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Chromatin assembly factor 1 subunit B

Acts as a component of the histone chaperone complex chromatin assembly factor 1 (CAF-1), which assembles histone octamers onto DNA during replication and repair. CAF-1 performs the first step of the nucleosome assembly process, bringing newly synthesized histones H3 and H4 to replicating DNA; histones H2A/H2B can bind to this chromatin precursor subsequent to DNA replication to complete the histone octamer.

AlphaFold DB , UniProt , Accession A0A087X554, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 615 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	84.9	Confident	87.8	Confident	31 Å²	31	51.3 Å²	51.3	15%	0.153	28%	0.275	C	S	.	.				0	121.3	0	-173.5	179.8	74.1	0	0	105.5	L336 V348 L380 S381 F382 E386 L557	M1-L336 HydrophobicContact SD-CD1 3.97Å; M1-V348 HydrophobicContact CE-CG2 3.43Å; M1-V348 VanDerWaalsContact CE-CG2 3.43Å; M1-V348 HydrophobicContact SD-CG2 4.12Å; M1-L380 HydrophobicContact SD-CD2 4.21Å; M1-S381 CarbonylContact C-O 3.55Å; M1-S381 WeakPolarHBondContact CA-O 3.31Å; M1-F382 HydrophobicContact CB-CD1 4.26Å; M1-F382 HydrophobicContact CB-CE1 4.22Å; M1-F382 HydrophobicContact CG-CD1 4.15Å; M1-F382 HydrophobicContact CG-CE1 3.72Å; M1-F382 HydrophobicContact CG-CZ 4.31Å; M1-F382 HydrophobicContact SD-CE1 3.77Å; M1-F382 HydrophobicContact SD-CZ 4.24Å; M1-E386 PolarHBondContact N-OE1 3.24Å; M1-E386 PolarHBondContact N-OE2 3.2Å; M1-L557 HydrophobicContact CE-CD2 3.78Å; M1-L557 HydrophobicContact SD-CD2 4.42Å
2	K	86.8	Confident	87.8	Confident	94 Å²	94	55.6 Å²	55.6	41%	0.409	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.1	174.6	-68.7	166.1	179.7	172.5	0	106.9	D51 G52 L380 S381	K2-D51 PolarHBondContact NZ-O 3.34Å; K2-G52 VanDerWaalsContact CD-O 3.24Å; K2-G52 WeakPolarHBondContact CD-O 3.46Å; K2-L380 CarbonylContact O-C 3.54Å; K2-L380 WeakPolarHBondContact O-CA 3.35Å; K2-S381 PolarHBondContact N-O 3.43Å; K2-S381 PolarHBondContact O-N 3.23Å
3	V	90.1	Very high	87.8	Confident	55 Å²	55	61.5 Å²	61.5	33%	0.333	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.4	178.1	-171.3	0	0	0	0	107.8	V348 I351 F379 L380	V3-V348 HydrophobicContact CG1-CG1 4.23Å; V3-V348 HydrophobicContact CG2-CG1 4.13Å; V3-V348 HydrophobicContact CG2-CG2 4.17Å; V3-I351 HydrophobicContact CG1-CG2 3.96Å; V3-F379 WeakPolarHBondContact CA-O 3.42Å; V3-L380 HydrophobicContact CG1-CD1 4.2Å; V3-L380 HydrophobicContact CG2-CG 4.3Å
4	V	91.1	Very high	88.3	Confident	21 Å²	21	64.1 Å²	64.1	13%	0.127	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	111	-174	-170.8	0	0	0	0	109.1	K53 S378 F379	V4-K53 HydrophobicContact CG1-CB 4.43Å; V4-K53 HydrophobicContact CG1-CD 4.04Å; V4-K53 HydrophobicContact CG2-CB 3.72Å; V4-K53 HydrophobicContact CG2-CD 3.8Å; V4-K53 HydrophobicContact CG2-CG 3.52Å; V4-S378 CarbonylContact O-C 3.53Å; V4-S378 VanDerWaalsContact O-CA 3.31Å; V4-S378 WeakPolarHBondContact O-CA 3.29Å; V4-F379 PolarHBondContact N-O 3.34Å; V4-F379 PolarHBondContact O-N 3.49Å
5	T	89.1	Confident	88.8	Confident	58 Å²	58	61.7 Å²	61.7	36%	0.356	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	126.7	165.7	-50.7	0	0	0	0	107.7	S378	T5-S378 WeakPolarHBondContact CA-OG 3.39Å; T5-S378 WeakPolarHBondContact CB-OG 3.33Å; T5-S378 WeakPolarHBondContact CG2-OG 3.44Å; T5-S378 PolarHBondContact OG1-OG 3.1Å
6	C	86.4	Confident	89.3	Confident	12 Å²	12	57.9 Å²	57.9	8%	0.081	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	111.8	-178	-68.6	0	0	0	0	109.5	I8 W10 C377	C6-I8 HydrophobicContact CB-CD1 4.16Å; C6-I8 HydrophobicContact CB-CG1 4.31Å; C6-I8 PolarHBondContact O-N 2.8Å; C6-W10 HydrophobicContact CB-CZ2 3.71Å; C6-W10 PolarHBondContact O-NE1 2.96Å; C6-C377 PolarHBondContact N-O 3.07Å; C6-C377 VanDerWaalsContact N-O 3.12Å
7	E	85.2	Confident	89.7	Confident	187 Å²	187	56.8 Å²	56.8	87%	0.874	29%	0.291	S	S	*	.			trans	-72.4	52.8	178.5	-63.6	178.9	-165.5	0	0	112.3
8	I	85.7	Confident	90.2	Very high	58 Å²	58	53.7 Å²	53.7	30%	0.297	28%	0.275	S	S	.	.	S	Bend	trans	-107.6	146.8	178.3	-60.3	173.9	0	0	0	107.6	C6 W10 W44 V56	C6-I8 HydrophobicContact CB-CD1 4.16Å; C6-I8 HydrophobicContact CB-CG1 4.31Å; C6-I8 PolarHBondContact O-N 2.8Å; I8-W10 HydrophobicContact CD1-CZ2 4.48Å; I8-W10 PolarHBondContact O-N 3.08Å; I8-W44 HydrophobicContact CG2-CH2 4.08Å; I8-W44 HydrophobicContact CG2-CZ3 3.94Å; I8-V56 HydrophobicContact CD1-CB 3.85Å; I8-V56 HydrophobicContact CD1-CG1 4.07Å
9	A	85.2	Confident	90.6	Very high	48 Å²	48	50.8 Å²	50.8	40%	0.397	26%	0.261	S	S	.	.			trans	-77.2	67.9	173.5	0	0	0	0	0	111.1	H11 N12 R42	A9-H11 PolarHBondContact O-N 3.18Å; A9-N12 PolarHBondContact O-N 2.88Å; A9-R42 PolarHBondContact O-NH1 3.33Å
10	W	89.9	Confident	91	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-60.9	-171.5	-72.2	88.1	0	0	0	112.8	C6 I8 V16 L32 T34 R42 W44 V56 C377 F379	C6-W10 HydrophobicContact CB-CZ2 3.71Å; C6-W10 PolarHBondContact O-NE1 2.96Å; I8-W10 HydrophobicContact CD1-CZ2 4.48Å; I8-W10 PolarHBondContact O-N 3.08Å; W10-V16 HydrophobicContact CB-CG2 4.01Å; W10-L32 HydrophobicContact CH2-CD2 4.36Å; W10-L32 HydrophobicContact CZ3-CD2 4.13Å; W10-T34 HydrophobicContact CE3-CG2 3.8Å; W10-T34 HydrophobicContact CZ3-CG2 3.83Å; W10-R42 WeakPolarHBondContact O-CD 3.15Å; W10-R42 PolarHBondContact O-NE 2.69Å; W10-R42 PolarHBondContact O-NH1 2.84Å; W10-W44 HydrophobicContact CD2-CZ2 4.47Å; W10-W44 HydrophobicContact CE3-CD2 4.13Å; W10-W44 AromaticContact CE3-CE2 3.58Å; W10-W44 HydrophobicContact CE3-CH2 4.35Å; W10-W44 AromaticContact CE3-CZ2 3.72Å; W10-W44 HydrophobicContact CE3-CZ2 3.72Å; W10-W44 AromaticContact CE3-NE1 3.74Å; W10-W44 AromaticContact CZ3-CD1 3.81Å; W10-W44 AromaticContact CZ3-CD2 3.75Å; W10-W44 HydrophobicContact CZ3-CD2 3.75Å; W10-W44 AromaticContact CZ3-CE2 3.65Å; W10-W44 HydrophobicContact CZ3-CE3 4.39Å; W10-W44 AromaticContact CZ3-CG 3.87Å; W10-W44 HydrophobicContact CZ3-CG 3.87Å; W10-W44 HydrophobicContact CZ3-CZ2 4.22Å; W10-W44 AromaticContact CZ3-NE1 3.66Å; W10-W44 WeakPolarHBondContact O-CZ2 3.48Å; W10-V56 HydrophobicContact CH2-CB 4.48Å; W10-V56 HydrophobicContact CH2-CG1 3.68Å; W10-V56 HydrophobicContact CH2-CG2 4.16Å; W10-V56 HydrophobicContact CZ2-CG1 4.29Å; W10-V56 HydrophobicContact CZ2-CG2 4.38Å; W10-V56 HydrophobicContact CZ3-CG1 4.34Å; W10-C377 HydrophobicContact CD2-CB 3.86Å; W10-C377 HydrophobicContact CE3-CB 4.21Å; W10-C377 HydrophobicContact CG-CB 4.43Å; W10-C377 HydrophobicContact CH2-CB 4.13Å; W10-C377 HydrophobicContact CZ2-CB 3.79Å; W10-C377 HydrophobicContact CZ3-CB 4.33Å; W10-F379 AromaticContact CH2-CE2 3.76Å; W10-F379 HydrophobicContact CH2-CE2 3.76Å; W10-F379 AromaticContact CH2-CZ 3.79Å; W10-F379 HydrophobicContact CH2-CZ 3.79Å; W10-F379 AromaticContact CZ2-CE2 3.82Å; W10-F379 HydrophobicContact CZ2-CE2 3.82Å; W10-F379 HydrophobicContact CZ2-CZ 4.33Å
11	H	91.4	Very high	91.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	59.5	170.5	-74.1	-95.2	0	0	0	109.2	A9 K13 E14 T34 A35 D38 T40	A9-H11 PolarHBondContact O-N 3.18Å; H11-K13 PolarHBondContact O-N 3.14Å; H11-E14 VanDerWaalsContact O-CB 3.31Å; H11-E14 WeakPolarHBondContact O-CB 3.46Å; H11-E14 PolarHBondContact O-N 3.2Å; H11-T34 PolarHBondContact CE1-O 3.1Å; H11-T34 VanDerWaalsContact NE2-C 3.26Å; H11-T34 WeakPolarHBondContact NE2-CB 3.49Å; H11-T34 PolarHBondContact NE2-O 2.9Å; H11-T34 PolarHBondContact NE2-OG1 3.5Å; H11-A35 PolarHBondContact NE2-N 3.42Å; H11-D38 WeakPolarHBondContact CA-OD2 3.4Å; H11-D38 HydrophobicContact CB-CB 4.49Å; H11-D38 IonicContact CE1-OD1 3.79Å; H11-D38 IonicContact CG-OD1 3.72Å; H11-D38 IonicContact CG-OD2 3.8Å; H11-D38 IonicContact ND1-OD1 2.8Å; H11-D38 PolarHBondContact ND1-OD1 3.14Å; H11-D38 IonicContact ND1-OD2 3.38Å; H11-D38 PolarHBondContact ND1-OD2 3.3Å; H11-T40 PolarHBondContact CE1-O 3.1Å; H11-T40 PolarHBondContact ND1-OG1 3.4Å
12	N	88.2	Confident	91.7	Very high	103 Å²	103	46 Å²	46	55%	0.551	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	19.8	-178.4	-58	-12.1	0	0	0	115.2	A9 E14 R42	A9-N12 PolarHBondContact O-N 2.88Å; N12-E14 VanDerWaalsContact C-N 3.28Å; N12-R42 VanDerWaalsContact CG-NH2 3.35Å; N12-R42 PolarHBondContact OD1-NH1 2.83Å; N12-R42 PolarHBondContact OD1-NH2 3.4Å
13	K	88	Confident	91.6	Very high	132 Å²	132	44.2 Å²	44.2	57%	0.574	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	5.9	-169.3	-52.6	174.4	178	175.7	0	115.4	H11	H11-K13 PolarHBondContact O-N 3.14Å
14	E	94.3	Very high	90.8	Very high	99 Å²	99	47.3 Å²	47.3	46%	0.463	24%	0.244	S	C	.	.	S	Bend	trans	-74.5	157.1	166.2	-65.7	-61.5	153.9	0	0	111.3	H11 N12 V16 V37 G375	H11-E14 VanDerWaalsContact O-CB 3.31Å; H11-E14 WeakPolarHBondContact O-CB 3.46Å; H11-E14 PolarHBondContact O-N 3.2Å; N12-E14 VanDerWaalsContact C-N 3.28Å; E14-V16 PolarHBondContact O-N 3.14Å; E14-V37 HydrophobicContact CB-CB 4.11Å; E14-G375 WeakPolarHBondContact O-CA 3.25Å
15	P	95.4	Very high	89.5	Confident	28 Å²	28	47.7 Å²	47.7	18%	0.182	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-51.1	129.8	-176.1	-29	34	0	0	0	114.6	Y17 G36 V37 T373	P15-Y17 HydrophobicContact CB-CD1 4.27Å; P15-Y17 HydrophobicContact CB-CE1 3.78Å; P15-G36 WeakPolarHBondContact O-CA 3.19Å; P15-V37 HydrophobicContact CB-CG2 3.88Å; P15-V37 HydrophobicContact CG-CG2 3.99Å; P15-V37 PolarHBondContact O-N 3.43Å; P15-V37 VanDerWaalsContact O-N 3.15Å; P15-T373 HydrophobicContact CB-CG2 4.46Å
16	V	96.9	Very high	88.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.5	169.3	-169.4	0	0	0	0	108.1	W10 E14 A35 S357 S372	W10-V16 HydrophobicContact CB-CG2 4.01Å; E14-V16 PolarHBondContact O-N 3.14Å; V16-A35 WeakPolarHBondContact CG1-O 3.46Å; V16-S357 WeakPolarHBondContact O-CB 3.5Å; V16-S357 PolarHBondContact O-OG 3Å; V16-S372 PolarHBondContact N-O 2.87Å
17	Y	96.9	Very high	86.6	Confident	40 Å²	40	55 Å²	55	16%	0.157	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-25.7	-174.3	-70.6	-33.7	0	0	0	114	P15 A35 V37 A68 F238 R240 T373	P15-Y17 HydrophobicContact CB-CD1 4.27Å; P15-Y17 HydrophobicContact CB-CE1 3.78Å; Y17-A35 PolarHBondContact N-O 2.99Å; Y17-V37 HydrophobicContact CD2-CG2 4.33Å; Y17-V37 HydrophobicContact CE1-CG2 4.29Å; Y17-V37 HydrophobicContact CE2-CG2 3.44Å; Y17-V37 VanDerWaalsContact CE2-CG2 3.44Å; Y17-V37 VanDerWaalsContact CZ-CG2 3.41Å; Y17-V37 VanDerWaalsContact OH-CG2 3.26Å; Y17-V37 WeakPolarHBondContact OH-CG2 3.42Å; Y17-A68 HydrophobicContact CE2-CB 4.26Å; Y17-F238 HydrophobicContact CD1-CE2 4.14Å; Y17-F238 HydrophobicContact CD1-CZ 4.11Å; Y17-F238 HydrophobicContact CG-CE2 4.46Å; Y17-F238 HydrophobicContact CG-CZ 4.05Å; Y17-R240 PolarHBondContact O-NH1 2.66Å; Y17-T373 HydrophobicContact CD1-CG2 4.44Å; Y17-T373 HydrophobicContact CE1-CG2 4.39Å
18	S	97.9	Very high	85.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	150.8	-179.2	-171.5	0	0	0	0	112	T34 A35 N70 V72 R73 D358	S18-T34 WeakPolarHBondContact O-CA 3.47Å; S18-A35 PolarHBondContact N-O 3.27Å; S18-A35 PolarHBondContact O-N 2.95Å; S18-N70 WeakPolarHBondContact CB-O 3.44Å; S18-V72 PolarHBondContact OG-N 2.76Å; S18-V72 PolarHBondContact OG-O 3.04Å; S18-R73 PolarHBondContact OG-NH1 3.25Å; S18-R73 VanDerWaalsContact OG-NH1 3.11Å; S18-R73 PolarHBondContact OG-NH2 3.01Å; S18-D358 WeakPolarHBondContact CA-OD2 3.33Å; S18-D358 WeakPolarHBondContact CB-OD2 3.2Å; S18-D358 PolarHBondContact OG-OD2 3.22Å
19	L	98.1	Very high	85.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	153.6	167.3	48.5	65.4	0	0	0	111.3	L32 A33 T34 R73 D358 T360 A369 C377	L19-L32 HydrophobicContact CB-CD1 4.31Å; L19-A33 CarbonylContact C-O 3.53Å; L19-A33 WeakPolarHBondContact CA-O 3.22Å; L19-A33 WeakPolarHBondContact CB-O 3.29Å; L19-T34 HydrophobicContact CB-CG2 3.98Å; L19-R73 PolarHBondContact O-NH1 2.92Å; L19-R73 VanDerWaalsContact O-NH1 3.1Å; L19-D358 PolarHBondContact N-OD2 2.84Å; L19-T360 HydrophobicContact CD1-CG2 3.52Å; L19-A369 HydrophobicContact CD1-CB 4.16Å; L19-A369 HydrophobicContact CD2-CB 4.08Å; L19-C377 HydrophobicContact CD2-CB 4.25Å
20	D	98.3	Very high	85.9	Confident	18 Å²	18	51.8 Å²	51.8	10%	0.096	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	144.1	173.6	-154.3	20.2	0	0	0	112.5	A33 R73 F74 T360	D20-A33 PolarHBondContact N-O 3.02Å; D20-A33 PolarHBondContact O-N 2.63Å; D20-R73 VanDerWaalsContact OD2-CA 3.28Å; D20-R73 WeakPolarHBondContact OD2-CA 3.42Å; D20-F74 HydrophobicContact CB-CD2 4.33Å; D20-F74 WeakPolarHBondContact O-CE2 3.26Å; D20-F74 PolarHBondContact OD2-N 3.48Å; D20-T360 VanDerWaalsContact CA-CG2 3.5Å; D20-T360 WeakPolarHBondContact OD1-CB 3.37Å; D20-T360 PolarHBondContact OD1-OG1 2.93Å
21	F	96.8	Very high	86.2	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	136.6	176.3	-89	-63.6	0	0	0	109.4	H23 H30 L32 V46 F74 T360 W361 F367 A369 F379	F21-H23 PolarHBondContact O-CD2 3.34Å; F21-H23 VanDerWaalsContact O-CD2 3.3Å; F21-H23 PolarHBondContact O-N 2.84Å; F21-H30 HydrophobicContact CD1-CB 4Å; F21-H30 HydrophobicContact CE1-CB 3.78Å; F21-L32 HydrophobicContact CD1-CB 3.95Å; F21-L32 HydrophobicContact CD1-CD1 3.77Å; F21-L32 HydrophobicContact CD1-CG 4.49Å; F21-L32 HydrophobicContact CD2-CD1 4.02Å; F21-L32 HydrophobicContact CE1-CB 3.85Å; F21-L32 HydrophobicContact CE1-CD1 3.86Å; F21-L32 HydrophobicContact CE1-CG 4.39Å; F21-L32 HydrophobicContact CE2-CD1 4.12Å; F21-L32 HydrophobicContact CG-CD1 3.85Å; F21-L32 HydrophobicContact CZ-CD1 4.04Å; F21-V46 HydrophobicContact CE1-CB 3.98Å; F21-V46 HydrophobicContact CE1-CG1 4.5Å; F21-V46 HydrophobicContact CE1-CG2 3.95Å; F21-V46 HydrophobicContact CZ-CB 4.33Å; F21-V46 HydrophobicContact CZ-CG1 4.37Å; F21-V46 HydrophobicContact CZ-CG2 4.34Å; F21-F74 VanDerWaalsContact C-CD2 3.44Å; F21-T360 HydrophobicContact CB-CG2 4.19Å; F21-T360 HydrophobicContact CD2-CG2 3.49Å; F21-T360 VanDerWaalsContact CD2-CG2 3.49Å; F21-T360 HydrophobicContact CE2-CG2 4.23Å; F21-T360 HydrophobicContact CG-CG2 4.06Å; F21-W361 VanDerWaalsContact CD2-C 3.44Å; F21-F367 HydrophobicContact CE2-CB 4.13Å; F21-F367 HydrophobicContact CZ-CB 4.12Å; F21-A369 HydrophobicContact CD2-CB 4.49Å; F21-A369 HydrophobicContact CE2-CB 3.72Å; F21-A369 HydrophobicContact CZ-CB 4.23Å; F21-F379 HydrophobicContact CZ-CD1 4.49Å; F21-F379 HydrophobicContact CZ-CE1 4.03Å
22	Q	94.7	Very high	86.4	Confident	12 Å²	12	52.8 Å²	52.8	6%	0.056	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-68.1	117.8	169.5	-169.1	-178.4	27.2	0	0	108.9	R31 F74 G78	Q22-R31 HydrophobicContact CB-CB 3.99Å; Q22-R31 PolarHBondContact N-O 3.41Å; Q22-F74 VanDerWaalsContact CA-CD2 3.49Å; Q22-F74 HydrophobicContact CB-CD1 3.78Å; Q22-F74 HydrophobicContact CB-CD2 3.87Å; Q22-F74 HydrophobicContact CB-CE1 3.81Å; Q22-F74 HydrophobicContact CB-CE2 3.87Å; Q22-F74 HydrophobicContact CB-CG 3.81Å; Q22-F74 HydrophobicContact CB-CZ 3.86Å; Q22-F74 HydrophobicContact CG-CD1 3.68Å; Q22-F74 HydrophobicContact CG-CE1 3.89Å; Q22-F74 HydrophobicContact CG-CG 4.08Å; Q22-F74 HydrophobicContact CG-CZ 4.44Å; Q22-G78 PolarHBondContact NE2-O 3.12Å
