A0A087WZP4_HUMAN Loading...

Family with sequence similarity 72 member B

AlphaFold DB , UniProt , Accession A0A087WZP4, Species HUMAN (Homo sapiens, Human), Gene FAM72B, Length 94 aa.

						>A0A087WZP4_HUMAN|A0A087WZP4|FAM72B
MSTNICSFKDRCVSILCCKFCKQVLSSRGMKAVLLADTEIDLFSTDIPPTNAVDFTGRCYFTKICKCKLKDIACLKWCKHPTLGQLARDRREYR
					

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(Predicted Aligned Error values between residue pairs)

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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	37.5	Very low	57.9	Low	238 Å²	238	136.2 Å²	136.2	100%	1.172	71%	0.71	S	S	*	*				0	104.1	0	-73.2	-173.4	169.2	0	0	107.6	T3	M1-T3 PolarHBondContact O-N 3.44Å
2	S	45.5	Very low	59	Low	127 Å²	127	134.8 Å²	134.8	89%	0.888	72%	0.718	S	S	*	*			trans	-73	112.1	178	-63.1	0	0	0	0	108.8	N4	S2-N4 PolarHBondContact O-N 2.94Å
3	T	54.8	Low	61.1	Low	118 Å²	118	130.8 Å²	130.8	72%	0.724	70%	0.702	S	S	*	*			trans	-63.2	103.5	166.3	41.6	0	0	0	0	107	M1 I5	M1-T3 PolarHBondContact O-N 3.44Å; T3-I5 PolarHBondContact O-N 2.84Å
4	N	58.8	Low	63.1	Low	154 Å²	154	124.6 Å²	124.6	82%	0.824	67%	0.673	S	S	*	*			trans	-70.8	85	171.8	-154.5	-70.1	0	0	0	106.5	S2 C6	S2-N4 PolarHBondContact O-N 2.94Å; N4-C6 VanDerWaalsContact C-N 3.28Å; N4-C6 PolarHBondContact O-N 3Å
5	I	61.2	Low	64.9	Low	143 Å²	143	123.9 Å²	123.9	73%	0.733	67%	0.668	S	S	*	*			trans	-72.3	91.3	176.9	-59.6	169.1	0	0	0	105.7	T3 S7	T3-I5 PolarHBondContact O-N 2.84Å; I5-S7 PolarHBondContact O-N 3.25Å
6	C	61.1	Low	66.4	Low	75 Å²	75	118.6 Å²	118.6	51%	0.507	64%	0.638	S	S	.	*			trans	-61.5	119	169.7	67.9	0	0	0	0	108.2	N4	N4-C6 VanDerWaalsContact C-N 3.28Å; N4-C6 PolarHBondContact O-N 3Å
7	S	64.6	Low	67.8	Low	52 Å²	52	115.6 Å²	115.6	36%	0.364	63%	0.628	S	S	.	*			trans	-66.8	150.7	171.2	170.6	0	0	0	0	108.3	I5 K9 D10	I5-S7 PolarHBondContact O-N 3.25Å; S7-K9 PolarHBondContact O-N 2.7Å; S7-K9 PolarHBondContact OG-N 2.95Å; S7-D10 VanDerWaalsContact CB-OD2 3.26Å; S7-D10 WeakPolarHBondContact CB-OD2 3.04Å; S7-D10 PolarHBondContact N-OD2 3.18Å; S7-D10 WeakPolarHBondContact O-CB 3.48Å; S7-D10 PolarHBondContact O-N 3.27Å
8	F	60.1	Low	68.9	Low	150 Å²	150	109.8 Å²	109.8	66%	0.658	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-53.8	-29.5	171.4	-177.3	-96.7	0	0	0	111.8	D10 R11 M30	F8-D10 PolarHBondContact O-N 3.28Å; F8-R11 PolarHBondContact O-N 3.34Å; F8-M30 HydrophobicContact CE2-SD 4.48Å; F8-M30 HydrophobicContact CZ-SD 4.46Å
9	K	62.3	Low	69.8	Low	187 Å²	187	112.9 Å²	112.9	81%	0.813	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-66.5	-20.6	175.7	-61.8	-175.6	179.9	-179.4	0	113.8	S7	S7-K9 PolarHBondContact O-N 2.7Å; S7-K9 PolarHBondContact OG-N 2.95Å
10	D	62.5	Low	70.6	Confident	105 Å²	105	113.2 Å²	113.2	56%	0.561	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-87.8	-7.3	-178.7	-56.2	-34.8	0	0	0	112.4	S7 F8 C12	S7-D10 VanDerWaalsContact CB-OD2 3.26Å; S7-D10 WeakPolarHBondContact CB-OD2 3.04Å; S7-D10 PolarHBondContact N-OD2 3.18Å; S7-D10 WeakPolarHBondContact O-CB 3.48Å; S7-D10 PolarHBondContact O-N 3.27Å; F8-D10 PolarHBondContact O-N 3.28Å; D10-C12 PolarHBondContact O-N 2.86Å
11	R	69	Low	71.2	Confident	149 Å²	149	109.2 Å²	109.2	56%	0.562	58%	0.581	S	S	*	*	S	Bend	trans	-71.3	122.1	176.7	-67.4	-165.6	177.8	-163.9	1	109.8	F8 V13	F8-R11 PolarHBondContact O-N 3.34Å; R11-V13 PolarHBondContact O-N 3.33Å
12	C	71.2	Confident	73.6	Confident	120 Å²	120	104.9 Å²	104.9	81%	0.811	56%	0.556	S	S	*	*			trans	-60.6	106.6	178.6	-60.2	0	0	0	0	110.9	D10	D10-C12 PolarHBondContact O-N 2.86Å
13	V	85.1	Confident	75.6	Confident	83 Å²	83	101.3 Å²	101.3	50%	0.503	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-84.6	139.2	167	-66.9	0	0	0	0	109.6	R11 M30	R11-V13 PolarHBondContact O-N 3.33Å; V13-M30 HydrophobicContact CG1-CG 4.39Å
14	S	89	Confident	77.2	Confident	44 Å²	44	99.5 Å²	99.5	31%	0.308	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	141.8	176.6	-60.6	0	0	0	0	110.2	G29	S14-G29 PolarHBondContact N-O 3.33Å; S14-G29 WeakPolarHBondContact O-CA 3.46Å; S14-G29 PolarHBondContact O-N 3.33Å
15	I	90.4	Very high	78.6	Confident	114 Å²	114	94.1 Å²	94.1	59%	0.585	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	118.9	168.1	-57.6	177.2	0	0	0	107.8	V24 S26	I15-V24 HydrophobicContact CG2-CG1 3.83Å; I15-V24 HydrophobicContact CG2-CG2 4.24Å; I15-S26 CarbonylContact C-O 3.58Å; I15-S26 WeakPolarHBondContact CA-O 3.23Å
16	L	89.7	Confident	79.9	Confident	38 Å²	38	87.9 Å²	87.9	20%	0.199	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.9	176.2	-55.3	-177	0	0	0	109.4	L25 S26 F43 T45	L16-L25 PolarHBondContact O-N 2.78Å; L16-S26 PolarHBondContact N-O 3.13Å; L16-S26 PolarHBondContact O-N 3.24Å; L16-F43 HydrophobicContact CD1-CB 3.83Å; L16-F43 HydrophobicContact CD1-CG 4.33Å; L16-F43 HydrophobicContact CD2-CB 4.02Å; L16-F43 HydrophobicContact CD2-CD1 3.73Å; L16-F43 HydrophobicContact CD2-CD2 3.83Å; L16-F43 HydrophobicContact CD2-CE1 4.1Å; L16-F43 HydrophobicContact CD2-CE2 4.2Å; L16-F43 HydrophobicContact CD2-CG 3.58Å; L16-F43 HydrophobicContact CD2-CZ 4.33Å; L16-T45 HydrophobicContact CD1-CG2 3.94Å
