A0A087WXL2_HUMAN Loading...

Odorant binding protein 2A

AlphaFold DB , UniProt , Accession A0A087WXL2, Species HUMAN (Homo sapiens, Human), Gene OBP2A, Length 220 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	47.7	Very low	244 Å²	244	150.4 Å²	150.4	100%	1.202	84%	0.844	S	S	*	*				0	123.9	0	-67	171.6	-171.8	0	0	107
2	K	36.9	Very low	47.7	Very low	213 Å²	213	150.9 Å²	150.9	93%	0.926	84%	0.842	S	S	*	*			trans	-90	121.5	-174.1	-85.7	166.8	171.3	170.5	0	109.6
3	T	47.7	Very low	47.6	Very low	112 Å²	112	146.5 Å²	146.5	69%	0.687	84%	0.837	S	S	*	*			trans	-86.4	117.7	176.5	-16.7	0	0	0	0	109.1	F5	T3-F5 HydrophobicContact CG2-CD2 3.87Å; T3-F5 HydrophobicContact CG2-CE2 3.49Å; T3-F5 VanDerWaalsContact CG2-CE2 3.49Å; T3-F5 HydrophobicContact CG2-CZ 4.34Å
4	L	48.4	Very low	47.2	Very low	162 Å²	162	141.9 Å²	141.9	85%	0.848	83%	0.825	S	S	*	*			trans	-121.6	98.1	167.9	-73.3	173	0	0	0	107.5	L6	L4-L6 PolarHBondContact O-N 3.39Å
5	F	49.3	Very low	46.9	Very low	194 Å²	194	137.9 Å²	137.9	85%	0.851	82%	0.816	S	S	*	*			trans	-80.3	103.4	168.1	-78.4	-79.8	0	0	0	108.1	T3 G7	T3-F5 HydrophobicContact CG2-CD2 3.87Å; T3-F5 HydrophobicContact CG2-CE2 3.49Å; T3-F5 VanDerWaalsContact CG2-CE2 3.49Å; T3-F5 HydrophobicContact CG2-CZ 4.34Å; F5-G7 PolarHBondContact O-N 3.45Å
6	L	50	Low	46.5	Very low	165 Å²	165	138.3 Å²	138.3	86%	0.864	81%	0.812	S	S	*	*			trans	-70.8	115.5	170	-97.5	136.5	0	0	0	108.9	L4 V8	L4-L6 PolarHBondContact O-N 3.39Å; L6-V8 PolarHBondContact O-N 3.01Å
7	G	54.3	Low	46.2	Very low	70 Å²	70	135.6 Å²	135.6	72%	0.722	80%	0.803	S	S	*	*			trans	-63.9	123.1	175.3	0	0	0	0	0	111.4	F5 T9	F5-G7 PolarHBondContact O-N 3.45Å; G7-T9 PolarHBondContact O-N 2.84Å
8	V	51	Low	46.3	Very low	130 Å²	130	137.2 Å²	137.2	79%	0.788	80%	0.798	S	S	*	*			trans	-82.7	100.5	167.4	176.3	0	0	0	0	107.2	L6 L10	L6-V8 PolarHBondContact O-N 3.01Å; V8-L10 PolarHBondContact O-N 3Å
9	T	53.6	Low	46.8	Very low	138 Å²	138	135 Å²	135	85%	0.847	79%	0.787	S	S	*	*			trans	-77.6	98.3	165.5	42.7	0	0	0	0	108.3	G7 G11	G7-T9 PolarHBondContact O-N 2.84Å; T9-G11 PolarHBondContact O-N 3.37Å
10	L	46.7	Very low	47.6	Very low	153 Å²	153	130 Å²	130	80%	0.801	76%	0.756	S	S	*	*			trans	-71.5	93.4	170.7	-165.4	73.1	0	0	0	108.2	V8 L12	V8-L10 PolarHBondContact O-N 3Å; L10-L12 PolarHBondContact O-N 2.76Å
11	G	50.7	Low	48.5	Very low	73 Å²	73	129.3 Å²	129.3	75%	0.753	75%	0.746	S	S	*	*			trans	-66.8	96.4	171	0	0	0	0	0	109.9	T9 A13	T9-G11 PolarHBondContact O-N 3.37Å; G11-A13 VanDerWaalsContact C-N 3.31Å; G11-A13 PolarHBondContact O-N 3.15Å
12	L	47.3	Very low	49.7	Very low	157 Å²	157	120.5 Å²	120.5	82%	0.822	70%	0.702	S	S	*	*			trans	-70	89.4	170	-171.8	74	0	0	0	108.2	L10 A14	L10-L12 PolarHBondContact O-N 2.76Å; L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.24Å
13	A	46.4	Very low	50.9	Low	94 Å²	94	117.8 Å²	117.8	78%	0.777	69%	0.692	S	S	*	*			trans	-67.7	98	164.3	0	0	0	0	0	107.2	G11 A15	G11-A13 VanDerWaalsContact C-N 3.31Å; G11-A13 PolarHBondContact O-N 3.15Å; A13-A15 VanDerWaalsContact C-N 3.25Å; A13-A15 PolarHBondContact O-N 3.02Å
14	A	41.9	Very low	52.4	Low	81 Å²	81	117 Å²	117	67%	0.669	68%	0.684	S	S	*	*			trans	-64.1	90.9	168.8	0	0	0	0	0	108.2	L12 L16	L12-A14 VanDerWaalsContact C-N 3.33Å; L12-A14 PolarHBondContact O-N 3.24Å; A14-L16 PolarHBondContact O-N 3.32Å
15	A	42.6	Very low	54.1	Low	82 Å²	82	109.5 Å²	109.5	68%	0.678	65%	0.645	S	S	*	*			trans	-65	102.5	160.5	0	0	0	0	0	106.2	A13 S17	A13-A15 VanDerWaalsContact C-N 3.25Å; A13-A15 PolarHBondContact O-N 3.02Å; A15-S17 PolarHBondContact O-N 2.64Å
16	L	40.2	Very low	56.1	Low	145 Å²	145	102.8 Å²	102.8	76%	0.759	62%	0.62	S	S	*	*			trans	-65.8	72.9	167.3	-76.4	163.8	0	0	0	108.3	A14 F18	A14-L16 PolarHBondContact O-N 3.32Å; L16-F18 HydrophobicContact CB-CE2 4.32Å; L16-F18 PolarHBondContact O-N 2.97Å
17	S	42.2	Very low	58	Low	93 Å²	93	96.5 Å²	96.5	65%	0.65	60%	0.595	S	S	*	*			trans	-80.9	92.2	164.1	-51.7	0	0	0	0	105.3	A15 T19	A15-S17 PolarHBondContact O-N 2.64Å; S17-T19 PolarHBondContact O-N 3.24Å
18	F	48.4	Very low	59.7	Low	164 Å²	164	96 Å²	96	72%	0.719	58%	0.578	S	S	*	*			trans	-58.6	112	172	-81.8	-88.3	0	0	0	108.3	L16 L20	L16-F18 HydrophobicContact CB-CE2 4.32Å; L16-F18 PolarHBondContact O-N 2.97Å; F18-L20 PolarHBondContact O-N 3.27Å
19	T	54.8	Low	61.5	Low	95 Å²	95	90 Å²	90	58%	0.583	54%	0.541	S	S	*	.			trans	-77.7	104.4	172.6	48.4	0	0	0	0	107.4	S17 E21	S17-T19 PolarHBondContact O-N 3.24Å; T19-E21 PolarHBondContact O-N 3.15Å
20	L	64.1	Low	63.1	Low	34 Å²	34	86.1 Å²	86.1	18%	0.178	51%	0.512	C	S	.	.			trans	-58.7	109.8	173.6	-162.6	82.9	0	0	0	109	F18 I25 L101 Y110	F18-L20 PolarHBondContact O-N 3.27Å; L20-I25 HydrophobicContact CD2-CD1 3.44Å; L20-I25 VanDerWaalsContact CD2-CD1 3.44Å; L20-I25 HydrophobicContact CD2-CG1 3.48Å; L20-I25 VanDerWaalsContact CD2-CG1 3.48Å; L20-I25 HydrophobicContact CG-CD1 3.91Å; L20-I25 HydrophobicContact CG-CG1 3.75Å; L20-L101 HydrophobicContact CD2-CB 4.08Å; L20-L101 HydrophobicContact CD2-CD2 3.62Å; L20-L101 HydrophobicContact CD2-CG 3.84Å; L20-Y110 HydrophobicContact CD1-CE1 3.97Å
21	E	65.4	Low	64.9	Low	117 Å²	117	79 Å²	79	55%	0.547	48%	0.475	S	S	.	.			trans	-79.2	159.8	-178.8	-61.4	-145.7	128.8	0	0	111	T19 E23 D24 I25	T19-E21 PolarHBondContact O-N 3.15Å; E21-E23 PolarHBondContact O-N 3Å; E21-D24 PolarHBondContact N-OD2 3.4Å; E21-D24 PolarHBondContact O-N 3.37Å; E21-I25 WeakPolarHBondContact O-CG1 3.46Å
22	E	61.9	Low	66.5	Low	59 Å²	59	77.7 Å²	77.7	28%	0.276	45%	0.448	S	S	.	.	H	α-helix	trans	-58.9	-40.1	-179.7	-173.1	176.2	171.7	0	0	111	D24 I25 T26 A56 G60 L62	E22-D24 VanDerWaalsContact C-N 3.33Å; E22-D24 PolarHBondContact O-N 3.13Å; E22-I25 PolarHBondContact O-N 2.99Å; E22-T26 WeakPolarHBondContact O-CG2 3.44Å; E22-T26 PolarHBondContact O-N 3.36Å; E22-A56 HydrophobicContact CG-CB 4.35Å; E22-A56 WeakPolarHBondContact OE1-CA 3.46Å; E22-A56 WeakPolarHBondContact OE1-CB 3.26Å; E22-G60 WeakPolarHBondContact OE2-CA 3.34Å; E22-G60 PolarHBondContact OE2-N 3.42Å; E22-L62 HydrophobicContact CG-CD2 3.73Å
23	E	62.9	Low	68.2	Low	155 Å²	155	70.6 Å²	70.6	72%	0.724	41%	0.412	S	S	*	.	H	α-helix	trans	-61.5	-39.8	-178.4	-66	-175.5	170.9	0	0	112.1	E21 I25 T26	E21-E23 PolarHBondContact O-N 3Å; E23-I25 PolarHBondContact O-N 3.21Å; E23-T26 PolarHBondContact O-N 2.94Å; E23-T26 PolarHBondContact O-OG1 2.89Å
24	D	77.6	Confident	70	Confident	96 Å²	96	67 Å²	67	51%	0.513	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-24.6	179.3	-61.6	-35.6	0	0	0	113.2	E21 E22	E21-D24 PolarHBondContact N-OD2 3.4Å; E21-D24 PolarHBondContact O-N 3.37Å; E22-D24 VanDerWaalsContact C-N 3.33Å; E22-D24 PolarHBondContact O-N 3.13Å
25	I	85.1	Confident	72.2	Confident	4 Å²	4	64 Å²	64	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-91.1	-25.8	-176.4	-52.1	167.9	0	0	0	111.2	L20 E21 E22 E23 W29 V54 L62 F90 L101	L20-I25 HydrophobicContact CD2-CD1 3.44Å; L20-I25 VanDerWaalsContact CD2-CD1 3.44Å; L20-I25 HydrophobicContact CD2-CG1 3.48Å; L20-I25 VanDerWaalsContact CD2-CG1 3.48Å; L20-I25 HydrophobicContact CG-CD1 3.91Å; L20-I25 HydrophobicContact CG-CG1 3.75Å; E21-I25 WeakPolarHBondContact O-CG1 3.46Å; E22-I25 PolarHBondContact O-N 2.99Å; E23-I25 PolarHBondContact O-N 3.21Å; I25-W29 PolarHBondContact O-NE1 3.38Å; I25-V54 HydrophobicContact CG2-CG1 4.24Å; I25-L62 HydrophobicContact CB-CD1 4.04Å; I25-L62 HydrophobicContact CD1-CD1 4.19Å; I25-L62 HydrophobicContact CG2-CD1 3.55Å; I25-F90 HydrophobicContact CD1-CE2 4.08Å; I25-F90 HydrophobicContact CD1-CZ 3.74Å; I25-L101 HydrophobicContact CB-CD2 4.25Å; I25-L101 HydrophobicContact CD1-CD2 4.4Å; I25-L101 HydrophobicContact CG1-CD2 3.87Å; I25-L101 HydrophobicContact CG2-CD2 3.56Å
26	T	91.3	Very high	74.2	Confident	53 Å²	53	61.3 Å²	61.3	33%	0.325	33%	0.328	S	S	.	.			trans	-70.3	155.8	-179.5	64.4	0	0	0	0	112.2	E22 E23 A56 L62	E22-T26 WeakPolarHBondContact O-CG2 3.44Å; E22-T26 PolarHBondContact O-N 3.36Å; E23-T26 PolarHBondContact O-N 2.94Å; E23-T26 PolarHBondContact O-OG1 2.89Å; T26-A56 HydrophobicContact CG2-CB 3.88Å; T26-L62 HydrophobicContact CG2-CD2 4.12Å
27	G	90.6	Very high	76.2	Confident	34 Å²	34	56.7 Å²	56.7	35%	0.351	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	118.3	-154.5	178.2	0	0	0	0	0	113.2	K53 V54	G27-K53 WeakPolarHBondContact O-CA 2.97Å; G27-V54 PolarHBondContact N-O 2.95Å; G27-V54 PolarHBondContact O-N 3.17Å
28	T	88.8	Confident	77.8	Confident	58 Å²	58	61.4 Å²	61.4	36%	0.356	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.6	-174.4	-58.2	0	0	0	0	110.4	Y30 P51	T28-Y30 HydrophobicContact CG2-CE1 4.42Å; T28-Y30 HydrophobicContact CG2-CE2 3.92Å; T28-P51 HydrophobicContact CG2-CB 3.56Å
29	W	88.9	Confident	79.2	Confident	6 Å²	6	60.6 Å²	60.6	2%	0.023	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.3	-179.2	-65.4	87.7	0	0	0	111.3	I25 P51 V52 Y110 F112 V129 A130	I25-W29 PolarHBondContact O-NE1 3.38Å; W29-P51 CarbonylContact O-C 3.58Å; W29-P51 VanDerWaalsContact O-CA 3.27Å; W29-P51 WeakPolarHBondContact O-CA 2.9Å; W29-V52 HydrophobicContact CB-CB 4.26Å; W29-V52 PolarHBondContact N-O 3.04Å; W29-V52 PolarHBondContact O-N 2.75Å; W29-Y110 HydrophobicContact CH2-CD1 4.32Å; W29-Y110 AromaticContact CH2-CD2 3.66Å; W29-Y110 HydrophobicContact CH2-CD2 3.66Å; W29-Y110 AromaticContact CH2-CE2 3.96Å; W29-Y110 HydrophobicContact CH2-CE2 3.96Å; W29-Y110 AromaticContact CH2-CG 3.89Å; W29-Y110 HydrophobicContact CH2-CG 3.89Å; W29-Y110 AromaticContact CZ3-CD2 3.49Å; W29-Y110 HydrophobicContact CZ3-CD2 3.49Å; W29-Y110 VanDerWaalsContact CZ3-CD2 3.49Å; W29-Y110 HydrophobicContact CZ3-CE2 4.17Å; W29-Y110 AromaticContact CZ3-CG 3.81Å; W29-Y110 HydrophobicContact CZ3-CG 3.81Å; W29-F112 HydrophobicContact CB-CE2 4.46Å; W29-F112 HydrophobicContact CD2-CE2 4.3Å; W29-F112 HydrophobicContact CG-CE2 4.21Å; W29-V129 HydrophobicContact CB-CB 4.4Å; W29-V129 HydrophobicContact CD2-CG2 4.35Å; W29-V129 HydrophobicContact CE3-CB 3.98Å; W29-V129 HydrophobicContact CE3-CG2 3.55Å; W29-V129 HydrophobicContact CZ3-CG2 4.01Å; W29-A130 CarbonylContact C-O 3.58Å; W29-A130 WeakPolarHBondContact CA-O 3.45Å
30	Y	86.5	Confident	80.2	Confident	56 Å²	56	57.2 Å²	57.2	22%	0.22	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	117.5	-178.8	-63.6	-87.7	0	0	0	110	T28 K32 P51 V129 A130 P133 L165	T28-Y30 HydrophobicContact CG2-CE1 4.42Å; T28-Y30 HydrophobicContact CG2-CE2 3.92Å; Y30-K32 PolarHBondContact O-N 3.26Å; Y30-P51 HydrophobicContact CD1-CB 3.97Å; Y30-P51 HydrophobicContact CD1-CG 3.7Å; Y30-P51 HydrophobicContact CE1-CB 3.89Å; Y30-P51 HydrophobicContact CE1-CG 3.51Å; Y30-V129 VanDerWaalsContact O-CA 3.26Å; Y30-V129 WeakPolarHBondContact O-CA 3.39Å; Y30-A130 PolarHBondContact N-O 2.89Å; Y30-A130 PolarHBondContact O-N 3.32Å; Y30-A130 VanDerWaalsContact O-N 3.1Å; Y30-P133 HydrophobicContact CD1-CB 3.97Å; Y30-P133 HydrophobicContact CD2-CB 4.11Å; Y30-P133 HydrophobicContact CE1-CB 3.82Å; Y30-P133 HydrophobicContact CE1-CG 4.38Å; Y30-P133 HydrophobicContact CE2-CB 4.01Å; Y30-P133 VanDerWaalsContact CE2-CD 3.49Å; Y30-P133 HydrophobicContact CE2-CG 4.07Å; Y30-P133 HydrophobicContact CG-CB 4.09Å; Y30-L165 HydrophobicContact CD1-CD2 3.68Å; Y30-L165 HydrophobicContact CG-CD2 4.21Å