23	H	85	Confident	86.9	Confident	55 Å²	55	47.9 Å²	47.9	26%	0.255	24%	0.243	S	C	.	.	S	Bend	trans	-87.7	151.1	169	-66.4	-169.7	0	0	0	108.5	F21 G78 W361	F21-H23 PolarHBondContact O-CD2 3.34Å; F21-H23 VanDerWaalsContact O-CD2 3.3Å; F21-H23 PolarHBondContact O-N 2.84Å; H23-G78 WeakPolarHBondContact O-CA 3.4Å; H23-W361 PolarHBondContact NE2-O 3.14Å
24	N	72.8	Confident	87.4	Confident	120 Å²	120	41.6 Å²	41.6	64%	0.642	22%	0.216	S	C	*	.	S	Bend	trans	62.4	35.7	-176.6	-161.5	52.3	0	0	0	115.4	N77	N24-N77 PolarHBondContact ND2-O 3.34Å
25	S	63	Low	87.5	Confident	29 Å²	29	36.9 Å²	36.9	20%	0.203	19%	0.194	C	C	.	.			trans	-68.3	144.7	157.4	63	0	0	0	0	109.6	G27 F29	S25-G27 PolarHBondContact O-N 2.75Å; S25-F29 PolarHBondContact OG-O 3.27Å
26	E	59.2	Low	87.5	Confident	144 Å²	144	35.6 Å²	35.6	67%	0.673	19%	0.185	S	C	*	.			trans	-73.9	53.2	-173.1	-59.5	178.4	142.8	0	0	113.7	R28	E26-R28 HydrophobicContact CB-CG 4.31Å; E26-R28 WeakPolarHBondContact O-CG 3.28Å; E26-R28 PolarHBondContact O-N 3.44Å; E26-R28 IonicContact OE2-CZ 3.03Å; E26-R28 VanDerWaalsContact OE2-CZ 3.32Å; E26-R28 IonicContact OE2-NE 2.7Å; E26-R28 PolarHBondContact OE2-NE 2.85Å; E26-R28 IonicContact OE2-NH2 2.89Å; E26-R28 PolarHBondContact OE2-NH2 3.15Å
27	G	55.8	Low	87.4	Confident	79 Å²	79	37.8 Å²	37.8	81%	0.814	20%	0.198	S	C	*	.	S	Bend	trans	65.3	-0.2	-178.4	0	0	0	0	0	115.5	S25	S25-G27 PolarHBondContact O-N 2.75Å
28	R	65.4	Low	87.2	Confident	161 Å²	161	37.2 Å²	37.2	61%	0.608	20%	0.198	S	C	*	.	S	Bend	trans	-71	-40.2	-170.1	-49.7	-167.5	-161.9	175.1	6.6	113.3	E26	E26-R28 HydrophobicContact CB-CG 4.31Å; E26-R28 WeakPolarHBondContact O-CG 3.28Å; E26-R28 PolarHBondContact O-N 3.44Å; E26-R28 IonicContact OE2-CZ 3.03Å; E26-R28 VanDerWaalsContact OE2-CZ 3.32Å; E26-R28 IonicContact OE2-NE 2.7Å; E26-R28 PolarHBondContact OE2-NE 2.85Å; E26-R28 IonicContact OE2-NH2 2.89Å; E26-R28 PolarHBondContact OE2-NH2 3.15Å
29	F	84.8	Confident	87.1	Confident	30 Å²	30	39.6 Å²	39.6	13%	0.132	21%	0.213	C	C	.	.			trans	178.4	172.2	175.6	55.4	-87.2	0	0	0	110.3	S25 R31 R45 E47 L59	S25-F29 PolarHBondContact OG-O 3.27Å; F29-R31 HydrophobicContact CD2-CB 4.28Å; F29-R31 HydrophobicContact CE2-CB 3.73Å; F29-R31 HydrophobicContact CE2-CG 4.15Å; F29-R45 HydrophobicContact CB-CG 3.99Å; F29-R45 HydrophobicContact CD2-CB 3.77Å; F29-R45 HydrophobicContact CD2-CG 3.81Å; F29-R45 HydrophobicContact CE2-CB 4.03Å; F29-R45 HydrophobicContact CG-CB 4.36Å; F29-R45 HydrophobicContact CG-CG 3.95Å; F29-E47 HydrophobicContact CB-CG 4.25Å; F29-E47 WeakPolarHBondContact CB-OE1 3.2Å; F29-L59 HydrophobicContact CE2-CD1 3.6Å; F29-L59 HydrophobicContact CZ-CD1 3.94Å
30	H	91.9	Very high	86.9	Confident	35 Å²	35	40 Å²	40	16%	0.162	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	111.2	167.8	-48	-69.8	0	0	0	110.2	F21 V46 D364 F367	F21-H30 HydrophobicContact CD1-CB 4Å; F21-H30 HydrophobicContact CE1-CB 3.78Å; H30-V46 WeakPolarHBondContact CB-O 3.41Å; H30-V46 PolarHBondContact CD2-O 2.92Å; H30-V46 PolarHBondContact O-N 2.86Å; H30-D364 IonicContact CE1-OD1 3.88Å; H30-D364 PolarHBondContact CE1-OD1 3.32Å; H30-D364 IonicContact CE1-OD2 3.78Å; H30-D364 IonicContact NE2-OD1 3.76Å; H30-D364 IonicContact NE2-OD2 3.58Å; H30-F367 AromaticContact CD2-CD2 3.9Å; H30-F367 AromaticContact CD2-CE2 3.84Å; H30-F367 AromaticContact NE2-CD2 3.99Å; H30-F367 AromaticContact NE2-CE2 3.95Å
31	R	94.9	Very high	86.9	Confident	22 Å²	22	39.2 Å²	39.2	8%	0.083	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.8	172	-168.5	-178.7	-80	128.6	-11.4	109.1	Q22 F29 W44 L59 F74 E118	Q22-R31 HydrophobicContact CB-CB 3.99Å; Q22-R31 PolarHBondContact N-O 3.41Å; F29-R31 HydrophobicContact CD2-CB 4.28Å; F29-R31 HydrophobicContact CE2-CB 3.73Å; F29-R31 HydrophobicContact CE2-CG 4.15Å; R31-W44 CarbonylContact C-O 3.58Å; R31-W44 WeakPolarHBondContact CA-O 3.48Å; R31-L59 HydrophobicContact CG-CD1 4.07Å; R31-F74 HydrophobicContact CG-CZ 4.37Å; R31-E118 IonicContact CZ-OE1 2.7Å; R31-E118 IonicContact CZ-OE2 2.8Å; R31-E118 IonicContact NE-OE1 3.83Å; R31-E118 PolarHBondContact NE-OE1 3.41Å; R31-E118 IonicContact NE-OE2 3.65Å; R31-E118 PolarHBondContact NE-OE2 2.91Å; R31-E118 IonicContact NH2-OE1 3.84Å; R31-E118 PolarHBondContact NH2-OE1 2.76Å; R31-E118 IonicContact NH2-OE2 4Å; R31-E118 PolarHBondContact NH2-OE2 3.38Å; R31-E118 VanDerWaalsContact NH2-OE2 3.15Å
32	L	96.8	Very high	86.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138.2	173.8	-176.8	76.1	0	0	0	109	W10 L19 F21 T34 L43 W44 V46 T360 A369 F379	W10-L32 HydrophobicContact CH2-CD2 4.36Å; W10-L32 HydrophobicContact CZ3-CD2 4.13Å; L19-L32 HydrophobicContact CB-CD1 4.31Å; F21-L32 HydrophobicContact CD1-CB 3.95Å; F21-L32 HydrophobicContact CD1-CD1 3.77Å; F21-L32 HydrophobicContact CD1-CG 4.49Å; F21-L32 HydrophobicContact CD2-CD1 4.02Å; F21-L32 HydrophobicContact CE1-CB 3.85Å; F21-L32 HydrophobicContact CE1-CD1 3.86Å; F21-L32 HydrophobicContact CE1-CG 4.39Å; F21-L32 HydrophobicContact CE2-CD1 4.12Å; F21-L32 HydrophobicContact CG-CD1 3.85Å; F21-L32 HydrophobicContact CZ-CD1 4.04Å; L32-T34 HydrophobicContact CD2-CG2 4Å; L32-T34 HydrophobicContact CG-CG2 4.29Å; L32-L43 WeakPolarHBondContact O-CA 3.45Å; L32-W44 HydrophobicContact CB-CB 4.42Å; L32-W44 PolarHBondContact N-O 3.11Å; L32-W44 PolarHBondContact O-N 3.04Å; L32-V46 HydrophobicContact CB-CG2 3.82Å; L32-V46 HydrophobicContact CD2-CG2 4.15Å; L32-T360 HydrophobicContact CD1-CG2 3.95Å; L32-A369 HydrophobicContact CD1-CB 4.27Å; L32-F379 HydrophobicContact CD2-CE1 4.03Å; L32-F379 HydrophobicContact CD2-CZ 3.75Å
33	A	98	Very high	86.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.2	165.5	0	0	0	0	0	109.8	L19 D20 V41 R42 L43 V72 F74 L81	L19-A33 CarbonylContact C-O 3.53Å; L19-A33 WeakPolarHBondContact CA-O 3.22Å; L19-A33 WeakPolarHBondContact CB-O 3.29Å; D20-A33 PolarHBondContact N-O 3.02Å; D20-A33 PolarHBondContact O-N 2.63Å; A33-V41 HydrophobicContact CB-CG1 4.28Å; A33-R42 CarbonylContact C-O 3.51Å; A33-R42 WeakPolarHBondContact CA-O 3.36Å; A33-L43 HydrophobicContact CB-CD2 3.5Å; A33-L43 VanDerWaalsContact CB-CD2 3.5Å; A33-V72 HydrophobicContact CB-CG1 4.36Å; A33-V72 HydrophobicContact CB-CG2 3.71Å; A33-F74 HydrophobicContact CB-CD2 4.41Å; A33-F74 HydrophobicContact CB-CE2 3.51Å; A33-F74 HydrophobicContact CB-CZ 3.92Å; A33-L81 HydrophobicContact CB-CD1 4.06Å; A33-L81 HydrophobicContact CB-CD2 4.07Å
34	T	98.3	Very high	87.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.9	172.9	63.3	0	0	0	0	110.4	W10 H11 S18 L19 L32 V41 R42 W44	W10-T34 HydrophobicContact CE3-CG2 3.8Å; W10-T34 HydrophobicContact CZ3-CG2 3.83Å; H11-T34 PolarHBondContact CE1-O 3.1Å; H11-T34 VanDerWaalsContact NE2-C 3.26Å; H11-T34 WeakPolarHBondContact NE2-CB 3.49Å; H11-T34 PolarHBondContact NE2-O 2.9Å; H11-T34 PolarHBondContact NE2-OG1 3.5Å; S18-T34 WeakPolarHBondContact O-CA 3.47Å; L19-T34 HydrophobicContact CB-CG2 3.98Å; L32-T34 HydrophobicContact CD2-CG2 4Å; L32-T34 HydrophobicContact CG-CG2 4.29Å; T34-V41 CarbonylContact O-C 3.59Å; T34-V41 VanDerWaalsContact O-CA 3.29Å; T34-V41 WeakPolarHBondContact O-CA 3.49Å; T34-V41 WeakPolarHBondContact O-CG1 3.42Å; T34-R42 PolarHBondContact N-O 3.22Å; T34-R42 PolarHBondContact O-N 3.34Å; T34-W44 PolarHBondContact OG1-NE1 3.28Å
35	A	97.3	Very high	88.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.4	-179.1	0	0	0	0	0	110.6	H11 V16 Y17 S18 V41 V69 V72	H11-A35 PolarHBondContact NE2-N 3.42Å; V16-A35 WeakPolarHBondContact CG1-O 3.46Å; Y17-A35 PolarHBondContact N-O 2.99Å; S18-A35 PolarHBondContact N-O 3.27Å; S18-A35 PolarHBondContact O-N 2.95Å; A35-V41 HydrophobicContact CB-CG2 4.19Å; A35-V69 CarbonylContact C-O 3.47Å; A35-V69 HydrophobicContact CB-CB 3.97Å; A35-V69 HydrophobicContact CB-CG1 3.81Å; A35-V72 HydrophobicContact CB-CB 3.88Å; A35-V72 HydrophobicContact CB-CG1 3.73Å
36	G	94.8	Very high	89.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	-162.3	-174.9	0	0	0	0	0	114.5	P15 D38 V69	P15-G36 WeakPolarHBondContact O-CA 3.19Å; G36-D38 VanDerWaalsContact C-N 3.34Å; G36-D38 PolarHBondContact O-N 2.94Å; G36-V69 PolarHBondContact N-O 2.91Å; G36-V69 PolarHBondContact O-N 3.09Å
37	V	95.3	Very high	91.5	Very high	46 Å²	46	30.6 Å²	30.6	28%	0.279	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-29.8	-174.3	171.9	0	0	0	0	113.6	E14 P15 Y17 T39	E14-V37 HydrophobicContact CB-CB 4.11Å; P15-V37 HydrophobicContact CB-CG2 3.88Å; P15-V37 HydrophobicContact CG-CG2 3.99Å; P15-V37 PolarHBondContact O-N 3.43Å; P15-V37 VanDerWaalsContact O-N 3.15Å; Y17-V37 HydrophobicContact CD2-CG2 4.33Å; Y17-V37 HydrophobicContact CE1-CG2 4.29Å; Y17-V37 HydrophobicContact CE2-CG2 3.44Å; Y17-V37 VanDerWaalsContact CE2-CG2 3.44Å; Y17-V37 VanDerWaalsContact CZ-CG2 3.41Å; Y17-V37 VanDerWaalsContact OH-CG2 3.26Å; Y17-V37 WeakPolarHBondContact OH-CG2 3.42Å; V37-T39 PolarHBondContact O-N 3.25Å
38	D	93.1	Very high	93	Very high	28 Å²	28	31.7 Å²	31.7	15%	0.15	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	15.3	-172.4	77.4	-9.7	0	0	0	115.6	H11 G36 T40 R42	H11-D38 WeakPolarHBondContact CA-OD2 3.4Å; H11-D38 HydrophobicContact CB-CB 4.49Å; H11-D38 IonicContact CE1-OD1 3.79Å; H11-D38 IonicContact CG-OD1 3.72Å; H11-D38 IonicContact CG-OD2 3.8Å; H11-D38 IonicContact ND1-OD1 2.8Å; H11-D38 PolarHBondContact ND1-OD1 3.14Å; H11-D38 IonicContact ND1-OD2 3.38Å; H11-D38 PolarHBondContact ND1-OD2 3.3Å; G36-D38 VanDerWaalsContact C-N 3.34Å; G36-D38 PolarHBondContact O-N 2.94Å; D38-T40 PolarHBondContact O-N 2.75Å; D38-T40 VanDerWaalsContact O-N 3.12Å; D38-T40 WeakPolarHBondContact OD1-CB 3.48Å; D38-T40 PolarHBondContact OD1-N 3.16Å; D38-T40 PolarHBondContact OD1-OG1 3.11Å; D38-T40 PolarHBondContact OD2-OG1 3.29Å; D38-T40 VanDerWaalsContact OD2-OG1 3.12Å; D38-R42 IonicContact OD2-CZ 3.34Å; D38-R42 VanDerWaalsContact OD2-CZ 3.23Å; D38-R42 IonicContact OD2-NE 3.15Å; D38-R42 PolarHBondContact OD2-NE 2.63Å; D38-R42 IonicContact OD2-NH2 2.68Å; D38-R42 PolarHBondContact OD2-NH2 3.46Å
39	T	94.8	Very high	94	Very high	51 Å²	51	24.6 Å²	24.6	31%	0.313	12%	0.121	S	C	.	.	S	Bend	trans	66	-0.9	-177.7	77.8	0	0	0	0	115.9	V37 K67	V37-T39 PolarHBondContact O-N 3.25Å; T39-K67 WeakPolarHBondContact CA-O 3.46Å; T39-K67 WeakPolarHBondContact CB-O 3.27Å
40	T	94.3	Very high	94	Very high	9 Å²	9	30.4 Å²	30.4	6%	0.055	16%	0.161	C	C	.	.			trans	-99.2	154.3	-178.1	71.1	0	0	0	0	113.1	H11 D38 R42 N61	H11-T40 PolarHBondContact CE1-O 3.1Å; H11-T40 PolarHBondContact ND1-OG1 3.4Å; D38-T40 PolarHBondContact O-N 2.75Å; D38-T40 VanDerWaalsContact O-N 3.12Å; D38-T40 WeakPolarHBondContact OD1-CB 3.48Å; D38-T40 PolarHBondContact OD1-N 3.16Å; D38-T40 PolarHBondContact OD1-OG1 3.11Å; D38-T40 PolarHBondContact OD2-OG1 3.29Å; D38-T40 VanDerWaalsContact OD2-OG1 3.12Å; T40-R42 PolarHBondContact OG1-NE 3.29Å; T40-R42 VanDerWaalsContact OG1-NE 3.1Å; T40-N61 WeakPolarHBondContact CB-OD1 3.45Å; T40-N61 VanDerWaalsContact CG2-OD1 3.24Å; T40-N61 WeakPolarHBondContact CG2-OD1 3.36Å
41	V	97.3	Very high	93.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.2	153.7	-176.5	0	0	0	0	107.1	A33 T34 A35 L62 V69 V72 L81	A33-V41 HydrophobicContact CB-CG1 4.28Å; T34-V41 CarbonylContact O-C 3.59Å; T34-V41 VanDerWaalsContact O-CA 3.29Å; T34-V41 WeakPolarHBondContact O-CA 3.49Å; T34-V41 WeakPolarHBondContact O-CG1 3.42Å; A35-V41 HydrophobicContact CB-CG2 4.19Å; V41-L62 HydrophobicContact CB-CB 4.01Å; V41-L62 HydrophobicContact CB-CD1 3.83Å; V41-L62 HydrophobicContact CB-CG 4.45Å; V41-L62 HydrophobicContact CG1-CD1 3.81Å; V41-L62 WeakPolarHBondContact O-CA 3.47Å; V41-L62 WeakPolarHBondContact O-CB 3.21Å; V41-L62 WeakPolarHBondContact O-CG 3.46Å; V41-L62 PolarHBondContact O-N 3.16Å; V41-V69 HydrophobicContact CG2-CB 4.41Å; V41-V69 HydrophobicContact CG2-CG1 3.83Å; V41-V69 HydrophobicContact CG2-CG2 4.39Å; V41-V72 HydrophobicContact CG1-CB 4.4Å; V41-V72 HydrophobicContact CG1-CG2 3.79Å; V41-L81 HydrophobicContact CG1-CD2 4.35Å
42	R	96.3	Very high	92.9	Very high	29 Å²	29	32 Å²	32	11%	0.109	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.8	-177	-66.2	170.3	-176.5	-145.9	-1.5	110.3	A9 W10 N12 A33 T34 D38 T40 W44	A9-R42 PolarHBondContact O-NH1 3.33Å; W10-R42 WeakPolarHBondContact O-CD 3.15Å; W10-R42 PolarHBondContact O-NE 2.69Å; W10-R42 PolarHBondContact O-NH1 2.84Å; N12-R42 VanDerWaalsContact CG-NH2 3.35Å; N12-R42 PolarHBondContact OD1-NH1 2.83Å; N12-R42 PolarHBondContact OD1-NH2 3.4Å; A33-R42 CarbonylContact C-O 3.51Å; A33-R42 WeakPolarHBondContact CA-O 3.36Å; T34-R42 PolarHBondContact N-O 3.22Å; T34-R42 PolarHBondContact O-N 3.34Å; D38-R42 IonicContact OD2-CZ 3.34Å; D38-R42 VanDerWaalsContact OD2-CZ 3.23Å; D38-R42 IonicContact OD2-NE 3.15Å; D38-R42 PolarHBondContact OD2-NE 2.63Å; D38-R42 IonicContact OD2-NH2 2.68Å; D38-R42 PolarHBondContact OD2-NH2 3.46Å; T40-R42 PolarHBondContact OG1-NE 3.29Å; T40-R42 VanDerWaalsContact OG1-NE 3.1Å; R42-W44 HydrophobicContact CB-CZ2 3.8Å; R42-W44 PolarHBondContact O-NE1 2.88Å
43	L	96.3	Very high	92.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.2	-177.6	-58.7	-174.2	0	0	0	111.3	L32 A33 L59 S60 L62 F74 L81 W120	L32-L43 WeakPolarHBondContact O-CA 3.45Å; A33-L43 HydrophobicContact CB-CD2 3.5Å; A33-L43 VanDerWaalsContact CB-CD2 3.5Å; L43-L59 HydrophobicContact CB-CB 4.16Å; L43-L59 WeakPolarHBondContact O-CB 3.48Å; L43-L59 PolarHBondContact O-N 3.11Å; L43-S60 PolarHBondContact N-O 3.05Å; L43-S60 PolarHBondContact O-N 2.79Å; L43-L62 HydrophobicContact CD1-CD1 4.05Å; L43-L62 HydrophobicContact CD2-CD1 4.01Å; L43-L62 HydrophobicContact CG-CD1 3.86Å; L43-L62 HydrophobicContact CG-CG 4.41Å; L43-F74 HydrophobicContact CD2-CZ 4.33Å; L43-L81 HydrophobicContact CD2-CD2 3.84Å; L43-W120 HydrophobicContact CD1-CD2 3.81Å; L43-W120 HydrophobicContact CD1-CG 4.05Å; L43-W120 HydrophobicContact CD1-CZ2 3.72Å