17	C	90.1	Very high	81.3	Confident	68 Å²	68	87.7 Å²	87.7	46%	0.459	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.2	177.6	-64.2	0	0	0	0	110.9	K19 Q23	C17-K19 PolarHBondContact O-N 2.78Å; C17-Q23 CarbonylContact C-O 3.56Å; C17-Q23 WeakPolarHBondContact CA-O 3.41Å
18	C	87.6	Confident	82.3	Confident	11 Å²	11	89.7 Å²	89.7	7%	0.074	45%	0.453	C	S	.	.			trans	-61.7	126	169.5	-179	0	0	0	0	109.4	F20 C21 K22 Q23 L25 C74	C18-F20 PolarHBondContact O-N 3.4Å; C18-F20 VanDerWaalsContact O-N 3.11Å; C18-C21 WeakPolarHBondContact CB-SG 3.22Å; C18-C21 VanDerWaalsContact SG-SG 3.6Å; C18-K22 WeakPolarHBondContact O-CA 3.41Å; C18-K22 PolarHBondContact O-N 3.4Å; C18-Q23 PolarHBondContact N-O 3.19Å; C18-L25 HydrophobicContact CB-CD1 4.3Å; C18-L25 HydrophobicContact CB-CD2 4.15Å; C18-L25 HydrophobicContact CB-CG 4.35Å; C18-C74 HydrophobicContact CB-CB 4.02Å
19	K	85.8	Confident	83.7	Confident	170 Å²	170	82.6 Å²	82.6	74%	0.739	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-34.3	179.4	-173.9	171.1	-179.2	172	0	112.7	C17 K22	C17-K19 PolarHBondContact O-N 2.78Å; K19-K22 PolarHBondContact O-NZ 3.23Å
20	F	85	Confident	85.1	Confident	117 Å²	117	76.4 Å²	76.4	51%	0.513	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-60.4	-172.6	-58.9	-81.9	0	0	0	113.5	C18 W77	C18-F20 PolarHBondContact O-N 3.4Å; C18-F20 VanDerWaalsContact O-N 3.11Å; F20-W77 HydrophobicContact CB-CD2 3.88Å; F20-W77 HydrophobicContact CB-CE3 3.55Å; F20-W77 HydrophobicContact CB-CH2 3.9Å; F20-W77 HydrophobicContact CB-CZ2 4.2Å; F20-W77 HydrophobicContact CB-CZ3 3.58Å; F20-W77 HydrophobicContact CD1-CH2 4.15Å; F20-W77 HydrophobicContact CD1-CZ2 4.07Å; F20-W77 HydrophobicContact CG-CD2 4.45Å; F20-W77 HydrophobicContact CG-CH2 4.37Å; F20-W77 HydrophobicContact CG-CZ2 4.31Å; F20-W77 HydrophobicContact CG-CZ3 4.49Å
21	C	84.1	Confident	86.3	Confident	31 Å²	31	77.1 Å²	77.1	21%	0.209	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-0.2	-175.5	70.3	0	0	0	0	114.1	C18 Q23 C74 K76 W77	C18-C21 WeakPolarHBondContact CB-SG 3.22Å; C18-C21 VanDerWaalsContact SG-SG 3.6Å; C21-Q23 PolarHBondContact O-N 3.25Å; C21-Q23 WeakPolarHBondContact SG-CB 3.26Å; C21-C74 PolarHBondContact SG-SG 2.95Å; C21-K76 HydrophobicContact CB-CD 4.4Å; C21-W77 HydrophobicContact CB-CE3 4.25Å
22	K	88.4	Confident	87.1	Confident	147 Å²	147	71.9 Å²	71.9	64%	0.639	38%	0.383	S	S	*	.			trans	58.2	8.7	-177.9	-52.3	-55	-172.8	-168.6	0	115.5	C18 K19 V24	C18-K22 WeakPolarHBondContact O-CA 3.41Å; C18-K22 PolarHBondContact O-N 3.4Å; K19-K22 PolarHBondContact O-NZ 3.23Å; K22-V24 PolarHBondContact O-N 2.96Å
23	Q	87.1	Confident	87.7	Confident	52 Å²	52	70.2 Å²	70.2	24%	0.243	37%	0.369	C	S	.	.			trans	-59.4	134.5	174.2	179.2	175.1	3.8	0	0	110.4	C17 C18 C21 L25 C74 K76	C17-Q23 CarbonylContact C-O 3.56Å; C17-Q23 WeakPolarHBondContact CA-O 3.41Å; C18-Q23 PolarHBondContact N-O 3.19Å; C21-Q23 PolarHBondContact O-N 3.25Å; C21-Q23 WeakPolarHBondContact SG-CB 3.26Å; Q23-L25 PolarHBondContact O-N 3.46Å; Q23-C74 PolarHBondContact OE1-SG 2.89Å; Q23-K76 HydrophobicContact CB-CD 4.46Å
24	V	88.6	Confident	87.5	Confident	79 Å²	79	70 Å²	70	48%	0.479	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	118.9	169.5	-179.6	0	0	0	0	108.6	I15 K22	I15-V24 HydrophobicContact CG2-CG1 3.83Å; I15-V24 HydrophobicContact CG2-CG2 4.24Å; K22-V24 PolarHBondContact O-N 2.96Å
25	L	88.6	Confident	87.3	Confident	41 Å²	41	76.5 Å²	76.5	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-42.4	176.2	-53.3	-176.5	0	0	0	110.1	L16 C18 Q23 P49 A52 V53 C74	L16-L25 PolarHBondContact O-N 2.78Å; C18-L25 HydrophobicContact CB-CD1 4.3Å; C18-L25 HydrophobicContact CB-CD2 4.15Å; C18-L25 HydrophobicContact CB-CG 4.35Å; Q23-L25 PolarHBondContact O-N 3.46Å; L25-P49 HydrophobicContact CB-CB 4.45Å; L25-P49 HydrophobicContact CB-CG 4.47Å; L25-P49 WeakPolarHBondContact O-CB 3.39Å; L25-P49 WeakPolarHBondContact O-CG 3.31Å; L25-A52 HydrophobicContact CD2-CB 4.07Å; L25-V53 HydrophobicContact CB-CG1 4.41Å; L25-V53 HydrophobicContact CD1-CG1 4.1Å; L25-V53 HydrophobicContact CD2-CG1 3.74Å; L25-V53 HydrophobicContact CG-CG1 4.29Å; L25-C74 HydrophobicContact CD2-CB 4.18Å
26	S	88.8	Confident	86.9	Confident	12 Å²	12	76.2 Å²	76.2	8%	0.084	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	142	175.1	179.8	0	0	0	0	110.1	I15 L16 R28	I15-S26 CarbonylContact C-O 3.58Å; I15-S26 WeakPolarHBondContact CA-O 3.23Å; L16-S26 PolarHBondContact N-O 3.13Å; L16-S26 PolarHBondContact O-N 3.24Å; S26-R28 PolarHBondContact OG-N 3.15Å; S26-R28 VanDerWaalsContact OG-N 3.12Å
27	S	88.4	Confident	86.4	Confident	71 Å²	71	77 Å²	77	50%	0.497	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	1.1	170.5	52.4	0	0	0	0	112.9