31	V	85.6	Confident	80.8	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	111.2	178.7	-173.4	0	0	0	0	109.6	A33 V49 V52 K127 L128 V129 W162	V31-A33 WeakPolarHBondContact CG1-O 3.36Å; V31-V49 HydrophobicContact CB-CG1 4.49Å; V31-V49 HydrophobicContact CG2-CG1 3.91Å; V31-V52 HydrophobicContact CG2-CG2 4.09Å; V31-K127 HydrophobicContact CG1-CB 4.32Å; V31-L128 CarbonylContact C-O 3.58Å; V31-V129 HydrophobicContact CB-CG1 4.5Å; V31-V129 HydrophobicContact CG2-CG1 4.02Å; V31-W162 VanDerWaalsContact O-CD1 3.26Å
32	K	84.4	Confident	81.4	Confident	45 Å²	45	58.9 Å²	58.9	20%	0.196	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-42.5	177.4	-68.7	-177.7	175.6	173.9	0	111.7	Y30 D109 L128 A130 W162	Y30-K32 PolarHBondContact O-N 3.26Å; K32-D109 IonicContact NZ-OD1 2.63Å; K32-D109 PolarHBondContact NZ-OD1 3.18Å; K32-D109 IonicContact NZ-OD2 2.76Å; K32-D109 PolarHBondContact NZ-OD2 3.42Å; K32-L128 HydrophobicContact CB-CD2 4.15Å; K32-L128 HydrophobicContact CB-CG 4.26Å; K32-L128 HydrophobicContact CD-CD2 4.44Å; K32-L128 PolarHBondContact N-O 3.21Å; K32-A130 HydrophobicContact CD-CB 4.38Å; K32-A130 VanDerWaalsContact CE-CB 3.47Å; K32-W162 PolarHBondContact O-N 2.78Å
33	A	83.3	Confident	82.2	Confident	8 Å²	8	60 Å²	60	7%	0.066	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	162.2	179.8	0	0	0	0	0	111.4	V31 K127 L128 W159 R160	V31-A33 WeakPolarHBondContact CG1-O 3.36Å; A33-K127 WeakPolarHBondContact O-CA 3.42Å; A33-L128 HydrophobicContact CB-CB 4.33Å; A33-L128 PolarHBondContact O-N 3.32Å; A33-W159 HydrophobicContact CB-CB 4.01Å; A33-W159 HydrophobicContact CB-CD2 4.2Å; A33-W159 HydrophobicContact CB-CE3 3.45Å; A33-W159 VanDerWaalsContact CB-CE3 3.45Å; A33-W159 HydrophobicContact CB-CG 4.46Å; A33-W159 HydrophobicContact CB-CZ3 4.24Å; A33-W159 WeakPolarHBondContact O-CZ3 3.37Å; A33-R160 WeakPolarHBondContact CA-O 3.38Å
34	M	84.6	Confident	82.9	Confident	19 Å²	19	57.8 Å²	57.8	9%	0.094	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.1	172.6	65.5	173.4	-77.5	0	0	112.2	V36 P46 G126 K127 R160 W162	M34-V36 HydrophobicContact CE-CG1 3.62Å; M34-P46 HydrophobicContact CE-CG 4.35Å; M34-P46 HydrophobicContact SD-CB 4.33Å; M34-P46 HydrophobicContact SD-CG 4.29Å; M34-G126 WeakPolarHBondContact CA-O 3.33Å; M34-K127 HydrophobicContact CB-CG 4.43Å; M34-R160 PolarHBondContact O-N 2.8Å; M34-W162 HydrophobicContact CG-CZ2 4.1Å; M34-W162 HydrophobicContact SD-CH2 4.17Å; M34-W162 HydrophobicContact SD-CZ2 3.46Å; M34-W162 WeakPolarHBondContact SD-CZ2 3.08Å
35	V	86.4	Confident	82.9	Confident	18 Å²	18	56.4 Å²	56.4	11%	0.109	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.2	172.3	64.9	0	0	0	0	108.7	M125 G126 I154 T158 W159	V35-M125 CarbonylContact O-C 3.57Å; V35-M125 WeakPolarHBondContact O-CA 3.47Å; V35-M125 WeakPolarHBondContact O-CG 3.35Å; V35-G126 PolarHBondContact N-O 3.31Å; V35-G126 PolarHBondContact O-N 3.29Å; V35-I154 HydrophobicContact CG1-CG2 3.86Å; V35-I154 HydrophobicContact CG2-CG2 4.22Å; V35-T158 VanDerWaalsContact CG2-OG1 3.29Å; V35-T158 WeakPolarHBondContact CG2-OG1 3.49Å; V35-W159 HydrophobicContact CB-CD2 4.39Å; V35-W159 HydrophobicContact CB-CE3 4.36Å; V35-W159 HydrophobicContact CG1-CD2 4.48Å; V35-W159 HydrophobicContact CG1-CE3 4.4Å; V35-W159 HydrophobicContact CG1-CH2 4.04Å; V35-W159 HydrophobicContact CG1-CZ2 4.06Å; V35-W159 HydrophobicContact CG1-CZ3 4.17Å
36	V	85.4	Confident	82.7	Confident	24 Å²	24	57.2 Å²	57.2	15%	0.145	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	160.4	176.5	-68.6	0	0	0	0	108.1	M34 F40 R45 M125	M34-V36 HydrophobicContact CE-CG1 3.62Å; V36-F40 HydrophobicContact CB-CB 3.74Å; V36-F40 HydrophobicContact CB-CD1 4.24Å; V36-F40 HydrophobicContact CB-CD2 4.24Å; V36-F40 HydrophobicContact CB-CG 3.82Å; V36-F40 HydrophobicContact CG1-CD1 4.29Å; V36-F40 HydrophobicContact CG1-CD2 4.41Å; V36-F40 HydrophobicContact CG1-CG 4.19Å; V36-F40 HydrophobicContact CG2-CB 3.73Å; V36-F40 HydrophobicContact CG2-CD1 4.16Å; V36-F40 HydrophobicContact CG2-CG 4.05Å; V36-R45 HydrophobicContact CG2-CG 4.26Å; V36-M125 HydrophobicContact CG1-CB 4.3Å; V36-M125 HydrophobicContact CG1-CE 3.72Å; V36-M125 HydrophobicContact CG1-CG 3.92Å; V36-M125 HydrophobicContact CG1-SD 4.48Å
37	D	81.9	Confident	82.1	Confident	49 Å²	49	62.2 Å²	62.2	26%	0.262	30%	0.302	S	S	.	.			trans	-51	150.7	171.7	-70	-30.8	0	0	0	112.6	D39 F40 R123 Y124	D37-D39 PolarHBondContact O-N 3.27Å; D37-F40 HydrophobicContact CB-CB 4.49Å; D37-F40 WeakPolarHBondContact O-CB 3.41Å; D37-F40 PolarHBondContact O-N 3.06Å; D37-R123 WeakPolarHBondContact OD2-CA 3.45Å; D37-Y124 PolarHBondContact N-O 2.78Å; D37-Y124 WeakPolarHBondContact OD1-CB 3.41Å; D37-Y124 WeakPolarHBondContact OD1-CD2 3.03Å; D37-Y124 VanDerWaalsContact OD2-CD2 3.29Å; D37-Y124 WeakPolarHBondContact OD2-CD2 3.42Å; D37-Y124 PolarHBondContact OD2-N 2.81Å
38	K	75.8	Confident	81.6	Confident	191 Å²	191	64.3 Å²	64.3	83%	0.83	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-44.4	177.1	-170.8	179.8	176.9	-174.6	0	111.3	F40 R45	K38-F40 PolarHBondContact O-N 2.76Å; K38-R45 PolarHBondContact O-NH2 3.13Å
39	D	77.6	Confident	81.3	Confident	147 Å²	147	62.2 Å²	62.2	79%	0.786	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	7.7	-177.4	-50.7	-39.8	0	0	0	113.3	D37 P41	D37-D39 PolarHBondContact O-N 3.27Å; D39-P41 WeakPolarHBondContact O-CD 3.27Å
40	F	75.8	Confident	81	Confident	24 Å²	24	62.5 Å²	62.5	11%	0.105	29%	0.291	C	S	.	.	S	Bend	trans	-70.1	121.3	176.1	-164.6	-84.2	0	0	0	110	V36 D37 K38 E42 R44 R45 M125	V36-F40 HydrophobicContact CB-CB 3.74Å; V36-F40 HydrophobicContact CB-CD1 4.24Å; V36-F40 HydrophobicContact CB-CD2 4.24Å; V36-F40 HydrophobicContact CB-CG 3.82Å; V36-F40 HydrophobicContact CG1-CD1 4.29Å; V36-F40 HydrophobicContact CG1-CD2 4.41Å; V36-F40 HydrophobicContact CG1-CG 4.19Å; V36-F40 HydrophobicContact CG2-CB 3.73Å; V36-F40 HydrophobicContact CG2-CD1 4.16Å; V36-F40 HydrophobicContact CG2-CG 4.05Å; D37-F40 HydrophobicContact CB-CB 4.49Å; D37-F40 WeakPolarHBondContact O-CB 3.41Å; D37-F40 PolarHBondContact O-N 3.06Å; K38-F40 PolarHBondContact O-N 2.76Å; F40-E42 PolarHBondContact O-N 3.3Å; F40-R44 HydrophobicContact CE1-CB 3.79Å; F40-R44 HydrophobicContact CZ-CB 4.33Å; F40-R45 HydrophobicContact CD1-CG 3.66Å; F40-R45 HydrophobicContact CE1-CG 4.05Å; F40-R45 PolarHBondContact O-NE 2.95Å; F40-R45 PolarHBondContact O-NH2 2.63Å; F40-M125 HydrophobicContact CE2-CE 4.17Å; F40-M125 HydrophobicContact CZ-CE 4.06Å
41	P	78.3	Confident	81.1	Confident	36 Å²	36	61.4 Å²	61.4	23%	0.234	29%	0.291	C	S	.	.			trans	-57.5	131.1	-173.2	-24.6	33.1	0	0	0	112.3	D39 D43 R44 R45	D39-P41 WeakPolarHBondContact O-CD 3.27Å; P41-D43 WeakPolarHBondContact CB-OD1 3.26Å; P41-D43 PolarHBondContact O-N 3.02Å; P41-R44 HydrophobicContact CB-CB 4.16Å; P41-R44 HydrophobicContact CB-CG 3.94Å; P41-R44 HydrophobicContact CG-CG 4.44Å; P41-R44 WeakPolarHBondContact O-CB 3.37Å; P41-R44 PolarHBondContact O-N 3Å; P41-R45 PolarHBondContact O-N 3.08Å
42	E	78	Confident	81.4	Confident	151 Å²	151	61.9 Å²	61.9	71%	0.706	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-65.9	-38.3	-172.9	-172.8	161.9	-153.5	0	0	112.7	F40 R44 R45	F40-E42 PolarHBondContact O-N 3.3Å; E42-R44 PolarHBondContact O-N 3.34Å; E42-R45 WeakPolarHBondContact O-CB 3.16Å; E42-R45 PolarHBondContact O-N 2.86Å
43	D	77.4	Confident	81.7	Confident	81 Å²	81	65.7 Å²	65.7	43%	0.433	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-59.1	-26.9	172.3	67.1	-57.5	0	0	0	112.8	P41 R70	P41-D43 WeakPolarHBondContact CB-OD1 3.26Å; P41-D43 PolarHBondContact O-N 3.02Å; D43-R70 WeakPolarHBondContact O-CG 2.98Å; D43-R70 PolarHBondContact O-NE 2.81Å; D43-R70 IonicContact OD2-NH2 3.84Å; D43-R70 PolarHBondContact OD2-NH2 3.36Å; D43-R70 VanDerWaalsContact OD2-NH2 3.14Å
44	R	77.2	Confident	82.3	Confident	109 Å²	109	65.4 Å²	65.4	41%	0.411	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-88.9	-10.1	178.5	-61.1	-169.5	-177.8	-169.2	0.9	113.4	F40 P41 E42	F40-R44 HydrophobicContact CE1-CB 3.79Å; F40-R44 HydrophobicContact CZ-CB 4.33Å; P41-R44 HydrophobicContact CB-CB 4.16Å; P41-R44 HydrophobicContact CB-CG 3.94Å; P41-R44 HydrophobicContact CG-CG 4.44Å; P41-R44 WeakPolarHBondContact O-CB 3.37Å; P41-R44 PolarHBondContact O-N 3Å; E42-R44 PolarHBondContact O-N 3.34Å
45	R	79	Confident	82.8	Confident	67 Å²	67	66.6 Å²	66.6	25%	0.253	32%	0.316	S	S	.	.	S	Bend	trans	-72.4	128.3	178.9	-64.4	177.3	-170.8	-167.6	-5.4	108.4	V36 K38 F40 P41 E42 R47	V36-R45 HydrophobicContact CG2-CG 4.26Å; K38-R45 PolarHBondContact O-NH2 3.13Å; F40-R45 HydrophobicContact CD1-CG 3.66Å; F40-R45 HydrophobicContact CE1-CG 4.05Å; F40-R45 PolarHBondContact O-NE 2.95Å; F40-R45 PolarHBondContact O-NH2 2.63Å; P41-R45 PolarHBondContact O-N 3.08Å; E42-R45 WeakPolarHBondContact O-CB 3.16Å; E42-R45 PolarHBondContact O-N 2.86Å; R45-R47 PolarHBondContact O-N 3.39Å
46	P	79.5	Confident	83.2	Confident	21 Å²	21	68.3 Å²	68.3	14%	0.136	33%	0.332	C	S	.	.			trans	-53	138.9	171.1	-26.3	35.3	0	0	0	110.8	M34 V49 F68 M69 W162	M34-P46 HydrophobicContact CE-CG 4.35Å; M34-P46 HydrophobicContact SD-CB 4.33Å; M34-P46 HydrophobicContact SD-CG 4.29Å; P46-V49 HydrophobicContact CB-CG2 3.73Å; P46-V49 HydrophobicContact CG-CG2 4.33Å; P46-F68 HydrophobicContact CB-CB 4.23Å; P46-F68 HydrophobicContact CB-CD2 4.16Å; P46-F68 HydrophobicContact CG-CD2 4.12Å; P46-F68 HydrophobicContact CG-CG 4.48Å; P46-M69 CarbonylContact C-O 3.53Å; P46-M69 WeakPolarHBondContact CA-O 3.49Å; P46-W162 HydrophobicContact CB-CH2 4.06Å; P46-W162 HydrophobicContact CB-CZ2 4.3Å; P46-W162 VanDerWaalsContact O-CH2 3.26Å; P46-W162 WeakPolarHBondContact O-CH2 3.49Å
47	R	80.1	Confident	83.6	Confident	158 Å²	158	71.3 Å²	71.3	60%	0.596	35%	0.347	S	S	*	.	S	Bend	trans	-93.8	-20	171.9	-83.4	-175.5	154.2	-158.8	-6.8	113.9	R45 M69 D72 W162	R45-R47 PolarHBondContact O-N 3.39Å; R47-M69 HydrophobicContact CB-CB 4.43Å; R47-M69 HydrophobicContact CB-CG 4.44Å; R47-M69 PolarHBondContact N-O 2.81Å; R47-D72 IonicContact NH1-OD1 3.21Å; R47-D72 PolarHBondContact NH1-OD1 3.1Å; R47-D72 IonicContact NH1-OD2 2.77Å; R47-W162 VanDerWaalsContact C-CH2 3.41Å; R47-W162 WeakPolarHBondContact O-CZ3 3.37Å
48	K	79.4	Confident	83.9	Confident	78 Å²	78	71 Å²	71	34%	0.339	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	151.5	171.1	-63.4	-172.1	-176.9	169.5	0	108.2	F68 M69 W162	K48-F68 CarbonylContact O-C 3.55Å; K48-F68 VanDerWaalsContact O-CA 3.23Å; K48-F68 WeakPolarHBondContact O-CA 3.4Å; K48-F68 WeakPolarHBondContact O-CB 2.68Å; K48-M69 HydrophobicContact CB-CB 4.1Å; K48-M69 PolarHBondContact O-N 3.27Å; K48-W162 VanDerWaalsContact CA-CH2 3.48Å; K48-W162 VanDerWaalsContact N-CH2 3.32Å; K48-W162 VanDerWaalsContact N-CZ3 3.32Å
49	V	81.9	Confident	84.5	Confident	14 Å²	14	65.3 Å²	65.3	9%	0.085	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	134.2	174.6	174.1	0	0	0	0	108	V31 P46 F66 F68 W162	V31-V49 HydrophobicContact CB-CG1 4.49Å; V31-V49 HydrophobicContact CG2-CG1 3.91Å; P46-V49 HydrophobicContact CB-CG2 3.73Å; P46-V49 HydrophobicContact CG-CG2 4.33Å; V49-F66 HydrophobicContact CG1-CD2 4.39Å; V49-F68 HydrophobicContact CG2-CB 3.88Å; V49-W162 HydrophobicContact CB-CZ2 4.12Å; V49-W162 HydrophobicContact CG2-CH2 4.16Å; V49-W162 HydrophobicContact CG2-CZ2 3.56Å
50	S	84	Confident	85	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.084	32%	0.318	C	S	.	.			trans	-71.7	167.3	172.4	74.8	0	0	0	0	110.8	V52 T67	S50-V52 PolarHBondContact O-N 2.94Å; S50-T67 VanDerWaalsContact CB-OG1 3.26Å; S50-T67 WeakPolarHBondContact CB-OG1 3.23Å; S50-T67 PolarHBondContact N-O 2.8Å; S50-T67 PolarHBondContact OG-N 3.34Å; S50-T67 PolarHBondContact OG-O 2.77Å; S50-T67 PolarHBondContact OG-OG1 3.43Å