44	W	95.5	Very high	91.9	Very high	10 Å²	10	37 Å²	37	4%	0.038	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.8	-173	-43	84	0	0	0	110.9	I8 W10 R31 L32 T34 R42 V56 E57 F58	I8-W44 HydrophobicContact CG2-CH2 4.08Å; I8-W44 HydrophobicContact CG2-CZ3 3.94Å; W10-W44 HydrophobicContact CD2-CZ2 4.47Å; W10-W44 HydrophobicContact CE3-CD2 4.13Å; W10-W44 AromaticContact CE3-CE2 3.58Å; W10-W44 HydrophobicContact CE3-CH2 4.35Å; W10-W44 AromaticContact CE3-CZ2 3.72Å; W10-W44 HydrophobicContact CE3-CZ2 3.72Å; W10-W44 AromaticContact CE3-NE1 3.74Å; W10-W44 AromaticContact CZ3-CD1 3.81Å; W10-W44 AromaticContact CZ3-CD2 3.75Å; W10-W44 HydrophobicContact CZ3-CD2 3.75Å; W10-W44 AromaticContact CZ3-CE2 3.65Å; W10-W44 HydrophobicContact CZ3-CE3 4.39Å; W10-W44 AromaticContact CZ3-CG 3.87Å; W10-W44 HydrophobicContact CZ3-CG 3.87Å; W10-W44 HydrophobicContact CZ3-CZ2 4.22Å; W10-W44 AromaticContact CZ3-NE1 3.66Å; W10-W44 WeakPolarHBondContact O-CZ2 3.48Å; R31-W44 CarbonylContact C-O 3.58Å; R31-W44 WeakPolarHBondContact CA-O 3.48Å; L32-W44 HydrophobicContact CB-CB 4.42Å; L32-W44 PolarHBondContact N-O 3.11Å; L32-W44 PolarHBondContact O-N 3.04Å; T34-W44 PolarHBondContact OG1-NE1 3.28Å; R42-W44 HydrophobicContact CB-CZ2 3.8Å; R42-W44 PolarHBondContact O-NE1 2.88Å; W44-V56 HydrophobicContact CB-CG1 3.97Å; W44-V56 HydrophobicContact CD2-CG1 4.27Å; W44-V56 HydrophobicContact CE3-CG1 3.87Å; W44-V56 HydrophobicContact CG-CG1 4.34Å; W44-E57 CarbonylContact C-O 3.52Å; W44-E57 WeakPolarHBondContact CA-O 3.49Å; W44-F58 HydrophobicContact CE3-CB 4Å; W44-F58 HydrophobicContact CE3-CD2 4.27Å; W44-F58 HydrophobicContact CH2-CD2 4.19Å; W44-F58 HydrophobicContact CZ3-CB 3.89Å; W44-F58 HydrophobicContact CZ3-CD2 4.01Å; W44-F58 HydrophobicContact CZ3-CG 4.45Å
45	R	94.4	Very high	91.6	Very high	65 Å²	65	39.2 Å²	39.2	25%	0.245	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.6	161.3	164	-162.4	-58.6	-85.5	-5.4	106.9	F29 E47 V56 E57 L59	F29-R45 HydrophobicContact CB-CG 3.99Å; F29-R45 HydrophobicContact CD2-CB 3.77Å; F29-R45 HydrophobicContact CD2-CG 3.81Å; F29-R45 HydrophobicContact CE2-CB 4.03Å; F29-R45 HydrophobicContact CG-CB 4.36Å; F29-R45 HydrophobicContact CG-CG 3.95Å; R45-E47 VanDerWaalsContact CD-OE1 3.26Å; R45-E47 WeakPolarHBondContact CD-OE1 2.98Å; R45-E47 HydrophobicContact CG-CG 3.94Å; R45-E47 IonicContact CZ-OE1 3.45Å; R45-E47 IonicContact NE-OE1 3.23Å; R45-E47 IonicContact NH1-OE1 4Å; R45-E47 PolarHBondContact NH1-OE1 3.17Å; R45-V56 WeakPolarHBondContact O-CA 3.21Å; R45-E57 HydrophobicContact CB-CB 4.2Å; R45-E57 WeakPolarHBondContact CD-OE2 3.28Å; R45-E57 IonicContact CZ-OE2 3.34Å; R45-E57 PolarHBondContact N-O 3.31Å; R45-E57 IonicContact NE-OE2 3.08Å; R45-E57 PolarHBondContact NE-OE2 2.77Å; R45-E57 PolarHBondContact O-N 2.58Å; R45-L59 HydrophobicContact CB-CD1 4.08Å; R45-L59 HydrophobicContact CB-CD2 4.1Å; R45-L59 HydrophobicContact CB-CG 4.21Å; R45-L59 VanDerWaalsContact N-CD1 3.3Å
46	V	93.8	Very high	91.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.3	170.8	-173.1	0	0	0	0	108.7	F21 H30 L32 A54 A55 V56 F367 F379	F21-V46 HydrophobicContact CE1-CB 3.98Å; F21-V46 HydrophobicContact CE1-CG1 4.5Å; F21-V46 HydrophobicContact CE1-CG2 3.95Å; F21-V46 HydrophobicContact CZ-CB 4.33Å; F21-V46 HydrophobicContact CZ-CG1 4.37Å; F21-V46 HydrophobicContact CZ-CG2 4.34Å; H30-V46 WeakPolarHBondContact CB-O 3.41Å; H30-V46 PolarHBondContact CD2-O 2.92Å; H30-V46 PolarHBondContact O-N 2.86Å; L32-V46 HydrophobicContact CB-CG2 3.82Å; L32-V46 HydrophobicContact CD2-CG2 4.15Å; V46-A54 HydrophobicContact CG1-CB 4.19Å; V46-A55 WeakPolarHBondContact CA-O 3.49Å; V46-V56 HydrophobicContact CG2-CG2 4.44Å; V46-F367 HydrophobicContact CG1-CD1 4.48Å; V46-F367 HydrophobicContact CG1-CE1 4.38Å; V46-F367 HydrophobicContact CG1-CZ 4.44Å; V46-F379 HydrophobicContact CG1-CD1 4.17Å; V46-F379 HydrophobicContact CG1-CE1 3.82Å; V46-F379 HydrophobicContact CG1-CZ 4.31Å; V46-F379 HydrophobicContact CG2-CE1 3.96Å; V46-F379 HydrophobicContact CG2-CZ 4Å
47	E	91.9	Very high	91.4	Very high	78 Å²	78	44.3 Å²	44.3	36%	0.364	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	163.3	-179.4	-72.8	-179.9	-173.2	0	0	111	F29 R45 G49 A55	F29-E47 HydrophobicContact CB-CG 4.25Å; F29-E47 WeakPolarHBondContact CB-OE1 3.2Å; R45-E47 VanDerWaalsContact CD-OE1 3.26Å; R45-E47 WeakPolarHBondContact CD-OE1 2.98Å; R45-E47 HydrophobicContact CG-CG 3.94Å; R45-E47 IonicContact CZ-OE1 3.45Å; R45-E47 IonicContact NE-OE1 3.23Å; R45-E47 IonicContact NH1-OE1 4Å; R45-E47 PolarHBondContact NH1-OE1 3.17Å; E47-G49 PolarHBondContact O-N 2.85Å; E47-A55 PolarHBondContact N-O 3.16Å; E47-A55 PolarHBondContact O-N 3.49Å
48	Q	88.4	Confident	91.3	Very high	102 Å²	102	44.7 Å²	44.7	48%	0.477	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	107.5	174.7	-172.4	161.6	102	0	0	110	K53 F367	Q48-K53 WeakPolarHBondContact CA-O 3.26Å; Q48-F367 HydrophobicContact CB-CE2 4.47Å; Q48-F367 HydrophobicContact CB-CZ 3.95Å
49	G	86.6	Confident	91.3	Very high	12 Å²	12	43.5 Å²	43.5	12%	0.124	24%	0.235	C	C	.	.			trans	-67.3	166.6	177.8	0	0	0	0	0	112.9	E47 D51 G52 K53	E47-G49 PolarHBondContact O-N 2.85Å; G49-D51 PolarHBondContact O-N 2.82Å; G49-D51 VanDerWaalsContact O-N 3.09Å; G49-G52 WeakPolarHBondContact O-CA 3.48Å; G49-G52 PolarHBondContact O-N 2.66Å; G49-K53 PolarHBondContact N-O 3.18Å
50	P	84.5	Confident	91.3	Very high	151 Å²	151	41.3 Å²	41.3	98%	0.981	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.3	-173.4	-26.6	35.8	0	0	0	115.7	G52	P50-G52 VanDerWaalsContact C-N 3.3Å
51	D	83.2	Confident	91.3	Very high	82 Å²	82	41.5 Å²	41.5	44%	0.439	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	5.3	173.8	71.5	-12.3	0	0	0	113.2	K2 G49 K53	K2-D51 PolarHBondContact NZ-O 3.34Å; G49-D51 PolarHBondContact O-N 2.82Å; G49-D51 VanDerWaalsContact O-N 3.09Å; D51-K53 VanDerWaalsContact OD1-CB 3.27Å; D51-K53 WeakPolarHBondContact OD1-CB 3.44Å; D51-K53 WeakPolarHBondContact OD1-CG 3.42Å; D51-K53 PolarHBondContact OD1-N 3.33Å; D51-K53 VanDerWaalsContact OD1-N 3.12Å; D51-K53 WeakPolarHBondContact OD2-CD 3.36Å; D51-K53 WeakPolarHBondContact OD2-CE 3.41Å; D51-K53 WeakPolarHBondContact OD2-CG 3.49Å; D51-K53 IonicContact OD2-NZ 2.66Å; D51-K53 PolarHBondContact OD2-NZ 2.76Å
52	G	80.1	Confident	91.1	Very high	10 Å²	10	41.7 Å²	41.7	10%	0.103	22%	0.223	C	C	.	.	S	Bend	trans	71.8	23	-178.3	0	0	0	0	0	114.9	K2 G49 P50	K2-G52 VanDerWaalsContact CD-O 3.24Å; K2-G52 WeakPolarHBondContact CD-O 3.46Å; G49-G52 WeakPolarHBondContact O-CA 3.48Å; G49-G52 PolarHBondContact O-N 2.66Å; P50-G52 VanDerWaalsContact C-N 3.3Å
53	K	84.4	Confident	90.9	Very high	92 Å²	92	42.1 Å²	42.1	40%	0.4	23%	0.232	S	C	.	.	S	Bend	trans	-87.9	170.9	167.6	-67.1	-173.6	-168.9	130.8	0	111.5	V4 Q48 G49 D51 A55	V4-K53 HydrophobicContact CG1-CB 4.43Å; V4-K53 HydrophobicContact CG1-CD 4.04Å; V4-K53 HydrophobicContact CG2-CB 3.72Å; V4-K53 HydrophobicContact CG2-CD 3.8Å; V4-K53 HydrophobicContact CG2-CG 3.52Å; Q48-K53 WeakPolarHBondContact CA-O 3.26Å; G49-K53 PolarHBondContact N-O 3.18Å; D51-K53 VanDerWaalsContact OD1-CB 3.27Å; D51-K53 WeakPolarHBondContact OD1-CB 3.44Å; D51-K53 WeakPolarHBondContact OD1-CG 3.42Å; D51-K53 PolarHBondContact OD1-N 3.33Å; D51-K53 VanDerWaalsContact OD1-N 3.12Å; D51-K53 WeakPolarHBondContact OD2-CD 3.36Å; D51-K53 WeakPolarHBondContact OD2-CE 3.41Å; D51-K53 WeakPolarHBondContact OD2-CG 3.49Å; D51-K53 IonicContact OD2-NZ 2.66Å; D51-K53 PolarHBondContact OD2-NZ 2.76Å; K53-A55 PolarHBondContact O-N 2.93Å
54	A	89.7	Confident	90.9	Very high	11 Å²	11	47.3 Å²	47.3	9%	0.091	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	123.4	160.8	0	0	0	0	0	110.1	V46 F367 F379	V46-A54 HydrophobicContact CG1-CB 4.19Å; A54-F367 HydrophobicContact CB-CD1 4.22Å; A54-F367 HydrophobicContact CB-CE1 3.71Å; A54-F379 HydrophobicContact CB-CB 3.63Å; A54-F379 HydrophobicContact CB-CD1 4.14Å; A54-F379 HydrophobicContact CB-CD2 3.74Å; A54-F379 HydrophobicContact CB-CE2 4.45Å; A54-F379 HydrophobicContact CB-CG 3.55Å
55	A	91.3	Very high	90.9	Very high	47 Å²	47	47.2 Å²	47.2	39%	0.388	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.1	158.2	0	0	0	0	0	107.7	V46 E47 K53	V46-A55 WeakPolarHBondContact CA-O 3.49Å; E47-A55 PolarHBondContact N-O 3.16Å; E47-A55 PolarHBondContact O-N 3.49Å; K53-A55 PolarHBondContact O-N 2.93Å
56	V	93.8	Very high	90.9	Very high	31 Å²	31	48.7 Å²	48.7	19%	0.188	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.7	-176	-176.8	0	0	0	0	109.4	I8 W10 W44 R45 V46 F379	I8-V56 HydrophobicContact CD1-CB 3.85Å; I8-V56 HydrophobicContact CD1-CG1 4.07Å; W10-V56 HydrophobicContact CH2-CB 4.48Å; W10-V56 HydrophobicContact CH2-CG1 3.68Å; W10-V56 HydrophobicContact CH2-CG2 4.16Å; W10-V56 HydrophobicContact CZ2-CG1 4.29Å; W10-V56 HydrophobicContact CZ2-CG2 4.38Å; W10-V56 HydrophobicContact CZ3-CG1 4.34Å; W44-V56 HydrophobicContact CB-CG1 3.97Å; W44-V56 HydrophobicContact CD2-CG1 4.27Å; W44-V56 HydrophobicContact CE3-CG1 3.87Å; W44-V56 HydrophobicContact CG-CG1 4.34Å; R45-V56 WeakPolarHBondContact O-CA 3.21Å; V46-V56 HydrophobicContact CG2-CG2 4.44Å; V56-F379 HydrophobicContact CG2-CD2 4.48Å; V56-F379 HydrophobicContact CG2-CE2 3.73Å; V56-F379 HydrophobicContact CG2-CZ 4.03Å
57	E	93.8	Very high	91.1	Very high	76 Å²	76	53.4 Å²	53.4	36%	0.355	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.9	176.5	176.2	-168.7	-149.6	0	0	109.7	W44 R45 K117	W44-E57 CarbonylContact C-O 3.52Å; W44-E57 WeakPolarHBondContact CA-O 3.49Å; R45-E57 HydrophobicContact CB-CB 4.2Å; R45-E57 WeakPolarHBondContact CD-OE2 3.28Å; R45-E57 IonicContact CZ-OE2 3.34Å; R45-E57 PolarHBondContact N-O 3.31Å; R45-E57 IonicContact NE-OE2 3.08Å; R45-E57 PolarHBondContact NE-OE2 2.77Å; R45-E57 PolarHBondContact O-N 2.58Å; E57-K117 VanDerWaalsContact CD-NZ 3.27Å; E57-K117 VanDerWaalsContact CG-NZ 3.25Å; E57-K117 IonicContact OE1-NZ 3.66Å; E57-K117 PolarHBondContact OE1-NZ 3.02Å
58	F	94.1	Very high	91.3	Very high	54 Å²	54	50.2 Å²	50.2	24%	0.237	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	139.5	173.2	175	-100.2	0	0	0	112.3	W44 S60 N61 L115 K117	W44-F58 HydrophobicContact CE3-CB 4Å; W44-F58 HydrophobicContact CE3-CD2 4.27Å; W44-F58 HydrophobicContact CH2-CD2 4.19Å; W44-F58 HydrophobicContact CZ3-CB 3.89Å; W44-F58 HydrophobicContact CZ3-CD2 4.01Å; W44-F58 HydrophobicContact CZ3-CG 4.45Å; F58-S60 WeakPolarHBondContact CE2-O 3.09Å; F58-N61 HydrophobicContact CZ-CB 4.1Å; F58-L115 HydrophobicContact CE1-CB 4.38Å; F58-K117 WeakPolarHBondContact O-CD 3.46Å; F58-K117 WeakPolarHBondContact O-CE 3.41Å; F58-K117 PolarHBondContact O-NZ 2.9Å
59	L	93.4	Very high	91.8	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	-47.5	-179.3	-62.6	172.8	0	0	0	113.9	F29 R31 L43 R45 K117 E118	F29-L59 HydrophobicContact CE2-CD1 3.6Å; F29-L59 HydrophobicContact CZ-CD1 3.94Å; R31-L59 HydrophobicContact CG-CD1 4.07Å; L43-L59 HydrophobicContact CB-CB 4.16Å; L43-L59 WeakPolarHBondContact O-CB 3.48Å; L43-L59 PolarHBondContact O-N 3.11Å; R45-L59 HydrophobicContact CB-CD1 4.08Å; R45-L59 HydrophobicContact CB-CD2 4.1Å; R45-L59 HydrophobicContact CB-CG 4.21Å; R45-L59 VanDerWaalsContact N-CD1 3.3Å; L59-K117 WeakPolarHBondContact O-CA 3.47Å; L59-K117 PolarHBondContact O-N 2.85Å; L59-E118 HydrophobicContact CB-CG 4.18Å; L59-E118 PolarHBondContact O-N 3.13Å
60	S	93.6	Very high	92.3	Very high	4 Å²	4	45 Å²	45	3%	0.028	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	147.3	-174.9	-168.6	0	0	0	0	112.8	L43 F58 N116 E118	L43-S60 PolarHBondContact N-O 3.05Å; L43-S60 PolarHBondContact O-N 2.79Å; F58-S60 WeakPolarHBondContact CE2-O 3.09Å; S60-N116 VanDerWaalsContact CA-OD1 3.29Å; S60-N116 WeakPolarHBondContact CA-OD1 3.35Å; S60-E118 PolarHBondContact OG-O 3.32Å; S60-E118 VanDerWaalsContact OG-O 3.08Å
61	N	93.9	Very high	93	Very high	14 Å²	14	37.9 Å²	37.9	8%	0.075	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	138.2	165.7	-166	17.4	0	0	0	111	T40 F58 D112 N116	T40-N61 WeakPolarHBondContact CB-OD1 3.45Å; T40-N61 VanDerWaalsContact CG2-OD1 3.24Å; T40-N61 WeakPolarHBondContact CG2-OD1 3.36Å; F58-N61 HydrophobicContact CZ-CB 4.1Å; N61-D112 PolarHBondContact ND2-OD2 2.75Å; N61-N116 PolarHBondContact N-OD1 2.92Å
62	L	94.8	Very high	93.7	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	69.7	-174.8	-55.7	170.9	0	0	0	110.2	V41 L43 R64 L81 W93 W120	V41-L62 HydrophobicContact CB-CB 4.01Å; V41-L62 HydrophobicContact CB-CD1 3.83Å; V41-L62 HydrophobicContact CB-CG 4.45Å; V41-L62 HydrophobicContact CG1-CD1 3.81Å; V41-L62 WeakPolarHBondContact O-CA 3.47Å; V41-L62 WeakPolarHBondContact O-CB 3.21Å; V41-L62 WeakPolarHBondContact O-CG 3.46Å; V41-L62 PolarHBondContact O-N 3.16Å; L43-L62 HydrophobicContact CD1-CD1 4.05Å; L43-L62 HydrophobicContact CD2-CD1 4.01Å; L43-L62 HydrophobicContact CG-CD1 3.86Å; L43-L62 HydrophobicContact CG-CG 4.41Å; L62-R64 PolarHBondContact O-N 3Å; L62-L81 HydrophobicContact CD1-CD2 3.93Å; L62-W93 HydrophobicContact CB-CE3 4.27Å; L62-W93 HydrophobicContact CB-CH2 3.56Å; L62-W93 HydrophobicContact CB-CZ2 3.88Å; L62-W93 HydrophobicContact CB-CZ3 3.79Å; L62-W93 HydrophobicContact CD1-CD2 4.47Å; L62-W93 HydrophobicContact CD2-CD2 4.45Å; L62-W93 HydrophobicContact CD2-CE3 3.88Å; L62-W93 HydrophobicContact CD2-CZ3 3.95Å; L62-W93 HydrophobicContact CG-CZ3 4.43Å; L62-W93 WeakPolarHBondContact O-CH2 3.3Å; L62-W120 HydrophobicContact CD2-CB 3.4Å; L62-W120 HydrophobicContact CD2-CG 3.88Å
63	A	92.3	Very high	94.6	Very high	37 Å²	37	33.8 Å²	33.8	31%	0.306	18%	0.181	S	C	.	.			trans	-83.6	89.3	-178	0	0	0	0	0	112.2
64	R	94.7	Very high	95.2	Very high	109 Å²	109	29.8 Å²	29.8	41%	0.411	16%	0.164	S	C	.	.			trans	-141.7	-16.6	172.2	-64.8	-67.2	-170.5	-139.8	0.8	115.9	L62 L91 W93 T105 V122	L62-R64 PolarHBondContact O-N 3Å; R64-L91 HydrophobicContact CB-CD1 3.68Å; R64-W93 HydrophobicContact CB-CH2 3.43Å; R64-W93 VanDerWaalsContact CB-CH2 3.43Å; R64-W93 HydrophobicContact CB-CZ2 4Å; R64-W93 HydrophobicContact CB-CZ3 4.24Å; R64-W93 HydrophobicContact CG-CH2 3.38Å; R64-W93 HydrophobicContact CG-CZ2 4.38Å; R64-W93 HydrophobicContact CG-CZ3 3.69Å; R64-T105 PolarHBondContact NH1-OG1 3.44Å; R64-T105 PolarHBondContact NH2-OG1 2.68Å; R64-V122 HydrophobicContact CB-CG2 4.34Å; R64-V122 HydrophobicContact CG-CG2 3.96Å
65	H	96.1	Very high	95.5	Very high	9 Å²	9	29.3 Å²	29.3	4%	0.042	16%	0.16	C	C	.	.			trans	-72.7	147.5	169.6	-78.9	-74.8	0	0	0	109.6	V69 S83 D87	H65-V69 HydrophobicContact CB-CG2 3.74Å; H65-V69 VanDerWaalsContact CD2-CG2 3.46Å; H65-V69 WeakPolarHBondContact CD2-CG2 3.12Å; H65-S83 PolarHBondContact CD2-OG 2.81Å; H65-S83 WeakPolarHBondContact NE2-CB 3.39Å; H65-S83 PolarHBondContact NE2-O 3.47Å; H65-S83 PolarHBondContact NE2-OG 2.9Å; H65-D87 WeakPolarHBondContact CA-OD2 3.33Å; H65-D87 WeakPolarHBondContact CB-OD2 3.45Å; H65-D87 IonicContact CE1-OD1 3.84Å; H65-D87 IonicContact CE1-OD2 3.86Å; H65-D87 IonicContact CG-OD2 3.49Å; H65-D87 VanDerWaalsContact ND1-CG 3.34Å; H65-D87 IonicContact ND1-OD1 2.95Å; H65-D87 PolarHBondContact ND1-OD1 3.29Å; H65-D87 IonicContact ND1-OD2 3.81Å; H65-D87 PolarHBondContact ND1-OD2 2.65Å
66	S	95.6	Very high	95.5	Very high	95 Å²	95	29.7 Å²	29.7	66%	0.664	16%	0.158	S	C	*	.	S	Bend	trans	-98.7	3.9	-179.9	66.4	0	0	0	0	114	D87	S66-D87 PolarHBondContact N-OD2 2.82Å
