Å; L102-F106 WeakPolarHBondContact O-CB 3.43Å; L102-F106 PolarHBondContact O-N 3.15Å
103	E	98.1	Very high	97.1	Very high	98 Å²	98	95.9 Å²	95.9	46%	0.458	48%	0.48	S	S	.	.	H	α-helix	trans	-60.4	-46.5	178.1	-175.4	-177.9	176.5	0	0	111.8	L99 S100 F106 R107	L99-E103 WeakPolarHBondContact O-CB 3.31Å; L99-E103 PolarHBondContact O-N 2.91Å; S100-E103 PolarHBondContact O-N 3.4Å; E103-F106 PolarHBondContact O-N 3.14Å; E103-R107 VanDerWaalsContact O-CG 3.31Å; E103-R107 WeakPolarHBondContact O-CG 3.41Å; E103-R107 PolarHBondContact O-N 2.86Å; E103-R107 IonicContact OE1-CZ 2.92Å; E103-R107 VanDerWaalsContact OE1-CZ 3.22Å; E103-R107 IonicContact OE1-NE 3.15Å; E103-R107 PolarHBondContact OE1-NE 2.73Å; E103-R107 VanDerWaalsContact OE1-NE 3.15Å; E103-R107 IonicContact OE1-NH2 2.63Å; E103-R107 PolarHBondContact OE1-NH2 2.91Å
104	E	98.1	Very high	96.7	Very high	124 Å²	124	99.1 Å²	99.1	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-60	-50.9	178.3	-175.7	179.6	-172.5	0	0	111.4	S100 L101 F106 R107 V108	S100-E104 PolarHBondContact O-N 3.37Å; L101-E104 PolarHBondContact O-N 2.78Å; E104-F106 VanDerWaalsContact C-N 3.29Å; E104-F106 PolarHBondContact O-N 2.9Å; E104-R107 PolarHBondContact O-N 2.63Å; E104-V108 WeakPolarHBondContact O-CG2 3.49Å; E104-V108 PolarHBondContact O-N 3.23Å
105	R	97.9	Very high	96	Very high	167 Å²	167	102.3 Å²	102.3	63%	0.63	50%	0.502	S	S	*	.	H	α-helix	trans	-62.1	-38.3	178.6	-72	-179.6	179.3	-163.1	0.9	112.1	L101 L102 V108 A109	L101-R105 HydrophobicContact CD1-CG 4.31Å; L101-R105 WeakPolarHBondContact O-CB 3.07Å; L101-R105 WeakPolarHBondContact O-CG 3.37Å; L101-R105 PolarHBondContact O-N 2.79Å; L102-R105 PolarHBondContact O-N 2.85Å; R105-V108 PolarHBondContact O-N 2.7Å; R105-A109 WeakPolarHBondContact O-CB 3.48Å; R105-A109 PolarHBondContact O-N 2.99Å
106	F	98.1	Very high	94.6	Very high	130 Å²	130	104 Å²	104	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-65.3	-41.9	177	-175.4	-108.9	0	0	0	111.6	L102 E103 E104 V108 A109 I110	L102-F106 WeakPolarHBondContact O-CB 3.43Å; L102-F106 PolarHBondContact O-N 3.15Å; E103-F106 PolarHBondContact O-N 3.14Å; E104-F106 VanDerWaalsContact C-N 3.29Å; E104-F106 PolarHBondContact O-N 2.9Å; F106-V108 PolarHBondContact O-N 2.9Å; F106-A109 PolarHBondContact O-N 3.46Å; F106-I110 HydrophobicContact CD1-CD1 3.7Å; F106-I110 HydrophobicContact CE1-CD1 3.28Å; F106-I110 HydrophobicContact CE1-CG1 4.23Å; F106-I110 HydrophobicContact CE2-CD1 4.44Å; F106-I110 HydrophobicContact CG-CD1 4.45Å; F106-I110 HydrophobicContact CZ-CD1 3.7Å; F106-I110 HydrophobicContact CZ-CG1 4.27Å; F106-I110 WeakPolarHBondContact O-CG1 3.27Å; F106-I110 PolarHBondContact O-N 3.08Å