51	P	88.4	Confident	85.9	Confident	34 Å²	34	59.7 Å²	59.7	22%	0.221	32%	0.324	C	S	.	.			trans	-50.6	142.4	160.7	-22.7	33.8	0	0	0	110.6	T28 W29 Y30	T28-P51 HydrophobicContact CG2-CB 3.56Å; W29-P51 CarbonylContact O-C 3.58Å; W29-P51 VanDerWaalsContact O-CA 3.27Å; W29-P51 WeakPolarHBondContact O-CA 2.9Å; Y30-P51 HydrophobicContact CD1-CB 3.97Å; Y30-P51 HydrophobicContact CD1-CG 3.7Å; Y30-P51 HydrophobicContact CE1-CB 3.89Å; Y30-P51 HydrophobicContact CE1-CG 3.51Å
52	V	90.6	Very high	86.7	Confident	13 Å²	13	58 Å²	58	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.4	177.4	-176	0	0	0	0	107.4	W29 V31 S50 V54 A64 F66	W29-V52 HydrophobicContact CB-CB 4.26Å; W29-V52 PolarHBondContact N-O 3.04Å; W29-V52 PolarHBondContact O-N 2.75Å; V31-V52 HydrophobicContact CG2-CG2 4.09Å; S50-V52 PolarHBondContact O-N 2.94Å; V52-V54 HydrophobicContact CG1-CG2 4.09Å; V52-A64 HydrophobicContact CG1-CB 4.03Å; V52-F66 HydrophobicContact CB-CB 4.35Å; V52-F66 HydrophobicContact CG1-CB 4.42Å; V52-F66 HydrophobicContact CG1-CD1 4.14Å; V52-F66 HydrophobicContact CG2-CB 3.94Å; V52-F66 HydrophobicContact CG2-CD1 4.4Å; V52-F66 HydrophobicContact CG2-CG 4.22Å
53	K	91.9	Very high	87.6	Confident	126 Å²	126	52.4 Å²	52.4	55%	0.548	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.2	172.1	-171.7	177.7	-179.1	180	0	108.5	G27 T55 A64 T65	G27-K53 WeakPolarHBondContact O-CA 2.97Å; K53-T55 HydrophobicContact CD-CG2 4.42Å; K53-T55 HydrophobicContact CG-CG2 4.22Å; K53-A64 CarbonylContact O-C 3.58Å; K53-A64 WeakPolarHBondContact O-CA 3.41Å; K53-T65 PolarHBondContact N-O 2.82Å; K53-T65 PolarHBondContact O-N 2.84Å
54	V	94.7	Very high	88.5	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.012	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.2	175.5	-177	0	0	0	0	108.7	I25 G27 V52 L62 E63 A64 M81	I25-V54 HydrophobicContact CG2-CG1 4.24Å; G27-V54 PolarHBondContact N-O 2.95Å; G27-V54 PolarHBondContact O-N 3.17Å; V52-V54 HydrophobicContact CG1-CG2 4.09Å; V54-L62 HydrophobicContact CG1-CB 4.19Å; V54-L62 HydrophobicContact CG1-CD1 4.07Å; V54-L62 HydrophobicContact CG1-CD2 4.3Å; V54-L62 HydrophobicContact CG1-CG 4.44Å; V54-E63 CarbonylContact C-O 3.59Å; V54-E63 VanDerWaalsContact CA-O 3.3Å; V54-E63 WeakPolarHBondContact CA-O 3.42Å; V54-A64 HydrophobicContact CG2-CB 4.37Å; V54-M81 HydrophobicContact CG1-CE 4.01Å
55	T	94.8	Very high	89.3	Confident	44 Å²	44	45.4 Å²	45.4	27%	0.27	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.2	179.8	52.4	0	0	0	0	110.7	K53 L62 E63	K53-T55 HydrophobicContact CD-CG2 4.42Å; K53-T55 HydrophobicContact CG-CG2 4.22Å; T55-L62 CarbonylContact O-C 3.58Å; T55-L62 WeakPolarHBondContact O-CA 3Å; T55-E63 PolarHBondContact N-O 3.02Å; T55-E63 PolarHBondContact O-N 3.29Å; T55-E63 PolarHBondContact OG1-O 3.41Å
56	A	95	Very high	89.8	Confident	53 Å²	53	43.6 Å²	43.6	44%	0.438	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	136.4	168.2	0	0	0	0	0	110.9	E22 T26 L62	E22-A56 HydrophobicContact CG-CB 4.35Å; E22-A56 WeakPolarHBondContact OE1-CA 3.46Å; E22-A56 WeakPolarHBondContact OE1-CB 3.26Å; T26-A56 HydrophobicContact CG2-CB 3.88Å; A56-L62 HydrophobicContact CB-CD2 4.48Å
57	L	93.5	Very high	90.2	Very high	88 Å²	88	43.6 Å²	43.6	46%	0.461	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	0.3	171.9	-63.3	-176.4	0	0	0	112.3	N61 E63 L80	L57-N61 HydrophobicContact CB-CB 4.3Å; L57-N61 WeakPolarHBondContact CB-O 3.37Å; L57-N61 PolarHBondContact N-O 2.97Å; L57-E63 HydrophobicContact CD1-CB 3.86Å; L57-E63 HydrophobicContact CD2-CB 4.04Å; L57-E63 HydrophobicContact CG-CB 3.92Å; L57-L80 HydrophobicContact CD1-CD1 3.38Å
58	G	88.7	Confident	90.4	Very high	41 Å²	41	37.4 Å²	37.4	42%	0.423	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	87.1	154.6	-175.3	0	0	0	0	0	113.2	G60 N61	G58-G60 PolarHBondContact O-N 2.99Å; G58-N61 PolarHBondContact O-N 3.17Å
59	G	88.1	Confident	90.4	Very high	72 Å²	72	34.7 Å²	34.7	74%	0.742	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	24.4	-175.7	0	0	0	0	0	113.6	N61	G59-N61 PolarHBondContact O-N 3.49Å
60	G	89.4	Confident	90.4	Very high	9 Å²	9	37.1 Å²	37.1	9%	0.093	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	80	-2.3	-176.7	0	0	0	0	0	115.3	E22 G58 K83	E22-G60 WeakPolarHBondContact OE2-CA 3.34Å; E22-G60 PolarHBondContact OE2-N 3.42Å; G58-G60 PolarHBondContact O-N 2.99Å; G60-K83 WeakPolarHBondContact O-CB 3.35Å
61	N	94.1	Very high	90.2	Very high	45 Å²	45	41.6 Å²	41.6	24%	0.241	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	142.5	178.9	-64.1	-41.1	0	0	0	110.4	L57 G58 G59 R82 K83	L57-N61 HydrophobicContact CB-CB 4.3Å; L57-N61 WeakPolarHBondContact CB-O 3.37Å; L57-N61 PolarHBondContact N-O 2.97Å; G58-N61 PolarHBondContact O-N 3.17Å; G59-N61 PolarHBondContact O-N 3.49Å; N61-R82 VanDerWaalsContact OD1-CA 3.28Å; N61-R82 WeakPolarHBondContact OD1-CA 3.49Å; N61-K83 PolarHBondContact OD1-N 2.93Å
62	L	95.3	Very high	89.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	158.9	-177.9	-63.7	178	0	0	0	111.1	E22 I25 T26 V54 T55 A56 M81 F90	E22-L62 HydrophobicContact CG-CD2 3.73Å; I25-L62 HydrophobicContact CB-CD1 4.04Å; I25-L62 HydrophobicContact CD1-CD1 4.19Å; I25-L62 HydrophobicContact CG2-CD1 3.55Å; T26-L62 HydrophobicContact CG2-CD2 4.12Å; V54-L62 HydrophobicContact CG1-CB 4.19Å; V54-L62 HydrophobicContact CG1-CD1 4.07Å; V54-L62 HydrophobicContact CG1-CD2 4.3Å; V54-L62 HydrophobicContact CG1-CG 4.44Å; T55-L62 CarbonylContact O-C 3.58Å; T55-L62 WeakPolarHBondContact O-CA 3Å; A56-L62 HydrophobicContact CB-CD2 4.48Å; L62-M81 HydrophobicContact CB-CB 4.13Å; L62-M81 HydrophobicContact CB-CE 3.48Å; L62-M81 VanDerWaalsContact CB-CE 3.48Å; L62-M81 HydrophobicContact CD1-CE 3.99Å; L62-M81 HydrophobicContact CG-CE 4.41Å; L62-M81 PolarHBondContact N-O 3.15Å; L62-M81 PolarHBondContact O-N 2.9Å; L62-F90 HydrophobicContact CD1-CD1 4.44Å; L62-F90 HydrophobicContact CD1-CE1 3.62Å; L62-F90 HydrophobicContact CD1-CE2 4.21Å; L62-F90 HydrophobicContact CD1-CZ 3.49Å; L62-F90 VanDerWaalsContact CD1-CZ 3.49Å; L62-F90 HydrophobicContact CG-CE1 4Å; L62-F90 HydrophobicContact CG-CZ 4.35Å
63	E	97	Very high	89.4	Confident	33 Å²	33	53.6 Å²	53.6	15%	0.154	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.1	172.9	178.9	170.1	109.7	0	0	110.3	V54 T55 L57 K78 I79	V54-E63 CarbonylContact C-O 3.59Å; V54-E63 VanDerWaalsContact CA-O 3.3Å; V54-E63 WeakPolarHBondContact CA-O 3.42Å; T55-E63 PolarHBondContact N-O 3.02Å; T55-E63 PolarHBondContact O-N 3.29Å; T55-E63 PolarHBondContact OG1-O 3.41Å; L57-E63 HydrophobicContact CD1-CB 3.86Å; L57-E63 HydrophobicContact CD2-CB 4.04Å; L57-E63 HydrophobicContact CG-CB 3.92Å; E63-K78 VanDerWaalsContact CD-NZ 3.35Å; E63-K78 HydrophobicContact CG-CG 4.17Å; E63-K78 WeakPolarHBondContact OE1-CE 3.4Å; E63-K78 IonicContact OE1-NZ 2.97Å; E63-K78 PolarHBondContact OE1-NZ 2.75Å; E63-K78 WeakPolarHBondContact OE2-CE 3.48Å; E63-K78 IonicContact OE2-NZ 3.05Å; E63-K78 PolarHBondContact OE2-NZ 3Å; E63-I79 WeakPolarHBondContact CA-O 3.3Å
64	A	95.5	Very high	89	Confident	6 Å²	6	50.6 Å²	50.6	5%	0.05	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.5	174.6	0	0	0	0	0	110.3	V52 K53 V54 K78 I79 M81	V52-A64 HydrophobicContact CG1-CB 4.03Å; K53-A64 CarbonylContact O-C 3.58Å; K53-A64 WeakPolarHBondContact O-CA 3.41Å; V54-A64 HydrophobicContact CG2-CB 4.37Å; A64-K78 WeakPolarHBondContact O-CA 3.28Å; A64-I79 HydrophobicContact CB-CB 4.45Å; A64-I79 PolarHBondContact N-O 2.81Å; A64-I79 PolarHBondContact O-N 2.83Å; A64-M81 HydrophobicContact CB-CE 3.94Å; A64-M81 HydrophobicContact CB-SD 4.03Å
65	T	94.6	Very high	88.6	Confident	38 Å²	38	53 Å²	53	23%	0.233	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.6	176.3	-59.6	0	0	0	0	110.5	K53 K77	K53-T65 PolarHBondContact N-O 2.82Å; K53-T65 PolarHBondContact O-N 2.84Å; T65-K77 WeakPolarHBondContact CA-O 3.49Å
66	F	90	Very high	88.5	Confident	29 Å²	29	57.5 Å²	57.5	13%	0.127	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	159.5	177.1	60.2	-81.7	0	0	0	110.5	V49 V52 F68 K77 I79	V49-F66 HydrophobicContact CG1-CD2 4.39Å; V52-F66 HydrophobicContact CB-CB 4.35Å; V52-F66 HydrophobicContact CG1-CB 4.42Å; V52-F66 HydrophobicContact CG1-CD1 4.14Å; V52-F66 HydrophobicContact CG2-CB 3.94Å; V52-F66 HydrophobicContact CG2-CD1 4.4Å; V52-F66 HydrophobicContact CG2-CG 4.22Å; F66-F68 HydrophobicContact CD2-CD1 4.19Å; F66-F68 AromaticContact CE2-CD1 3.76Å; F66-F68 HydrophobicContact CE2-CD1 3.76Å; F66-F68 HydrophobicContact CE2-CE1 4.37Å; F66-K77 HydrophobicContact CD1-CB 4.44Å; F66-K77 HydrophobicContact CE1-CB 3.99Å; F66-K77 HydrophobicContact CE2-CB 4.11Å; F66-K77 HydrophobicContact CE2-CG 4.38Å; F66-K77 HydrophobicContact CZ-CB 3.81Å; F66-K77 HydrophobicContact CZ-CG 4.27Å; F66-K77 PolarHBondContact N-O 3.32Å; F66-K77 PolarHBondContact O-N 3.22Å; F66-K77 VanDerWaalsContact O-O 3.13Å; F66-I79 HydrophobicContact CE1-CD1 3.65Å; F66-I79 HydrophobicContact CE1-CG1 4.09Å; F66-I79 HydrophobicContact CZ-CD1 3.93Å
67	T	86.3	Confident	88.4	Confident	21 Å²	21	59 Å²	59	13%	0.129	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	149.5	168.6	61.5	0	0	0	0	109.4	S50 I75 Q76 N167	S50-T67 VanDerWaalsContact CB-OG1 3.26Å; S50-T67 WeakPolarHBondContact CB-OG1 3.23Å; S50-T67 PolarHBondContact N-O 2.8Å; S50-T67 PolarHBondContact OG-N 3.34Å; S50-T67 PolarHBondContact OG-O 2.77Å; S50-T67 PolarHBondContact OG-OG1 3.43Å; T67-I75 CarbonylContact C-O 3.6Å; T67-I75 WeakPolarHBondContact CA-O 3.35Å; T67-Q76 HydrophobicContact CG2-CB 3.97Å; T67-Q76 HydrophobicContact CG2-CG 3.92Å; T67-N167 PolarHBondContact OG1-OD1 2.8Å
68	F	85.1	Confident	88.5	Confident	28 Å²	28	61.1 Å²	61.1	12%	0.123	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	153.8	169.8	69.4	-91.4	0	0	0	110.7	P46 K48 V49 F66 R70 I75 K77	P46-F68 HydrophobicContact CB-CB 4.23Å; P46-F68 HydrophobicContact CB-CD2 4.16Å; P46-F68 HydrophobicContact CG-CD2 4.12Å; P46-F68 HydrophobicContact CG-CG 4.48Å; K48-F68 CarbonylContact O-C 3.55Å; K48-F68 VanDerWaalsContact O-CA 3.23Å; K48-F68 WeakPolarHBondContact O-CA 3.4Å; K48-F68 WeakPolarHBondContact O-CB 2.68Å; V49-F68 HydrophobicContact CG2-CB 3.88Å; F66-F68 HydrophobicContact CD2-CD1 4.19Å; F66-F68 AromaticContact CE2-CD1 3.76Å; F66-F68 HydrophobicContact CE2-CD1 3.76Å; F66-F68 HydrophobicContact CE2-CE1 4.37Å; F68-R70 HydrophobicContact CD2-CB 4.24Å; F68-R70 HydrophobicContact CE2-CB 3.95Å; F68-I75 HydrophobicContact CE1-CB 4.19Å; F68-I75 HydrophobicContact CE1-CG2 4.04Å; F68-I75 HydrophobicContact CE2-CB 4.25Å; F68-I75 HydrophobicContact CE2-CD1 4.02Å; F68-I75 HydrophobicContact CZ-CB 4.02Å; F68-I75 HydrophobicContact CZ-CD1 4.15Å; F68-I75 HydrophobicContact CZ-CG2 3.98Å; F68-I75 PolarHBondContact N-O 2.81Å; F68-I75 PolarHBondContact O-N 2.89Å; F68-K77 HydrophobicContact CD1-CG 4.15Å; F68-K77 HydrophobicContact CE1-CD 4.39Å; F68-K77 HydrophobicContact CE1-CG 3.52Å
69	M	79.6	Confident	88.8	Confident	20 Å²	20	59.5 Å²	59.5	10%	0.099	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.1	178.3	-173.2	173	-78.2	0	0	109.8	P46 R47 K48 R73 W168	P46-M69 CarbonylContact C-O 3.53Å; P46-M69 WeakPolarHBondContact CA-O 3.49Å; R47-M69 HydrophobicContact CB-CB 4.43Å; R47-M69 HydrophobicContact CB-CG 4.44Å; R47-M69 PolarHBondContact N-O 2.81Å; K48-M69 HydrophobicContact CB-CB 4.1Å; K48-M69 PolarHBondContact O-N 3.27Å; M69-R73 WeakPolarHBondContact CA-O 3.46Å; M69-W168 HydrophobicContact CE-CB 4.45Å; M69-W168 HydrophobicContact CE-CG 4.43Å