67	K	97	Very high	95.2	Very high	99 Å²	99	30.6 Å²	30.6	43%	0.43	16%	0.162	S	C	.	.	S	Bend	trans	-152.6	-178.9	178.2	-61.9	-170.4	-165.2	166.7	0	109.2	T39 D86 D132	T39-K67 WeakPolarHBondContact CA-O 3.46Å; T39-K67 WeakPolarHBondContact CB-O 3.27Å; K67-D86 HydrophobicContact CB-CB 3.77Å; K67-D86 HydrophobicContact CD-CB 3.44Å; K67-D86 VanDerWaalsContact CD-CB 3.44Å; K67-D86 WeakPolarHBondContact CD-O 3.3Å; K67-D86 WeakPolarHBondContact CE-O 3.47Å; K67-D86 HydrophobicContact CG-CB 4.32Å; K67-D86 PolarHBondContact NZ-O 3.45Å; K67-D132 IonicContact NZ-OD1 2.94Å
68	A	96.6	Very high	94.9	Very high	11 Å²	11	27.3 Å²	27.3	9%	0.091	15%	0.148	C	C	.	.			trans	-52.6	147.6	177.5	0	0	0	0	0	113.5	Y17 G85 D86	Y17-A68 HydrophobicContact CE2-CB 4.26Å; A68-G85 WeakPolarHBondContact O-CA 3.46Å; A68-D86 PolarHBondContact O-N 2.56Å
69	V	98.1	Very high	94.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	105.3	-176.6	-167.2	0	0	0	0	109.7	A35 G36 V41 H65 G84	A35-V69 CarbonylContact C-O 3.47Å; A35-V69 HydrophobicContact CB-CB 3.97Å; A35-V69 HydrophobicContact CB-CG1 3.81Å; G36-V69 PolarHBondContact N-O 2.91Å; G36-V69 PolarHBondContact O-N 3.09Å; V41-V69 HydrophobicContact CG2-CB 4.41Å; V41-V69 HydrophobicContact CG2-CG1 3.83Å; V41-V69 HydrophobicContact CG2-CG2 4.39Å; H65-V69 HydrophobicContact CB-CG2 3.74Å; H65-V69 VanDerWaalsContact CD2-CG2 3.46Å; H65-V69 WeakPolarHBondContact CD2-CG2 3.12Å; V69-G84 WeakPolarHBondContact CG1-O 3.47Å
70	N	97.7	Very high	94.8	Very high	6 Å²	6	31.3 Å²	31.3	3%	0.032	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-28.7	-172	-65.8	-45.3	0	0	0	113.8	S18 G84 D86 V133 Y134 F238 R240	S18-N70 WeakPolarHBondContact CB-O 3.44Å; N70-G84 PolarHBondContact N-O 3.39Å; N70-D86 PolarHBondContact ND2-OD1 2.94Å; N70-V133 VanDerWaalsContact CB-O 3.25Å; N70-V133 WeakPolarHBondContact CB-O 3.28Å; N70-V133 PolarHBondContact ND2-O 3.34Å; N70-Y134 HydrophobicContact CB-CD1 4.28Å; N70-F238 HydrophobicContact CB-CE1 4.31Å; N70-R240 PolarHBondContact O-NH2 2.86Å
71	V	98.4	Very high	95	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	136.8	-173.1	56.4	0	0	0	0	112.3	R73 S83 G84 V133 I136	V71-R73 HydrophobicContact CG2-CG 3.98Å; V71-S83 VanDerWaalsContact O-CA 3.31Å; V71-S83 WeakPolarHBondContact O-CA 3.34Å; V71-G84 PolarHBondContact N-O 3.22Å; V71-G84 VanDerWaalsContact N-O 3.11Å; V71-G84 PolarHBondContact O-N 2.82Å; V71-V133 HydrophobicContact CG1-CG1 4.37Å; V71-I136 HydrophobicContact CG1-CB 4.33Å; V71-I136 HydrophobicContact CG1-CD1 3.81Å; V71-I136 HydrophobicContact CG1-CG1 3.83Å; V71-I136 HydrophobicContact CG2-CB 3.99Å; V71-I136 HydrophobicContact CG2-CG1 4.42Å
72	V	98.4	Very high	95.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.7	169.9	62.5	0	0	0	0	110.1	S18 A33 A35 V41 L81 A82	S18-V72 PolarHBondContact OG-N 2.76Å; S18-V72 PolarHBondContact OG-O 3.04Å; A33-V72 HydrophobicContact CB-CG1 4.36Å; A33-V72 HydrophobicContact CB-CG2 3.71Å; A35-V72 HydrophobicContact CB-CB 3.88Å; A35-V72 HydrophobicContact CB-CG1 3.73Å; V41-V72 HydrophobicContact CG1-CB 4.4Å; V41-V72 HydrophobicContact CG1-CG2 3.79Å; V72-L81 HydrophobicContact CG2-CD1 3.39Å; V72-L81 HydrophobicContact CG2-CD2 4.25Å; V72-L81 HydrophobicContact CG2-CG 3.99Å; V72-A82 CarbonylContact C-O 3.54Å; V72-A82 WeakPolarHBondContact CA-O 3.33Å
73	R	98.1	Very high	95.4	Very high	6 Å²	6	30.2 Å²	30.2	2%	0.023	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	126.7	-178.4	-59.3	-66.3	166.7	-125.3	-4	112.4	S18 L19 D20 V71 A82 D135 I136 W138 D358	S18-R73 PolarHBondContact OG-NH1 3.25Å; S18-R73 VanDerWaalsContact OG-NH1 3.11Å; S18-R73 PolarHBondContact OG-NH2 3.01Å; L19-R73 PolarHBondContact O-NH1 2.92Å; L19-R73 VanDerWaalsContact O-NH1 3.1Å; D20-R73 VanDerWaalsContact OD2-CA 3.28Å; D20-R73 WeakPolarHBondContact OD2-CA 3.42Å; V71-R73 HydrophobicContact CG2-CG 3.98Å; R73-A82 PolarHBondContact N-O 2.98Å; R73-A82 PolarHBondContact O-N 2.96Å; R73-D135 IonicContact NH2-OD1 3.93Å; R73-D135 PolarHBondContact NH2-OD1 2.85Å; R73-I136 HydrophobicContact CB-CG2 4.27Å; R73-I136 HydrophobicContact CG-CB 4.06Å; R73-I136 HydrophobicContact CG-CG2 4.01Å; R73-I136 WeakPolarHBondContact CG-O 3.37Å; R73-W138 PolarHBondContact O-NE1 3.48Å; R73-D358 IonicContact CZ-OD2 2.7Å; R73-D358 VanDerWaalsContact CZ-OD2 3.23Å; R73-D358 IonicContact NH1-OD1 3.82Å; R73-D358 IonicContact NH1-OD2 3.81Å; R73-D358 PolarHBondContact NH1-OD2 3.2Å; R73-D358 IonicContact NH2-OD1 3Å; R73-D358 IonicContact NH2-OD2 3.5Å; R73-D358 PolarHBondContact NH2-OD2 3.3Å
74	F	97.4	Very high	95.7	Very high	9 Å²	9	28.5 Å²	28.5	4%	0.039	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144.5	167.6	-78.4	-79.9	0	0	0	110.7	D20 F21 Q22 R31 A33 L43 L81 W120 W138	D20-F74 HydrophobicContact CB-CD2 4.33Å; D20-F74 WeakPolarHBondContact O-CE2 3.26Å; D20-F74 PolarHBondContact OD2-N 3.48Å; F21-F74 VanDerWaalsContact C-CD2 3.44Å; Q22-F74 VanDerWaalsContact CA-CD2 3.49Å; Q22-F74 HydrophobicContact CB-CD1 3.78Å; Q22-F74 HydrophobicContact CB-CD2 3.87Å; Q22-F74 HydrophobicContact CB-CE1 3.81Å; Q22-F74 HydrophobicContact CB-CE2 3.87Å; Q22-F74 HydrophobicContact CB-CG 3.81Å; Q22-F74 HydrophobicContact CB-CZ 3.86Å; Q22-F74 HydrophobicContact CG-CD1 3.68Å; Q22-F74 HydrophobicContact CG-CE1 3.89Å; Q22-F74 HydrophobicContact CG-CG 4.08Å; Q22-F74 HydrophobicContact CG-CZ 4.44Å; R31-F74 HydrophobicContact CG-CZ 4.37Å; A33-F74 HydrophobicContact CB-CD2 4.41Å; A33-F74 HydrophobicContact CB-CE2 3.51Å; A33-F74 HydrophobicContact CB-CZ 3.92Å; L43-F74 HydrophobicContact CD2-CZ 4.33Å; F74-L81 HydrophobicContact CD1-CB 4.11Å; F74-L81 HydrophobicContact CD1-CD1 3.79Å; F74-L81 HydrophobicContact CD1-CG 4.48Å; F74-L81 HydrophobicContact CD2-CD1 3.87Å; F74-L81 HydrophobicContact CE1-CB 4Å; F74-L81 HydrophobicContact CE1-CD1 3.81Å; F74-L81 HydrophobicContact CE1-CD2 4.23Å; F74-L81 HydrophobicContact CE1-CG 4.24Å; F74-L81 HydrophobicContact CE2-CD1 3.92Å; F74-L81 HydrophobicContact CG-CD1 3.82Å; F74-L81 HydrophobicContact CZ-CD1 3.88Å; F74-L81 HydrophobicContact CZ-CD2 4.17Å; F74-L81 HydrophobicContact CZ-CG 4.48Å; F74-W120 HydrophobicContact CE1-CH2 4.01Å; F74-W138 PolarHBondContact O-NE1 2.78Å
75	S	95.6	Very high	95.8	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.007	13%	0.128	C	C	.	.			trans	-66.6	140.9	166.3	53.2	0	0	0	0	110	N77 G78 E79 L80	S75-N77 WeakPolarHBondContact CB-OD1 3.45Å; S75-N77 PolarHBondContact O-N 2.73Å; S75-N77 VanDerWaalsContact O-N 3.12Å; S75-N77 PolarHBondContact OG-OD1 2.61Å; S75-G78 PolarHBondContact O-N 3.04Å; S75-E79 PolarHBondContact OG-N 3Å; S75-L80 WeakPolarHBondContact CB-O 3.45Å; S75-L80 PolarHBondContact N-O 3.39Å; S75-L80 WeakPolarHBondContact OG-CA 3.43Å; S75-L80 PolarHBondContact OG-N 2.8Å; S75-L80 PolarHBondContact OG-O 3.23Å
76	P	92	Very high	95.8	Very high	54 Å²	54	24.8 Å²	24.8	35%	0.351	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.9	-176.4	-27.9	38.2	0	0	0	116	W138 T139	P76-W138 HydrophobicContact CG-CB 4.14Å; P76-T139 WeakPolarHBondContact CD-O 3.33Å; P76-T139 WeakPolarHBondContact CG-O 3.45Å
77	N	88.4	Confident	95.9	Very high	50 Å²	50	22.1 Å²	22.1	27%	0.267	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-13.6	171	71.5	-11.2	0	0	0	113	N24 S75 E79	N24-N77 PolarHBondContact ND2-O 3.34Å; S75-N77 WeakPolarHBondContact CB-OD1 3.45Å; S75-N77 PolarHBondContact O-N 2.73Å; S75-N77 VanDerWaalsContact O-N 3.12Å; S75-N77 PolarHBondContact OG-OD1 2.61Å; N77-E79 WeakPolarHBondContact ND2-CG 3.5Å; N77-E79 PolarHBondContact ND2-OE2 3.28Å; N77-E79 PolarHBondContact OD1-N 3.45Å; N77-E79 VanDerWaalsContact OD1-N 3.09Å
78	G	87.1	Confident	95.9	Very high	7 Å²	7	18.3 Å²	18.3	7%	0.072	10%	0.102	C	C	.	.	S	Bend	trans	89	-7.2	179.8	0	0	0	0	0	115.2	Q22 H23 S75	Q22-G78 PolarHBondContact NE2-O 3.12Å; H23-G78 WeakPolarHBondContact O-CA 3.4Å; S75-G78 PolarHBondContact O-N 3.04Å
79	E	90.2	Very high	95.8	Very high	115 Å²	115	18.1 Å²	18.1	54%	0.537	10%	0.101	S	C	.	.	S	Bend	trans	-77.3	-34.7	-170.1	-64.8	-179	155	0	0	114.1	S75 N77	S75-E79 PolarHBondContact OG-N 3Å; N77-E79 WeakPolarHBondContact ND2-CG 3.5Å; N77-E79 PolarHBondContact ND2-OE2 3.28Å; N77-E79 PolarHBondContact OD1-N 3.45Å; N77-E79 VanDerWaalsContact OD1-N 3.09Å
80	L	95.4	Very high	95.8	Very high	27 Å²	27	18.2 Å²	18.2	14%	0.141	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.9	-173.4	-61	178.6	0	0	0	112.3	S75 W93 K94 V123 W138 I159	S75-L80 WeakPolarHBondContact CB-O 3.45Å; S75-L80 PolarHBondContact N-O 3.39Å; S75-L80 WeakPolarHBondContact OG-CA 3.43Å; S75-L80 PolarHBondContact OG-N 2.8Å; S75-L80 PolarHBondContact OG-O 3.23Å; L80-W93 WeakPolarHBondContact CA-O 3.34Å; L80-K94 HydrophobicContact CD2-CB 3.94Å; L80-K94 HydrophobicContact CD2-CD 4.49Å; L80-K94 HydrophobicContact CD2-CG 4.28Å; L80-V123 HydrophobicContact CD2-CG2 3.87Å; L80-W138 HydrophobicContact CB-CH2 3.91Å; L80-W138 HydrophobicContact CB-CZ2 4.32Å; L80-W138 HydrophobicContact CD1-CH2 4.13Å; L80-I159 HydrophobicContact CD1-CG2 3.91Å
81	L	97.8	Very high	95.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.5	168.9	179.1	60.8	0	0	0	108.6	A33 V41 L43 L62 V72 F74 L92 W93 W120	A33-L81 HydrophobicContact CB-CD1 4.06Å; A33-L81 HydrophobicContact CB-CD2 4.07Å; V41-L81 HydrophobicContact CG1-CD2 4.35Å; L43-L81 HydrophobicContact CD2-CD2 3.84Å; L62-L81 HydrophobicContact CD1-CD2 3.93Å; V72-L81 HydrophobicContact CG2-CD1 3.39Å; V72-L81 HydrophobicContact CG2-CD2 4.25Å; V72-L81 HydrophobicContact CG2-CG 3.99Å; F74-L81 HydrophobicContact CD1-CB 4.11Å; F74-L81 HydrophobicContact CD1-CD1 3.79Å; F74-L81 HydrophobicContact CD1-CG 4.48Å; F74-L81 HydrophobicContact CD2-CD1 3.87Å; F74-L81 HydrophobicContact CE1-CB 4Å; F74-L81 HydrophobicContact CE1-CD1 3.81Å; F74-L81 HydrophobicContact CE1-CD2 4.23Å; F74-L81 HydrophobicContact CE1-CG 4.24Å; F74-L81 HydrophobicContact CE2-CD1 3.92Å; F74-L81 HydrophobicContact CG-CD1 3.82Å; F74-L81 HydrophobicContact CZ-CD1 3.88Å; F74-L81 HydrophobicContact CZ-CD2 4.17Å; F74-L81 HydrophobicContact CZ-CG 4.48Å; L81-L92 CarbonylContact O-C 3.57Å; L81-L92 WeakPolarHBondContact O-CA 3.45Å; L81-W93 HydrophobicContact CB-CB 4.26Å; L81-W93 PolarHBondContact N-O 2.81Å; L81-W93 PolarHBondContact O-N 3.32Å; L81-W120 HydrophobicContact CB-CZ3 4.02Å
82	A	98.4	Very high	95.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	136.7	170.9	0	0	0	0	0	110.1	V72 R73 I90 L91 L92 I136 W138 M145	V72-A82 CarbonylContact C-O 3.54Å; V72-A82 WeakPolarHBondContact CA-O 3.33Å; R73-A82 PolarHBondContact N-O 2.98Å; R73-A82 PolarHBondContact O-N 2.96Å; A82-I90 HydrophobicContact CB-CG2 4.4Å; A82-L91 WeakPolarHBondContact CA-O 3.33Å; A82-L92 HydrophobicContact CB-CD2 3.72Å; A82-I136 HydrophobicContact CB-CD1 4.48Å; A82-I136 HydrophobicContact CB-CG2 4.33Å; A82-W138 HydrophobicContact CB-CH2 4.49Å; A82-W138 HydrophobicContact CB-CZ2 3.51Å; A82-M145 HydrophobicContact CB-SD 3.85Å
83	S	98.6	Very high	95.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.4	168.4	63.3	0	0	0	0	111.3	H65 V71 I90 L91 W93	H65-S83 PolarHBondContact CD2-OG 2.81Å; H65-S83 WeakPolarHBondContact NE2-CB 3.39Å; H65-S83 PolarHBondContact NE2-O 3.47Å; H65-S83 PolarHBondContact NE2-OG 2.9Å; V71-S83 VanDerWaalsContact O-CA 3.31Å; V71-S83 WeakPolarHBondContact O-CA 3.34Å; S83-I90 CarbonylContact O-C 3.52Å; S83-I90 VanDerWaalsContact O-CA 3.26Å; S83-I90 WeakPolarHBondContact O-CA 3.31Å; S83-I90 WeakPolarHBondContact O-CG2 3.36Å; S83-L91 PolarHBondContact N-O 2.82Å; S83-L91 PolarHBondContact O-N 3Å; S83-W93 PolarHBondContact OG-NE1 2.93Å
84	G	98	Very high	95.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	146	179.1	0	0	0	0	0	111.5	V69 N70 V71	V69-G84 WeakPolarHBondContact CG1-O 3.47Å; N70-G84 PolarHBondContact N-O 3.39Å; V71-G84 PolarHBondContact N-O 3.22Å; V71-G84 VanDerWaalsContact N-O 3.11Å; V71-G84 PolarHBondContact O-N 2.82Å
85	G	96.4	Very high	95.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	-160.9	-172.6	0	0	0	0	0	113.8	A68 D87 V133	A68-G85 WeakPolarHBondContact O-CA 3.46Å; G85-D87 PolarHBondContact O-N 3.35Å; G85-V133 PolarHBondContact O-N 3.02Å
86	D	97.4	Very high	95	Very high	40 Å²	40	25.2 Å²	25.2	21%	0.214	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-7.5	-174.9	-61.3	-10.9	0	0	0	112.9	K67 A68 N70 A88 D132	K67-D86 HydrophobicContact CB-CB 3.77Å; K67-D86 HydrophobicContact CD-CB 3.44Å; K67-D86 VanDerWaalsContact CD-CB 3.44Å; K67-D86 WeakPolarHBondContact CD-O 3.3Å; K67-D86 WeakPolarHBondContact CE-O 3.47Å; K67-D86 HydrophobicContact CG-CB 4.32Å; K67-D86 PolarHBondContact NZ-O 3.45Å; A68-D86 PolarHBondContact O-N 2.56Å; N70-D86 PolarHBondContact ND2-OD1 2.94Å; D86-A88 PolarHBondContact O-N 2.84Å; D86-D132 WeakPolarHBondContact CA-OD1 3.3Å; D86-D132 HydrophobicContact CB-CB 4.33Å; D86-D132 WeakPolarHBondContact CB-OD1 3.28Å; D86-D132 VanDerWaalsContact O-OD1 3.13Å
87	D	96.4	Very high	94.2	Very high	39 Å²	39	28.5 Å²	28.5	21%	0.209	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	9.9	176.2	63	7.4	0	0	0	113.5	H65 S66 G85 A89	H65-D87 WeakPolarHBondContact CA-OD2 3.33Å; H65-D87 WeakPolarHBondContact CB-OD2 3.45Å; H65-D87 IonicContact CE1-OD1 3.84Å; H65-D87 IonicContact CE1-OD2 3.86Å; H65-D87 IonicContact CG-OD2 3.49Å; H65-D87 VanDerWaalsContact ND1-CG 3.34Å; H65-D87 IonicContact ND1-OD1 2.95Å; H65-D87 PolarHBondContact ND1-OD1 3.29Å; H65-D87 IonicContact ND1-OD2 3.81Å; H65-D87 PolarHBondContact ND1-OD2 2.65Å; S66-D87 PolarHBondContact N-OD2 2.82Å; G85-D87 PolarHBondContact O-N 3.35Å; D87-A89 PolarHBondContact O-N 3.12Å; D87-A89 WeakPolarHBondContact OD1-CB 3.46Å; D87-A89 PolarHBondContact OD1-N 3.01Å
88	A	96.6	Very high	93.1	Very high	20 Å²	20	29.5 Å²	29.5	17%	0.165	16%	0.16	C	C	.	.	S	Bend	trans	54.6	14.8	-176.4	0	0	0	0	0	114.5	D86	D86-A88 PolarHBondContact O-N 2.84Å
89	A	95.3	Very high	91.6	Very high	7 Å²	7	39.2 Å²	39.2	6%	0.058	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	152.6	179.1	0	0	0	0	0	111.1	D87 T125	D87-A89 PolarHBondContact O-N 3.12Å; D87-A89 WeakPolarHBondContact OD1-CB 3.46Å; D87-A89 PolarHBondContact OD1-N 3.01Å; A89-T125 HydrophobicContact CB-CG2 4.21Å
90	I	98.1	Very high	89.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.7	166.1	-54	171.4	0	0	0	107.7	A82 S83 L92 L126 V133 I136 M145 S147 W157	A82-I90 HydrophobicContact CB-CG2 4.4Å; S83-I90 CarbonylContact O-C 3.52Å; S83-I90 VanDerWaalsContact O-CA 3.26Å; S83-I90 WeakPolarHBondContact O-CA 3.31Å; S83-I90 WeakPolarHBondContact O-CG2 3.36Å; I90-L92 HydrophobicContact CG2-CD2 4.42Å; I90-L126 HydrophobicContact CB-CB 4.21Å; I90-L126 HydrophobicContact CG2-CD1 4.49Å; I90-L126 PolarHBondContact N-O 3.42Å; I90-L126 PolarHBondContact O-N 2.78Å; I90-V133 HydrophobicContact CD1-CG1 4.23Å; I90-V133 HydrophobicContact CG1-CG1 4.28Å; I90-V133 HydrophobicContact CG1-CG2 4.18Å; I90-I136 HydrophobicContact CD1-CD1 4.06Å; I90-I136 HydrophobicContact CD1-CG1 4.43Å; I90-I136 HydrophobicContact CG1-CD1 4.16Å; I90-I136 HydrophobicContact CG2-CD1 3.68Å; I90-M145 HydrophobicContact CD1-CE 4.15Å; I90-M145 HydrophobicContact CG2-CE 3.87Å; I90-S147 VanDerWaalsContact CD1-CB 3.4Å; I90-W157 HydrophobicContact CD1-CZ2 4.48Å