28	R	87.3	Confident	86.1	Confident	95 Å²	95	78.9 Å²	78.9	36%	0.358	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	36.5	-170.9	-59.6	-173.8	-60.4	149	21.8	112	S26 M30 D46	S26-R28 PolarHBondContact OG-N 3.15Å; S26-R28 VanDerWaalsContact OG-N 3.12Å; R28-M30 PolarHBondContact O-N 3.01Å; R28-D46 VanDerWaalsContact CZ-CG 3.46Å; R28-D46 IonicContact CZ-OD1 3.12Å; R28-D46 IonicContact CZ-OD2 3Å; R28-D46 IonicContact NE-OD1 3.93Å; R28-D46 IonicContact NE-OD2 2.7Å; R28-D46 IonicContact NH1-OD1 3.71Å; R28-D46 IonicContact NH1-OD2 2.74Å; R28-D46 PolarHBondContact NH1-OD2 3.42Å; R28-D46 IonicContact NH2-OD1 2.69Å; R28-D46 PolarHBondContact NH2-OD1 2.83Å; R28-D46 IonicContact NH2-OD2 2.88Å; R28-D46 PolarHBondContact NH2-OD2 3.27Å
29	G	89.4	Confident	86.1	Confident	0 Å²	0	86.9 Å²	86.9	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.3	177.8	0	0	0	0	0	111.3	S14	S14-G29 PolarHBondContact N-O 3.33Å; S14-G29 WeakPolarHBondContact O-CA 3.46Å; S14-G29 PolarHBondContact O-N 3.33Å
30	M	90.1	Very high	86	Confident	58 Å²	58	82.9 Å²	82.9	29%	0.286	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	127.2	170.7	-65.2	-168.6	-59.1	0	0	109.4	F8 V13 R28 A32 F43 S44	F8-M30 HydrophobicContact CE2-SD 4.48Å; F8-M30 HydrophobicContact CZ-SD 4.46Å; V13-M30 HydrophobicContact CG1-CG 4.39Å; R28-M30 PolarHBondContact O-N 3.01Å; M30-A32 PolarHBondContact O-N 3.32Å; M30-F43 CarbonylContact O-C 3.48Å; M30-F43 VanDerWaalsContact O-CA 3.23Å; M30-F43 WeakPolarHBondContact O-CA 3.45Å; M30-S44 PolarHBondContact N-O 3.33Å; M30-S44 PolarHBondContact O-N 3.27Å
31	K	88.3	Confident	86	Confident	120 Å²	120	81.9 Å²	81.9	52%	0.522	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	124.9	176.2	-171.5	171.4	-175.7	163.7	0	109.7	V33 D41 F43	K31-V33 HydrophobicContact CG-CG2 4.37Å; K31-D41 WeakPolarHBondContact CE-OD1 3.48Å; K31-D41 IonicContact NZ-OD1 3.51Å; K31-D41 PolarHBondContact NZ-OD1 2.76Å; K31-F43 HydrophobicContact CB-CD1 4.16Å; K31-F43 HydrophobicContact CB-CE1 3.92Å; K31-F43 HydrophobicContact CG-CE1 4.21Å
32	A	86.6	Confident	86.2	Confident	38 Å²	38	83.5 Å²	83.5	31%	0.314	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138	169.7	0	0	0	0	0	108	M30 L42	M30-A32 PolarHBondContact O-N 3.32Å; A32-L42 HydrophobicContact CB-CB 4.02Å; A32-L42 PolarHBondContact N-O 3.48Å; A32-L42 CarbonylContact O-C 3.53Å; A32-L42 WeakPolarHBondContact O-CB 3.28Å; A32-L42 PolarHBondContact O-N 2.73Å
33	V	83.9	Confident	86.2	Confident	86 Å²	86	80.1 Å²	80.1	52%	0.521	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.7	178.9	-179.6	0	0	0	0	107.3	K31 T38	K31-V33 HydrophobicContact CG-CG2 4.37Å; V33-T38 HydrophobicContact CG1-CG2 3.94Å
34	L	80.9	Confident	86.2	Confident	79 Å²	79	80.5 Å²	80.5	41%	0.414	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	129.2	169.2	-59.2	176.9	0	0	0	108.1	A36 D37 L42	L34-A36 PolarHBondContact O-N 3.34Å; L34-D37 HydrophobicContact CB-CB 4.48Å; L34-D37 WeakPolarHBondContact CB-O 3.42Å; L34-D37 CarbonylContact O-C 3.33Å; L34-D37 PolarHBondContact O-N 2.86Å; L34-D37 VanDerWaalsContact O-O 3.07Å; L34-L42 HydrophobicContact CD1-CD1 3.74Å; L34-L42 HydrophobicContact CD2-CD1 3.62Å; L34-L42 HydrophobicContact CG-CD1 3.48Å; L34-L42 VanDerWaalsContact CG-CD1 3.48Å; L34-L42 HydrophobicContact CG-CG 4.47Å
35	L	83.5	Confident	86.1	Confident	180 Å²	180	79 Å²	79	94%	0.942	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-25.9	176.7	-62	178.9	0	0	0	112.4
36	A	82.3	Confident	85.8	Confident	107 Å²	107	81.8 Å²	81.8	88%	0.884	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-16.1	179.8	0	0	0	0	0	113.7	L34	L34-A36 PolarHBondContact O-N 3.34Å
37	D	79.3	Confident	85.3	Confident	56 Å²	56	85.3 Å²	85.3	30%	0.299	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	105	-177.6	-175.9	-12.1	0	0	0	109.9	L34 E39 I40	L34-D37 HydrophobicContact CB-CB 4.48Å; L34-D37 WeakPolarHBondContact CB-O 3.42Å; L34-D37 CarbonylContact O-C 3.33Å; L34-D37 PolarHBondContact O-N 2.86Å; L34-D37 VanDerWaalsContact O-O 3.07Å; D37-E39 WeakPolarHBondContact OD1-CB 3.48Å; D37-E39 PolarHBondContact OD1-N 2.97Å; D37-I40 PolarHBondContact OD1-N 3.06Å; D37-I40 VanDerWaalsContact OD2-CD1 3.22Å; D37-I40 WeakPolarHBondContact OD2-CD1 3.2Å; D37-I40 WeakPolarHBondContact OD2-CG1 3.32Å
38	T	84.7	Confident	84.6	Confident	106 Å²	106	86.6 Å²	86.6	65%	0.65	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	-3.3	179.9	58.4	0	0	0	0	113.2	V33	V33-T38 HydrophobicContact CG1-CG2 3.94Å
39	E	88.1	Confident	84	Confident	180 Å²	180	83.2 Å²	83.2	84%	0.841	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	-26.7	178.9	-60.9	-170.5	172.4	0	0	111.3	D37	D37-E39 WeakPolarHBondContact OD1-CB 3.48Å; D37-E39 PolarHBondContact OD1-N 2.97Å
40	I	83.1	Confident	83.2	Confident	86 Å²	86	88 Å²	88	44%	0.441	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.2	177.6	-54.8	-177.5	0	0	0	110.4	D37 L42	D37-I40 PolarHBondContact OD1-N 3.06Å; D37-I40 VanDerWaalsContact OD2-CD1 3.22Å; D37-I40 WeakPolarHBondContact OD2-CD1 3.2Å; D37-I40 WeakPolarHBondContact OD2-CG1 3.32Å; I40-L42 HydrophobicContact CG2-CD2 3.86Å; I40-L42 HydrophobicContact CG2-CG 4.19Å; I40-L42 PolarHBondContact O-N 2.99Å