70	R	80.8	Confident	89.2	Confident	65 Å²	65	59.2 Å²	59.2	25%	0.245	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	129.5	173.7	178.9	-178.7	172.2	-152.9	-11.5	108.3	D43 F68 D72 R73 I75	D43-R70 WeakPolarHBondContact O-CG 2.98Å; D43-R70 PolarHBondContact O-NE 2.81Å; D43-R70 IonicContact OD2-NH2 3.84Å; D43-R70 PolarHBondContact OD2-NH2 3.36Å; D43-R70 VanDerWaalsContact OD2-NH2 3.14Å; F68-R70 HydrophobicContact CD2-CB 4.24Å; F68-R70 HydrophobicContact CE2-CB 3.95Å; R70-D72 PolarHBondContact O-N 3.25Å; R70-D72 VanDerWaalsContact O-N 3.14Å; R70-R73 PolarHBondContact N-O 2.82Å; R70-R73 WeakPolarHBondContact O-CA 3.46Å; R70-R73 WeakPolarHBondContact O-CB 3.26Å; R70-R73 PolarHBondContact O-N 3.42Å; R70-I75 HydrophobicContact CB-CD1 4.05Å
71	E	81.4	Confident	89.6	Confident	107 Å²	107	59.1 Å²	59.1	50%	0.5	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	43.4	-179.3	-63.5	159.4	-149.9	0	0	111.4	R73	E71-R73 PolarHBondContact O-N 3.05Å
72	D	79.3	Confident	89.7	Confident	112 Å²	112	63.3 Å²	63.3	60%	0.599	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	7.2	-176.9	-51.6	-35.1	0	0	0	116.2	R47 R70	R47-D72 IonicContact NH1-OD1 3.21Å; R47-D72 PolarHBondContact NH1-OD1 3.1Å; R47-D72 IonicContact NH1-OD2 2.77Å; R70-D72 PolarHBondContact O-N 3.25Å; R70-D72 VanDerWaalsContact O-N 3.14Å
73	R	82.6	Confident	89.6	Confident	187 Å²	187	69.7 Å²	69.7	71%	0.706	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.7	170.6	-56.4	-178.7	80.9	173.3	5.9	110.6	M69 R70 E71	M69-R73 WeakPolarHBondContact CA-O 3.46Å; R70-R73 PolarHBondContact N-O 2.82Å; R70-R73 WeakPolarHBondContact O-CA 3.46Å; R70-R73 WeakPolarHBondContact O-CB 3.26Å; R70-R73 PolarHBondContact O-N 3.42Å; E71-R73 PolarHBondContact O-N 3.05Å
74	C	83.6	Confident	89.5	Confident	63 Å²	63	69.7 Å²	69.7	43%	0.426	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.1	170.3	-78.4	0	0	0	0	110.1	C169	C74-C169 HydrophobicContact CB-CB 3.61Å; C74-C169 WeakPolarHBondContact CB-SG 3.07Å; C74-C169 WeakPolarHBondContact SG-CA 3.46Å; C74-C169 WeakPolarHBondContact SG-CB 3.38Å; C74-C169 CovalentContact SG-SG 2.03Å; C74-C169 PolarHBondContact SG-SG 2.96Å
75	I	86.8	Confident	89.3	Confident	51 Å²	51	78.8 Å²	78.8	26%	0.262	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	117.7	-179.6	-56.9	175	0	0	0	108.2	T67 F68 R70	T67-I75 CarbonylContact C-O 3.6Å; T67-I75 WeakPolarHBondContact CA-O 3.35Å; F68-I75 HydrophobicContact CE1-CB 4.19Å; F68-I75 HydrophobicContact CE1-CG2 4.04Å; F68-I75 HydrophobicContact CE2-CB 4.25Å; F68-I75 HydrophobicContact CE2-CD1 4.02Å; F68-I75 HydrophobicContact CZ-CB 4.02Å; F68-I75 HydrophobicContact CZ-CD1 4.15Å; F68-I75 HydrophobicContact CZ-CG2 3.98Å; F68-I75 PolarHBondContact N-O 2.81Å; F68-I75 PolarHBondContact O-N 2.89Å; R70-I75 HydrophobicContact CB-CD1 4.05Å
76	Q	91.1	Very high	89	Confident	139 Å²	139	81.8 Å²	81.8	65%	0.65	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	139	170	-167	173.3	27.7	0	0	110.2	T67	T67-Q76 HydrophobicContact CG2-CB 3.97Å; T67-Q76 HydrophobicContact CG2-CG 3.92Å
77	K	92.8	Very high	88.9	Confident	84 Å²	84	85.1 Å²	85.1	37%	0.365	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.8	170.1	-70.4	-62.5	179.7	-170.5	0	110.4	T65 F66 F68 I79	T65-K77 WeakPolarHBondContact CA-O 3.49Å; F66-K77 HydrophobicContact CD1-CB 4.44Å; F66-K77 HydrophobicContact CE1-CB 3.99Å; F66-K77 HydrophobicContact CE2-CB 4.11Å; F66-K77 HydrophobicContact CE2-CG 4.38Å; F66-K77 HydrophobicContact CZ-CB 3.81Å; F66-K77 HydrophobicContact CZ-CG 4.27Å; F66-K77 PolarHBondContact N-O 3.32Å; F66-K77 PolarHBondContact O-N 3.22Å; F66-K77 VanDerWaalsContact O-O 3.13Å; F68-K77 HydrophobicContact CD1-CG 4.15Å; F68-K77 HydrophobicContact CE1-CD 4.39Å; F68-K77 HydrophobicContact CE1-CG 3.52Å; K77-I79 HydrophobicContact CB-CG1 4.48Å
78	K	95.9	Very high	88.9	Confident	133 Å²	133	84.6 Å²	84.6	58%	0.578	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	116.9	173.1	-173.8	174.5	-179.6	165.4	0	105.8	E63 A64	E63-K78 VanDerWaalsContact CD-NZ 3.35Å; E63-K78 HydrophobicContact CG-CG 4.17Å; E63-K78 WeakPolarHBondContact OE1-CE 3.4Å; E63-K78 IonicContact OE1-NZ 2.97Å; E63-K78 PolarHBondContact OE1-NZ 2.75Å; E63-K78 WeakPolarHBondContact OE2-CE 3.48Å; E63-K78 IonicContact OE2-NZ 3.05Å; E63-K78 PolarHBondContact OE2-NZ 3Å; A64-K78 WeakPolarHBondContact O-CA 3.28Å
79	I	95.9	Very high	89.3	Confident	7 Å²	7	85 Å²	85	4%	0.036	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	114.6	-174.6	-50.7	-170.8	0	0	0	108.2	E63 A64 F66 K77 M81 A92 Y93 I99	E63-I79 WeakPolarHBondContact CA-O 3.3Å; A64-I79 HydrophobicContact CB-CB 4.45Å; A64-I79 PolarHBondContact N-O 2.81Å; A64-I79 PolarHBondContact O-N 2.83Å; F66-I79 HydrophobicContact CE1-CD1 3.65Å; F66-I79 HydrophobicContact CE1-CG1 4.09Å; F66-I79 HydrophobicContact CZ-CD1 3.93Å; K77-I79 HydrophobicContact CB-CG1 4.48Å; I79-M81 HydrophobicContact CG2-CG 4.17Å; I79-M81 PolarHBondContact O-N 3.27Å; I79-A92 HydrophobicContact CG2-CB 3.81Å; I79-Y93 HydrophobicContact CG2-CE2 4.37Å; I79-I99 HydrophobicContact CG2-CD1 4.38Å
80	L	96.8	Very high	90	Very high	67 Å²	67	84.7 Å²	84.7	35%	0.351	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	118.9	167.1	176.7	62.8	0	0	0	109.1	L57 R82 A92	L57-L80 HydrophobicContact CD1-CD1 3.38Å; L80-R82 HydrophobicContact CG-CG 4.34Å; L80-A92 VanDerWaalsContact O-CB 3.29Å; L80-A92 WeakPolarHBondContact O-CB 3.28Å
81	M	96.3	Very high	90.8	Very high	6 Å²	6	82.7 Å²	82.7	3%	0.03	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	104.9	179.3	-58.9	-170.1	-57.8	0	0	108.1	V54 L62 A64 I79 F90 I99	V54-M81 HydrophobicContact CG1-CE 4.01Å; L62-M81 HydrophobicContact CB-CB 4.13Å; L62-M81 HydrophobicContact CB-CE 3.48Å; L62-M81 VanDerWaalsContact CB-CE 3.48Å; L62-M81 HydrophobicContact CD1-CE 3.99Å; L62-M81 HydrophobicContact CG-CE 4.41Å; L62-M81 PolarHBondContact N-O 3.15Å; L62-M81 PolarHBondContact O-N 2.9Å; A64-M81 HydrophobicContact CB-CE 3.94Å; A64-M81 HydrophobicContact CB-SD 4.03Å; I79-M81 HydrophobicContact CG2-CG 4.17Å; I79-M81 PolarHBondContact O-N 3.27Å; M81-F90 HydrophobicContact CB-CB 3.91Å; M81-F90 HydrophobicContact CB-CD1 4.12Å; M81-F90 HydrophobicContact CB-CG 4.15Å; M81-I99 HydrophobicContact CG-CD1 3.84Å; M81-I99 HydrophobicContact SD-CD1 3.74Å; M81-I99 HydrophobicContact SD-CG2 4.46Å
82	R	96.6	Very high	91.5	Very high	134 Å²	134	77.6 Å²	77.6	51%	0.506	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	132.3	179.6	-64.4	-179.2	179	-93.5	0.9	109.9	N61 L80 F90 S91	N61-R82 VanDerWaalsContact OD1-CA 3.28Å; N61-R82 WeakPolarHBondContact OD1-CA 3.49Å; L80-R82 HydrophobicContact CG-CG 4.34Å; R82-F90 CarbonylContact O-C 3.56Å; R82-F90 VanDerWaalsContact O-CA 3.3Å; R82-F90 WeakPolarHBondContact O-CA 3.4Å; R82-S91 PolarHBondContact N-O 2.87Å; R82-S91 PolarHBondContact O-N 3.05Å
83	K	94.4	Very high	92.2	Very high	133 Å²	133	76.9 Å²	76.9	58%	0.578	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.7	143.5	173.4	179.7	164.7	173.1	178.9	0	110.2	G60 N61	G60-K83 WeakPolarHBondContact O-CB 3.35Å; N61-K83 PolarHBondContact OD1-N 2.93Å
84	T	93.6	Very high	92.6	Very high	34 Å²	34	71.7 Å²	71.7	21%	0.209	37%	0.367	C	S	.	.			trans	-116.8	175	168.9	73.5	0	0	0	0	109.6	E86 K89	T84-E86 PolarHBondContact O-N 2.97Å; T84-E86 PolarHBondContact OG1-O 2.03Å; T84-K89 HydrophobicContact CG2-CG 4.33Å; T84-K89 PolarHBondContact N-O 3.35Å; T84-K89 WeakPolarHBondContact OG1-CB 3.43Å; T84-K89 WeakPolarHBondContact OG1-CG 3.46Å; T84-K89 PolarHBondContact OG1-O 2.86Å
85	E	91.3	Very high	93.1	Very high	196 Å²	196	70.6 Å²	70.6	92%	0.916	37%	0.366	S	S	*	.	S	Bend	trans	-65.6	-29.2	176.9	-64.5	175	-174.1	0	0	112.2	P87	E85-P87 WeakPolarHBondContact O-CD 3.49Å
86	E	89.5	Confident	93.4	Very high	102 Å²	102	75.4 Å²	75.4	48%	0.477	38%	0.381	S	S	.	.	S	Bend	trans	-82.1	122.3	176.3	-71.1	165.4	-130.5	0	0	110.3	T84 K89	T84-E86 PolarHBondContact O-N 2.97Å; T84-E86 PolarHBondContact OG1-O 2.03Å; E86-K89 HydrophobicContact CB-CB 3.91Å; E86-K89 HydrophobicContact CB-CD 3.89Å; E86-K89 HydrophobicContact CG-CD 4.33Å; E86-K89 WeakPolarHBondContact O-CB 3.33Å; E86-K89 PolarHBondContact O-N 3.32Å; E86-K89 IonicContact OE1-NZ 2.95Å; E86-K89 PolarHBondContact OE1-NZ 2.78Å; E86-K89 WeakPolarHBondContact OE2-CD 3.38Å; E86-K89 IonicContact OE2-NZ 2.92Å; E86-K89 PolarHBondContact OE2-NZ 3.01Å
87	P	86.7	Confident	93.6	Very high	98 Å²	98	70 Å²	70	64%	0.636	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	143.5	173.2	-24.3	34.6	0	0	0	112.1	E85 K89	E85-P87 WeakPolarHBondContact O-CD 3.49Å; P87-K89 PolarHBondContact O-N 3.45Å; P87-K89 VanDerWaalsContact O-N 3.11Å
88	G	86.9	Confident	93.7	Very high	11 Å²	11	68.3 Å²	68.3	11%	0.113	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	-2.5	-177.4	0	0	0	0	0	115.1	Y100 L101	G88-Y100 CarbonylContact O-C 3.57Å; G88-Y100 WeakPolarHBondContact O-CA 3.29Å; G88-L101 PolarHBondContact O-N 3.41Å
89	K	93.6	Very high	93.6	Very high	36 Å²	36	62.3 Å²	62.3	16%	0.157	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.2	174.7	-179.9	-175.3	-179	-179.5	0	111.4	T84 E86 P87 I99 Y100	T84-K89 HydrophobicContact CG2-CG 4.33Å; T84-K89 PolarHBondContact N-O 3.35Å; T84-K89 WeakPolarHBondContact OG1-CB 3.43Å; T84-K89 WeakPolarHBondContact OG1-CG 3.46Å; T84-K89 PolarHBondContact OG1-O 2.86Å; E86-K89 HydrophobicContact CB-CB 3.91Å; E86-K89 HydrophobicContact CB-CD 3.89Å; E86-K89 HydrophobicContact CG-CD 4.33Å; E86-K89 WeakPolarHBondContact O-CB 3.33Å; E86-K89 PolarHBondContact O-N 3.32Å; E86-K89 IonicContact OE1-NZ 2.95Å; E86-K89 PolarHBondContact OE1-NZ 2.78Å; E86-K89 WeakPolarHBondContact OE2-CD 3.38Å; E86-K89 IonicContact OE2-NZ 2.92Å; E86-K89 PolarHBondContact OE2-NZ 3.01Å; P87-K89 PolarHBondContact O-N 3.45Å; P87-K89 VanDerWaalsContact O-N 3.11Å; K89-I99 CarbonylContact C-O 3.54Å; K89-I99 WeakPolarHBondContact CA-O 3.4Å; K89-Y100 HydrophobicContact CB-CD1 4.1Å; K89-Y100 HydrophobicContact CB-CE1 4.23Å; K89-Y100 HydrophobicContact CD-CD1 4.39Å; K89-Y100 HydrophobicContact CD-CE1 3.7Å; K89-Y100 HydrophobicContact CG-CD1 4.02Å; K89-Y100 HydrophobicContact CG-CE1 3.73Å
90	F	94.9	Very high	93.5	Very high	13 Å²	13	63.8 Å²	63.8	6%	0.057	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.5	179	-58.3	-89.9	0	0	0	111.1	I25 L62 M81 R82 L98 I99	I25-F90 HydrophobicContact CD1-CE2 4.08Å; I25-F90 HydrophobicContact CD1-CZ 3.74Å; L62-F90 HydrophobicContact CD1-CD1 4.44Å; L62-F90 HydrophobicContact CD1-CE1 3.62Å; L62-F90 HydrophobicContact CD1-CE2 4.21Å; L62-F90 HydrophobicContact CD1-CZ 3.49Å; L62-F90 VanDerWaalsContact CD1-CZ 3.49Å; L62-F90 HydrophobicContact CG-CE1 4Å; L62-F90 HydrophobicContact CG-CZ 4.35Å; M81-F90 HydrophobicContact CB-CB 3.91Å; M81-F90 HydrophobicContact CB-CD1 4.12Å; M81-F90 HydrophobicContact CB-CG 4.15Å; R82-F90 CarbonylContact O-C 3.56Å; R82-F90 VanDerWaalsContact O-CA 3.3Å; R82-F90 WeakPolarHBondContact O-CA 3.4Å; F90-L98 WeakPolarHBondContact O-CA 3.45Å; F90-I99 HydrophobicContact CB-CB 4.36Å; F90-I99 PolarHBondContact N-O 2.81Å; F90-I99 PolarHBondContact O-N 2.87Å
91	S	96.4	Very high	93.2	Very high	23 Å²	23	61.2 Å²	61.2	16%	0.161	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	143.6	172.5	72.2	0	0	0	0	111.4	R82 K97	R82-S91 PolarHBondContact N-O 2.87Å; R82-S91 PolarHBondContact O-N 3.05Å; S91-K97 CarbonylContact C-O 3.58Å; S91-K97 WeakPolarHBondContact CA-O 3.42Å