91	L	98.1	Very high	87.5	Confident	11 Å²	11	45.6 Å²	45.6	6%	0.058	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.8	177.7	-58.4	-177.9	0	0	0	109.1	R64 A82 S83 W93 V122 T125	R64-L91 HydrophobicContact CB-CD1 3.68Å; A82-L91 WeakPolarHBondContact CA-O 3.33Å; S83-L91 PolarHBondContact N-O 2.82Å; S83-L91 PolarHBondContact O-N 3Å; L91-W93 HydrophobicContact CB-CZ2 4.31Å; L91-W93 HydrophobicContact CD1-CH2 4.38Å; L91-W93 HydrophobicContact CD1-CZ2 3.67Å; L91-V122 HydrophobicContact CB-CG1 4.48Å; L91-V122 HydrophobicContact CD1-CG2 4.49Å; L91-V122 HydrophobicContact CD2-CG1 4.13Å; L91-T125 HydrophobicContact CD2-CG2 3.77Å; L91-T125 WeakPolarHBondContact CD2-OG1 3.48Å
92	L	98	Very high	85.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.4	169.5	-55.9	-172.5	0	0	0	108.4	L81 A82 I90 V122 V123 K124 L126 W138 M145 I159	L81-L92 CarbonylContact O-C 3.57Å; L81-L92 WeakPolarHBondContact O-CA 3.45Å; A82-L92 HydrophobicContact CB-CD2 3.72Å; I90-L92 HydrophobicContact CG2-CD2 4.42Å; L92-V122 CarbonylContact O-C 3.55Å; L92-V122 WeakPolarHBondContact O-CA 3.47Å; L92-V123 HydrophobicContact CB-CG2 4.16Å; L92-V123 WeakPolarHBondContact O-CG2 3.38Å; L92-V123 PolarHBondContact O-N 3.03Å; L92-K124 HydrophobicContact CB-CB 4.29Å; L92-K124 HydrophobicContact CD1-CB 4.17Å; L92-K124 HydrophobicContact CG-CB 4.42Å; L92-K124 PolarHBondContact N-O 2.68Å; L92-K124 PolarHBondContact O-N 3.21Å; L92-L126 HydrophobicContact CD1-CD1 4.25Å; L92-L126 HydrophobicContact CD1-CD2 4.42Å; L92-L126 HydrophobicContact CD1-CG 4.36Å; L92-L126 HydrophobicContact CD2-CD1 4.36Å; L92-L126 HydrophobicContact CG-CD1 4.35Å; L92-L126 HydrophobicContact CG-CG 4.36Å; L92-W138 HydrophobicContact CD2-CH2 4.13Å; L92-W138 HydrophobicContact CD2-CZ2 4.33Å; L92-M145 HydrophobicContact CD2-CE 4.48Å; L92-I159 HydrophobicContact CD1-CD1 3.83Å; L92-I159 HydrophobicContact CD1-CG2 3.74Å; L92-I159 HydrophobicContact CD2-CD1 4.45Å
93	W	97.3	Very high	82.6	Confident	5 Å²	5	61 Å²	61	2%	0.019	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	148.5	-179.1	-46.6	79.4	0	0	0	110.8	L62 R64 L80 L81 S83 L91 W120 S121 V122	L62-W93 HydrophobicContact CB-CE3 4.27Å; L62-W93 HydrophobicContact CB-CH2 3.56Å; L62-W93 HydrophobicContact CB-CZ2 3.88Å; L62-W93 HydrophobicContact CB-CZ3 3.79Å; L62-W93 HydrophobicContact CD1-CD2 4.47Å; L62-W93 HydrophobicContact CD2-CD2 4.45Å; L62-W93 HydrophobicContact CD2-CE3 3.88Å; L62-W93 HydrophobicContact CD2-CZ3 3.95Å; L62-W93 HydrophobicContact CG-CZ3 4.43Å; L62-W93 WeakPolarHBondContact O-CH2 3.3Å; R64-W93 HydrophobicContact CB-CH2 3.43Å; R64-W93 VanDerWaalsContact CB-CH2 3.43Å; R64-W93 HydrophobicContact CB-CZ2 4Å; R64-W93 HydrophobicContact CB-CZ3 4.24Å; R64-W93 HydrophobicContact CG-CH2 3.38Å; R64-W93 HydrophobicContact CG-CZ2 4.38Å; R64-W93 HydrophobicContact CG-CZ3 3.69Å; L80-W93 WeakPolarHBondContact CA-O 3.34Å; L81-W93 HydrophobicContact CB-CB 4.26Å; L81-W93 PolarHBondContact N-O 2.81Å; L81-W93 PolarHBondContact O-N 3.32Å; S83-W93 PolarHBondContact OG-NE1 2.93Å; L91-W93 HydrophobicContact CB-CZ2 4.31Å; L91-W93 HydrophobicContact CD1-CH2 4.38Å; L91-W93 HydrophobicContact CD1-CZ2 3.67Å; W93-W120 HydrophobicContact CB-CE3 3.92Å; W93-W120 HydrophobicContact CB-CZ3 4.46Å; W93-S121 CarbonylContact C-O 3.59Å; W93-S121 VanDerWaalsContact CA-O 3.23Å; W93-S121 WeakPolarHBondContact CA-O 3.22Å; W93-V122 HydrophobicContact CD2-CG2 3.83Å; W93-V122 HydrophobicContact CE3-CG2 3.46Å; W93-V122 VanDerWaalsContact CE3-CG2 3.46Å; W93-V122 HydrophobicContact CH2-CG2 3.93Å; W93-V122 HydrophobicContact CZ2-CG2 4.22Å; W93-V122 HydrophobicContact CZ3-CG2 3.52Å
94	K	94.8	Very high	80.1	Confident	91 Å²	91	63.7 Å²	63.7	40%	0.396	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.1	170.1	-171.2	174.6	177	177.6	0	110.1	L80 W120 S121 V123	L80-K94 HydrophobicContact CD2-CB 3.94Å; L80-K94 HydrophobicContact CD2-CD 4.49Å; L80-K94 HydrophobicContact CD2-CG 4.28Å; K94-W120 CarbonylContact O-C 3.5Å; K94-W120 VanDerWaalsContact O-CA 3.31Å; K94-W120 WeakPolarHBondContact O-CA 3.21Å; K94-S121 PolarHBondContact N-O 3.33Å; K94-S121 PolarHBondContact O-N 2.84Å; K94-V123 HydrophobicContact CB-CG1 3.58Å; K94-V123 HydrophobicContact CB-CG2 4.4Å
95	L	92.3	Very high	77.7	Confident	34 Å²	34	66.4 Å²	66.4	18%	0.178	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	130.9	169.6	179.7	69	0	0	0	109.6	E118 W120	L95-E118 HydrophobicContact CD1-CB 4.02Å; L95-E118 HydrophobicContact CD1-CG 4.44Å; L95-W120 HydrophobicContact CB-CD2 4.17Å; L95-W120 HydrophobicContact CB-CE3 4.37Å; L95-W120 HydrophobicContact CB-CH2 3.97Å; L95-W120 HydrophobicContact CB-CZ2 3.77Å; L95-W120 HydrophobicContact CB-CZ3 4.28Å; L95-W120 HydrophobicContact CD1-CD2 4.35Å; L95-W120 HydrophobicContact CD1-CG 4.48Å; L95-W120 HydrophobicContact CD1-CZ2 3.99Å; L95-W120 VanDerWaalsContact CD1-NE1 3.31Å; L95-W120 HydrophobicContact CG-CZ2 4.38Å; L95-W120 VanDerWaalsContact N-CE3 3.29Å
96	N	88.9	Confident	75.5	Confident	29 Å²	29	73 Å²	73	16%	0.155	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	108.2	171.4	-67.5	-16.3	0	0	0	108.6	S98 E102 S119 S121	N96-S98 PolarHBondContact O-N 2.88Å; N96-E102 PolarHBondContact ND2-OE2 3.1Å; N96-S119 WeakPolarHBondContact CB-O 3.43Å; N96-S119 PolarHBondContact N-O 2.88Å; N96-S119 PolarHBondContact ND2-OG 3.06Å; N96-S121 WeakPolarHBondContact OD1-CB 3.17Å; N96-S121 PolarHBondContact OD1-OG 3.01Å
97	D	75.1	Confident	73.3	Confident	123 Å²	123	80 Å²	80	66%	0.658	42%	0.419	S	S	*	.			trans	-73.3	-10.8	175.5	-65.3	-63.4	0	0	0	113.4	K99	D97-K99 PolarHBondContact O-N 3.32Å
98	S	65.8	Low	71.4	Confident	71 Å²	71	80.4 Å²	80.4	50%	0.497	42%	0.419	S	S	.	.			trans	-70.8	121.1	175.4	51.3	0	0	0	0	111.3	N96 E100	N96-S98 PolarHBondContact O-N 2.88Å; S98-E100 VanDerWaalsContact C-N 3.26Å; S98-E100 PolarHBondContact O-N 2.85Å
99	K	54.8	Low	69.5	Low	210 Å²	210	85.8 Å²	85.8	91%	0.913	45%	0.445	S	S	*	.	S	Bend	trans	-76	-7.2	176.9	-69	-171.8	177.8	-177	0	114.8	D97 P101	D97-K99 PolarHBondContact O-N 3.32Å; K99-P101 WeakPolarHBondContact O-CD 3.5Å
100	E	50.7	Low	67.7	Low	165 Å²	165	93.5 Å²	93.5	77%	0.771	48%	0.48	S	S	*	.	S	Bend	trans	-73.9	122	166.4	-65.7	-170.3	162.1	0	0	108.1	S98 E102	S98-E100 VanDerWaalsContact C-N 3.26Å; S98-E100 PolarHBondContact O-N 2.85Å; E100-E102 PolarHBondContact O-N 2.83Å
101	P	49.1	Very low	66	Low	112 Å²	112	100.8 Å²	100.8	73%	0.727	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-65.5	121.8	170.2	27.6	-31.7	0	0	0	108.1	K99 Q103	K99-P101 WeakPolarHBondContact O-CD 3.5Å; P101-Q103 PolarHBondContact O-N 2.91Å
102	E	48.1	Very low	64.3	Low	136 Å²	136	102.8 Å²	102.8	64%	0.636	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-50.6	131.1	160.8	-80.7	-171.2	112.8	0	0	107.6	N96 E100 A104	N96-E102 PolarHBondContact ND2-OE2 3.1Å; E100-E102 PolarHBondContact O-N 2.83Å; E102-A104 PolarHBondContact O-N 3.35Å; E102-A104 VanDerWaalsContact O-N 3.14Å
103	Q	44.3	Very low	62.7	Low	187 Å²	187	104.3 Å²	104.3	87%	0.874	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-51.1	125.5	-179.4	-70.4	179.3	-10.8	0	0	109	P101 T105	P101-Q103 PolarHBondContact O-N 2.91Å; Q103-T105 PolarHBondContact O-N 2.87Å
104	A	46.6	Very low	61.1	Low	56 Å²	56	112.3 Å²	112.3	46%	0.463	58%	0.575	S	S	.	*			trans	-49.4	112.6	-173.2	0	0	0	0	0	109.6	E102 V106	E102-A104 PolarHBondContact O-N 3.35Å; E102-A104 VanDerWaalsContact O-N 3.14Å; A104-V106 PolarHBondContact O-N 2.87Å
105	T	47.7	Very low	60.4	Low	57 Å²	57	113 Å²	113	35%	0.35	58%	0.583	S	S	.	*			trans	-58.1	136.1	178.3	55.8	0	0	0	0	107.8	R64 Q103 F107 Q108	R64-T105 PolarHBondContact NH1-OG1 3.44Å; R64-T105 PolarHBondContact NH2-OG1 2.68Å; Q103-T105 PolarHBondContact O-N 2.87Å; T105-F107 PolarHBondContact O-N 2.92Å; T105-Q108 PolarHBondContact O-N 3.3Å
106	V	50.9	Low	60.1	Low	138 Å²	138	113.3 Å²	113.3	84%	0.836	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	8.1	-165.4	-172.7	0	0	0	0	116	A104	A104-V106 PolarHBondContact O-N 2.87Å
107	F	50.5	Low	60.2	Low	188 Å²	188	117.6 Å²	117.6	83%	0.825	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.3	20.8	-179.9	-53.8	-79.2	0	0	0	112.9	T105	T105-F107 PolarHBondContact O-N 2.92Å
108	Q	55.7	Low	60.9	Low	48 Å²	48	113 Å²	113	22%	0.224	58%	0.576	C	S	.	*	S	Bend	trans	-122	119	174.9	-169.4	166.7	14.1	0	0	108.2	T105 E110	T105-Q108 PolarHBondContact O-N 3.3Å; Q108-E110 PolarHBondContact O-N 3.49Å
109	D	56.8	Low	62	Low	132 Å²	132	111.7 Å²	111.7	71%	0.706	57%	0.567	S	S	*	*			trans	-60.8	133.4	-176.5	-63.9	-56.1	0	0	0	110.6	E111 D112 A113	D109-E111 VanDerWaalsContact C-N 3.25Å; D109-E111 PolarHBondContact O-N 2.79Å; D109-D112 HydrophobicContact CB-CB 4.41Å; D109-D112 WeakPolarHBondContact O-CB 3.39Å; D109-D112 PolarHBondContact O-N 2.9Å; D109-A113 PolarHBondContact O-N 3.1Å
110	E	58.6	Low	63.9	Low	169 Å²	169	102.8 Å²	102.8	79%	0.79	53%	0.528	S	S	*	.	H	α-helix	trans	-62	-33.3	-168.6	-61.6	-173.8	141.1	0	0	112.7	Q108 Q114	Q108-E110 PolarHBondContact O-N 3.49Å; E110-Q114 WeakPolarHBondContact O-CB 3.07Å; E110-Q114 PolarHBondContact O-N 2.8Å; E110-Q114 VanDerWaalsContact O-N 3.09Å
111	E	61.9	Low	65.9	Low	155 Å²	155	96.3 Å²	96.3	72%	0.724	50%	0.501	S	S	*	.	H	α-helix	trans	-62.2	-42.9	174.3	-175.9	170.5	-164.6	0	0	111.8	D109 Q114 L115	D109-E111 VanDerWaalsContact C-N 3.25Å; D109-E111 PolarHBondContact O-N 2.79Å; E111-Q114 PolarHBondContact O-N 2.92Å; E111-L115 WeakPolarHBondContact O-CG 3.3Å; E111-L115 PolarHBondContact O-N 2.91Å
112	D	62.6	Low	68.2	Low	52 Å²	52	93.2 Å²	93.2	28%	0.278	48%	0.48	S	S	.	.	H	α-helix	trans	-73	-35.9	-177.6	-145	58.9	0	0	0	111.2	N61 D109 Q114 L115 N116	N61-D112 PolarHBondContact ND2-OD2 2.75Å; D109-D112 HydrophobicContact CB-CB 4.41Å; D109-D112 WeakPolarHBondContact O-CB 3.39Å; D109-D112 PolarHBondContact O-N 2.9Å; D112-Q114 VanDerWaalsContact C-N 3.32Å; D112-Q114 PolarHBondContact O-N 3.39Å; D112-L115 PolarHBondContact O-N 2.78Å; D112-N116 PolarHBondContact O-ND2 2.83Å
113	A	64.5	Low	70.4	Confident	33 Å²	33	89.8 Å²	89.8	27%	0.273	47%	0.468	S	S	.	.	H	α-helix	trans	-62.9	-36.6	170.4	0	0	0	0	0	112.4	D109 L115 N116	D109-A113 PolarHBondContact O-N 3.1Å; A113-L115 VanDerWaalsContact C-N 3.31Å; A113-L115 PolarHBondContact O-N 2.87Å; A113-N116 PolarHBondContact O-N 3.26Å
114	Q	64.4	Low	72.8	Confident	173 Å²	173	84.3 Å²	84.3	81%	0.808	44%	0.441	S	S	*	.	H	α-helix	trans	-74.6	-17	-178.4	-165	168.5	20.7	0	0	113.9	E110 E111 D112	E110-Q114 WeakPolarHBondContact O-CB 3.07Å; E110-Q114 PolarHBondContact O-N 2.8Å; E110-Q114 VanDerWaalsContact O-N 3.09Å; E111-Q114 PolarHBondContact O-N 2.92Å; D112-Q114 VanDerWaalsContact C-N 3.32Å; D112-Q114 PolarHBondContact O-N 3.39Å
115	L	79.3	Confident	75.2	Confident	105 Å²	105	84.2 Å²	84.2	55%	0.55	44%	0.435	S	S	.	.	H	α-helix	trans	-88.2	-13.9	176.3	-67.5	173	0	0	0	114.1	F58 E111 D112 A113	F58-L115 HydrophobicContact CE1-CB 4.38Å; E111-L115 WeakPolarHBondContact O-CG 3.3Å; E111-L115 PolarHBondContact O-N 2.91Å; D112-L115 PolarHBondContact O-N 2.78Å; A113-L115 VanDerWaalsContact C-N 3.31Å; A113-L115 PolarHBondContact O-N 2.87Å
116	N	86.4	Confident	77.6	Confident	41 Å²	41	81.6 Å²	81.6	22%	0.219	42%	0.419	C	S	.	.			trans	-77.3	125	-176.2	-66.6	-40.3	0	0	0	112.2	S60 N61 D112 A113	S60-N116 VanDerWaalsContact CA-OD1 3.29Å; S60-N116 WeakPolarHBondContact CA-OD1 3.35Å; N61-N116 PolarHBondContact N-OD1 2.92Å; D112-N116 PolarHBondContact O-ND2 2.83Å; A113-N116 PolarHBondContact O-N 3.26Å
117	K	89.5	Confident	79.7	Confident	119 Å²	119	84 Å²	84	52%	0.517	41%	0.413	S	S	.	.	S	Bend	trans	-92.7	-16.8	175.3	-58.3	174.2	-169.1	159.3	0	112.8	E57 F58 L59	E57-K117 VanDerWaalsContact CD-NZ 3.27Å; E57-K117 VanDerWaalsContact CG-NZ 3.25Å; E57-K117 IonicContact OE1-NZ 3.66Å; E57-K117 PolarHBondContact OE1-NZ 3.02Å; F58-K117 WeakPolarHBondContact O-CD 3.46Å; F58-K117 WeakPolarHBondContact O-CE 3.41Å; F58-K117 PolarHBondContact O-NZ 2.9Å; L59-K117 WeakPolarHBondContact O-CA 3.47Å; L59-K117 PolarHBondContact O-N 2.85Å
118	E	90.1	Very high	81.8	Confident	26 Å²	26	75.6 Å²	75.6	12%	0.121	38%	0.38	C	S	.	.	S	Bend	trans	-126.1	140.1	175.2	-57.8	-173	165.5	0	0	109.7	R31 L59 S60 L95 W120	R31-E118 IonicContact CZ-OE1 2.7Å; R31-E118 IonicContact CZ-OE2 2.8Å; R31-E118 IonicContact NE-OE1 3.83Å; R31-E118 PolarHBondContact NE-OE1 3.41Å; R31-E118 IonicContact NE-OE2 3.65Å; R31-E118 PolarHBondContact NE-OE2 2.91Å; R31-E118 IonicContact NH2-OE1 3.84Å; R31-E118 PolarHBondContact NH2-OE1 2.76Å; R31-E118 IonicContact NH2-OE2 4Å; R31-E118 PolarHBondContact NH2-OE2 3.38Å; R31-E118 VanDerWaalsContact NH2-OE2 3.15Å; L59-E118 HydrophobicContact CB-CG 4.18Å; L59-E118 PolarHBondContact O-N 3.13Å; S60-E118 PolarHBondContact OG-O 3.32Å; S60-E118 VanDerWaalsContact OG-O 3.08Å; L95-E118 HydrophobicContact CD1-CB 4.02Å; L95-E118 HydrophobicContact CD1-CG 4.44Å; E118-W120 PolarHBondContact OE2-NE1 2.78Å
119	S	89.9	Confident	83.8	Confident	44 Å²	44	73.9 Å²	73.9	31%	0.308	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	136.7	171	178.8	0	0	0	0	109.4	N96	N96-S119 WeakPolarHBondContact CB-O 3.43Å; N96-S119 PolarHBondContact N-O 2.88Å; N96-S119 PolarHBondContact ND2-OG 3.06Å
120	W	93.6	Very high	85.7	Confident	23 Å²	23	74.4 Å²	74.4	9%	0.087	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	127	-177.7	-78.3	78.9	0	0	0	110.1	L43 L62 F74 L81 W93 K94 L95 E118	L43-W120 HydrophobicContact CD1-CD2 3.81Å; L43-W120 HydrophobicContact CD1-CG 4.05Å; L43-W120 HydrophobicContact CD1-CZ2 3.72Å; L62-W120 HydrophobicContact CD2-CB 3.4Å; L62-W120 HydrophobicContact CD2-CG 3.88Å; F74-W120 HydrophobicContact CE1-CH2 4.01Å; L81-W120 HydrophobicContact CB-CZ3 4.02Å; W93-W120 HydrophobicContact CB-CE3 3.92Å; W93-W120 HydrophobicContact CB-CZ3 4.46Å; K94-W120 CarbonylContact O-C 3.5Å; K94-W120 VanDerWaalsContact O-CA 3.31Å; K94-W120 WeakPolarHBondContact O-CA 3.21Å; L95-W120 HydrophobicContact CB-CD2 4.17Å; L95-W120 HydrophobicContact CB-CE3 4.37Å; L95-W120 HydrophobicContact CB-CH2 3.97Å; L95-W120 HydrophobicContact CB-CZ2 3.77Å; L95-W120 HydrophobicContact CB-CZ3 4.28Å; L95-W120 HydrophobicContact CD1-CD2 4.35Å; L95-W120 HydrophobicContact CD1-CG 4.48Å; L95-W120 HydrophobicContact CD1-CZ2 3.99Å; L95-W120 VanDerWaalsContact CD1-NE1 3.31Å; L95-W120 HydrophobicContact CG-CZ2 4.38Å; L95-W120 VanDerWaalsContact N-CE3 3.29Å; E118-W120 PolarHBondContact OE2-NE1 2.78Å