107	R	96.8	Very high	92.6	Very high	152 Å²	152	105 Å²	105	57%	0.574	53%	0.529	S	S	*	.	H	α-helix	trans	-62.2	-40.8	174.8	-73	173.1	179	-144.6	2.8	112.2	E103 E104 I110 K111	E103-R107 VanDerWaalsContact O-CG 3.31Å; E103-R107 WeakPolarHBondContact O-CG 3.41Å; E103-R107 PolarHBondContact O-N 2.86Å; E103-R107 IonicContact OE1-CZ 2.92Å; E103-R107 VanDerWaalsContact OE1-CZ 3.22Å; E103-R107 IonicContact OE1-NE 3.15Å; E103-R107 PolarHBondContact OE1-NE 2.73Å; E103-R107 VanDerWaalsContact OE1-NE 3.15Å; E103-R107 IonicContact OE1-NH2 2.63Å; E103-R107 PolarHBondContact OE1-NH2 2.91Å; E104-R107 PolarHBondContact O-N 2.63Å; R107-I110 PolarHBondContact O-N 3.27Å; R107-K111 WeakPolarHBondContact O-CG 3.26Å; R107-K111 PolarHBondContact O-N 3.49Å
108	V	96.4	Very high	90.3	Very high	73 Å²	73	114 Å²	114	44%	0.442	56%	0.563	S	S	.	*	H	α-helix	trans	-62.8	-50.1	174.4	174	0	0	0	0	110.4	E104 R105 F106 I110 K111 D112	E104-V108 WeakPolarHBondContact O-CG2 3.49Å; E104-V108 PolarHBondContact O-N 3.23Å; R105-V108 PolarHBondContact O-N 2.7Å; F106-V108 PolarHBondContact O-N 2.9Å; V108-I110 VanDerWaalsContact C-N 3.26Å; V108-I110 PolarHBondContact O-N 3.25Å; V108-K111 WeakPolarHBondContact O-CB 3.05Å; V108-K111 PolarHBondContact O-N 2.88Å; V108-D112 PolarHBondContact O-N 2.79Å
109	A	96.1	Very high	90	Very high	54 Å²	54	114.8 Å²	114.8	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-59.4	-34.5	179.5	0	0	0	0	0	113.3	R105 F106 K113	R105-A109 WeakPolarHBondContact O-CB 3.48Å; R105-A109 PolarHBondContact O-N 2.99Å; F106-A109 PolarHBondContact O-N 3.46Å; A109-K113 WeakPolarHBondContact O-CB 3.11Å; A109-K113 PolarHBondContact O-N 3.43Å
110	I	96.6	Very high	89.6	Confident	68 Å²	68	116.1 Å²	116.1	35%	0.349	57%	0.574	S	S	.	*	H	α-helix	trans	-64.3	-45.2	173.1	-73.4	171.3	0	0	0	111.1	F106 R107 V108 K113 Q114	F106-I110 HydrophobicContact CD1-CD1 3.7Å; F106-I110 HydrophobicContact CE1-CD1 3.28Å; F106-I110 HydrophobicContact CE1-CG1 4.23Å; F106-I110 HydrophobicContact CE2-CD1 4.44Å; F106-I110 HydrophobicContact CG-CD1 4.45Å; F106-I110 HydrophobicContact CZ-CD1 3.7Å; F106-I110 HydrophobicContact CZ-CG1 4.27Å; F106-I110 WeakPolarHBondContact O-CG1 3.27Å; F106-I110 PolarHBondContact O-N 3.08Å; R107-I110 PolarHBondContact O-N 3.27Å; V108-I110 VanDerWaalsContact C-N 3.26Å; V108-I110 PolarHBondContact O-N 3.25Å; I110-K113 PolarHBondContact O-N 2.93Å; I110-Q114 WeakPolarHBondContact O-CG 3.26Å; I110-Q114 PolarHBondContact O-N 2.8Å