92	A	96.3	Very high	92.7	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.008	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	160.5	178	0	0	0	0	0	110.6	I79 L80 G94 G95 R96 K97 I99	I79-A92 HydrophobicContact CG2-CB 3.81Å; L80-A92 VanDerWaalsContact O-CB 3.29Å; L80-A92 WeakPolarHBondContact O-CB 3.28Å; A92-G94 VanDerWaalsContact C-N 3.29Å; A92-G94 PolarHBondContact O-N 3.24Å; A92-G95 PolarHBondContact O-N 2.91Å; A92-R96 PolarHBondContact O-N 2.78Å; A92-K97 HydrophobicContact CB-CB 4.22Å; A92-K97 PolarHBondContact N-O 2.83Å; A92-K97 PolarHBondContact O-N 2.98Å; A92-K97 VanDerWaalsContact O-N 3.11Å; A92-I99 HydrophobicContact CB-CD1 4.3Å
93	Y	94.5	Very high	92.2	Very high	97 Å²	97	63.6 Å²	63.6	38%	0.38	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	40.2	178.1	-52.7	-63	0	0	0	114.6	I79 R96 K97	I79-Y93 HydrophobicContact CG2-CE2 4.37Å; Y93-R96 PolarHBondContact O-NE 2.89Å; Y93-R96 VanDerWaalsContact O-NE 3.11Å; Y93-K97 HydrophobicContact CD2-CB 3.84Å; Y93-K97 HydrophobicContact CD2-CD 4.1Å; Y93-K97 HydrophobicContact CE2-CD 3.93Å
94	G	91.9	Very high	91.6	Very high	78 Å²	78	59.2 Å²	59.2	80%	0.804	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	39	-179.5	0	0	0	0	0	113	A92 R96	A92-G94 VanDerWaalsContact C-N 3.29Å; A92-G94 PolarHBondContact O-N 3.24Å; G94-R96 VanDerWaalsContact C-N 3.28Å; G94-R96 PolarHBondContact O-N 3.38Å
95	G	92.4	Very high	90.9	Very high	40 Å²	40	61 Å²	61	41%	0.412	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-13	178.7	0	0	0	0	0	115.1	A92 K97	A92-G95 PolarHBondContact O-N 2.91Å; G95-K97 PolarHBondContact O-N 3.38Å
96	R	93.4	Very high	90.1	Very high	151 Å²	151	56 Å²	56	57%	0.57	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.8	179.3	-68.2	-173.8	-66.6	176.9	-1.5	113.7	A92 Y93 G94 Q117	A92-R96 PolarHBondContact O-N 2.78Å; Y93-R96 PolarHBondContact O-NE 2.89Å; Y93-R96 VanDerWaalsContact O-NE 3.11Å; G94-R96 VanDerWaalsContact C-N 3.28Å; G94-R96 PolarHBondContact O-N 3.38Å; R96-Q117 PolarHBondContact O-N 2.95Å
97	K	94.7	Very high	89.6	Confident	27 Å²	27	53.5 Å²	53.5	12%	0.117	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.5	176.7	-175.3	178.2	-179.3	-174.6	0	109.9	S91 A92 Y93 G95 I99 K115 D116	S91-K97 CarbonylContact C-O 3.58Å; S91-K97 WeakPolarHBondContact CA-O 3.42Å; A92-K97 HydrophobicContact CB-CB 4.22Å; A92-K97 PolarHBondContact N-O 2.83Å; A92-K97 PolarHBondContact O-N 2.98Å; A92-K97 VanDerWaalsContact O-N 3.11Å; Y93-K97 HydrophobicContact CD2-CB 3.84Å; Y93-K97 HydrophobicContact CD2-CD 4.1Å; Y93-K97 HydrophobicContact CE2-CD 3.93Å; G95-K97 PolarHBondContact O-N 3.38Å; K97-I99 HydrophobicContact CD-CD1 4.39Å; K97-I99 HydrophobicContact CD-CG1 4.36Å; K97-I99 HydrophobicContact CG-CG1 4.18Å; K97-K115 CarbonylContact C-O 3.56Å; K97-K115 VanDerWaalsContact CA-O 3.27Å; K97-K115 WeakPolarHBondContact CA-O 3.42Å; K97-D116 HydrophobicContact CG-CB 4.35Å
98	L	95.3	Very high	89.3	Confident	48 Å²	48	54 Å²	54	25%	0.251	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.8	170.1	-59.9	176	0	0	0	109.1	F90 Y100 C114 K115	F90-L98 WeakPolarHBondContact O-CA 3.45Å; L98-Y100 HydrophobicContact CB-CE2 3.76Å; L98-C114 CarbonylContact O-C 3.59Å; L98-C114 VanDerWaalsContact O-CA 3.32Å; L98-C114 WeakPolarHBondContact O-CA 3.35Å; L98-K115 HydrophobicContact CB-CB 4.31Å; L98-K115 PolarHBondContact N-O 3.33Å; L98-K115 PolarHBondContact O-N 2.85Å
99	I	95.2	Very high	89.3	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.7	-178.6	-57.6	165.7	0	0	0	106.7	I79 M81 K89 F90 A92 K97 F112 Y113	I79-I99 HydrophobicContact CG2-CD1 4.38Å; M81-I99 HydrophobicContact CG-CD1 3.84Å; M81-I99 HydrophobicContact SD-CD1 3.74Å; M81-I99 HydrophobicContact SD-CG2 4.46Å; K89-I99 CarbonylContact C-O 3.54Å; K89-I99 WeakPolarHBondContact CA-O 3.4Å; F90-I99 HydrophobicContact CB-CB 4.36Å; F90-I99 PolarHBondContact N-O 2.81Å; F90-I99 PolarHBondContact O-N 2.87Å; A92-I99 HydrophobicContact CB-CD1 4.3Å; K97-I99 HydrophobicContact CD-CD1 4.39Å; K97-I99 HydrophobicContact CD-CG1 4.36Å; K97-I99 HydrophobicContact CG-CG1 4.18Å; I99-F112 HydrophobicContact CG2-CD1 4.03Å; I99-Y113 CarbonylContact C-O 3.5Å; I99-Y113 WeakPolarHBondContact CA-O 3.42Å
100	Y	92.8	Very high	89	Confident	38 Å²	38	54.3 Å²	54.3	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.9	177.9	-55.8	-96.7	0	0	0	107.5	G88 K89 L98 F112 Y113 K115	G88-Y100 CarbonylContact O-C 3.57Å; G88-Y100 WeakPolarHBondContact O-CA 3.29Å; K89-Y100 HydrophobicContact CB-CD1 4.1Å; K89-Y100 HydrophobicContact CB-CE1 4.23Å; K89-Y100 HydrophobicContact CD-CD1 4.39Å; K89-Y100 HydrophobicContact CD-CE1 3.7Å; K89-Y100 HydrophobicContact CG-CD1 4.02Å; K89-Y100 HydrophobicContact CG-CE1 3.73Å; L98-Y100 HydrophobicContact CB-CE2 3.76Å; Y100-F112 CarbonylContact O-C 3.56Å; Y100-F112 WeakPolarHBondContact O-CA 3.44Å; Y100-Y113 AromaticContact CD2-CD1 3.77Å; Y100-Y113 HydrophobicContact CD2-CD1 3.77Å; Y100-Y113 HydrophobicContact CE2-CD1 4.37Å; Y100-Y113 HydrophobicContact CG-CD1 4.37Å; Y100-Y113 PolarHBondContact N-O 3.12Å; Y100-Y113 PolarHBondContact O-N 3.11Å; Y100-K115 HydrophobicContact CE2-CD 4.06Å; Y100-K115 HydrophobicContact CE2-CG 4.05Å
101	L	90.1	Very high	88.8	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.073	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.4	170.5	-176.9	52.3	0	0	0	107.7	L20 I25 G88 Y110 F112	L20-L101 HydrophobicContact CD2-CB 4.08Å; L20-L101 HydrophobicContact CD2-CD2 3.62Å; L20-L101 HydrophobicContact CD2-CG 3.84Å; I25-L101 HydrophobicContact CB-CD2 4.25Å; I25-L101 HydrophobicContact CD1-CD2 4.4Å; I25-L101 HydrophobicContact CG1-CD2 3.87Å; I25-L101 HydrophobicContact CG2-CD2 3.56Å; G88-L101 PolarHBondContact O-N 3.41Å; L101-Y110 HydrophobicContact CD1-CD1 3.88Å; L101-Y110 HydrophobicContact CD1-CG 4.17Å; L101-Y110 HydrophobicContact CG-CD1 4.12Å; L101-F112 HydrophobicContact CB-CD1 4.3Å; L101-F112 HydrophobicContact CB-CE1 4.11Å; L101-F112 HydrophobicContact CD1-CD1 3.86Å; L101-F112 HydrophobicContact CD1-CE1 3.66Å; L101-F112 HydrophobicContact CD1-CE2 4.34Å; L101-F112 HydrophobicContact CD1-CG 4.28Å; L101-F112 HydrophobicContact CD1-CZ 3.91Å; L101-F112 HydrophobicContact CD2-CE1 3.95Å; L101-F112 HydrophobicContact CD2-CZ 4.16Å; L101-F112 HydrophobicContact CG-CE1 4.14Å
102	Q	87	Confident	88.6	Confident	87 Å²	87	54.5 Å²	54.5	41%	0.407	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.3	-176.9	-66.2	177.5	9.1	0	0	109.3	Y110 V111	Q102-Y110 CarbonylContact O-C 3.59Å; Q102-Y110 WeakPolarHBondContact O-CA 3.32Å; Q102-V111 PolarHBondContact N-O 3.3Å; Q102-V111 PolarHBondContact O-N 2.87Å
103	E	85.1	Confident	88.3	Confident	102 Å²	102	55.2 Å²	55.2	48%	0.477	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	142.9	170.8	-52.9	-160.7	145.5	0	0	109.5	P105 Y110	E103-P105 WeakPolarHBondContact O-CD 3.3Å; E103-Y110 HydrophobicContact CB-CE1 4.4Å; E103-Y110 HydrophobicContact CG-CD1 3.97Å; E103-Y110 HydrophobicContact CG-CE1 3.5Å; E103-Y110 PolarHBondContact OE1-OH 2.85Å
104	L	81.5	Confident	88.2	Confident	41 Å²	41	51.1 Å²	51.1	22%	0.215	30%	0.303	C	S	.	.			trans	-94.1	110.9	172.2	-176.1	67.9	0	0	0	108.7	G106 T107 D109 L128 W146	L104-G106 PolarHBondContact O-N 3.19Å; L104-T107 WeakPolarHBondContact CB-OG1 3.45Å; L104-T107 HydrophobicContact CD2-CG2 4.3Å; L104-T107 PolarHBondContact O-N 3.44Å; L104-T107 VanDerWaalsContact O-N 3.13Å; L104-T107 PolarHBondContact O-OG1 2.99Å; L104-D109 WeakPolarHBondContact CB-O 3.43Å; L104-D109 PolarHBondContact N-O 3.44Å; L104-L128 HydrophobicContact CD2-CD1 3.86Å; L104-W146 HydrophobicContact CD1-CH2 4.3Å
105	P	79.4	Confident	88.2	Confident	73 Å²	73	50.3 Å²	50.3	47%	0.474	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	134.8	-173.5	-26	34.7	0	0	0	112.6	E103 T107	E103-P105 WeakPolarHBondContact O-CD 3.3Å; P105-T107 VanDerWaalsContact C-N 3.32Å
106	G	75.6	Confident	88	Confident	91 Å²	91	49.6 Å²	49.6	94%	0.938	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	11.4	-179.9	0	0	0	0	0	114.7	L104	L104-G106 PolarHBondContact O-N 3.19Å
107	T	78.7	Confident	87.8	Confident	49 Å²	49	48.4 Å²	48.4	30%	0.301	27%	0.265	S	S	.	.	S	Bend	trans	-140.8	160.7	175.2	68.7	0	0	0	0	111.3	L104 P105 D109	L104-T107 WeakPolarHBondContact CB-OG1 3.45Å; L104-T107 HydrophobicContact CD2-CG2 4.3Å; L104-T107 PolarHBondContact O-N 3.44Å; L104-T107 VanDerWaalsContact O-N 3.13Å; L104-T107 PolarHBondContact O-OG1 2.99Å; P105-T107 VanDerWaalsContact C-N 3.32Å; T107-D109 PolarHBondContact O-N 2.85Å; T107-D109 PolarHBondContact OG1-N 2.86Å
108	D	80.6	Confident	87.2	Confident	108 Å²	108	53.3 Å²	53.3	58%	0.578	28%	0.283	S	S	*	.	S	Bend	trans	-82.1	12.4	169.4	-55.4	-30	0	0	0	112.1	R135	D108-R135 IonicContact OD2-NH1 3.32Å; D108-R135 PolarHBondContact OD2-NH1 2.95Å
109	D	85.3	Confident	86.3	Confident	9 Å²	9	63.8 Å²	63.8	5%	0.048	32%	0.319	C	S	.	.			trans	-98.1	155.1	-176.3	-71.7	-14.1	0	0	0	111.3	K32 L104 T107 L128 A130 V137	K32-D109 IonicContact NZ-OD1 2.63Å; K32-D109 PolarHBondContact NZ-OD1 3.18Å; K32-D109 IonicContact NZ-OD2 2.76Å; K32-D109 PolarHBondContact NZ-OD2 3.42Å; L104-D109 WeakPolarHBondContact CB-O 3.43Å; L104-D109 PolarHBondContact N-O 3.44Å; T107-D109 PolarHBondContact O-N 2.85Å; T107-D109 PolarHBondContact OG1-N 2.86Å; D109-L128 HydrophobicContact CB-CD1 3.87Å; D109-A130 WeakPolarHBondContact OD1-CB 3.38Å; D109-V137 WeakPolarHBondContact OD2-CG2 3.29Å
110	Y	89	Confident	85.3	Confident	44 Å²	44	66.7 Å²	66.7	17%	0.173	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	157.9	180	-66.6	-110	0	0	0	110.6	L20 W29 L101 Q102 E103 V129	L20-Y110 HydrophobicContact CD1-CE1 3.97Å; W29-Y110 HydrophobicContact CH2-CD1 4.32Å; W29-Y110 AromaticContact CH2-CD2 3.66Å; W29-Y110 HydrophobicContact CH2-CD2 3.66Å; W29-Y110 AromaticContact CH2-CE2 3.96Å; W29-Y110 HydrophobicContact CH2-CE2 3.96Å; W29-Y110 AromaticContact CH2-CG 3.89Å; W29-Y110 HydrophobicContact CH2-CG 3.89Å; W29-Y110 AromaticContact CZ3-CD2 3.49Å; W29-Y110 HydrophobicContact CZ3-CD2 3.49Å; W29-Y110 VanDerWaalsContact CZ3-CD2 3.49Å; W29-Y110 HydrophobicContact CZ3-CE2 4.17Å; W29-Y110 AromaticContact CZ3-CG 3.81Å; W29-Y110 HydrophobicContact CZ3-CG 3.81Å; L101-Y110 HydrophobicContact CD1-CD1 3.88Å; L101-Y110 HydrophobicContact CD1-CG 4.17Å; L101-Y110 HydrophobicContact CG-CD1 4.12Å; Q102-Y110 CarbonylContact O-C 3.59Å; Q102-Y110 WeakPolarHBondContact O-CA 3.32Å; E103-Y110 HydrophobicContact CB-CE1 4.4Å; E103-Y110 HydrophobicContact CG-CD1 3.97Å; E103-Y110 HydrophobicContact CG-CE1 3.5Å; E103-Y110 PolarHBondContact OE1-OH 2.85Å; Y110-V129 PolarHBondContact N-O 3.44Å; Y110-V129 WeakPolarHBondContact O-CG2 3.13Å; Y110-V129 PolarHBondContact O-N 2.88Å
111	V	90.4	Very high	84.8	Confident	21 Å²	21	66.7 Å²	66.7	13%	0.127	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.5	173.3	-179	0	0	0	0	109.1	Q102 Y113 K127 L128	Q102-V111 PolarHBondContact N-O 3.3Å; Q102-V111 PolarHBondContact O-N 2.87Å; V111-Y113 PolarHBondContact O-N 3.36Å; V111-K127 CarbonylContact C-O 3.49Å; V111-K127 WeakPolarHBondContact CA-O 3.36Å; V111-L128 HydrophobicContact CG2-CD1 4.33Å