121	S	93.8	Very high	87.6	Confident	29 Å²	29	71.2 Å²	71.2	20%	0.203	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.7	-179.4	57.3	0	0	0	0	111.9	W93 K94 N96 V123	W93-S121 CarbonylContact C-O 3.59Å; W93-S121 VanDerWaalsContact CA-O 3.23Å; W93-S121 WeakPolarHBondContact CA-O 3.22Å; K94-S121 PolarHBondContact N-O 3.33Å; K94-S121 PolarHBondContact O-N 2.84Å; N96-S121 WeakPolarHBondContact OD1-CB 3.17Å; N96-S121 PolarHBondContact OD1-OG 3.01Å; S121-V123 PolarHBondContact O-N 2.77Å
122	V	96	Very high	89.2	Confident	46 Å²	46	65.3 Å²	65.3	28%	0.279	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	104.8	168.5	177.2	0	0	0	0	108.2	R64 L91 L92 W93	R64-V122 HydrophobicContact CB-CG2 4.34Å; R64-V122 HydrophobicContact CG-CG2 3.96Å; L91-V122 HydrophobicContact CB-CG1 4.48Å; L91-V122 HydrophobicContact CD1-CG2 4.49Å; L91-V122 HydrophobicContact CD2-CG1 4.13Å; L92-V122 CarbonylContact O-C 3.55Å; L92-V122 WeakPolarHBondContact O-CA 3.47Å; W93-V122 HydrophobicContact CD2-CG2 3.83Å; W93-V122 HydrophobicContact CE3-CG2 3.46Å; W93-V122 VanDerWaalsContact CE3-CG2 3.46Å; W93-V122 HydrophobicContact CH2-CG2 3.93Å; W93-V122 HydrophobicContact CZ2-CG2 4.22Å; W93-V122 HydrophobicContact CZ3-CG2 3.52Å
123	V	95.3	Very high	90.9	Very high	65 Å²	65	62.9 Å²	62.9	39%	0.394	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-29.2	179.6	-65.9	0	0	0	0	112.7	L80 L92 K94 S121	L80-V123 HydrophobicContact CD2-CG2 3.87Å; L92-V123 HydrophobicContact CB-CG2 4.16Å; L92-V123 WeakPolarHBondContact O-CG2 3.38Å; L92-V123 PolarHBondContact O-N 3.03Å; K94-V123 HydrophobicContact CB-CG1 3.58Å; K94-V123 HydrophobicContact CB-CG2 4.4Å; S121-V123 PolarHBondContact O-N 2.77Å
124	K	95.4	Very high	92.5	Very high	71 Å²	71	62.4 Å²	62.4	31%	0.309	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	147	176.1	-58.4	-175.4	-173.2	176.2	0	111.6	L92 I159 S160	L92-K124 HydrophobicContact CB-CB 4.29Å; L92-K124 HydrophobicContact CD1-CB 4.17Å; L92-K124 HydrophobicContact CG-CB 4.42Å; L92-K124 PolarHBondContact N-O 2.68Å; L92-K124 PolarHBondContact O-N 3.21Å; K124-I159 PolarHBondContact NZ-O 3.48Å; K124-S160 PolarHBondContact NZ-O 3.07Å
125	T	96.7	Very high	94.1	Very high	54 Å²	54	54.3 Å²	54.3	33%	0.331	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	114.1	166.1	-55.9	0	0	0	0	109.1	A89 L91 R127	A89-T125 HydrophobicContact CB-CG2 4.21Å; L91-T125 HydrophobicContact CD2-CG2 3.77Å; L91-T125 WeakPolarHBondContact CD2-OG1 3.48Å; T125-R127 HydrophobicContact CG2-CG 3.92Å
126	L	97.3	Very high	95	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	113.4	174.1	-48	177.8	0	0	0	108.3	I90 L92 M145 W157 I159	I90-L126 HydrophobicContact CB-CB 4.21Å; I90-L126 HydrophobicContact CG2-CD1 4.49Å; I90-L126 PolarHBondContact N-O 3.42Å; I90-L126 PolarHBondContact O-N 2.78Å; L92-L126 HydrophobicContact CD1-CD1 4.25Å; L92-L126 HydrophobicContact CD1-CD2 4.42Å; L92-L126 HydrophobicContact CD1-CG 4.36Å; L92-L126 HydrophobicContact CD2-CD1 4.36Å; L92-L126 HydrophobicContact CG-CD1 4.35Å; L92-L126 HydrophobicContact CG-CG 4.36Å; L126-M145 HydrophobicContact CD1-CE 3.55Å; L126-W157 HydrophobicContact CB-CD2 4.28Å; L126-W157 HydrophobicContact CB-CE3 3.92Å; L126-W157 HydrophobicContact CB-CH2 3.92Å; L126-W157 HydrophobicContact CB-CZ2 4.29Å; L126-W157 HydrophobicContact CB-CZ3 3.73Å; L126-W157 HydrophobicContact CD1-CB 4.26Å; L126-W157 HydrophobicContact CD1-CD2 3.89Å; L126-W157 HydrophobicContact CD1-CE3 4.05Å; L126-W157 HydrophobicContact CD1-CG 3.99Å; L126-W157 HydrophobicContact CD2-CE3 4.25Å; L126-W157 HydrophobicContact CG-CE3 4.31Å; L126-I159 HydrophobicContact CD1-CD1 3.98Å
127	R	95.4	Very high	95.5	Very high	188 Å²	188	48.6 Å²	48.6	71%	0.709	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.1	173.9	-64.1	-166.3	172.5	102.3	0.8	110	T125 K164	T125-R127 HydrophobicContact CG2-CG 3.92Å; R127-K164 WeakPolarHBondContact O-CE 3.46Å
128	G	94.3	Very high	95.9	Very high	13 Å²	13	43.7 Å²	43.7	13%	0.134	22%	0.223	C	C	.	.			trans	171.5	-16.4	177.1	0	0	0	0	0	119.1	I155 K164	G128-I155 VanDerWaalsContact C-CD1 3.49Å; G128-I155 WeakPolarHBondContact O-CD1 3.29Å; G128-K164 PolarHBondContact O-NZ 3.29Å; G128-K164 VanDerWaalsContact O-NZ 3.09Å
129	H	97.6	Very high	96.2	Very high	12 Å²	12	42.9 Å²	42.9	6%	0.056	22%	0.22	C	C	.	.			trans	-72	161.4	157.2	-78	-62.9	0	0	0	109.9	V133 S147 S149 D151 T153	H129-V133 HydrophobicContact CB-CG2 4.28Å; H129-S147 PolarHBondContact CD2-OG 2.86Å; H129-S147 PolarHBondContact NE2-OG 2.93Å; H129-S149 VanDerWaalsContact CE1-CB 3.41Å; H129-S149 WeakPolarHBondContact CE1-CB 3.46Å; H129-S149 WeakPolarHBondContact ND1-CB 3.42Å; H129-D151 WeakPolarHBondContact CA-OD2 3.27Å; H129-D151 WeakPolarHBondContact CB-OD2 3.49Å; H129-D151 IonicContact CE1-OD1 3.56Å; H129-D151 IonicContact CG-OD2 3.2Å; H129-D151 IonicContact ND1-OD1 2.75Å; H129-D151 PolarHBondContact ND1-OD1 2.95Å; H129-D151 IonicContact ND1-OD2 2.86Å; H129-D151 PolarHBondContact ND1-OD2 2.67Å; H129-T153 PolarHBondContact CE1-OG1 2.86Å; H129-T153 PolarHBondContact ND1-OG1 2.76Å
130	L	97.1	Very high	96.2	Very high	142 Å²	142	47.3 Å²	47.3	74%	0.743	23%	0.23	S	C	*	.	S	Bend	trans	-102.7	-24.4	176.6	-59.5	179.7	0	0	0	112.9	D151	L130-D151 HydrophobicContact CB-CB 4.1Å; L130-D151 PolarHBondContact N-OD2 2.91Å
131	E	97.8	Very high	96	Very high	102 Å²	102	50.1 Å²	50.1	48%	0.477	25%	0.246	S	C	.	.	S	Bend	trans	-133.8	179.6	-176.3	-52.6	-66.2	164.7	0	0	109.7	S149 V150 D151	E131-S149 PolarHBondContact O-OG 3.02Å; E131-V150 HydrophobicContact CB-CB 3.78Å; E131-V150 HydrophobicContact CB-CG1 3.89Å; E131-V150 HydrophobicContact CG-CG1 4.34Å; E131-D151 HydrophobicContact CB-CB 4.07Å; E131-D151 HydrophobicContact CG-CB 3.97Å
132	D	97.4	Very high	95.9	Very high	32 Å²	32	49 Å²	49	17%	0.171	24%	0.239	C	C	.	.			trans	-46.1	138.7	-175.4	-40.6	-37.8	0	0	0	114.3	K67 D86 S149 V150	K67-D132 IonicContact NZ-OD1 2.94Å; D86-D132 WeakPolarHBondContact CA-OD1 3.3Å; D86-D132 HydrophobicContact CB-CB 4.33Å; D86-D132 WeakPolarHBondContact CB-OD1 3.28Å; D86-D132 VanDerWaalsContact O-OD1 3.13Å; D132-S149 CarbonylContact O-C 3.48Å; D132-S149 WeakPolarHBondContact O-CA 3.37Å; D132-S149 VanDerWaalsContact O-CB 3.25Å; D132-S149 WeakPolarHBondContact O-CB 3.42Å; D132-S149 PolarHBondContact O-OG 2.75Å; D132-V150 HydrophobicContact CB-CB 4.39Å; D132-V150 HydrophobicContact CB-CG2 3.89Å; D132-V150 PolarHBondContact O-N 2.7Å
133	V	98.3	Very high	95.8	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.4	175.2	-177.4	0	0	0	0	109.2	N70 V71 G85 I90 H129 I136	N70-V133 VanDerWaalsContact CB-O 3.25Å; N70-V133 WeakPolarHBondContact CB-O 3.28Å; N70-V133 PolarHBondContact ND2-O 3.34Å; V71-V133 HydrophobicContact CG1-CG1 4.37Å; G85-V133 PolarHBondContact O-N 3.02Å; I90-V133 HydrophobicContact CD1-CG1 4.23Å; I90-V133 HydrophobicContact CG1-CG1 4.28Å; I90-V133 HydrophobicContact CG1-CG2 4.18Å; H129-V133 HydrophobicContact CB-CG2 4.28Å; V133-I136 HydrophobicContact CG1-CD1 4.4Å; V133-I136 HydrophobicContact CG1-CG1 4.21Å
134	Y	97.1	Very high	95.8	Very high	23 Å²	23	50.3 Å²	50.3	9%	0.09	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-31.1	-175.5	-78.3	-31.1	0	0	0	115.3	N70 G148 V150 Q176 F238 R240	N70-Y134 HydrophobicContact CB-CD1 4.28Å; Y134-G148 PolarHBondContact N-O 2.9Å; Y134-V150 HydrophobicContact CD2-CG2 4.01Å; Y134-V150 HydrophobicContact CE1-CG2 4.18Å; Y134-V150 HydrophobicContact CE2-CG2 3.35Å; Y134-V150 VanDerWaalsContact CZ-CG2 3.44Å; Y134-Q176 HydrophobicContact CD2-CG 4Å; Y134-Q176 HydrophobicContact CE2-CG 4.3Å; Y134-F238 HydrophobicContact CD1-CE1 4.49Å; Y134-R240 PolarHBondContact O-NH2 2.93Å; Y134-R240 VanDerWaalsContact O-NH2 3.14Å
135	D	97.9	Very high	95.9	Very high	3 Å²	3	47 Å²	47	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	150.1	-177.8	-158.5	38.8	0	0	0	112.4	R73 S147 G148 G177 V178 R240	R73-D135 IonicContact NH2-OD1 3.93Å; R73-D135 PolarHBondContact NH2-OD1 2.85Å; D135-S147 CarbonylContact O-C 3.58Å; D135-S147 WeakPolarHBondContact O-CA 3.45Å; D135-G148 PolarHBondContact O-N 2.89Å; D135-G177 WeakPolarHBondContact OD2-CA 3.46Å; D135-V178 HydrophobicContact CB-CG2 4.2Å; D135-V178 WeakPolarHBondContact O-CG2 3.24Å; D135-V178 PolarHBondContact OD2-N 3.09Å; D135-R240 IonicContact OD1-NE 3.18Å; D135-R240 PolarHBondContact OD1-NE 2.95Å; D135-R240 VanDerWaalsContact OD1-NE 3.08Å
136	I	98.3	Very high	96	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	141.7	-174.3	-72.6	174.9	0	0	0	108.4	V71 R73 A82 I90 V133 M145 I146	V71-I136 HydrophobicContact CG1-CB 4.33Å; V71-I136 HydrophobicContact CG1-CD1 3.81Å; V71-I136 HydrophobicContact CG1-CG1 3.83Å; V71-I136 HydrophobicContact CG2-CB 3.99Å; V71-I136 HydrophobicContact CG2-CG1 4.42Å; R73-I136 HydrophobicContact CB-CG2 4.27Å; R73-I136 HydrophobicContact CG-CB 4.06Å; R73-I136 HydrophobicContact CG-CG2 4.01Å; R73-I136 WeakPolarHBondContact CG-O 3.37Å; A82-I136 HydrophobicContact CB-CD1 4.48Å; A82-I136 HydrophobicContact CB-CG2 4.33Å; I90-I136 HydrophobicContact CD1-CD1 4.06Å; I90-I136 HydrophobicContact CD1-CG1 4.43Å; I90-I136 HydrophobicContact CG1-CD1 4.16Å; I90-I136 HydrophobicContact CG2-CD1 3.68Å; V133-I136 HydrophobicContact CG1-CD1 4.4Å; V133-I136 HydrophobicContact CG1-CG1 4.21Å; I136-M145 HydrophobicContact CG2-CE 4.42Å; I136-M145 HydrophobicContact CG2-CG 3.7Å; I136-M145 HydrophobicContact CG2-SD 3.43Å; I136-M145 WeakPolarHBondContact CG2-SD 3.39Å; I136-I146 WeakPolarHBondContact CA-O 3.38Å
137	C	97.9	Very high	96	Very high	25 Å²	25	44.3 Å²	44.3	17%	0.169	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	131.2	171.1	-170.4	0	0	0	0	111.7	M145 I146 V178 W180	C137-M145 CarbonylContact O-C 3.58Å; C137-M145 WeakPolarHBondContact O-CA 3.19Å; C137-M145 WeakPolarHBondContact O-CG 3.45Å; C137-I146 HydrophobicContact CB-CG2 4.04Å; C137-I146 PolarHBondContact N-O 3.48Å; C137-I146 PolarHBondContact O-N 2.92Å; C137-V178 HydrophobicContact CB-CG2 4.19Å; C137-V178 WeakPolarHBondContact CB-O 3.46Å; C137-W180 PolarHBondContact SG-N 3.02Å
138	W	97.2	Very high	96.2	Very high	16 Å²	16	35.3 Å²	35.3	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	159.7	179	-67.4	96.7	0	0	0	112.6	R73 F74 P76 L80 A82 L92 G142 M145 I159	R73-W138 PolarHBondContact O-NE1 3.48Å; F74-W138 PolarHBondContact O-NE1 2.78Å; P76-W138 HydrophobicContact CG-CB 4.14Å; L80-W138 HydrophobicContact CB-CH2 3.91Å; L80-W138 HydrophobicContact CB-CZ2 4.32Å; L80-W138 HydrophobicContact CD1-CH2 4.13Å; A82-W138 HydrophobicContact CB-CH2 4.49Å; A82-W138 HydrophobicContact CB-CZ2 3.51Å; L92-W138 HydrophobicContact CD2-CH2 4.13Å; L92-W138 HydrophobicContact CD2-CZ2 4.33Å; W138-G142 WeakPolarHBondContact CZ3-O 3.48Å; W138-M145 HydrophobicContact CD2-CG 4.37Å; W138-M145 HydrophobicContact CD2-SD 4.18Å; W138-M145 HydrophobicContact CE3-CB 4.37Å; W138-M145 HydrophobicContact CE3-SD 4.44Å; W138-M145 HydrophobicContact CZ2-SD 4.3Å; W138-I159 HydrophobicContact CE3-CG1 4.3Å; W138-I159 HydrophobicContact CH2-CD1 4.41Å; W138-I159 HydrophobicContact CH2-CG2 4.39Å; W138-I159 HydrophobicContact CZ3-CB 4.38Å; W138-I159 HydrophobicContact CZ3-CD1 4.02Å; W138-I159 HydrophobicContact CZ3-CG1 3.74Å; W138-I159 HydrophobicContact CZ3-CG2 4.03Å
139	T	95.4	Very high	96.3	Very high	9 Å²	9	34.7 Å²	34.7	6%	0.055	17%	0.169	C	C	.	.			trans	-78	156	160.3	39.9	0	0	0	0	111.8	P76 D141 G142 F144 W180	P76-T139 WeakPolarHBondContact CD-O 3.33Å; P76-T139 WeakPolarHBondContact CG-O 3.45Å; T139-D141 WeakPolarHBondContact CB-OD1 3.4Å; T139-D141 PolarHBondContact O-N 3.12Å; T139-D141 PolarHBondContact OG1-OD1 2.98Å; T139-G142 PolarHBondContact O-N 2.86Å; T139-F144 HydrophobicContact CG2-CB 3.79Å; T139-F144 HydrophobicContact CG2-CD2 4.32Å; T139-F144 PolarHBondContact N-O 3.22Å; T139-F144 WeakPolarHBondContact OG1-CA 3.4Å; T139-F144 PolarHBondContact OG1-N 2.82Å; T139-F144 PolarHBondContact OG1-O 2.88Å; T139-W180 HydrophobicContact CG2-CD2 3.6Å; T139-W180 HydrophobicContact CG2-CE3 4.27Å; T139-W180 HydrophobicContact CG2-CG 3.79Å; T139-W180 HydrophobicContact CG2-CH2 4.37Å; T139-W180 HydrophobicContact CG2-CZ2 3.74Å; T139-W180 VanDerWaalsContact CG2-NE1 3.34Å
140	R	90.8	Very high	96.3	Very high	137 Å²	137	35 Å²	35	52%	0.517	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.2	-180	-174.3	177.2	176.5	93.4	8.4	113.7
141	D	89.4	Confident	96.3	Very high	81 Å²	81	29.4 Å²	29.4	43%	0.433	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-0.1	177.9	67.6	-24.3	0	0	0	113.6	T139 N143	T139-D141 WeakPolarHBondContact CB-OD1 3.4Å; T139-D141 PolarHBondContact O-N 3.12Å; T139-D141 PolarHBondContact OG1-OD1 2.98Å; D141-N143 PolarHBondContact O-N 2.88Å; D141-N143 VanDerWaalsContact O-N 3.1Å; D141-N143 PolarHBondContact OD1-N 2.68Å; D141-N143 WeakPolarHBondContact OD2-CB 3.36Å; D141-N143 PolarHBondContact OD2-ND2 2.86Å
142	G	92.4	Very high	96.3	Very high	6 Å²	6	27.2 Å²	27.2	6%	0.062	13%	0.133	C	C	.	.	S	Bend	trans	71.6	-7.2	-179.8	0	0	0	0	0	115.7	W138 T139 F144	W138-G142 WeakPolarHBondContact CZ3-O 3.48Å; T139-G142 PolarHBondContact O-N 2.86Å; G142-F144 PolarHBondContact O-N 3.32Å
143	N	93.1	Very high	96.4	Very high	73 Å²	73	26.3 Å²	26.3	39%	0.39	13%	0.129	S	C	.	.	S	Bend	trans	-74.6	-24.2	-173.6	-73.4	-54.3	0	0	0	113.9	D141 I159	D141-N143 PolarHBondContact O-N 2.88Å; D141-N143 VanDerWaalsContact O-N 3.1Å; D141-N143 PolarHBondContact OD1-N 2.68Å; D141-N143 WeakPolarHBondContact OD2-CB 3.36Å; D141-N143 PolarHBondContact OD2-ND2 2.86Å; N143-I159 WeakPolarHBondContact O-CB 3.48Å; N143-I159 PolarHBondContact O-N 3.01Å
144	F	95.6	Very high	96.4	Very high	66 Å²	66	26.3 Å²	26.3	29%	0.289	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	158.9	-176.9	-48.5	-75.5	0	0	0	112.4	T139 G142 W157 D158 L165 W180	T139-F144 HydrophobicContact CG2-CB 3.79Å; T139-F144 HydrophobicContact CG2-CD2 4.32Å; T139-F144 PolarHBondContact N-O 3.22Å; T139-F144 WeakPolarHBondContact OG1-CA 3.4Å; T139-F144 PolarHBondContact OG1-N 2.82Å; T139-F144 PolarHBondContact OG1-O 2.88Å; G142-F144 PolarHBondContact O-N 3.32Å; F144-W157 VanDerWaalsContact CA-O 3.3Å; F144-W157 WeakPolarHBondContact CA-O 3.48Å; F144-D158 HydrophobicContact CD1-CB 4.42Å; F144-D158 HydrophobicContact CE1-CB 4.39Å; F144-L165 HydrophobicContact CD1-CD1 3.44Å; F144-L165 VanDerWaalsContact CD1-CD1 3.44Å; F144-L165 HydrophobicContact CE1-CD1 3.75Å; F144-L165 HydrophobicContact CG-CD1 4.49Å; F144-W180 HydrophobicContact CB-CH2 3.83Å; F144-W180 HydrophobicContact CB-CZ2 4.2Å; F144-W180 HydrophobicContact CB-CZ3 4.33Å