41	D	84.9	Confident	82.5	Confident	95 Å²	95	91.9 Å²	91.9	51%	0.508	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	111.9	168.1	-78	-34.4	0	0	0	110.6	K31 F43	K31-D41 WeakPolarHBondContact CE-OD1 3.48Å; K31-D41 IonicContact NZ-OD1 3.51Å; K31-D41 PolarHBondContact NZ-OD1 2.76Å; D41-F43 HydrophobicContact CB-CE2 3.88Å; D41-F43 HydrophobicContact CB-CZ 4.46Å
42	L	88	Confident	82.2	Confident	66 Å²	66	86.4 Å²	86.4	35%	0.346	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	150.7	170	-63.8	-177.1	0	0	0	110.8	A32 L34 I40	A32-L42 HydrophobicContact CB-CB 4.02Å; A32-L42 PolarHBondContact N-O 3.48Å; A32-L42 CarbonylContact O-C 3.53Å; A32-L42 WeakPolarHBondContact O-CB 3.28Å; A32-L42 PolarHBondContact O-N 2.73Å; L34-L42 HydrophobicContact CD1-CD1 3.74Å; L34-L42 HydrophobicContact CD2-CD1 3.62Å; L34-L42 HydrophobicContact CG-CD1 3.48Å; L34-L42 VanDerWaalsContact CG-CD1 3.48Å; L34-L42 HydrophobicContact CG-CG 4.47Å; I40-L42 HydrophobicContact CG2-CD2 3.86Å; I40-L42 HydrophobicContact CG2-CG 4.19Å; I40-L42 PolarHBondContact O-N 2.99Å
43	F	89.2	Confident	82.1	Confident	76 Å²	76	85.8 Å²	85.8	33%	0.333	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.4	174.8	-63.7	-92.4	0	0	0	110.2	L16 M30 K31 D41	L16-F43 HydrophobicContact CD1-CB 3.83Å; L16-F43 HydrophobicContact CD1-CG 4.33Å; L16-F43 HydrophobicContact CD2-CB 4.02Å; L16-F43 HydrophobicContact CD2-CD1 3.73Å; L16-F43 HydrophobicContact CD2-CD2 3.83Å; L16-F43 HydrophobicContact CD2-CE1 4.1Å; L16-F43 HydrophobicContact CD2-CE2 4.2Å; L16-F43 HydrophobicContact CD2-CG 3.58Å; L16-F43 HydrophobicContact CD2-CZ 4.33Å; M30-F43 CarbonylContact O-C 3.48Å; M30-F43 VanDerWaalsContact O-CA 3.23Å; M30-F43 WeakPolarHBondContact O-CA 3.45Å; K31-F43 HydrophobicContact CB-CD1 4.16Å; K31-F43 HydrophobicContact CB-CE1 3.92Å; K31-F43 HydrophobicContact CG-CE1 4.21Å; D41-F43 HydrophobicContact CB-CE2 3.88Å; D41-F43 HydrophobicContact CB-CZ 4.46Å
44	S	86.3	Confident	82.1	Confident	60 Å²	60	85.9 Å²	85.9	42%	0.42	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.7	171.1	-176.4	0	0	0	0	109.5	M30	M30-S44 PolarHBondContact N-O 3.33Å; M30-S44 PolarHBondContact O-N 3.27Å
45	T	86.8	Confident	82.3	Confident	48 Å²	48	87.8 Å²	87.8	29%	0.294	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.4	173.4	58.6	0	0	0	0	108.5	L16 I47	L16-T45 HydrophobicContact CD1-CG2 3.94Å; T45-I47 VanDerWaalsContact C-N 3.35Å
46	D	82.2	Confident	82.4	Confident	99 Å²	99	80.4 Å²	80.4	53%	0.529	45%	0.452	S	S	.	.	S	Bend	trans	-77.2	-20.2	178.4	65.8	-38.7	0	0	0	113.2	R28	R28-D46 VanDerWaalsContact CZ-CG 3.46Å; R28-D46 IonicContact CZ-OD1 3.12Å; R28-D46 IonicContact CZ-OD2 3Å; R28-D46 IonicContact NE-OD1 3.93Å; R28-D46 IonicContact NE-OD2 2.7Å; R28-D46 IonicContact NH1-OD1 3.71Å; R28-D46 IonicContact NH1-OD2 2.74Å; R28-D46 PolarHBondContact NH1-OD2 3.42Å; R28-D46 IonicContact NH2-OD1 2.69Å; R28-D46 PolarHBondContact NH2-OD1 2.83Å; R28-D46 IonicContact NH2-OD2 2.88Å; R28-D46 PolarHBondContact NH2-OD2 3.27Å
47	I	77.6	Confident	82.4	Confident	85 Å²	85	78.3 Å²	78.3	44%	0.436	44%	0.44	S	S	.	.	S	Bend	trans	-131	134.8	173.5	-64.8	179.7	0	0	0	108.9	T45	T45-I47 VanDerWaalsContact C-N 3.35Å
48	P	73.6	Confident	82.7	Confident	98 Å²	98	86.5 Å²	86.5	64%	0.636	47%	0.467	S	S	*	.			trans	-58.9	140	174.9	23	-32.7	0	0	0	110.7	T50	P48-T50 VanDerWaalsContact C-N 3.28Å; P48-T50 PolarHBondContact O-N 2.76Å; P48-T50 PolarHBondContact O-OG1 3.11Å
49	P	75.1	Confident	83	Confident	24 Å²	24	83.8 Å²	83.8	16%	0.156	45%	0.451	C	S	.	.			trans	-57.1	78.7	173.8	-30	38.3	0	0	0	114.3	L25 N51 A52 V53	L25-P49 HydrophobicContact CB-CB 4.45Å; L25-P49 HydrophobicContact CB-CG 4.47Å; L25-P49 WeakPolarHBondContact O-CB 3.39Å; L25-P49 WeakPolarHBondContact O-CG 3.31Å; P49-N51 PolarHBondContact O-N 3.26Å; P49-A52 HydrophobicContact CB-CB 4.17Å; P49-A52 PolarHBondContact O-N 3Å; P49-V53 HydrophobicContact CB-CB 4.43Å; P49-V53 HydrophobicContact CB-CG1 4.01Å; P49-V53 HydrophobicContact CB-CG2 3.73Å; P49-V53 HydrophobicContact CG-CG1 4.46Å; P49-V53 HydrophobicContact CG-CG2 4.13Å; P49-V53 PolarHBondContact O-N 2.81Å
50	T	72.3	Confident	83.2	Confident	102 Å²	102	80.2 Å²	80.2	63%	0.626	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	128.9	-174.1	-43.1	0	0	0	0	110.5	P48 A52	P48-T50 VanDerWaalsContact C-N 3.28Å; P48-T50 PolarHBondContact O-N 2.76Å; P48-T50 PolarHBondContact O-OG1 3.11Å; T50-A52 PolarHBondContact O-N 2.99Å
51	N	76.7	Confident	83.6	Confident	138 Å²	138	82.2 Å²	82.2	74%	0.738	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	1.9	179.4	-52.5	-33.4	0	0	0	116.1	P49	P49-N51 PolarHBondContact O-N 3.26Å
52	A	80.8	Confident	83.6	Confident	6 Å²	6	79.7 Å²	79.7	5%	0.05	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-30.8	178.6	0	0	0	0	0	112.8	L25 P49 T50 C74 L75	L25-A52 HydrophobicContact CD2-CB 4.07Å; P49-A52 HydrophobicContact CB-CB 4.17Å; P49-A52 PolarHBondContact O-N 3Å; T50-A52 PolarHBondContact O-N 2.99Å; A52-C74 CarbonylContact O-C 3.54Å; A52-C74 VanDerWaalsContact O-CA 3.32Å; A52-C74 WeakPolarHBondContact O-CA 3.25Å; A52-C74 PolarHBondContact O-SG 2.92Å; A52-C74 VanDerWaalsContact O-SG 3.41Å; A52-L75 PolarHBondContact O-N 3.24Å