112	F	90.9	Very high	84.6	Confident	19 Å²	19	70 Å²	70	8%	0.083	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	106.1	159.9	-78.9	-64.6	0	0	0	108.9	W29 I99 Y100 L101 G126 K127 V129	W29-F112 HydrophobicContact CB-CE2 4.46Å; W29-F112 HydrophobicContact CD2-CE2 4.3Å; W29-F112 HydrophobicContact CG-CE2 4.21Å; I99-F112 HydrophobicContact CG2-CD1 4.03Å; Y100-F112 CarbonylContact O-C 3.56Å; Y100-F112 WeakPolarHBondContact O-CA 3.44Å; L101-F112 HydrophobicContact CB-CD1 4.3Å; L101-F112 HydrophobicContact CB-CE1 4.11Å; L101-F112 HydrophobicContact CD1-CD1 3.86Å; L101-F112 HydrophobicContact CD1-CE1 3.66Å; L101-F112 HydrophobicContact CD1-CE2 4.34Å; L101-F112 HydrophobicContact CD1-CG 4.28Å; L101-F112 HydrophobicContact CD1-CZ 3.91Å; L101-F112 HydrophobicContact CD2-CE1 3.95Å; L101-F112 HydrophobicContact CD2-CZ 4.16Å; L101-F112 HydrophobicContact CG-CE1 4.14Å; F112-G126 CarbonylContact O-C 3.6Å; F112-G126 WeakPolarHBondContact O-CA 3.45Å; F112-K127 HydrophobicContact CB-CB 4.21Å; F112-K127 PolarHBondContact N-O 2.86Å; F112-K127 PolarHBondContact O-N 2.8Å; F112-V129 HydrophobicContact CD2-CB 4.21Å; F112-V129 HydrophobicContact CD2-CG1 3.68Å; F112-V129 HydrophobicContact CD2-CG2 3.54Å; F112-V129 HydrophobicContact CE2-CB 4.4Å; F112-V129 HydrophobicContact CE2-CG1 4.18Å; F112-V129 HydrophobicContact CE2-CG2 3.69Å
113	Y	91.4	Very high	84.5	Confident	17 Å²	17	68 Å²	68	7%	0.067	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.4	172.4	-179.8	-121.5	0	0	0	110.3	I99 Y100 V111 K115 Y124 V152 I154	I99-Y113 CarbonylContact C-O 3.5Å; I99-Y113 WeakPolarHBondContact CA-O 3.42Å; Y100-Y113 AromaticContact CD2-CD1 3.77Å; Y100-Y113 HydrophobicContact CD2-CD1 3.77Å; Y100-Y113 HydrophobicContact CE2-CD1 4.37Å; Y100-Y113 HydrophobicContact CG-CD1 4.37Å; Y100-Y113 PolarHBondContact N-O 3.12Å; Y100-Y113 PolarHBondContact O-N 3.11Å; V111-Y113 PolarHBondContact O-N 3.36Å; Y113-K115 HydrophobicContact CE1-CD 4.33Å; Y113-K115 VanDerWaalsContact CE1-CE 3.41Å; Y113-K115 HydrophobicContact CE1-CG 3.95Å; Y113-Y124 HydrophobicContact CE2-CD1 4.36Å; Y113-Y124 AromaticContact CZ-CD1 3.84Å; Y113-Y124 WeakPolarHBondContact OH-CD1 3.29Å; Y113-V152 HydrophobicContact CE1-CG1 4.22Å; Y113-V152 HydrophobicContact CE2-CG1 4.21Å; Y113-V152 WeakPolarHBondContact OH-CG1 3.46Å; Y113-I154 HydrophobicContact CD2-CD1 4.15Å; Y113-I154 HydrophobicContact CE2-CD1 4.01Å
114	C	91.2	Very high	84.6	Confident	10 Å²	10	66.9 Å²	66.9	7%	0.068	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.9	-175.7	-69.4	0	0	0	0	110.2	L98 Y124 M125	L98-C114 CarbonylContact O-C 3.59Å; L98-C114 VanDerWaalsContact O-CA 3.32Å; L98-C114 WeakPolarHBondContact O-CA 3.35Å; C114-Y124 WeakPolarHBondContact O-CA 3.06Å; C114-M125 HydrophobicContact CB-CB 4.28Å; C114-M125 PolarHBondContact N-O 3.42Å; C114-M125 PolarHBondContact O-N 2.91Å
115	K	91.8	Very high	84.9	Confident	62 Å²	62	66.6 Å²	66.6	27%	0.27	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.4	165.1	-54	-172	176.6	-179.8	0	108.1	K97 L98 Y100 Y113 L122 R123 Y124	K97-K115 CarbonylContact C-O 3.56Å; K97-K115 VanDerWaalsContact CA-O 3.27Å; K97-K115 WeakPolarHBondContact CA-O 3.42Å; L98-K115 HydrophobicContact CB-CB 4.31Å; L98-K115 PolarHBondContact N-O 3.33Å; L98-K115 PolarHBondContact O-N 2.85Å; Y100-K115 HydrophobicContact CE2-CD 4.06Å; Y100-K115 HydrophobicContact CE2-CG 4.05Å; Y113-K115 HydrophobicContact CE1-CD 4.33Å; Y113-K115 VanDerWaalsContact CE1-CE 3.41Å; Y113-K115 HydrophobicContact CE1-CG 3.95Å; K115-L122 HydrophobicContact CB-CD1 4.3Å; K115-R123 CarbonylContact C-O 3.56Å; K115-R123 WeakPolarHBondContact CA-O 3.35Å; K115-Y124 HydrophobicContact CB-CD1 4.4Å; K115-Y124 HydrophobicContact CB-CE1 4.48Å; K115-Y124 HydrophobicContact CD-CD1 4.37Å; K115-Y124 HydrophobicContact CD-CE1 3.96Å; K115-Y124 HydrophobicContact CG-CD1 3.83Å; K115-Y124 HydrophobicContact CG-CE1 3.91Å
116	D	89.4	Confident	85.4	Confident	25 Å²	25	63.1 Å²	63.1	13%	0.134	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	111.6	-177.3	-172	6.6	0	0	0	109.9	K97 R118 R123	K97-D116 HydrophobicContact CG-CB 4.35Å; D116-R118 IonicContact OD1-NE 2.78Å; D116-R118 IonicContact OD2-CZ 3.14Å; D116-R118 IonicContact OD2-NE 3.73Å; D116-R118 PolarHBondContact OD2-NE 2.83Å; D116-R118 IonicContact OD2-NH2 2.67Å; D116-R118 PolarHBondContact OD2-NH2 2.93Å; D116-R123 PolarHBondContact N-O 2.92Å; D116-R123 PolarHBondContact O-N 3.49Å
117	Q	88.5	Confident	86.1	Confident	126 Å²	126	60 Å²	60	59%	0.589	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	115	177.3	-167.7	176.4	25.1	0	0	110	R96 L122	R96-Q117 PolarHBondContact O-N 2.95Å; Q117-L122 HydrophobicContact CB-CD1 4.28Å
118	R	81.9	Confident	86.6	Confident	129 Å²	129	59.1 Å²	59.1	49%	0.487	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	170.5	178.8	-62.2	-164.9	178.2	-155.5	1.4	111.1	D116 G120 G121	D116-R118 IonicContact OD1-NE 2.78Å; D116-R118 IonicContact OD2-CZ 3.14Å; D116-R118 IonicContact OD2-NE 3.73Å; D116-R118 PolarHBondContact OD2-NE 2.83Å; D116-R118 IonicContact OD2-NH2 2.67Å; D116-R118 PolarHBondContact OD2-NH2 2.93Å; R118-G120 PolarHBondContact O-N 2.9Å; R118-G121 PolarHBondContact N-O 3.05Å; R118-G121 PolarHBondContact O-N 2.84Å
119	R	76.9	Confident	87	Confident	269 Å²	269	54 Å²	54	100%	1.015	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-17.1	175.3	-70.8	-172.9	178.8	-173.9	-0.8	114.1
120	G	72.9	Confident	87	Confident	67 Å²	67	53.8 Å²	53.8	69%	0.691	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	27.6	175.9	0	0	0	0	0	114	R118	R118-G120 PolarHBondContact O-N 2.9Å
121	G	83.6	Confident	86.7	Confident	38 Å²	38	55.5 Å²	55.5	39%	0.392	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100	-174.8	177.7	0	0	0	0	0	114.9	R118	R118-G121 PolarHBondContact N-O 3.05Å; R118-G121 PolarHBondContact O-N 2.84Å
122	L	84.9	Confident	85.5	Confident	84 Å²	84	56.8 Å²	56.8	44%	0.44	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.3	179.4	-172.9	56.5	0	0	0	109.9	K115 Q117 Y124	K115-L122 HydrophobicContact CB-CD1 4.3Å; Q117-L122 HydrophobicContact CB-CD1 4.28Å; L122-Y124 HydrophobicContact CD2-CE1 3.93Å; L122-Y124 HydrophobicContact CD2-CE2 4.37Å; L122-Y124 WeakPolarHBondContact CD2-OH 3.43Å; L122-Y124 HydrophobicContact CG-CE1 4.04Å; L122-Y124 HydrophobicContact CG-CE2 4.23Å
123	R	84.9	Confident	83.8	Confident	44 Å²	44	59.4 Å²	59.4	17%	0.166	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.8	178.2	-63.2	-179	-179.6	-159.7	-6.6	111	D37 K115 D116	D37-R123 WeakPolarHBondContact OD2-CA 3.45Å; K115-R123 CarbonylContact C-O 3.56Å; K115-R123 WeakPolarHBondContact CA-O 3.35Å; D116-R123 PolarHBondContact N-O 2.92Å; D116-R123 PolarHBondContact O-N 3.49Å
124	Y	87.7	Confident	81.3	Confident	79 Å²	79	62.2 Å²	62.2	31%	0.31	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.5	177.8	-50	-80.6	0	0	0	111	D37 Y113 C114 K115 L122	D37-Y124 PolarHBondContact N-O 2.78Å; D37-Y124 WeakPolarHBondContact OD1-CB 3.41Å; D37-Y124 WeakPolarHBondContact OD1-CD2 3.03Å; D37-Y124 VanDerWaalsContact OD2-CD2 3.29Å; D37-Y124 WeakPolarHBondContact OD2-CD2 3.42Å; D37-Y124 PolarHBondContact OD2-N 2.81Å; Y113-Y124 HydrophobicContact CE2-CD1 4.36Å; Y113-Y124 AromaticContact CZ-CD1 3.84Å; Y113-Y124 WeakPolarHBondContact OH-CD1 3.29Å; C114-Y124 WeakPolarHBondContact O-CA 3.06Å; K115-Y124 HydrophobicContact CB-CD1 4.4Å; K115-Y124 HydrophobicContact CB-CE1 4.48Å; K115-Y124 HydrophobicContact CD-CD1 4.37Å; K115-Y124 HydrophobicContact CD-CE1 3.96Å; K115-Y124 HydrophobicContact CG-CD1 3.83Å; K115-Y124 HydrophobicContact CG-CE1 3.91Å; L122-Y124 HydrophobicContact CD2-CE1 3.93Å; L122-Y124 HydrophobicContact CD2-CE2 4.37Å; L122-Y124 WeakPolarHBondContact CD2-OH 3.43Å; L122-Y124 HydrophobicContact CG-CE1 4.04Å; L122-Y124 HydrophobicContact CG-CE2 4.23Å
125	M	87.9	Confident	78.9	Confident	34 Å²	34	70.7 Å²	70.7	17%	0.167	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	129.2	176.6	179.3	-178.5	-60.3	0	0	109.6	V35 V36 F40 C114 K127	V35-M125 CarbonylContact O-C 3.57Å; V35-M125 WeakPolarHBondContact O-CA 3.47Å; V35-M125 WeakPolarHBondContact O-CG 3.35Å; V36-M125 HydrophobicContact CG1-CB 4.3Å; V36-M125 HydrophobicContact CG1-CE 3.72Å; V36-M125 HydrophobicContact CG1-CG 3.92Å; V36-M125 HydrophobicContact CG1-SD 4.48Å; F40-M125 HydrophobicContact CE2-CE 4.17Å; F40-M125 HydrophobicContact CZ-CE 4.06Å; C114-M125 HydrophobicContact CB-CB 4.28Å; C114-M125 PolarHBondContact N-O 3.42Å; C114-M125 PolarHBondContact O-N 2.91Å; M125-K127 HydrophobicContact CG-CG 4.46Å; M125-K127 WeakPolarHBondContact SD-CE 3.27Å; M125-K127 PolarHBondContact SD-NZ 2.86Å
126	G	89.7	Confident	76.3	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.01	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	142.6	170.7	0	0	0	0	0	110.6	M34 V35 F112	M34-G126 WeakPolarHBondContact CA-O 3.33Å; V35-G126 PolarHBondContact N-O 3.31Å; V35-G126 PolarHBondContact O-N 3.29Å; F112-G126 CarbonylContact O-C 3.6Å; F112-G126 WeakPolarHBondContact O-CA 3.45Å
127	K	89.9	Confident	74	Confident	26 Å²	26	74.7 Å²	74.7	11%	0.113	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.5	172.4	-60.5	177	-175.1	-64.8	0	108.9	V31 A33 M34 V111 F112 M125 V129	V31-K127 HydrophobicContact CG1-CB 4.32Å; A33-K127 WeakPolarHBondContact O-CA 3.42Å; M34-K127 HydrophobicContact CB-CG 4.43Å; V111-K127 CarbonylContact C-O 3.49Å; V111-K127 WeakPolarHBondContact CA-O 3.36Å; F112-K127 HydrophobicContact CB-CB 4.21Å; F112-K127 PolarHBondContact N-O 2.86Å; F112-K127 PolarHBondContact O-N 2.8Å; M125-K127 HydrophobicContact CG-CG 4.46Å; M125-K127 WeakPolarHBondContact SD-CE 3.27Å; M125-K127 PolarHBondContact SD-NZ 2.86Å; K127-V129 HydrophobicContact CB-CG1 4.3Å
128	L	89.2	Confident	71.3	Confident	30 Å²	30	73.7 Å²	73.7	16%	0.157	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.9	171.6	-178.6	67.8	0	0	0	107.1	V31 K32 A33 L104 D109 V111 W159	V31-L128 CarbonylContact C-O 3.58Å; K32-L128 HydrophobicContact CB-CD2 4.15Å; K32-L128 HydrophobicContact CB-CG 4.26Å; K32-L128 HydrophobicContact CD-CD2 4.44Å; K32-L128 PolarHBondContact N-O 3.21Å; A33-L128 HydrophobicContact CB-CB 4.33Å; A33-L128 PolarHBondContact O-N 3.32Å; L104-L128 HydrophobicContact CD2-CD1 3.86Å; D109-L128 HydrophobicContact CB-CD1 3.87Å; V111-L128 HydrophobicContact CG2-CD1 4.33Å; L128-W159 HydrophobicContact CB-CE3 4.16Å; L128-W159 HydrophobicContact CB-CH2 3.94Å; L128-W159 HydrophobicContact CB-CZ3 3.67Å
129	V	88.7	Confident	69.3	Low	0 Å²	0	75.5 Å²	75.5	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	155.3	-174.7	-63.1	0	0	0	0	111.9	W29 Y30 V31 Y110 F112 K127	W29-V129 HydrophobicContact CB-CB 4.4Å; W29-V129 HydrophobicContact CD2-CG2 4.35Å; W29-V129 HydrophobicContact CE3-CB 3.98Å; W29-V129 HydrophobicContact CE3-CG2 3.55Å; W29-V129 HydrophobicContact CZ3-CG2 4.01Å; Y30-V129 VanDerWaalsContact O-CA 3.26Å; Y30-V129 WeakPolarHBondContact O-CA 3.39Å; V31-V129 HydrophobicContact CB-CG1 4.5Å; V31-V129 HydrophobicContact CG2-CG1 4.02Å; Y110-V129 PolarHBondContact N-O 3.44Å; Y110-V129 WeakPolarHBondContact O-CG2 3.13Å; Y110-V129 PolarHBondContact O-N 2.88Å; F112-V129 HydrophobicContact CD2-CB 4.21Å; F112-V129 HydrophobicContact CD2-CG1 3.68Å; F112-V129 HydrophobicContact CD2-CG2 3.54Å; F112-V129 HydrophobicContact CE2-CB 4.4Å; F112-V129 HydrophobicContact CE2-CG1 4.18Å; F112-V129 HydrophobicContact CE2-CG2 3.69Å; K127-V129 HydrophobicContact CB-CG1 4.3Å