145	M	97.1	Very high	96.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	150.5	-176.5	-171.8	177.4	73.5	0	0	110.2	A82 I90 L92 L126 I136 C137 W138 M156 W157 I159	A82-M145 HydrophobicContact CB-SD 3.85Å; I90-M145 HydrophobicContact CD1-CE 4.15Å; I90-M145 HydrophobicContact CG2-CE 3.87Å; L92-M145 HydrophobicContact CD2-CE 4.48Å; L126-M145 HydrophobicContact CD1-CE 3.55Å; I136-M145 HydrophobicContact CG2-CE 4.42Å; I136-M145 HydrophobicContact CG2-CG 3.7Å; I136-M145 HydrophobicContact CG2-SD 3.43Å; I136-M145 WeakPolarHBondContact CG2-SD 3.39Å; C137-M145 CarbonylContact O-C 3.58Å; C137-M145 WeakPolarHBondContact O-CA 3.19Å; C137-M145 WeakPolarHBondContact O-CG 3.45Å; W138-M145 HydrophobicContact CD2-CG 4.37Å; W138-M145 HydrophobicContact CD2-SD 4.18Å; W138-M145 HydrophobicContact CE3-CB 4.37Å; W138-M145 HydrophobicContact CE3-SD 4.44Å; W138-M145 HydrophobicContact CZ2-SD 4.3Å; M145-M156 CarbonylContact O-C 3.6Å; M145-M156 WeakPolarHBondContact O-CA 3.46Å; M145-W157 HydrophobicContact CB-CB 4.44Å; M145-W157 HydrophobicContact CE-CG 4.37Å; M145-W157 PolarHBondContact N-O 3.41Å; M145-W157 PolarHBondContact O-N 3.14Å; M145-I159 HydrophobicContact CB-CD1 3.83Å; M145-I159 HydrophobicContact CB-CG1 4.14Å; M145-I159 HydrophobicContact CE-CD1 4Å; M145-I159 HydrophobicContact SD-CD1 4.17Å
146	I	98.4	Very high	96.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	143.3	164.4	-175.2	164.3	0	0	0	110.3	I136 C137 A154 I155 L168 V178 W180 V187 T189	I136-I146 WeakPolarHBondContact CA-O 3.38Å; C137-I146 HydrophobicContact CB-CG2 4.04Å; C137-I146 PolarHBondContact N-O 3.48Å; C137-I146 PolarHBondContact O-N 2.92Å; I146-A154 HydrophobicContact CD1-CB 3.9Å; I146-A154 HydrophobicContact CG1-CB 4.24Å; I146-I155 WeakPolarHBondContact CA-O 3.41Å; I146-L168 HydrophobicContact CD1-CD1 4.1Å; I146-V178 HydrophobicContact CD1-CB 4.43Å; I146-V178 HydrophobicContact CD1-CG1 4.39Å; I146-V178 HydrophobicContact CG1-CB 4.23Å; I146-V178 HydrophobicContact CG1-CG1 4.27Å; I146-V178 HydrophobicContact CG2-CB 3.81Å; I146-V178 HydrophobicContact CG2-CG2 3.81Å; I146-W180 HydrophobicContact CB-CE3 3.88Å; I146-W180 HydrophobicContact CB-CZ3 4.09Å; I146-W180 HydrophobicContact CG2-CE3 3.91Å; I146-V187 HydrophobicContact CB-CG1 4.1Å; I146-V187 HydrophobicContact CD1-CB 4.46Å; I146-V187 HydrophobicContact CD1-CG1 3.43Å; I146-V187 VanDerWaalsContact CD1-CG1 3.43Å; I146-V187 HydrophobicContact CG1-CG1 4.33Å; I146-V187 HydrophobicContact CG2-CG1 3.74Å; I146-T189 HydrophobicContact CD1-CG2 3.78Å
147	S	98.4	Very high	96.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	151	167.1	56.2	0	0	0	0	111.2	I90 H129 D135 A154 I155 W157	I90-S147 VanDerWaalsContact CD1-CB 3.4Å; H129-S147 PolarHBondContact CD2-OG 2.86Å; H129-S147 PolarHBondContact NE2-OG 2.93Å; D135-S147 CarbonylContact O-C 3.58Å; D135-S147 WeakPolarHBondContact O-CA 3.45Å; S147-A154 CarbonylContact O-C 3.56Å; S147-A154 WeakPolarHBondContact O-CA 3.43Å; S147-A154 VanDerWaalsContact O-CB 3.29Å; S147-A154 WeakPolarHBondContact O-CB 3.44Å; S147-I155 PolarHBondContact N-O 3Å; S147-I155 PolarHBondContact O-N 2.77Å; S147-W157 PolarHBondContact OG-NE1 3.06Å
148	G	98.1	Very high	96.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.1	171.6	0	0	0	0	0	111.9	Y134 D135 V175	Y134-G148 PolarHBondContact N-O 2.9Å; D135-G148 PolarHBondContact O-N 2.89Å; G148-V175 CarbonylContact C-O 3.55Å
149	S	98.1	Very high	96.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	163.4	-170.4	171.9	0	0	0	0	114	H129 E131 D132 D151 T153 V175	H129-S149 VanDerWaalsContact CE1-CB 3.41Å; H129-S149 WeakPolarHBondContact CE1-CB 3.46Å; H129-S149 WeakPolarHBondContact ND1-CB 3.42Å; E131-S149 PolarHBondContact O-OG 3.02Å; D132-S149 CarbonylContact O-C 3.48Å; D132-S149 WeakPolarHBondContact O-CA 3.37Å; D132-S149 VanDerWaalsContact O-CB 3.25Å; D132-S149 WeakPolarHBondContact O-CB 3.42Å; D132-S149 PolarHBondContact O-OG 2.75Å; S149-D151 WeakPolarHBondContact CB-OD1 3.49Å; S149-D151 PolarHBondContact O-N 2.85Å; S149-D151 VanDerWaalsContact OG-CG 3.31Å; S149-D151 PolarHBondContact OG-N 3.35Å; S149-D151 PolarHBondContact OG-OD1 3.01Å; S149-T153 PolarHBondContact N-O 2.95Å; S149-V175 PolarHBondContact O-N 2.94Å
150	V	97.3	Very high	96	Very high	19 Å²	19	26.9 Å²	26.9	12%	0.115	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.5	163.6	172.3	0	0	0	0	112.4	E131 D132 Y134 N152 Y174	E131-V150 HydrophobicContact CB-CB 3.78Å; E131-V150 HydrophobicContact CB-CG1 3.89Å; E131-V150 HydrophobicContact CG-CG1 4.34Å; D132-V150 HydrophobicContact CB-CB 4.39Å; D132-V150 HydrophobicContact CB-CG2 3.89Å; D132-V150 PolarHBondContact O-N 2.7Å; Y134-V150 HydrophobicContact CD2-CG2 4.01Å; Y134-V150 HydrophobicContact CE1-CG2 4.18Å; Y134-V150 HydrophobicContact CE2-CG2 3.35Å; Y134-V150 VanDerWaalsContact CZ-CG2 3.44Å; V150-N152 PolarHBondContact O-N 2.89Å; V150-Y174 HydrophobicContact CB-CD1 4.24Å; V150-Y174 HydrophobicContact CG1-CD1 3.86Å; V150-Y174 HydrophobicContact CG1-CE1 3.72Å; V150-Y174 HydrophobicContact CG1-CG 4.5Å; V150-Y174 HydrophobicContact CG2-CG 4.46Å; V150-Y174 VanDerWaalsContact O-CD1 3.23Å; V150-Y174 WeakPolarHBondContact O-CD1 3.31Å
151	D	97.5	Very high	96.1	Very high	24 Å²	24	26.2 Å²	26.2	13%	0.128	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	4.7	179.7	73.4	12.9	0	0	0	115.2	H129 L130 E131 S149 T153	H129-D151 WeakPolarHBondContact CA-OD2 3.27Å; H129-D151 WeakPolarHBondContact CB-OD2 3.49Å; H129-D151 IonicContact CE1-OD1 3.56Å; H129-D151 IonicContact CG-OD2 3.2Å; H129-D151 IonicContact ND1-OD1 2.75Å; H129-D151 PolarHBondContact ND1-OD1 2.95Å; H129-D151 IonicContact ND1-OD2 2.86Å; H129-D151 PolarHBondContact ND1-OD2 2.67Å; L130-D151 HydrophobicContact CB-CB 4.1Å; L130-D151 PolarHBondContact N-OD2 2.91Å; E131-D151 HydrophobicContact CB-CB 4.07Å; E131-D151 HydrophobicContact CG-CB 3.97Å; S149-D151 WeakPolarHBondContact CB-OD1 3.49Å; S149-D151 PolarHBondContact O-N 2.85Å; S149-D151 VanDerWaalsContact OG-CG 3.31Å; S149-D151 PolarHBondContact OG-N 3.35Å; S149-D151 PolarHBondContact OG-OD1 3.01Å; D151-T153 PolarHBondContact O-N 2.98Å; D151-T153 WeakPolarHBondContact OD1-CA 3.34Å; D151-T153 VanDerWaalsContact OD1-CB 3.24Å; D151-T153 WeakPolarHBondContact OD1-CB 3.32Å; D151-T153 WeakPolarHBondContact OD1-CG2 3.47Å; D151-T153 PolarHBondContact OD1-N 2.88Å; D151-T153 PolarHBondContact OD1-OG1 3.37Å; D151-T153 PolarHBondContact OD2-OG1 3.34Å
152	N	97.7	Very high	96.2	Very high	55 Å²	55	23.6 Å²	23.6	29%	0.294	13%	0.131	S	C	.	.	S	Bend	trans	64.8	24.1	-176.2	-41.8	-77.3	0	0	0	113.5	V150 H171 S173 Y174	V150-N152 PolarHBondContact O-N 2.89Å; N152-H171 WeakPolarHBondContact O-CB 3.35Å; N152-S173 WeakPolarHBondContact OD1-CA 3.34Å; N152-S173 PolarHBondContact OD1-N 3.2Å; N152-S173 PolarHBondContact OD1-O 2.94Å; N152-Y174 PolarHBondContact OD1-N 2.76Å
153	T	97.8	Very high	96.2	Very high	14 Å²	14	29.1 Å²	29.1	9%	0.086	16%	0.155	C	C	.	.			trans	-122.3	161.7	171.6	81	0	0	0	0	111.9	H129 S149 D151 M167 N169	H129-T153 PolarHBondContact CE1-OG1 2.86Å; H129-T153 PolarHBondContact ND1-OG1 2.76Å; S149-T153 PolarHBondContact N-O 2.95Å; D151-T153 PolarHBondContact O-N 2.98Å; D151-T153 WeakPolarHBondContact OD1-CA 3.34Å; D151-T153 VanDerWaalsContact OD1-CB 3.24Å; D151-T153 WeakPolarHBondContact OD1-CB 3.32Å; D151-T153 WeakPolarHBondContact OD1-CG2 3.47Å; D151-T153 PolarHBondContact OD1-N 2.88Å; D151-T153 PolarHBondContact OD1-OG1 3.37Å; D151-T153 PolarHBondContact OD2-OG1 3.34Å; T153-M167 HydrophobicContact CG2-CG 4.09Å; T153-M167 HydrophobicContact CG2-SD 4.23Å; T153-N169 HydrophobicContact CG2-CB 4.09Å
154	A	98.1	Very high	96.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136.9	159.5	0	0	0	0	0	109	I146 S147 L168 V175 T189	I146-A154 HydrophobicContact CD1-CB 3.9Å; I146-A154 HydrophobicContact CG1-CB 4.24Å; S147-A154 CarbonylContact O-C 3.56Å; S147-A154 WeakPolarHBondContact O-CA 3.43Å; S147-A154 VanDerWaalsContact O-CB 3.29Å; S147-A154 WeakPolarHBondContact O-CB 3.44Å; A154-L168 HydrophobicContact CB-CB 4.34Å; A154-L168 HydrophobicContact CB-CD1 4.43Å; A154-L168 PolarHBondContact N-O 3.29Å; A154-L168 VanDerWaalsContact O-CB 3.3Å; A154-L168 WeakPolarHBondContact O-CB 3.44Å; A154-L168 WeakPolarHBondContact O-CG 3.31Å; A154-L168 PolarHBondContact O-N 3.26Å; A154-V175 HydrophobicContact CB-CG1 4.31Å; A154-T189 HydrophobicContact CB-CG2 3.97Å
155	I	98.2	Very high	96.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.5	-175.2	-61.5	174.4	0	0	0	109.6	G128 I146 S147 W157 K164 C166 M167	G128-I155 VanDerWaalsContact C-CD1 3.49Å; G128-I155 WeakPolarHBondContact O-CD1 3.29Å; I146-I155 WeakPolarHBondContact CA-O 3.41Å; S147-I155 PolarHBondContact N-O 3Å; S147-I155 PolarHBondContact O-N 2.77Å; I155-W157 HydrophobicContact CB-CZ2 4.01Å; I155-W157 HydrophobicContact CD1-CZ2 4.1Å; I155-W157 HydrophobicContact CG2-CD2 3.85Å; I155-W157 VanDerWaalsContact CG2-CE2 3.4Å; I155-W157 HydrophobicContact CG2-CE3 4.38Å; I155-W157 HydrophobicContact CG2-CG 4.34Å; I155-W157 HydrophobicContact CG2-CH2 4.18Å; I155-W157 HydrophobicContact CG2-CZ2 3.6Å; I155-W157 VanDerWaalsContact O-CD1 3.25Å; I155-W157 PolarHBondContact O-NE1 2.92Å; I155-K164 HydrophobicContact CG2-CB 4.25Å; I155-K164 HydrophobicContact CG2-CG 4.38Å; I155-C166 WeakPolarHBondContact CA-O 3.5Å; I155-M167 HydrophobicContact CG1-CB 4.49Å; I155-M167 HydrophobicContact CG1-CG 4.19Å
156	M	97.8	Very high	96.1	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.025	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.5	168.6	-61.8	171.3	73.6	0	0	108.7	M145 L165 C166 L168 W180 V187 T201	M145-M156 CarbonylContact O-C 3.6Å; M145-M156 WeakPolarHBondContact O-CA 3.46Å; M156-L165 HydrophobicContact CB-CB 4.21Å; M156-L165 WeakPolarHBondContact O-CB 3.33Å; M156-L165 PolarHBondContact O-N 3.43Å; M156-C166 HydrophobicContact CB-CB 4.16Å; M156-C166 HydrophobicContact CG-CB 4.32Å; M156-C166 PolarHBondContact N-O 2.87Å; M156-C166 PolarHBondContact O-N 2.84Å; M156-C166 HydrophobicContact SD-CB 3.88Å; M156-L168 HydrophobicContact CG-CD1 4.36Å; M156-L168 HydrophobicContact SD-CD1 4.41Å; M156-W180 HydrophobicContact CB-CH2 4.47Å; M156-W180 HydrophobicContact CB-CZ3 4.41Å; M156-W180 HydrophobicContact CE-CH2 3.37Å; M156-W180 HydrophobicContact CE-CZ2 3.84Å; M156-W180 HydrophobicContact CE-CZ3 4.06Å; M156-W180 HydrophobicContact CG-CH2 4.4Å; M156-W180 HydrophobicContact CG-CZ3 4.24Å; M156-V187 HydrophobicContact CE-CG2 4.2Å; M156-T201 HydrophobicContact CE-CG2 4.45Å
157	W	97.6	Very high	96.1	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.011	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.9	-174.8	-59.2	94.3	0	0	0	112	I90 L126 F144 M145 S147 I155 I159 Q163 K164	I90-W157 HydrophobicContact CD1-CZ2 4.48Å; L126-W157 HydrophobicContact CB-CD2 4.28Å; L126-W157 HydrophobicContact CB-CE3 3.92Å; L126-W157 HydrophobicContact CB-CH2 3.92Å; L126-W157 HydrophobicContact CB-CZ2 4.29Å; L126-W157 HydrophobicContact CB-CZ3 3.73Å; L126-W157 HydrophobicContact CD1-CB 4.26Å; L126-W157 HydrophobicContact CD1-CD2 3.89Å; L126-W157 HydrophobicContact CD1-CE3 4.05Å; L126-W157 HydrophobicContact CD1-CG 3.99Å; L126-W157 HydrophobicContact CD2-CE3 4.25Å; L126-W157 HydrophobicContact CG-CE3 4.31Å; F144-W157 VanDerWaalsContact CA-O 3.3Å; F144-W157 WeakPolarHBondContact CA-O 3.48Å; M145-W157 HydrophobicContact CB-CB 4.44Å; M145-W157 HydrophobicContact CE-CG 4.37Å; M145-W157 PolarHBondContact N-O 3.41Å; M145-W157 PolarHBondContact O-N 3.14Å; S147-W157 PolarHBondContact OG-NE1 3.06Å; I155-W157 HydrophobicContact CB-CZ2 4.01Å; I155-W157 HydrophobicContact CD1-CZ2 4.1Å; I155-W157 HydrophobicContact CG2-CD2 3.85Å; I155-W157 VanDerWaalsContact CG2-CE2 3.4Å; I155-W157 HydrophobicContact CG2-CE3 4.38Å; I155-W157 HydrophobicContact CG2-CG 4.34Å; I155-W157 HydrophobicContact CG2-CH2 4.18Å; I155-W157 HydrophobicContact CG2-CZ2 3.6Å; I155-W157 VanDerWaalsContact O-CD1 3.25Å; I155-W157 PolarHBondContact O-NE1 2.92Å; W157-I159 HydrophobicContact CB-CD1 4.35Å; W157-Q163 WeakPolarHBondContact CA-O 3.1Å; W157-K164 HydrophobicContact CE3-CG 4.24Å; W157-K164 HydrophobicContact CH2-CG 4.03Å; W157-K164 HydrophobicContact CZ3-CB 4.5Å; W157-K164 HydrophobicContact CZ3-CG 3.63Å
158	D	95.8	Very high	96	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.032	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	109.8	162.9	-174.2	-42.5	0	0	0	108	F144 S160 K161 G162 Q163 L165	F144-D158 HydrophobicContact CD1-CB 4.42Å; F144-D158 HydrophobicContact CE1-CB 4.39Å; D158-S160 WeakPolarHBondContact OD1-CA 3.35Å; D158-S160 WeakPolarHBondContact OD1-CB 3.46Å; D158-S160 PolarHBondContact OD1-N 3.03Å; D158-S160 VanDerWaalsContact OD1-N 3.09Å; D158-S160 PolarHBondContact OD1-OG 3.24Å; D158-K161 HydrophobicContact CB-CB 4.29Å; D158-K161 PolarHBondContact OD1-N 3.23Å; D158-K161 IonicContact OD1-NZ 3.33Å; D158-K161 WeakPolarHBondContact OD2-CD 3.17Å; D158-K161 IonicContact OD2-NZ 3.48Å; D158-K161 PolarHBondContact OD2-NZ 3.3Å; D158-G162 VanDerWaalsContact O-CA 3.3Å; D158-G162 WeakPolarHBondContact O-CA 3.41Å; D158-G162 PolarHBondContact O-N 3.42Å; D158-Q163 PolarHBondContact N-O 3.33Å; D158-Q163 PolarHBondContact O-N 2.89Å; D158-Q163 VanDerWaalsContact O-N 3.1Å; D158-L165 HydrophobicContact CB-CD1 3.95Å; D158-L165 HydrophobicContact CB-CD2 3.95Å; D158-L165 HydrophobicContact CB-CG 3.75Å
159	I	95.4	Very high	95.9	Very high	7 Å²	7	42 Å²	42	4%	0.036	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-33.6	-176	-57.8	-66.9	0	0	0	110.7	L80 L92 K124 L126 W138 N143 M145 W157 K161 G162	L80-I159 HydrophobicContact CD1-CG2 3.91Å; L92-I159 HydrophobicContact CD1-CD1 3.83Å; L92-I159 HydrophobicContact CD1-CG2 3.74Å; L92-I159 HydrophobicContact CD2-CD1 4.45Å; K124-I159 PolarHBondContact NZ-O 3.48Å; L126-I159 HydrophobicContact CD1-CD1 3.98Å; W138-I159 HydrophobicContact CE3-CG1 4.3Å; W138-I159 HydrophobicContact CH2-CD1 4.41Å; W138-I159 HydrophobicContact CH2-CG2 4.39Å; W138-I159 HydrophobicContact CZ3-CB 4.38Å; W138-I159 HydrophobicContact CZ3-CD1 4.02Å; W138-I159 HydrophobicContact CZ3-CG1 3.74Å; W138-I159 HydrophobicContact CZ3-CG2 4.03Å; N143-I159 WeakPolarHBondContact O-CB 3.48Å; N143-I159 PolarHBondContact O-N 3.01Å; M145-I159 HydrophobicContact CB-CD1 3.83Å; M145-I159 HydrophobicContact CB-CG1 4.14Å; M145-I159 HydrophobicContact CE-CD1 4Å; M145-I159 HydrophobicContact SD-CD1 4.17Å; W157-I159 HydrophobicContact CB-CD1 4.35Å; I159-K161 VanDerWaalsContact C-N 3.3Å; I159-K161 PolarHBondContact O-N 3.09Å; I159-G162 PolarHBondContact O-N 2.62Å
160	S	91.7	Very high	95.8	Very high	69 Å²	69	45 Å²	45	48%	0.483	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-41.8	174.8	78.4	0	0	0	0	111.3	K124 D158	K124-S160 PolarHBondContact NZ-O 3.07Å; D158-S160 WeakPolarHBondContact OD1-CA 3.35Å; D158-S160 WeakPolarHBondContact OD1-CB 3.46Å; D158-S160 PolarHBondContact OD1-N 3.03Å; D158-S160 VanDerWaalsContact OD1-N 3.09Å; D158-S160 PolarHBondContact OD1-OG 3.24Å