53	V	84.6	Confident	83.6	Confident	24 Å²	24	85.6 Å²	85.6	15%	0.145	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	160.2	177.7	-51.8	0	0	0	0	110.9	L25 P49 I72 A73	L25-V53 HydrophobicContact CB-CG1 4.41Å; L25-V53 HydrophobicContact CD1-CG1 4.1Å; L25-V53 HydrophobicContact CD2-CG1 3.74Å; L25-V53 HydrophobicContact CG-CG1 4.29Å; P49-V53 HydrophobicContact CB-CB 4.43Å; P49-V53 HydrophobicContact CB-CG1 4.01Å; P49-V53 HydrophobicContact CB-CG2 3.73Å; P49-V53 HydrophobicContact CG-CG1 4.46Å; P49-V53 HydrophobicContact CG-CG2 4.13Å; P49-V53 PolarHBondContact O-N 2.81Å; V53-I72 HydrophobicContact CB-CB 4.48Å; V53-I72 HydrophobicContact CG2-CB 4.4Å; V53-I72 HydrophobicContact CG2-CD1 4.1Å; V53-A73 CarbonylContact C-O 3.59Å; V53-A73 WeakPolarHBondContact CA-O 3.31Å; V53-A73 WeakPolarHBondContact CB-O 3.42Å
54	D	84.5	Confident	83.4	Confident	88 Å²	88	90 Å²	90	47%	0.471	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160.2	167.9	-165.5	2.6	0	0	0	109.7	I72 A73 L75	D54-I72 CarbonylContact O-C 3.52Å; D54-I72 VanDerWaalsContact O-CA 3.28Å; D54-I72 WeakPolarHBondContact O-CA 3.28Å; D54-A73 PolarHBondContact N-O 3.19Å; D54-A73 PolarHBondContact O-N 2.97Å; D54-L75 HydrophobicContact CB-CD1 4.2Å; D54-L75 HydrophobicContact CB-CD2 3.46Å; D54-L75 VanDerWaalsContact CB-CD2 3.46Å; D54-L75 HydrophobicContact CB-CG 3.86Å
55	F	84.8	Confident	83.5	Confident	120 Å²	120	91 Å²	91	53%	0.526	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	141.9	176.3	-63.3	-67.6	0	0	0	111.3	K70 D71 I72	F55-K70 HydrophobicContact CB-CD 3.65Å; F55-K70 VanDerWaalsContact CB-CE 3.43Å; F55-K70 HydrophobicContact CB-CG 4.14Å; F55-K70 VanDerWaalsContact CB-NZ 3.34Å; F55-K70 HydrophobicContact CD1-CB 4.04Å; F55-K70 HydrophobicContact CD1-CD 3.58Å; F55-K70 HydrophobicContact CD1-CG 3.83Å; F55-K70 HydrophobicContact CD2-CD 4.38Å; F55-K70 HydrophobicContact CE1-CB 4.42Å; F55-K70 HydrophobicContact CE1-CD 4.31Å; F55-K70 HydrophobicContact CG-CD 3.63Å; F55-K70 HydrophobicContact CG-CG 4.25Å; F55-D71 CarbonylContact C-O 3.5Å; F55-D71 VanDerWaalsContact CA-O 3.32Å; F55-D71 WeakPolarHBondContact CA-O 3.47Å; F55-I72 HydrophobicContact CD1-CG2 3.52Å; F55-I72 HydrophobicContact CE1-CG2 3.82Å; F55-I72 HydrophobicContact CG-CG2 4.41Å
56	T	85.3	Confident	83.6	Confident	25 Å²	25	95.7 Å²	95.7	15%	0.153	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	145.4	177.3	68.2	0	0	0	0	110.9	D71 A73 R91	T56-D71 PolarHBondContact N-O 2.83Å; T56-A73 HydrophobicContact CG2-CB 3.39Å; T56-R91 PolarHBondContact OG1-NH1 3.31Å
57	G	81.9	Confident	83.9	Confident	62 Å²	62	93.9 Å²	93.9	64%	0.639	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	68	-163.2	178.2	0	0	0	0	0	114
58	R	86.3	Confident	84.5	Confident	228 Å²	228	96.5 Å²	96.5	86%	0.86	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	158.5	-179.2	-63.8	-176.2	-178.1	-152.5	0.6	110.4
59	C	91.6	Very high	85.3	Confident	49 Å²	49	95.1 Å²	95.1	33%	0.331	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	145.8	170.1	-54.2	0	0	0	0	109.4	K68 L69	C59-K68 HydrophobicContact CB-CD 4.35Å; C59-K68 VanDerWaalsContact CB-CE 3.43Å; C59-K68 HydrophobicContact CB-CG 4Å; C59-K68 WeakPolarHBondContact SG-CE 3.32Å; C59-L69 CarbonylContact C-O 3.54Å; C59-L69 VanDerWaalsContact CA-O 3.25Å; C59-L69 WeakPolarHBondContact CA-O 3.42Å
60	Y	91.5	Very high	85.9	Confident	105 Å²	105	98 Å²	98	41%	0.412	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	164.9	172.7	54.7	-84.8	0	0	0	109.9	L69 D71	Y60-L69 HydrophobicContact CD1-CB 4.47Å; Y60-L69 HydrophobicContact CD2-CB 3.77Å; Y60-L69 HydrophobicContact CD2-CD1 4.09Å; Y60-L69 HydrophobicContact CD2-CG 4.45Å; Y60-L69 HydrophobicContact CE1-CB 4.16Å; Y60-L69 HydrophobicContact CE2-CB 3.4Å; Y60-L69 HydrophobicContact CE2-CD1 3.49Å; Y60-L69 VanDerWaalsContact CE2-CD1 3.49Å; Y60-L69 HydrophobicContact CE2-CG 4.06Å; Y60-L69 HydrophobicContact CG-CB 4.29Å; Y60-L69 PolarHBondContact N-O 2.69Å; Y60-L69 PolarHBondContact O-N 2.88Å; Y60-D71 VanDerWaalsContact CE1-OD1 3.31Å; Y60-D71 WeakPolarHBondContact CE1-OD1 3.16Å; Y60-D71 PolarHBondContact OH-OD1 3.28Å
61	F	91.9	Very high	86.6	Confident	128 Å²	128	96 Å²	96	56%	0.561	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	138.8	-176.7	-63.4	-95.8	0	0	0	110.2	K66 C67 K68	F61-K66 WeakPolarHBondContact CD1-O 3.5Å; F61-C67 VanDerWaalsContact CA-O 3.31Å; F61-C67 WeakPolarHBondContact CA-O 3.41Å; F61-K68 HydrophobicContact CD1-CB 3.89Å; F61-K68 HydrophobicContact CD1-CG 4.32Å; F61-K68 HydrophobicContact CE1-CB 3.51Å; F61-K68 HydrophobicContact CE1-CD 4.1Å; F61-K68 HydrophobicContact CE1-CG 3.72Å; F61-K68 HydrophobicContact CZ-CB 4.16Å; F61-K68 HydrophobicContact CZ-CD 3.98Å; F61-K68 HydrophobicContact CZ-CG 3.83Å