130	A	86.4	Confident	67.5	Low	5 Å²	5	67.4 Å²	67.4	4%	0.041	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.4	172.4	0	0	0	0	0	110.6	W29 Y30 K32 D109 A132	W29-A130 CarbonylContact C-O 3.58Å; W29-A130 WeakPolarHBondContact CA-O 3.45Å; Y30-A130 PolarHBondContact N-O 2.89Å; Y30-A130 PolarHBondContact O-N 3.32Å; Y30-A130 VanDerWaalsContact O-N 3.1Å; K32-A130 HydrophobicContact CD-CB 4.38Å; K32-A130 VanDerWaalsContact CE-CB 3.47Å; D109-A130 WeakPolarHBondContact OD1-CB 3.38Å; A130-A132 VanDerWaalsContact C-N 3.29Å
131	S	81.5	Confident	65.9	Low	79 Å²	79	68.2 Å²	68.2	55%	0.552	41%	0.406	S	S	*	.	S	Bend	trans	-74.1	-19.5	176.1	56.3	0	0	0	0	112.9
132	A	66.5	Low	63.7	Low	49 Å²	49	71.2 Å²	71.2	41%	0.405	42%	0.418	S	S	.	.	S	Bend	trans	-118.8	143	174.8	0	0	0	0	0	111.7	A130 C134	A130-A132 VanDerWaalsContact C-N 3.29Å; A132-C134 PolarHBondContact O-N 2.77Å; A132-C134 VanDerWaalsContact O-N 3.15Å
133	P	54.1	Low	61.3	Low	73 Å²	73	78 Å²	78	47%	0.474	44%	0.438	S	S	.	.	S	Bend	trans	-68.4	-14.3	-174	22.2	-28.1	0	0	0	114.5	Y30	Y30-P133 HydrophobicContact CD1-CB 3.97Å; Y30-P133 HydrophobicContact CD2-CB 4.11Å; Y30-P133 HydrophobicContact CE1-CB 3.82Å; Y30-P133 HydrophobicContact CE1-CG 4.38Å; Y30-P133 HydrophobicContact CE2-CB 4.01Å; Y30-P133 VanDerWaalsContact CE2-CD 3.49Å; Y30-P133 HydrophobicContact CE2-CG 4.07Å; Y30-P133 HydrophobicContact CG-CB 4.09Å
134	C	39.8	Very low	59	Low	76 Å²	76	79.9 Å²	79.9	51%	0.514	45%	0.451	S	S	.	.			trans	-152.6	109	-176.2	-73	0	0	0	0	113.2	A132	A132-C134 PolarHBondContact O-N 2.77Å; A132-C134 VanDerWaalsContact O-N 3.15Å
135	R	40.4	Very low	56.3	Low	188 Å²	188	83 Å²	83	71%	0.709	48%	0.478	S	S	*	.			trans	-134.6	136.2	136.5	-78.6	-171.6	172.8	169.5	-4	107.4	D108 V137	D108-R135 IonicContact OD2-NH1 3.32Å; D108-R135 PolarHBondContact OD2-NH1 2.95Å; R135-V137 PolarHBondContact O-N 2.77Å; R135-V137 VanDerWaalsContact O-N 3.13Å
136	A	36.9	Very low	53.8	Low	104 Å²	104	86.8 Å²	86.8	86%	0.86	49%	0.491	S	S	*	.			trans	-64.6	112.5	178.5	0	0	0	0	0	108.6
137	V	40.8	Very low	51	Low	67 Å²	67	89.5 Å²	89.5	41%	0.406	51%	0.508	S	S	.	.			trans	-79.4	124.3	168.6	-175.3	0	0	0	0	106.5	D109 R135 L139	D109-V137 WeakPolarHBondContact OD2-CG2 3.29Å; R135-V137 PolarHBondContact O-N 2.77Å; R135-V137 VanDerWaalsContact O-N 3.13Å; V137-L139 PolarHBondContact O-N 2.67Å; V137-L139 VanDerWaalsContact O-N 3.08Å
138	P	33.4	Very low	48.2	Very low	106 Å²	106	93.6 Å²	93.6	69%	0.688	54%	0.538	S	S	*	.			trans	-58	116.5	166.7	-17.9	30.1	0	0	0	107.6	S140	P138-S140 PolarHBondContact O-N 3.02Å
139	L	39.4	Very low	45.8	Very low	167 Å²	167	99.6 Å²	99.6	87%	0.874	57%	0.565	S	S	*	*	S	Bend	trans	-61.8	108.3	172.9	-73.8	165.7	0	0	0	106.7	V137	V137-L139 PolarHBondContact O-N 2.67Å; V137-L139 VanDerWaalsContact O-N 3.08Å
140	S	38	Very low	43.3	Very low	99 Å²	99	104 Å²	104	69%	0.692	59%	0.587	S	S	*	*			trans	87.4	113.2	-180	73.7	0	0	0	0	117.8	P138	P138-S140 PolarHBondContact O-N 3.02Å
141	P	39.6	Very low	40.9	Very low	84 Å²	84	109.9 Å²	109.9	55%	0.545	61%	0.614	S	S	.	*			trans	-84.6	128.5	138.6	8	9.2	0	0	0	108.3	W143 L144	P141-W143 PolarHBondContact O-N 2.82Å; P141-W143 VanDerWaalsContact O-N 3.17Å; P141-L144 HydrophobicContact CG-CD1 4.32Å
142	P	37.8	Very low	38.7	Very low	101 Å²	101	109.7 Å²	109.7	66%	0.656	61%	0.61	S	S	*	*	S	Bend	trans	-74.7	0.6	-174.5	16.7	-14.9	0	0	0	115.1
143	W	33.7	Very low	36.8	Very low	227 Å²	227	111 Å²	111	86%	0.86	63%	0.628	S	S	*	*			trans	-147.7	94.3	-171.4	-49.3	95.5	0	0	0	111.9	P141	P141-W143 PolarHBondContact O-N 2.82Å; P141-W143 VanDerWaalsContact O-N 3.17Å
144	L	37.4	Very low	35.9	Very low	82 Å²	82	110.5 Å²	110.5	43%	0.429	62%	0.62	S	S	.	*			trans	-130.9	91.6	165.3	-81.1	166.4	0	0	0	108.4	P141	P141-L144 HydrophobicContact CG-CD1 4.32Å
145	T	30.3	Very low	35.4	Very low	144 Å²	144	113.4 Å²	113.4	88%	0.883	63%	0.63	S	S	*	*			trans	-82.4	111.6	165.5	39.1	0	0	0	0	108.3
146	W	35.3	Very low	35.1	Very low	114 Å²	114	110.1 Å²	110.1	43%	0.432	63%	0.625	S	S	.	*			trans	-74.3	142.7	-178.8	-65.8	87.1	0	0	0	112	L104 Q151	L104-W146 HydrophobicContact CD1-CH2 4.3Å; W146-Q151 HydrophobicContact CB-CG 4.1Å
147	P	30.9	Very low	34.7	Very low	59 Å²	59	110.7 Å²	110.7	38%	0.383	62%	0.62	S	S	.	*			trans	-58.3	140.3	167.8	-21.8	32.6	0	0	0	111.4	H149 L150	P147-H149 PolarHBondContact O-N 3.06Å; P147-L150 HydrophobicContact CB-CD1 4.48Å; P147-L150 HydrophobicContact CG-CD1 4.25Å; P147-L150 PolarHBondContact O-N 2.97Å
148	P	32.1	Very low	34.4	Very low	112 Å²	112	111.1 Å²	111.1	73%	0.727	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-18.7	-168.6	20.1	-30.4	0	0	0	115.1
149	H	39.3	Very low	34.8	Very low	156 Å²	156	108.7 Å²	108.7	72%	0.722	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-8.2	175.9	63.8	-85	0	0	0	114	P147	P147-H149 PolarHBondContact O-N 3.06Å
150	L	36.6	Very low	35.4	Very low	92 Å²	92	109.2 Å²	109.2	48%	0.482	59%	0.59	S	S	.	*	S	Bend	trans	-108.1	8	178.5	-67.5	173.4	0	0	0	112.8	P147 V152	P147-L150 HydrophobicContact CB-CD1 4.48Å; P147-L150 HydrophobicContact CG-CD1 4.25Å; P147-L150 PolarHBondContact O-N 2.97Å; L150-V152 PolarHBondContact O-N 2.85Å
151	Q	35.7	Very low	36.1	Very low	129 Å²	129	109.1 Å²	109.1	60%	0.603	59%	0.588	S	S	*	*			trans	-75.6	66.8	177.1	-64.9	-174.4	7.6	0	0	111.6	W146 G153	W146-Q151 HydrophobicContact CB-CG 4.1Å; Q151-G153 PolarHBondContact O-N 3.14Å
152	V	33.9	Very low	36.8	Very low	75 Å²	75	107.4 Å²	107.4	46%	0.455	57%	0.57	S	S	.	*			trans	-74.8	88.1	147.1	-179	0	0	0	0	105	Y113 L150 I154	Y113-V152 HydrophobicContact CE1-CG1 4.22Å; Y113-V152 HydrophobicContact CE2-CG1 4.21Å; Y113-V152 WeakPolarHBondContact OH-CG1 3.46Å; L150-V152 PolarHBondContact O-N 2.85Å; V152-I154 HydrophobicContact CG1-CD1 4.22Å; V152-I154 HydrophobicContact CG1-CG1 4.17Å; V152-I154 PolarHBondContact O-N 2.78Å
153	G	28.1	Very low	37	Very low	76 Å²	76	111.9 Å²	111.9	78%	0.784	58%	0.579	S	S	*	*			trans	-57.3	94.3	-178	0	0	0	0	0	111.5	Q151	Q151-G153 PolarHBondContact O-N 3.14Å
154	I	34.5	Very low	37.5	Very low	62 Å²	62	105.8 Å²	105.8	32%	0.318	56%	0.564	S	S	.	*			trans	-115.8	94.5	168.2	-58.4	179	0	0	0	106.5	V35 Y113 V152 I156	V35-I154 HydrophobicContact CG1-CG2 3.86Å; V35-I154 HydrophobicContact CG2-CG2 4.22Å; Y113-I154 HydrophobicContact CD2-CD1 4.15Å; Y113-I154 HydrophobicContact CE2-CD1 4.01Å; V152-I154 HydrophobicContact CG1-CD1 4.22Å; V152-I154 HydrophobicContact CG1-CG1 4.17Å; V152-I154 PolarHBondContact O-N 2.78Å; I154-I156 PolarHBondContact O-N 3.28Å
155	L	28.4	Very low	37.9	Very low	138 Å²	138	105 Å²	105	72%	0.723	56%	0.56	S	S	*	*			trans	-56.2	126.5	173.8	-83.5	157.6	0	0	0	109.8	P157 T158	L155-P157 HydrophobicContact CB-CG 4.41Å; L155-P157 VanDerWaalsContact O-CD 3.28Å; L155-P157 WeakPolarHBondContact O-CD 3.37Å; L155-T158 PolarHBondContact O-OG1 3.11Å
156	I	34.3	Very low	38.6	Very low	119 Å²	119	104 Å²	104	61%	0.61	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-57.8	-23.6	-179.7	-61.3	168.8	0	0	0	116	I154 T158 W159	I154-I156 PolarHBondContact O-N 3.28Å; I156-T158 PolarHBondContact O-N 3.42Å; I156-T158 VanDerWaalsContact O-N 3.12Å; I156-W159 VanDerWaalsContact O-CD1 3.29Å
157	P	28.8	Very low	39.2	Very low	115 Å²	115	101.9 Å²	101.9	75%	0.747	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-75.3	-1.6	-177.5	27.9	-26.7	0	0	0	114.5	L155	L155-P157 HydrophobicContact CB-CG 4.41Å; L155-P157 VanDerWaalsContact O-CD 3.28Å; L155-P157 WeakPolarHBondContact O-CD 3.37Å
158	T	34.2	Very low	39.9	Very low	77 Å²	77	106.5 Å²	106.5	47%	0.472	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-95.5	-6.2	-177.7	60.4	0	0	0	0	114.6	V35 L155 I156 R160	V35-T158 VanDerWaalsContact CG2-OG1 3.29Å; V35-T158 WeakPolarHBondContact CG2-OG1 3.49Å; L155-T158 PolarHBondContact O-OG1 3.11Å; I156-T158 PolarHBondContact O-N 3.42Å; I156-T158 VanDerWaalsContact O-N 3.12Å; T158-R160 PolarHBondContact O-N 3.23Å
159	W	42.3	Very low	40.9	Very low	54 Å²	54	103.3 Å²	103.3	21%	0.205	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-70.9	121.8	-179.3	-71.6	95.6	0	0	0	111.1	A33 V35 L128 I156 P161	A33-W159 HydrophobicContact CB-CB 4.01Å; A33-W159 HydrophobicContact CB-CD2 4.2Å; A33-W159 HydrophobicContact CB-CE3 3.45Å; A33-W159 VanDerWaalsContact CB-CE3 3.45Å; A33-W159 HydrophobicContact CB-CG 4.46Å; A33-W159 HydrophobicContact CB-CZ3 4.24Å; A33-W159 WeakPolarHBondContact O-CZ3 3.37Å; V35-W159 HydrophobicContact CB-CD2 4.39Å; V35-W159 HydrophobicContact CB-CE3 4.36Å; V35-W159 HydrophobicContact CG1-CD2 4.48Å; V35-W159 HydrophobicContact CG1-CE3 4.4Å; V35-W159 HydrophobicContact CG1-CH2 4.04Å; V35-W159 HydrophobicContact CG1-CZ2 4.06Å; V35-W159 HydrophobicContact CG1-CZ3 4.17Å; L128-W159 HydrophobicContact CB-CE3 4.16Å; L128-W159 HydrophobicContact CB-CH2 3.94Å; L128-W159 HydrophobicContact CB-CZ3 3.67Å; I156-W159 VanDerWaalsContact O-CD1 3.29Å; W159-P161 WeakPolarHBondContact O-CD 3.04Å
160	R	51.9	Low	41.4	Very low	178 Å²	178	98.2 Å²	98.2	67%	0.672	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	116.1	173	-65.9	-163.6	-170.2	-107.7	7.1	110.5	A33 M34 T158	A33-R160 WeakPolarHBondContact CA-O 3.38Å; M34-R160 PolarHBondContact O-N 2.8Å; T158-R160 PolarHBondContact O-N 3.23Å
161	P	52.5	Low	41.5	Very low	98 Å²	98	100.8 Å²	100.8	64%	0.636	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	139	177	-18.1	31.3	0	0	0	111.8	W159 K163	W159-P161 WeakPolarHBondContact O-CD 3.04Å; P161-K163 PolarHBondContact O-N 3.03Å
162	W	54.6	Low	41.7	Very low	48 Å²	48	105.2 Å²	105.2	18%	0.182	54%	0.539	C	S	.	.			trans	-79.7	113.5	171.7	-69.1	105.2	0	0	0	110.7	V31 K32 M34 P46 R47 K48 V49 N164	V31-W162 VanDerWaalsContact O-CD1 3.26Å; K32-W162 PolarHBondContact O-N 2.78Å; M34-W162 HydrophobicContact CG-CZ2 4.1Å; M34-W162 HydrophobicContact SD-CH2 4.17Å; M34-W162 HydrophobicContact SD-CZ2 3.46Å; M34-W162 WeakPolarHBondContact SD-CZ2 3.08Å; P46-W162 HydrophobicContact CB-CH2 4.06Å; P46-W162 HydrophobicContact CB-CZ2 4.3Å; P46-W162 VanDerWaalsContact O-CH2 3.26Å; P46-W162 WeakPolarHBondContact O-CH2 3.49Å; R47-W162 VanDerWaalsContact C-CH2 3.41Å; R47-W162 WeakPolarHBondContact O-CZ3 3.37Å; K48-W162 VanDerWaalsContact CA-CH2 3.48Å; K48-W162 VanDerWaalsContact N-CH2 3.32Å; K48-W162 VanDerWaalsContact N-CZ3 3.32Å; V49-W162 HydrophobicContact CB-CZ2 4.12Å; V49-W162 HydrophobicContact CG2-CH2 4.16Å; V49-W162 HydrophobicContact CG2-CZ2 3.56Å; W162-N164 VanDerWaalsContact C-N 3.32Å; W162-N164 PolarHBondContact O-N 3.34Å
163	K	42.9	Very low	42	Very low	194 Å²	194	104.6 Å²	104.6	84%	0.843	53%	0.534	S	S	*	.	S	Bend	trans	-76.4	-8.2	-176.6	-70.5	-173	177.6	-176.9	0	115.2	P161	P161-K163 PolarHBondContact O-N 3.03Å
164	N	43.8	Very low	42.3	Very low	100 Å²	100	105.7 Å²	105.7	54%	0.535	53%	0.529	S	S	.	.			trans	-156.3	109.1	-179.3	-74.4	-65.2	0	0	0	111.7	W162 R166	W162-N164 VanDerWaalsContact C-N 3.32Å; W162-N164 PolarHBondContact O-N 3.34Å; N164-R166 VanDerWaalsContact C-N 3.32Å; N164-R166 PolarHBondContact O-N 3.2Å
165	L	45.5	Very low	42.3	Very low	66 Å²	66	113.8 Å²	113.8	35%	0.346	56%	0.556	S	S	.	*			trans	-83.9	16	-176.4	-90	123.6	0	0	0	115.5	Y30	Y30-L165 HydrophobicContact CD1-CD2 3.68Å; Y30-L165 HydrophobicContact CG-CD2 4.21Å
166	R	45.3	Very low	42.5	Very low	123 Å²	123	116.9 Å²	116.9	46%	0.464	56%	0.558	S	S	.	*			trans	-89.7	136.6	-176.6	-140.8	-174.3	-57.8	-101.4	-9.9	112.5	N164 W168 S180 C181	N164-R166 VanDerWaalsContact C-N 3.32Å; N164-R166 PolarHBondContact O-N 3.2Å; R166-W168 PolarHBondContact O-N 3.25Å; R166-S180 VanDerWaalsContact CZ-O 3.23Å; R166-S180 PolarHBondContact NH1-O 2.97Å; R166-S180 PolarHBondContact NH2-O 3.11Å; R166-C181 VanDerWaalsContact NH2-CA 3.35Å