111	K	94.7	Very high	89.1	Confident	126 Å²	126	119 Å²	119	55%	0.548	58%	0.581	S	S	.	*	H	α-helix	trans	-63.5	-48.7	178.7	-70.3	177	179.2	-176.7	0	111.1	R107 V108 K113 Q114 E115	R107-K111 WeakPolarHBondContact O-CG 3.26Å; R107-K111 PolarHBondContact O-N 3.49Å; V108-K111 WeakPolarHBondContact O-CB 3.05Å; V108-K111 PolarHBondContact O-N 2.88Å; K111-K113 PolarHBondContact O-N 2.94Å; K111-Q114 PolarHBondContact O-N 3.11Å; K111-E115 PolarHBondContact O-N 3.18Å
112	D	94.2	Very high	88.6	Confident	97 Å²	97	121.5 Å²	121.5	52%	0.519	59%	0.592	S	S	.	*	H	α-helix	trans	-57.2	-39.3	177.7	-63.8	-10.2	0	0	0	111	V108 G116	V108-D112 PolarHBondContact O-N 2.79Å; D112-G116 PolarHBondContact O-N 3.06Å
113	K	93.3	Very high	88	Confident	139 Å²	139	122.2 Å²	122.2	60%	0.604	59%	0.592	S	S	*	*	H	α-helix	trans	-70.3	-32.6	176.9	-174.3	56.3	180	171.2	0	112.9	A109 I110 K111 I117	A109-K113 WeakPolarHBondContact O-CB 3.11Å; A109-K113 PolarHBondContact O-N 3.43Å; I110-K113 PolarHBondContact O-N 2.93Å; K111-K113 PolarHBondContact O-N 2.94Å; K113-I117 HydrophobicContact CD-CG1 4.48Å; K113-I117 WeakPolarHBondContact O-CD1 3.2Å; K113-I117 WeakPolarHBondContact O-CG1 3.4Å
114	Q	90.8	Very high	87.3	Confident	139 Å²	139	123.8 Å²	123.8	65%	0.65	60%	0.601	S	S	*	*	H	α-helix	trans	-73	-36.2	177.1	-73.6	171.4	-9.6	0	0	112	I110 K111	I110-Q114 WeakPolarHBondContact O-CG 3.26Å; I110-Q114 PolarHBondContact O-N 2.8Å; K111-Q114 PolarHBondContact O-N 3.11Å
115	E	82.8	Confident	86.5	Confident	157 Å²	157	123.8 Å²	123.8	73%	0.734	60%	0.603	S	S	*	*	H	α-helix	trans	-80.5	-32.4	179	-66.4	178.3	-178.1	0	0	112.5	K111 I117	K111-E115 PolarHBondContact O-N 3.18Å; E115-I117 VanDerWaalsContact C-N 3.34Å; E115-I117 PolarHBondContact O-N 2.98Å
116	G	67.3	Low	85.6	Confident	54 Å²	54	120.5 Å²	120.5	56%	0.557	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	18.6	179.6	0	0	0	0	0	115.6	D112 E118	D112-G116 PolarHBondContact O-N 3.06Å; G116-E118 PolarHBondContact O-N 3.25Å
117	I	56	Low	84.6	Confident	118 Å²	118	119.7 Å²	119.7	61%	0.605	60%	0.603	S	S	*	*			trans	-94.8	78.7	165.5	-64.2	158	0	0	0	107.2	K113 E115	K113-I117 HydrophobicContact CD-CG1 4.48Å; K113-I117 WeakPolarHBondContact O-CD1 3.2Å; K113-I117 WeakPolarHBondContact O-CG1 3.4Å; E115-I117 VanDerWaalsContact C-N 3.34Å; E115-I117 PolarHBondContact O-N 2.98Å
118	E	50.3	Low	83.5	Confident	259 Å²	259	116.7 Å²	116.7	100%	1.21	61%	0.606	S	S	*	*			trans	-110.8	0	145.3	-79.2	-168.9	158.8	0	0	108.2	G116	G116-E118 PolarHBondContact O-N 3.25Å

Retrieved 118 of 118 residues in 157.7 ms (Link to these results)

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