62	T	85.1	Confident	87	Confident	42 Å²	42	94.2 Å²	94.2	26%	0.258	47%	0.47	S	S	.	.			trans	-69	144.5	172.7	62.2	0	0	0	0	110.3	I64 C65 K66 C67 L69	T62-I64 PolarHBondContact O-N 3.48Å; T62-C65 PolarHBondContact OG1-SG 3.18Å; T62-K66 VanDerWaalsContact O-CA 3.28Å; T62-K66 WeakPolarHBondContact O-CA 3.41Å; T62-K66 PolarHBondContact O-N 2.93Å; T62-K66 PolarHBondContact OG1-N 3.41Å; T62-C67 HydrophobicContact CG2-CB 4.46Å; T62-C67 PolarHBondContact N-O 2.69Å; T62-C67 VanDerWaalsContact N-O 3.15Å; T62-C67 PolarHBondContact OG1-N 2.92Å; T62-C67 VanDerWaalsContact OG1-N 3.13Å; T62-L69 HydrophobicContact CG2-CD1 3.51Å; T62-L69 HydrophobicContact CG2-CG 4.19Å
63	K	87.1	Confident	87.2	Confident	191 Å²	191	95.4 Å²	95.4	83%	0.83	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.9	-176.6	-69.8	-177.9	-178.7	176.7	0	112.8	K66	K63-K66 WeakPolarHBondContact O-CE 3.08Å; K63-K66 PolarHBondContact O-NZ 2.77Å
64	I	86.5	Confident	87.3	Confident	167 Å²	167	94.8 Å²	94.8	86%	0.856	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-65	-172.2	-60.6	168.1	0	0	0	110.9	T62	T62-I64 PolarHBondContact O-N 3.48Å
65	C	86.8	Confident	87.1	Confident	83 Å²	83	93.1 Å²	93.1	56%	0.561	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-1	-173.7	52.8	0	0	0	0	114.5	T62 C67	T62-C65 PolarHBondContact OG1-SG 3.18Å; C65-C67 PolarHBondContact O-N 3.38Å; C65-C67 PolarHBondContact SG-SG 3.08Å
66	K	90.2	Very high	86.7	Confident	145 Å²	145	93.6 Å²	93.6	63%	0.63	47%	0.469	S	S	*	.			trans	53.1	23.6	-178.6	-52.9	-55.9	-171.6	-161.9	0	113.7	F61 T62 K63 K68	F61-K66 WeakPolarHBondContact CD1-O 3.5Å; T62-K66 VanDerWaalsContact O-CA 3.28Å; T62-K66 WeakPolarHBondContact O-CA 3.41Å; T62-K66 PolarHBondContact O-N 2.93Å; T62-K66 PolarHBondContact OG1-N 3.41Å; K63-K66 WeakPolarHBondContact O-CE 3.08Å; K63-K66 PolarHBondContact O-NZ 2.77Å; K66-K68 PolarHBondContact O-N 3.12Å
67	C	87	Confident	85.4	Confident	62 Å²	62	95.4 Å²	95.4	42%	0.419	47%	0.473	S	S	.	.			trans	-65.3	130.8	176.5	-66.4	0	0	0	0	109.1	F61 T62 C65 L69	F61-C67 VanDerWaalsContact CA-O 3.31Å; F61-C67 WeakPolarHBondContact CA-O 3.41Å; T62-C67 HydrophobicContact CG2-CB 4.46Å; T62-C67 PolarHBondContact N-O 2.69Å; T62-C67 VanDerWaalsContact N-O 3.15Å; T62-C67 PolarHBondContact OG1-N 2.92Å; T62-C67 VanDerWaalsContact OG1-N 3.13Å; C65-C67 PolarHBondContact O-N 3.38Å; C65-C67 PolarHBondContact SG-SG 3.08Å; C67-L69 PolarHBondContact O-N 2.74Å
68	K	91.8	Very high	84.2	Confident	140 Å²	140	95.9 Å²	95.9	61%	0.609	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.6	173.7	-170.8	177	177.7	179.5	0	109.3	C59 F61 K66	C59-K68 HydrophobicContact CB-CD 4.35Å; C59-K68 VanDerWaalsContact CB-CE 3.43Å; C59-K68 HydrophobicContact CB-CG 4Å; C59-K68 WeakPolarHBondContact SG-CE 3.32Å; F61-K68 HydrophobicContact CD1-CB 3.89Å; F61-K68 HydrophobicContact CD1-CG 4.32Å; F61-K68 HydrophobicContact CE1-CB 3.51Å; F61-K68 HydrophobicContact CE1-CD 4.1Å; F61-K68 HydrophobicContact CE1-CG 3.72Å; F61-K68 HydrophobicContact CZ-CB 4.16Å; F61-K68 HydrophobicContact CZ-CD 3.98Å; F61-K68 HydrophobicContact CZ-CG 3.83Å; K66-K68 PolarHBondContact O-N 3.12Å
69	L	89.3	Confident	82.6	Confident	68 Å²	68	93.5 Å²	93.5	36%	0.356	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	151.1	178.2	-58.8	179.5	0	0	0	109.9	C59 Y60 T62 C67	C59-L69 CarbonylContact C-O 3.54Å; C59-L69 VanDerWaalsContact CA-O 3.25Å; C59-L69 WeakPolarHBondContact CA-O 3.42Å; Y60-L69 HydrophobicContact CD1-CB 4.47Å; Y60-L69 HydrophobicContact CD2-CB 3.77Å; Y60-L69 HydrophobicContact CD2-CD1 4.09Å; Y60-L69 HydrophobicContact CD2-CG 4.45Å; Y60-L69 HydrophobicContact CE1-CB 4.16Å; Y60-L69 HydrophobicContact CE2-CB 3.4Å; Y60-L69 HydrophobicContact CE2-CD1 3.49Å; Y60-L69 VanDerWaalsContact CE2-CD1 3.49Å; Y60-L69 HydrophobicContact CE2-CG 4.06Å; Y60-L69 HydrophobicContact CG-CB 4.29Å; Y60-L69 PolarHBondContact N-O 2.69Å; Y60-L69 PolarHBondContact O-N 2.88Å; T62-L69 HydrophobicContact CG2-CD1 3.51Å; T62-L69 HydrophobicContact CG2-CG 4.19Å; C67-L69 PolarHBondContact O-N 2.74Å
70	K	89.2	Confident	80.8	Confident	86 Å²	86	96.3 Å²	96.3	37%	0.374	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	130	175.1	-163.2	175.7	-171.8	-161.4	0	108.7	F55	F55-K70 HydrophobicContact CB-CD 3.65Å; F55-K70 VanDerWaalsContact CB-CE 3.43Å; F55-K70 HydrophobicContact CB-CG 4.14Å; F55-K70 VanDerWaalsContact CB-NZ 3.34Å; F55-K70 HydrophobicContact CD1-CB 4.04Å; F55-K70 HydrophobicContact CD1-CD 3.58Å; F55-K70 HydrophobicContact CD1-CG 3.83Å; F55-K70 HydrophobicContact CD2-CD 4.38Å; F55-K70 HydrophobicContact CE1-CB 4.42Å; F55-K70 HydrophobicContact CE1-CD 4.31Å; F55-K70 HydrophobicContact CG-CD 3.63Å; F55-K70 HydrophobicContact CG-CG 4.25Å
71	D	86.1	Confident	79	Confident	59 Å²	59	96.3 Å²	96.3	32%	0.316	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	150.3	-179.8	-60.1	-26.9	0	0	0	110.6	F55 T56 Y60	F55-D71 CarbonylContact C-O 3.5Å; F55-D71 VanDerWaalsContact CA-O 3.32Å; F55-D71 WeakPolarHBondContact CA-O 3.47Å; T56-D71 PolarHBondContact N-O 2.83Å; Y60-D71 VanDerWaalsContact CE1-OD1 3.31Å; Y60-D71 WeakPolarHBondContact CE1-OD1 3.16Å; Y60-D71 PolarHBondContact OH-OD1 3.28Å