167	N	48.2	Very low	42.4	Very low	69 Å²	69	122.4 Å²	122.4	37%	0.369	57%	0.571	S	S	.	*			trans	-73	85.1	178.2	-176.3	17.6	0	0	0	111.7	T67 C169 S170	T67-N167 PolarHBondContact OG1-OD1 2.8Å; N167-C169 PolarHBondContact O-N 2.77Å; N167-C169 VanDerWaalsContact O-N 3.17Å; N167-C169 WeakPolarHBondContact OD1-CB 3.4Å; N167-C169 PolarHBondContact OD1-N 3.05Å; N167-S170 PolarHBondContact O-OG 2.72Å
168	W	44.8	Very low	42.3	Very low	156 Å²	156	122.1 Å²	122.1	59%	0.591	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-12	176.1	-167.5	-88.5	0	0	0	113.6	M69 R166 S170	M69-W168 HydrophobicContact CE-CB 4.45Å; M69-W168 HydrophobicContact CE-CG 4.43Å; R166-W168 PolarHBondContact O-N 3.25Å; W168-S170 PolarHBondContact O-N 3.27Å; W168-S170 VanDerWaalsContact O-N 3.15Å
169	C	53.6	Low	41.9	Very low	44 Å²	44	127 Å²	127	30%	0.297	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.5	17.6	-177.4	-57.5	0	0	0	0	113.9	C74 N167	C74-C169 HydrophobicContact CB-CB 3.61Å; C74-C169 WeakPolarHBondContact CB-SG 3.07Å; C74-C169 WeakPolarHBondContact SG-CA 3.46Å; C74-C169 WeakPolarHBondContact SG-CB 3.38Å; C74-C169 CovalentContact SG-SG 2.03Å; C74-C169 PolarHBondContact SG-SG 2.96Å; N167-C169 PolarHBondContact O-N 2.77Å; N167-C169 VanDerWaalsContact O-N 3.17Å; N167-C169 WeakPolarHBondContact OD1-CB 3.4Å; N167-C169 PolarHBondContact OD1-N 3.05Å
170	S	49.1	Very low	41.1	Very low	50 Å²	50	128.6 Å²	128.6	35%	0.35	60%	0.601	S	S	.	*	S	Bend	trans	-98.1	132.8	175.2	62.2	0	0	0	0	110.7	N167 W168 R172 D173	N167-S170 PolarHBondContact O-OG 2.72Å; W168-S170 PolarHBondContact O-N 3.27Å; W168-S170 VanDerWaalsContact O-N 3.15Å; S170-R172 PolarHBondContact O-N 2.81Å; S170-D173 PolarHBondContact O-N 3.27Å
171	T	39	Very low	40.2	Very low	145 Å²	145	123.2 Å²	123.2	89%	0.89	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-11.9	178	35.4	0	0	0	0	114.3
172	R	39.7	Very low	39.1	Very low	223 Å²	223	124.1 Å²	124.1	84%	0.842	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-19.6	-172.3	-149.3	175	-172.7	179.6	1.6	114.3	S170	S170-R172 PolarHBondContact O-N 2.81Å
173	D	39.9	Very low	38.1	Very low	62 Å²	62	126.3 Å²	126.3	33%	0.332	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	-6.4	-172.6	-112.3	-8	0	0	0	114.1	S170 R175	S170-D173 PolarHBondContact O-N 3.27Å; D173-R175 PolarHBondContact O-N 3.24Å
174	S	35	Very low	37.5	Very low	99 Å²	99	126.8 Å²	126.8	69%	0.692	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-13.3	179.6	60	0	0	0	0	114.3
175	R	34.6	Very low	37	Very low	231 Å²	231	133.3 Å²	133.3	87%	0.872	63%	0.632	S	S	*	*	S	Bend	trans	-115.4	-4.6	-170.8	-68.8	-165.8	-172.9	-156.2	3.2	116.9	D173	D173-R175 PolarHBondContact O-N 3.24Å
176	R	33.5	Very low	36	Very low	203 Å²	203	138.1 Å²	138.1	77%	0.766	65%	0.652	S	S	*	*			trans	-122.2	99.5	177.3	-75	-173	-169.9	-125.1	1.3	111.3	T178	R176-T178 PolarHBondContact O-N 3.14Å
177	R	31.9	Very low	35.2	Very low	236 Å²	236	135 Å²	135	89%	0.891	65%	0.653	S	S	*	*			trans	-74.1	61.9	164.9	-72.2	-174.4	-176.4	178.3	1.7	110.8
178	T	25.4	Very low	34.1	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	68%	0.675	S	S	*	*			trans	-134	108	167.5	38	0	0	0	0	108.2	R176	R176-T178 PolarHBondContact O-N 3.14Å
179	F	27.2	Very low	33.2	Very low	179 Å²	179	137.3 Å²	137.3	79%	0.785	68%	0.683	S	S	*	*			trans	-90.6	120.5	-170.5	-62.4	-95.5	0	0	0	110.2
180	S	24.7	Very low	32	Very low	87 Å²	87	140.4 Å²	140.4	61%	0.608	71%	0.705	S	S	*	*			trans	-123.9	78	169.8	-48.3	0	0	0	0	110	R166	R166-S180 VanDerWaalsContact CZ-O 3.23Å; R166-S180 PolarHBondContact NH1-O 2.97Å; R166-S180 PolarHBondContact NH2-O 3.11Å
181	C	32.7	Very low	30.9	Very low	65 Å²	65	145.7 Å²	145.7	44%	0.439	73%	0.729	S	S	.	*			trans	-54.2	130.4	166.5	-78.6	0	0	0	0	109.5	R166 C183	R166-C181 VanDerWaalsContact NH2-CA 3.35Å; C181-C183 PolarHBondContact O-N 3.32Å
182	P	29.9	Very low	30.5	Very low	118 Å²	118	144.6 Å²	144.6	77%	0.766	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-17.7	167.7	-13.8	28.4	0	0	0	111.7
183	C	34.3	Very low	30	Very low	94 Å²	94	144.9 Å²	144.9	64%	0.635	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	49.5	-178.6	-43.1	0	0	0	0	111.6	C181 R185	C181-C183 PolarHBondContact O-N 3.32Å; C183-R185 PolarHBondContact O-N 3.06Å
184	R	29.1	Very low	29.6	Very low	204 Å²	204	148.1 Å²	148.1	77%	0.77	75%	0.745	S	S	*	*			trans	-72.7	110.4	162.4	-171.4	179.7	-121.4	-132.9	1.1	106.6	E186	R184-E186 VanDerWaalsContact C-N 3.35Å; R184-E186 PolarHBondContact O-N 3.48Å
185	R	32.8	Very low	29.4	Very low	237 Å²	237	148.9 Å²	148.9	89%	0.894	75%	0.746	S	S	*	*			trans	-57.2	104.4	154.5	-93.6	-177.2	175.9	180	-2.3	106.2	C183 A187	C183-R185 PolarHBondContact O-N 3.06Å; R185-A187 PolarHBondContact O-N 2.83Å
186	E	25	Very low	29.2	Very low	167 Å²	167	143.7 Å²	143.7	78%	0.78	74%	0.742	S	S	*	*			trans	-74.2	92.6	140.4	-90.9	173.8	169	0	0	105.1	R184 A188	R184-E186 VanDerWaalsContact C-N 3.35Å; R184-E186 PolarHBondContact O-N 3.48Å; E186-A188 VanDerWaalsContact C-N 3.33Å; E186-A188 PolarHBondContact O-N 2.99Å; E186-A188 VanDerWaalsContact O-N 3.15Å
187	A	28.4	Very low	29.2	Very low	58 Å²	58	137.6 Å²	137.6	48%	0.479	74%	0.742	S	S	.	*			trans	-59.8	112.6	147.4	0	0	0	0	0	104.3	R185 F189	R185-A187 PolarHBondContact O-N 2.83Å; A187-F189 HydrophobicContact CB-CD2 3.78Å; A187-F189 HydrophobicContact CB-CE2 3.77Å; A187-F189 PolarHBondContact O-N 3.36Å
188	A	26.3	Very low	29.2	Very low	99 Å²	99	132 Å²	132	82%	0.818	74%	0.74	S	S	*	*			trans	-61.6	83.5	160.1	0	0	0	0	0	106.6	E186 S190	E186-A188 VanDerWaalsContact C-N 3.33Å; E186-A188 PolarHBondContact O-N 2.99Å; E186-A188 VanDerWaalsContact O-N 3.15Å; A188-S190 PolarHBondContact O-N 2.86Å
189	F	26	Very low	29.6	Very low	173 Å²	173	131.1 Å²	131.1	76%	0.759	74%	0.744	S	S	*	*			trans	-70.6	113.3	153.6	-81	-82.3	0	0	0	104.6	A187 N191	A187-F189 HydrophobicContact CB-CD2 3.78Å; A187-F189 HydrophobicContact CB-CE2 3.77Å; A187-F189 PolarHBondContact O-N 3.36Å; F189-N191 PolarHBondContact O-N 3.29Å
190	S	27.1	Very low	29.9	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	74%	0.744	S	S	*	*			trans	-46.5	115.4	164.3	-58.4	0	0	0	0	107.5	A188 T192	A188-S190 PolarHBondContact O-N 2.86Å; S190-T192 VanDerWaalsContact C-N 3.25Å; S190-T192 PolarHBondContact O-N 2.95Å
191	N	26.9	Very low	30.5	Very low	162 Å²	162	130.2 Å²	130.2	87%	0.866	75%	0.753	S	S	*	*			trans	-64.5	89.4	172.5	-88.8	-41.1	0	0	0	108.2	F189	F189-N191 PolarHBondContact O-N 3.29Å
192	T	29.7	Very low	30.5	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	77%	0.772	S	S	*	*			trans	-92.9	92.2	153.9	-23.5	0	0	0	0	106	S190 V194	S190-T192 VanDerWaalsContact C-N 3.25Å; S190-T192 PolarHBondContact O-N 2.95Å; T192-V194 PolarHBondContact O-N 2.9Å
193	R	30.5	Very low	30.7	Very low	228 Å²	228	135.8 Å²	135.8	86%	0.86	77%	0.773	S	S	*	*			trans	-57.6	107.3	163.6	-90	-176.4	-177.6	174.7	0.9	107
194	V	30.3	Very low	30.7	Very low	130 Å²	130	138 Å²	138	79%	0.788	78%	0.784	S	S	*	*			trans	-88.8	104	157	179.2	0	0	0	0	105.9	T192	T192-V194 PolarHBondContact O-N 2.9Å
195	T	31	Very low	31.2	Very low	115 Å²	115	136 Å²	136	71%	0.706	79%	0.788	S	S	*	*			trans	-74.5	124.6	169	-40.9	0	0	0	0	107.8
196	P	30.6	Very low	31.6	Very low	122 Å²	122	130 Å²	130	79%	0.792	78%	0.78	S	S	*	*			trans	-84	127.2	173.3	9.1	7	0	0	0	110
197	G	32.5	Very low	32.4	Very low	75 Å²	75	127.8 Å²	127.8	77%	0.773	78%	0.78	S	S	*	*			trans	92.7	86	159.5	0	0	0	0	0	116.3
198	S	32.1	Very low	32.7	Very low	119 Å²	119	133 Å²	133	83%	0.832	80%	0.8	S	S	*	*			trans	-155.4	129.7	141.3	14	0	0	0	0	107.3
199	A	34.6	Very low	33.4	Very low	91 Å²	91	135 Å²	135	75%	0.752	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-59.8	152.6	-177.2	0	0	0	0	0	112
200	P	33.3	Very low	34.2	Very low	123 Å²	123	135.2 Å²	135.2	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-75.5	134.8	178.3	30.2	-31.4	0	0	0	110.7
201	P	36.5	Very low	35.1	Very low	123 Å²	123	135.5 Å²	135.5	80%	0.799	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-82.6	141.1	154	27.2	-18.4	0	0	0	110.3
202	E	32.7	Very low	36.3	Very low	180 Å²	180	131 Å²	131	84%	0.841	80%	0.796	S	S	*	*			trans	-39.5	142.7	179.9	-153.1	168.4	135.2	0	0	115.8	T204	E202-T204 PolarHBondContact O-N 2.96Å
203	P	35.1	Very low	37.8	Very low	120 Å²	120	131.2 Å²	131.2	78%	0.779	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-82.3	117.1	-177.9	27.9	-23.9	0	0	0	112.1	L205	P203-L205 PolarHBondContact O-N 2.96Å
204	T	34.5	Very low	38.8	Very low	142 Å²	142	126.8 Å²	126.8	87%	0.871	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-70.5	116.8	167.5	-41.6	0	0	0	0	110.1	E202	E202-T204 PolarHBondContact O-N 2.96Å
205	L	38.8	Very low	39.6	Very low	162 Å²	162	123.8 Å²	123.8	85%	0.848	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59.6	137.6	175.7	-73.4	155.9	0	0	0	112.8	P203	P203-L205 PolarHBondContact O-N 2.96Å
206	P	41.1	Very low	40.9	Very low	111 Å²	111	124.6 Å²	124.6	72%	0.721	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-88.4	153.9	158	32.7	-28.9	0	0	0	111.7
207	P	41.5	Very low	41.6	Very low	120 Å²	120	125 Å²	125	78%	0.779	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79.8	153.3	-160.9	31.2	-35.3	0	0	0	115.1
208	D	34.8	Very low	42.3	Very low	168 Å²	168	129.7 Å²	129.7	90%	0.898	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-51.1	134	-178.3	-59.2	-61.4	0	0	0	114.2
209	T	42	Very low	43	Very low	140 Å²	140	132 Å²	132	86%	0.859	81%	0.808	S	S	*	*			trans	-113.6	118.7	160	-58.6	0	0	0	0	107.6
210	E	42.7	Very low	44.1	Very low	178 Å²	178	137 Å²	137	83%	0.832	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-54	145.8	-176	-86.3	-120.9	112.1	0	0	114.7
211	P	46.4	Very low	44.6	Very low	115 Å²	115	137.8 Å²	137.8	75%	0.747	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-80.4	130.9	172.1	0.5	17.4	0	0	0	112
212	G	50.9	Low	45	Very low	68 Å²	68	138.5 Å²	138.5	70%	0.701	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-67.5	160	170.5	0	0	0	0	0	113.6
213	P	62.8	Low	45.7	Very low	125 Å²	125	136.2 Å²	136.2	81%	0.812	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-75.6	157.6	-162.1	29.5	-35.3	0	0	0	114.6
214	P	51.1	Low	46.3	Very low	135 Å²	135	137.2 Å²	137.2	88%	0.877	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-79	135.3	-174.1	31.2	-33.4	0	0	0	112.8
215	G	46.4	Very low	47.1	Very low	68 Å²	68	136.9 Å²	136.9	70%	0.701	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-100.1	150.8	169.4	0	0	0	0	0	112
216	P	58.2	Low	47.6	Very low	132 Å²	132	135.2 Å²	135.2	86%	0.857	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-81.5	145	-148.8	30.5	-35.2	0	0	0	115.4
217	T	45.2	Very low	48.1	Very low	130 Å²	130	136.9 Å²	136.9	80%	0.798	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-73.2	131.2	166.5	-38.7	0	0	0	0	110.1
218	L	47.8	Very low	48.6	Very low	174 Å²	174	138.2 Å²	138.2	91%	0.911	85%	0.85	S	S	*	*			trans	-148	105.9	154.9	-100.1	163.9	0	0	0	109.5
219	Q	47.4	Very low	49.7	Very low	168 Å²	168	135.8 Å²	135.8	79%	0.785	85%	0.846	S	S	*	*			trans	-68.8	170	153.9	-90.4	-176.2	-9.3	0	0	109.8
220	P	56.1	Low	50.4	Low	196 Å²	196	135.4 Å²	135.4	100%	1.273	85%	0.845	S	S	*	*			cis	-118	0	21.8	21.5	0.9	0	0	0	116.6

Retrieved 220 of 220 residues in 75.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).