72	I	84	Confident	77.2	Confident	100 Å²	100	95 Å²	95	51%	0.513	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.6	172.9	60.7	169.9	0	0	0	110.1	V53 D54 F55	V53-I72 HydrophobicContact CB-CB 4.48Å; V53-I72 HydrophobicContact CG2-CB 4.4Å; V53-I72 HydrophobicContact CG2-CD1 4.1Å; D54-I72 CarbonylContact O-C 3.52Å; D54-I72 VanDerWaalsContact O-CA 3.28Å; D54-I72 WeakPolarHBondContact O-CA 3.28Å; F55-I72 HydrophobicContact CD1-CG2 3.52Å; F55-I72 HydrophobicContact CE1-CG2 3.82Å; F55-I72 HydrophobicContact CG-CG2 4.41Å
73	A	85.1	Confident	75.6	Confident	31 Å²	31	95.4 Å²	95.4	26%	0.256	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	153.7	174.2	0	0	0	0	0	111.2	V53 D54 T56 L75	V53-A73 CarbonylContact C-O 3.59Å; V53-A73 WeakPolarHBondContact CA-O 3.31Å; V53-A73 WeakPolarHBondContact CB-O 3.42Å; D54-A73 PolarHBondContact N-O 3.19Å; D54-A73 PolarHBondContact O-N 2.97Å; T56-A73 HydrophobicContact CG2-CB 3.39Å; A73-L75 PolarHBondContact O-N 3.24Å
74	C	87.2	Confident	73.9	Confident	12 Å²	12	87.8 Å²	87.8	8%	0.081	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	127.6	177.5	179	0	0	0	0	111.6	C18 C21 Q23 L25 A52 K76 W77 C78	C18-C74 HydrophobicContact CB-CB 4.02Å; C21-C74 PolarHBondContact SG-SG 2.95Å; Q23-C74 PolarHBondContact OE1-SG 2.89Å; L25-C74 HydrophobicContact CD2-CB 4.18Å; A52-C74 CarbonylContact O-C 3.54Å; A52-C74 VanDerWaalsContact O-CA 3.32Å; A52-C74 WeakPolarHBondContact O-CA 3.25Å; A52-C74 PolarHBondContact O-SG 2.92Å; A52-C74 VanDerWaalsContact O-SG 3.41Å; C74-K76 VanDerWaalsContact C-N 3.34Å; C74-K76 PolarHBondContact O-N 3.4Å; C74-W77 PolarHBondContact O-N 3.38Å; C74-C78 PolarHBondContact O-N 3.41Å; C74-C78 PolarHBondContact O-SG 3.41Å; C74-C78 VanDerWaalsContact O-SG 3.41Å
75	L	80.8	Confident	72.2	Confident	53 Å²	53	86 Å²	86	28%	0.277	45%	0.45	S	S	.	.	H	α-helix	trans	-66.3	-32.3	-177.7	-78.3	174.3	0	0	0	113.4	A52 D54 A73 W77 C78 K79	A52-L75 PolarHBondContact O-N 3.24Å; D54-L75 HydrophobicContact CB-CD1 4.2Å; D54-L75 HydrophobicContact CB-CD2 3.46Å; D54-L75 VanDerWaalsContact CB-CD2 3.46Å; D54-L75 HydrophobicContact CB-CG 3.86Å; A73-L75 PolarHBondContact O-N 3.24Å; L75-W77 VanDerWaalsContact C-N 3.27Å; L75-W77 PolarHBondContact O-N 3.34Å; L75-C78 PolarHBondContact O-N 2.91Å; L75-K79 PolarHBondContact O-N 3.41Å
76	K	75.4	Confident	70.4	Confident	130 Å²	130	87 Å²	87	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-66.3	-31.3	180	-170.9	176.1	-174.2	-178.1	0	112.3	C21 Q23 C74	C21-K76 HydrophobicContact CB-CD 4.4Å; Q23-K76 HydrophobicContact CB-CD 4.46Å; C74-K76 VanDerWaalsContact C-N 3.34Å; C74-K76 PolarHBondContact O-N 3.4Å
77	W	59.8	Low	68.5	Low	62 Å²	62	82 Å²	82	24%	0.235	44%	0.435	C	S	.	.	H	α-helix	trans	-74.9	-37.3	174.5	-167.1	-96.8	0	0	0	112	F20 C21 C74 L75 K79 H80 L83	F20-W77 HydrophobicContact CB-CD2 3.88Å; F20-W77 HydrophobicContact CB-CE3 3.55Å; F20-W77 HydrophobicContact CB-CH2 3.9Å; F20-W77 HydrophobicContact CB-CZ2 4.2Å; F20-W77 HydrophobicContact CB-CZ3 3.58Å; F20-W77 HydrophobicContact CD1-CH2 4.15Å; F20-W77 HydrophobicContact CD1-CZ2 4.07Å; F20-W77 HydrophobicContact CG-CD2 4.45Å; F20-W77 HydrophobicContact CG-CH2 4.37Å; F20-W77 HydrophobicContact CG-CZ2 4.31Å; F20-W77 HydrophobicContact CG-CZ3 4.49Å; C21-W77 HydrophobicContact CB-CE3 4.25Å; C74-W77 PolarHBondContact O-N 3.38Å; L75-W77 VanDerWaalsContact C-N 3.27Å; L75-W77 PolarHBondContact O-N 3.34Å; W77-K79 PolarHBondContact O-N 3.43Å; W77-K79 VanDerWaalsContact O-N 3.11Å; W77-H80 PolarHBondContact O-N 3.41Å; W77-H80 VanDerWaalsContact O-N 3.15Å; W77-L83 HydrophobicContact CD2-CB 4.47Å; W77-L83 HydrophobicContact CH2-CB 4.38Å; W77-L83 HydrophobicContact CH2-CD1 3.74Å; W77-L83 HydrophobicContact CH2-CD2 3.77Å; W77-L83 HydrophobicContact CH2-CG 4.17Å; W77-L83 HydrophobicContact CZ2-CB 3.65Å; W77-L83 HydrophobicContact CZ2-CD1 3.89Å; W77-L83 HydrophobicContact CZ2-CD2 3.45Å; W77-L83 VanDerWaalsContact CZ2-CD2 3.45Å; W77-L83 HydrophobicContact CZ2-CG 3.85Å; W77-L83 HydrophobicContact CZ3-CD1 4.12Å; W77-L83 PolarHBondContact NE1-O 3.27Å
78	C	56.7	Low	66.7	Low	72 Å²	72	88 Å²	88	49%	0.486	45%	0.449	S	S	.	.	H	α-helix	trans	-64.4	-13.4	177.1	-63	0	0	0	0	114	C74 L75	C74-C78 PolarHBondContact O-N 3.41Å; C74-C78 PolarHBondContact O-SG 3.41Å; C74-C78 VanDerWaalsContact O-SG 3.41Å; L75-C78 PolarHBondContact O-N 2.91Å
79	K	52.5	Low	64.4	Low	178 Å²	178	85.5 Å²	85.5	77%	0.774	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.7	175.8	-68.2	-170.8	-179.9	-171.4	0	114.3	L75 W77	L75-K79 PolarHBondContact O-N 3.41Å; W77-K79 PolarHBondContact O-N 3.43Å; W77-K79 VanDerWaalsContact O-N 3.11Å
80	H	52.9	Low	62.3	Low	109 Å²	109	91.5 Å²	91.5	51%	0.505	46%	0.46	S	S	.	.			trans	-108.3	105.7	174.3	-133.4	-85.8	0	0	0	110.4	W77 T82 L83 G84	W77-H80 PolarHBondContact O-N 3.41Å; W77-H80 VanDerWaalsContact O-N 3.15Å; H80-T82 VanDerWaalsContact C-N 3.3Å; H80-T82 PolarHBondContact ND1-OG1 3.43Å; H80-T82 PolarHBondContact O-N 2.85Å; H80-L83 HydrophobicContact CB-CB 4.41Å; H80-L83 HydrophobicContact CB-CD1 4.17Å; H80-L83 PolarHBondContact O-N 3.39Å; H80-L83 VanDerWaalsContact O-N 3.12Å; H80-G84 PolarHBondContact O-N 3.12Å
81	P	53.4	Low	60.2	Low	104 Å²	104	92.5 Å²	92.5	68%	0.675	46%	0.461	S	S	*	.	H	α-helix	trans	-61.7	-32.7	-168.7	19.3	-30.2	0	0	0	113.9	L83	P81-L83 VanDerWaalsContact C-N 3.34Å; P81-L83 PolarHBondContact O-N 3.22Å
82	T	54.8	Low	57.9	Low	101 Å²	101	97.4 Å²	97.4	62%	0.62	48%	0.482	S	S	*	.	H	α-helix	trans	-73	-20.2	178.9	40.5	0	0	0	0	114.6	H80	H80-T82 VanDerWaalsContact C-N 3.3Å; H80-T82 PolarHBondContact ND1-OG1 3.43Å; H80-T82 PolarHBondContact O-N 2.85Å
83	L	50.9	Low	55.5	Low	51 Å²	51	102.5 Å²	102.5	27%	0.267	50%	0.496	S	S	.	.	H	α-helix	trans	-104.2	-13.5	-177.1	-72.3	158.6	0	0	0	113	W77 H80 P81 L86	W77-L83 HydrophobicContact CD2-CB 4.47Å; W77-L83 HydrophobicContact CH2-CB 4.38Å; W77-L83 HydrophobicContact CH2-CD1 3.74Å; W77-L83 HydrophobicContact CH2-CD2 3.77Å; W77-L83 HydrophobicContact CH2-CG 4.17Å; W77-L83 HydrophobicContact CZ2-CB 3.65Å; W77-L83 HydrophobicContact CZ2-CD1 3.89Å; W77-L83 HydrophobicContact CZ2-CD2 3.45Å; W77-L83 VanDerWaalsContact CZ2-CD2 3.45Å; W77-L83 HydrophobicContact CZ2-CG 3.85Å; W77-L83 HydrophobicContact CZ3-CD1 4.12Å; W77-L83 PolarHBondContact NE1-O 3.27Å; H80-L83 HydrophobicContact CB-CB 4.41Å; H80-L83 HydrophobicContact CB-CD1 4.17Å; H80-L83 PolarHBondContact O-N 3.39Å; H80-L83 VanDerWaalsContact O-N 3.12Å; P81-L83 VanDerWaalsContact C-N 3.34Å; P81-L83 PolarHBondContact O-N 3.22Å; L83-L86 HydrophobicContact CD2-CD1 3.91Å
84	G	51.8	Low	53.2	Low	31 Å²	31	115.3 Å²	115.3	32%	0.32	54%	0.538	S	S	.	.	H	α-helix	trans	-69.5	-32	170.9	0	0	0	0	0	113.4	H80 R88	H80-G84 PolarHBondContact O-N 3.12Å; G84-R88 PolarHBondContact O-N 2.99Å
85	Q	50.4	Low	51.5	Low	129 Å²	129	120.5 Å²	120.5	60%	0.603	56%	0.561	S	S	*	*	H	α-helix	trans	-63.8	-48.7	173.1	-123.8	95.4	-1.5	0	0	111.4	A87 R88 D89	Q85-A87 PolarHBondContact O-N 2.79Å; Q85-R88 WeakPolarHBondContact O-CB 3.32Å; Q85-R88 PolarHBondContact O-N 3.15Å; Q85-D89 PolarHBondContact O-N 3.11Å; Q85-D89 VanDerWaalsContact O-N 3.08Å
86	L	49.2	Very low	49.9	Very low	104 Å²	104	124.1 Å²	124.1	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-60.9	-29	-180	-69.9	170.5	0	0	0	113.6	L83 R90	L83-L86 HydrophobicContact CD2-CD1 3.91Å; L86-R90 PolarHBondContact O-N 3.21Å
87	A	50.6	Low	48.5	Very low	41 Å²	41	123.7 Å²	123.7	34%	0.339	58%	0.577	S	S	.	*	H	α-helix	trans	-80.8	-17.3	175.7	0	0	0	0	0	113.6	Q85	Q85-A87 PolarHBondContact O-N 2.79Å
88	R	49.2	Very low	47.8	Very low	188 Å²	188	127.4 Å²	127.4	71%	0.709	60%	0.597	S	S	*	*	H	α-helix	trans	-80.7	-44.9	168	-77.4	-164.3	-177.6	159.4	2	111	G84 Q85 R90 R91	G84-R88 PolarHBondContact O-N 2.99Å; Q85-R88 WeakPolarHBondContact O-CB 3.32Å; Q85-R88 PolarHBondContact O-N 3.15Å; R88-R90 VanDerWaalsContact C-N 3.32Å; R88-R90 PolarHBondContact O-N 2.72Å; R88-R91 WeakPolarHBondContact O-CB 3.26Å; R88-R91 PolarHBondContact O-N 3.42Å
89	D	42.8	Very low	47.3	Very low	87 Å²	87	130.8 Å²	130.8	47%	0.465	60%	0.604	S	S	.	*	H	α-helix	trans	-64.3	-34.7	-177.7	-63.8	-12.5	0	0	0	112.6	Q85 R91 E92	Q85-D89 PolarHBondContact O-N 3.11Å; Q85-D89 VanDerWaalsContact O-N 3.08Å; D89-R91 VanDerWaalsContact C-N 3.26Å; D89-R91 PolarHBondContact O-N 3.19Å; D89-E92 PolarHBondContact O-N 3.39Å
90	R	45.4	Very low	46.9	Very low	193 Å²	193	127.7 Å²	127.7	73%	0.728	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-15	174.2	-91	-172	174.8	179.7	0.1	115	L86 R88 E92	L86-R90 PolarHBondContact O-N 3.21Å; R88-R90 VanDerWaalsContact C-N 3.32Å; R88-R90 PolarHBondContact O-N 2.72Å; R90-E92 VanDerWaalsContact C-N 3.34Å
91	R	46	Very low	46.5	Very low	107 Å²	107	129 Å²	129	40%	0.404	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	-13.6	175.9	-104.7	-173.1	-72.3	-153.2	-4.8	113	T56 R88 D89 Y93	T56-R91 PolarHBondContact OG1-NH1 3.31Å; R88-R91 WeakPolarHBondContact O-CB 3.26Å; R88-R91 PolarHBondContact O-N 3.42Å; D89-R91 VanDerWaalsContact C-N 3.26Å; D89-R91 PolarHBondContact O-N 3.19Å; R91-Y93 VanDerWaalsContact C-N 3.26Å
92	E	37.6	Very low	46	Very low	162 Å²	162	130.9 Å²	130.9	76%	0.757	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-9	178	-152.7	160.9	-161.3	0	0	112.5	D89 R90	D89-E92 PolarHBondContact O-N 3.39Å; R90-E92 VanDerWaalsContact C-N 3.34Å
93	Y	33.3	Very low	45.3	Very low	207 Å²	207	133.4 Å²	133.4	81%	0.812	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	18.2	-178.6	-72.5	-82	0	0	0	114.6	R91	R91-Y93 VanDerWaalsContact C-N 3.26Å
94	R	35.9	Very low	44.7	Very low	301 Å²	301	140.9 Å²	140.9	100%	1.136	62%	0.62	S	S	*	*			trans	-128.3	0	171.9	-94.9	-171.2	175.4	-172.4	-4.2	111.8

Retrieved 94 of 94 residues in 115.5 ms (Link to these results)

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