161	K	91.6	Very high	95.7	Very high	123 Å²	123	44.7 Å²	44.7	54%	0.535	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-18.8	-178.9	-61.3	177.5	-166	64.6	0	114.3	D158 I159 Q163	D158-K161 HydrophobicContact CB-CB 4.29Å; D158-K161 PolarHBondContact OD1-N 3.23Å; D158-K161 IonicContact OD1-NZ 3.33Å; D158-K161 WeakPolarHBondContact OD2-CD 3.17Å; D158-K161 IonicContact OD2-NZ 3.48Å; D158-K161 PolarHBondContact OD2-NZ 3.3Å; I159-K161 VanDerWaalsContact C-N 3.3Å; I159-K161 PolarHBondContact O-N 3.09Å; K161-Q163 HydrophobicContact CB-CB 4.17Å; K161-Q163 HydrophobicContact CB-CG 4.05Å
162	G	91.8	Very high	95.7	Very high	26 Å²	26	52.2 Å²	52.2	27%	0.268	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	31.4	-171.2	0	0	0	0	0	113.5	D158 I159	D158-G162 VanDerWaalsContact O-CA 3.3Å; D158-G162 WeakPolarHBondContact O-CA 3.41Å; D158-G162 PolarHBondContact O-N 3.42Å; I159-G162 PolarHBondContact O-N 2.62Å
163	Q	93.4	Very high	95.7	Very high	121 Å²	121	51 Å²	51	57%	0.565	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	152.7	-168	-71.4	-177.5	-0.8	0	0	113.7	W157 D158 K161 L165	W157-Q163 WeakPolarHBondContact CA-O 3.1Å; D158-Q163 PolarHBondContact N-O 3.33Å; D158-Q163 PolarHBondContact O-N 2.89Å; D158-Q163 VanDerWaalsContact O-N 3.1Å; K161-Q163 HydrophobicContact CB-CB 4.17Å; K161-Q163 HydrophobicContact CB-CG 4.05Å; Q163-L165 PolarHBondContact O-N 2.84Å
164	K	95.2	Very high	95.6	Very high	114 Å²	114	54.6 Å²	54.6	50%	0.496	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	118.2	173.4	-45	-173.6	-165.4	-167.2	0	109.7	R127 G128 I155 W157	R127-K164 WeakPolarHBondContact O-CE 3.46Å; G128-K164 PolarHBondContact O-NZ 3.29Å; G128-K164 VanDerWaalsContact O-NZ 3.09Å; I155-K164 HydrophobicContact CG2-CB 4.25Å; I155-K164 HydrophobicContact CG2-CG 4.38Å; W157-K164 HydrophobicContact CE3-CG 4.24Å; W157-K164 HydrophobicContact CH2-CG 4.03Å; W157-K164 HydrophobicContact CZ3-CB 4.5Å; W157-K164 HydrophobicContact CZ3-CG 3.63Å
165	L	94.1	Very high	95.6	Very high	54 Å²	54	54.6 Å²	54.6	28%	0.283	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-34.2	173.6	-75.2	176.2	0	0	0	113.4	F144 M156 D158 Q163 K204	F144-L165 HydrophobicContact CD1-CD1 3.44Å; F144-L165 VanDerWaalsContact CD1-CD1 3.44Å; F144-L165 HydrophobicContact CE1-CD1 3.75Å; F144-L165 HydrophobicContact CG-CD1 4.49Å; M156-L165 HydrophobicContact CB-CB 4.21Å; M156-L165 WeakPolarHBondContact O-CB 3.33Å; M156-L165 PolarHBondContact O-N 3.43Å; D158-L165 HydrophobicContact CB-CD1 3.95Å; D158-L165 HydrophobicContact CB-CD2 3.95Å; D158-L165 HydrophobicContact CB-CG 3.75Å; Q163-L165 PolarHBondContact O-N 2.84Å; L165-K204 PolarHBondContact O-NZ 3.08Å
166	C	95.1	Very high	95.6	Very high	27 Å²	27	54.7 Å²	54.7	18%	0.182	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	149.2	179.5	-159.6	0	0	0	0	110	I155 M156 L168 K204	I155-C166 WeakPolarHBondContact CA-O 3.5Å; M156-C166 HydrophobicContact CB-CB 4.16Å; M156-C166 HydrophobicContact CG-CB 4.32Å; M156-C166 PolarHBondContact N-O 2.87Å; M156-C166 PolarHBondContact O-N 2.84Å; M156-C166 HydrophobicContact SD-CB 3.88Å; C166-L168 HydrophobicContact CB-CD2 4.5Å; C166-K204 HydrophobicContact CB-CD 4Å; C166-K204 HydrophobicContact CB-CG 4.36Å
167	M	96.6	Very high	95.5	Very high	96 Å²	96	54.5 Å²	54.5	47%	0.473	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.8	169.7	-176.5	177.2	74.4	0	0	108.2	T153 I155 N169	T153-M167 HydrophobicContact CG2-CG 4.09Å; T153-M167 HydrophobicContact CG2-SD 4.23Å; I155-M167 HydrophobicContact CG1-CB 4.49Å; I155-M167 HydrophobicContact CG1-CG 4.19Å; M167-N169 HydrophobicContact CE-CB 4.5Å
168	L	96.9	Very high	95.6	Very high	7 Å²	7	54.5 Å²	54.5	4%	0.037	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	81.5	-173.1	-53.3	177	0	0	0	108.8	I146 A154 M156 C166 D170 Y199	I146-L168 HydrophobicContact CD1-CD1 4.1Å; A154-L168 HydrophobicContact CB-CB 4.34Å; A154-L168 HydrophobicContact CB-CD1 4.43Å; A154-L168 PolarHBondContact N-O 3.29Å; A154-L168 VanDerWaalsContact O-CB 3.3Å; A154-L168 WeakPolarHBondContact O-CB 3.44Å; A154-L168 WeakPolarHBondContact O-CG 3.31Å; A154-L168 PolarHBondContact O-N 3.26Å; M156-L168 HydrophobicContact CG-CD1 4.36Å; M156-L168 HydrophobicContact SD-CD1 4.41Å; C166-L168 HydrophobicContact CB-CD2 4.5Å; L168-D170 VanDerWaalsContact C-N 3.28Å; L168-D170 PolarHBondContact O-N 3.26Å; L168-Y199 HydrophobicContact CB-CE1 4.18Å; L168-Y199 HydrophobicContact CD1-CD1 4.18Å; L168-Y199 HydrophobicContact CD1-CD2 3.83Å; L168-Y199 HydrophobicContact CD1-CE1 4.31Å; L168-Y199 HydrophobicContact CD1-CE2 3.97Å; L168-Y199 HydrophobicContact CD1-CG 3.94Å; L168-Y199 HydrophobicContact CD2-CD1 3.79Å; L168-Y199 HydrophobicContact CD2-CE1 3.91Å; L168-Y199 HydrophobicContact CD2-CG 4.31Å; L168-Y199 HydrophobicContact CG-CD1 4.46Å; L168-Y199 HydrophobicContact CG-CE1 4.36Å
169	N	95.9	Very high	95.7	Very high	113 Å²	113	54.5 Å²	54.5	60%	0.604	28%	0.275	S	S	*	.			trans	-93	35.3	-174.9	63.5	-15.6	0	0	0	113.5	T153 M167	T153-N169 HydrophobicContact CG2-CB 4.09Å; M167-N169 HydrophobicContact CE-CB 4.5Å
170	D	95.3	Very high	95.8	Very high	61 Å²	61	55.1 Å²	55.1	33%	0.326	28%	0.277	S	S	.	.			trans	-88.1	-6.3	-177.4	-117.2	-38.7	0	0	0	112.8	L168 R197 Y199 K206	L168-D170 VanDerWaalsContact C-N 3.28Å; L168-D170 PolarHBondContact O-N 3.26Å; D170-R197 VanDerWaalsContact O-CZ 3.22Å; D170-R197 PolarHBondContact O-NE 2.88Å; D170-R197 PolarHBondContact O-NH2 3.3Å; D170-Y199 HydrophobicContact CB-CE1 4.46Å; D170-Y199 WeakPolarHBondContact CB-OH 3.41Å; D170-K206 IonicContact OD1-NZ 3.75Å; D170-K206 PolarHBondContact OD1-NZ 2.88Å; D170-K206 WeakPolarHBondContact OD2-CD 3.4Å; D170-K206 IonicContact OD2-NZ 2.65Å; D170-K206 PolarHBondContact OD2-NZ 3.22Å
171	H	97.2	Very high	96	Very high	13 Å²	13	52 Å²	52	6%	0.06	25%	0.254	C	S	.	.			trans	-89.2	152.1	-174.4	-66.7	-96.4	0	0	0	112	N152 V175 T189 S191 R197	N152-H171 WeakPolarHBondContact O-CB 3.35Å; H171-V175 HydrophobicContact CB-CG2 4.07Å; H171-T189 PolarHBondContact CE1-OG1 2.87Å; H171-T189 PolarHBondContact NE2-OG1 3.06Å; H171-S191 VanDerWaalsContact ND1-CB 3.35Å; H171-S191 WeakPolarHBondContact ND1-CB 3.43Å; H171-R197 PolarHBondContact ND1-NH1 2.92Å
172	K	96.8	Very high	96.1	Very high	183 Å²	183	47.1 Å²	47.1	80%	0.796	24%	0.236	S	C	*	.	S	Bend	trans	-112.4	-1.1	179.4	-62.1	-172.5	175.5	-171.3	0	113.8	D193	K172-D193 HydrophobicContact CB-CB 4.04Å; K172-D193 PolarHBondContact N-OD2 3.48Å
173	S	96.7	Very high	96.2	Very high	30 Å²	30	47.1 Å²	47.1	21%	0.21	23%	0.229	C	C	.	.	S	Bend	trans	-159.8	176.8	178.5	-152.9	0	0	0	0	108.3	N152 S191 C192	N152-S173 WeakPolarHBondContact OD1-CA 3.34Å; N152-S173 PolarHBondContact OD1-N 3.2Å; N152-S173 PolarHBondContact OD1-O 2.94Å; S173-S191 PolarHBondContact O-OG 3.23Å; S173-C192 PolarHBondContact OG-SG 2.92Å
174	Y	96.7	Very high	96.1	Very high	88 Å²	88	42.1 Å²	42.1	35%	0.345	21%	0.21	S	C	.	.			trans	-55.4	145.1	-167.2	-44.5	-33.5	0	0	0	113.3	V150 N152 S191 C192	V150-Y174 HydrophobicContact CB-CD1 4.24Å; V150-Y174 HydrophobicContact CG1-CD1 3.86Å; V150-Y174 HydrophobicContact CG1-CE1 3.72Å; V150-Y174 HydrophobicContact CG1-CG 4.5Å; V150-Y174 HydrophobicContact CG2-CG 4.46Å; V150-Y174 VanDerWaalsContact O-CD1 3.23Å; V150-Y174 WeakPolarHBondContact O-CD1 3.31Å; N152-Y174 PolarHBondContact OD1-N 2.76Å; Y174-S191 WeakPolarHBondContact O-CA 3.21Å; Y174-S191 WeakPolarHBondContact O-CB 3.29Å; Y174-S191 PolarHBondContact O-OG 2.81Å; Y174-C192 PolarHBondContact N-SG 2.81Å; Y174-C192 VanDerWaalsContact N-SG 3.41Å; Y174-C192 PolarHBondContact O-N 3.2Å
175	V	97.9	Very high	96	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	99	176.4	-172.2	0	0	0	0	109.2	G148 S149 A154 H171 V178	G148-V175 CarbonylContact C-O 3.55Å; S149-V175 PolarHBondContact O-N 2.94Å; A154-V175 HydrophobicContact CB-CG1 4.31Å; H171-V175 HydrophobicContact CB-CG2 4.07Å; V175-V178 HydrophobicContact CG1-CG1 3.91Å
176	Q	97	Very high	96.2	Very high	3 Å²	3	39 Å²	39	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	2.2	-168.2	-60.9	-171.6	-71	0	0	114	Y134 L190 S236 F237 R239	Y134-Q176 HydrophobicContact CD2-CG 4Å; Y134-Q176 HydrophobicContact CE2-CG 4.3Å; Q176-L190 PolarHBondContact N-O 2.87Å; Q176-S236 PolarHBondContact NE2-O 3.41Å; Q176-F237 WeakPolarHBondContact CB-O 3.48Å; Q176-F237 VanDerWaalsContact NE2-C 3.29Å; Q176-F237 PolarHBondContact NE2-O 3.2Å; Q176-R239 HydrophobicContact CB-CB 4.14Å; Q176-R239 HydrophobicContact CB-CG 3.91Å; Q176-R239 PolarHBondContact O-N 3.43Å
177	G	97.2	Very high	96.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	138.1	176.1	0	0	0	0	0	111.9	D135 T189 L190 L241	D135-G177 WeakPolarHBondContact OD2-CA 3.46Å; G177-T189 WeakPolarHBondContact O-CA 3.47Å; G177-L190 PolarHBondContact N-O 2.76Å; G177-L190 PolarHBondContact O-N 2.86Å; G177-L241 WeakPolarHBondContact O-CD2 3.44Å
178	V	98.4	Very high	96.4	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.4	179.3	-58.9	0	0	0	0	110.8	D135 C137 I146 V175 T189	D135-V178 HydrophobicContact CB-CG2 4.2Å; D135-V178 WeakPolarHBondContact O-CG2 3.24Å; D135-V178 PolarHBondContact OD2-N 3.09Å; C137-V178 HydrophobicContact CB-CG2 4.19Å; C137-V178 WeakPolarHBondContact CB-O 3.46Å; I146-V178 HydrophobicContact CD1-CB 4.43Å; I146-V178 HydrophobicContact CD1-CG1 4.39Å; I146-V178 HydrophobicContact CG1-CB 4.23Å; I146-V178 HydrophobicContact CG1-CG1 4.27Å; I146-V178 HydrophobicContact CG2-CB 3.81Å; I146-V178 HydrophobicContact CG2-CG2 3.81Å; V175-V178 HydrophobicContact CG1-CG1 3.91Å; V178-T189 HydrophobicContact CG1-CG2 4.01Å
179	T	98.3	Very high	96.5	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.043	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	136.5	175.3	-167.1	0	0	0	0	111.8	V187 A188 L241 F243 L250	T179-V187 VanDerWaalsContact O-CG1 3.28Å; T179-V187 WeakPolarHBondContact O-CG1 3.46Å; T179-A188 HydrophobicContact CG2-CB 3.9Å; T179-A188 PolarHBondContact N-O 3.01Å; T179-A188 PolarHBondContact O-N 2.71Å; T179-L241 WeakPolarHBondContact CB-O 3.39Å; T179-L241 HydrophobicContact CG2-CD1 4.01Å; T179-L241 HydrophobicContact CG2-CD2 4.28Å; T179-L241 HydrophobicContact CG2-CG 3.62Å; T179-F243 HydrophobicContact CG2-CD2 3.66Å; T179-F243 HydrophobicContact CG2-CE2 3.9Å; T179-F243 PolarHBondContact OG1-N 2.95Å; T179-L250 HydrophobicContact CG2-CD1 3.6Å
180	W	97.3	Very high	96.5	Very high	19 Å²	19	27.4 Å²	27.4	7%	0.072	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	141.9	175.9	-152.4	-64.5	0	0	0	110.4	C137 T139 F144 I146 M156 V187 T201 F243	C137-W180 PolarHBondContact SG-N 3.02Å; T139-W180 HydrophobicContact CG2-CD2 3.6Å; T139-W180 HydrophobicContact CG2-CE3 4.27Å; T139-W180 HydrophobicContact CG2-CG 3.79Å; T139-W180 HydrophobicContact CG2-CH2 4.37Å; T139-W180 HydrophobicContact CG2-CZ2 3.74Å; T139-W180 VanDerWaalsContact CG2-NE1 3.34Å; F144-W180 HydrophobicContact CB-CH2 3.83Å; F144-W180 HydrophobicContact CB-CZ2 4.2Å; F144-W180 HydrophobicContact CB-CZ3 4.33Å; I146-W180 HydrophobicContact CB-CE3 3.88Å; I146-W180 HydrophobicContact CB-CZ3 4.09Å; I146-W180 HydrophobicContact CG2-CE3 3.91Å; M156-W180 HydrophobicContact CB-CH2 4.47Å; M156-W180 HydrophobicContact CB-CZ3 4.41Å; M156-W180 HydrophobicContact CE-CH2 3.37Å; M156-W180 HydrophobicContact CE-CZ2 3.84Å; M156-W180 HydrophobicContact CE-CZ3 4.06Å; M156-W180 HydrophobicContact CG-CH2 4.4Å; M156-W180 HydrophobicContact CG-CZ3 4.24Å; W180-V187 HydrophobicContact CD2-CG1 4.36Å; W180-V187 HydrophobicContact CD2-CG2 3.66Å; W180-V187 HydrophobicContact CE3-CG1 4.19Å; W180-V187 HydrophobicContact CE3-CG2 3.91Å; W180-V187 HydrophobicContact CG-CG2 4.15Å; W180-V187 HydrophobicContact CH2-CG2 4.36Å; W180-V187 HydrophobicContact CZ2-CG2 4.11Å; W180-V187 HydrophobicContact CZ3-CG2 4.24Å; W180-T201 HydrophobicContact CZ2-CG2 3.77Å; W180-F243 WeakPolarHBondContact O-CD2 3.14Å
181	D	96.2	Very high	96.6	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	12%	0.116	C	C	.	.			trans	-68.2	125	175.1	175.8	10.4	0	0	0	112.6	Q183 G184 Q185 Y186 F243 R272	D181-Q183 PolarHBondContact O-N 3.04Å; D181-Q183 WeakPolarHBondContact OD1-CA 3.11Å; D181-Q183 WeakPolarHBondContact OD1-CB 3.28Å; D181-Q183 PolarHBondContact OD1-N 3.32Å; D181-G184 WeakPolarHBondContact O-CA 3.36Å; D181-G184 PolarHBondContact O-N 2.82Å; D181-Q185 WeakPolarHBondContact OD2-CA 3.18Å; D181-Q185 WeakPolarHBondContact OD2-CB 3.37Å; D181-Q185 PolarHBondContact OD2-N 2.8Å; D181-Y186 WeakPolarHBondContact CB-O 3.31Å; D181-Y186 PolarHBondContact N-O 2.83Å; D181-Y186 PolarHBondContact OD2-N 2.79Å; D181-Y186 VanDerWaalsContact OD2-N 3.16Å; D181-F243 HydrophobicContact CB-CD2 4.32Å; D181-F243 HydrophobicContact CB-CE2 4.01Å; D181-F243 HydrophobicContact CB-CZ 4.18Å; D181-R272 IonicContact OD1-CZ 2.89Å; D181-R272 IonicContact OD1-NH1 3.44Å; D181-R272 PolarHBondContact OD1-NH1 2.99Å; D181-R272 IonicContact OD1-NH2 3.33Å; D181-R272 PolarHBondContact OD1-NH2 3.23Å; D181-R272 IonicContact OD2-CZ 3.42Å; D181-R272 IonicContact OD2-NH1 2.75Å; D181-R272 PolarHBondContact OD2-NH1 2.85Å; D181-R272 IonicContact OD2-NH2 2.66Å; D181-R272 PolarHBondContact OD2-NH2 2.71Å
182	P	94.4	Very high	96.5	Very high	22 Å²	22	24.1 Å²	24.1	14%	0.143	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.2	175	28.5	-36.3	0	0	0	114.1	T244 L397	P182-T244 WeakPolarHBondContact CG-O 3.43Å; P182-L397 HydrophobicContact CB-CD1 4.49Å
183	Q	93.2	Very high	96.5	Very high	25 Å²	25	17 Å²	17	12%	0.117	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.9	169.4	-57.6	-179.1	5.2	0	0	112.8	D181 Q185 D246 R272 F400	D181-Q183 PolarHBondContact O-N 3.04Å; D181-Q183 WeakPolarHBondContact OD1-CA 3.11Å; D181-Q183 WeakPolarHBondContact OD1-CB 3.28Å; D181-Q183 PolarHBondContact OD1-N 3.32Å; Q183-Q185 VanDerWaalsContact C-N 3.31Å; Q183-Q185 PolarHBondContact O-N 3.2Å; Q183-D246 PolarHBondContact NE2-O 3.21Å; Q183-R272 VanDerWaalsContact CD-CZ 3.47Å; Q183-R272 VanDerWaalsContact OE1-NE 3.08Å; Q183-R272 VanDerWaalsContact OE1-NH1 3.08Å; Q183-F400 VanDerWaalsContact O-CB 3.31Å; Q183-F400 WeakPolarHBondContact O-CB 3.48Å; Q183-F400 PolarHBondContact O-N 3.15Å
184	G	91.9	Very high	96.5	Very high	17 Å²	17	17.8 Å²	17.8	18%	0.175	8%	0.084	C	C	.	.	S	Bend	trans	73.5	6	173.6	0	0	0	0	0	116.7	D181 T201	D181-G184 WeakPolarHBondContact O-CA 3.36Å; D181-G184 PolarHBondContact O-N 2.82Å; G184-T201 WeakPolarHBondContact O-CB 3.42Å; G184-T201 VanDerWaalsContact O-CG2 3.29Å; G184-T201 WeakPolarHBondContact O-CG2 3.43Å; G184-T201 PolarHBondContact O-OG1 2.75Å
185	Q	93.8	Very high	96.5	Very high	50 Å²	50	14.5 Å²	14.5	23%	0.234	7%	0.073	C	C	.	.	S	Bend	trans	-84.9	-33.5	-177	-60.7	172.4	-7.3	0	0	113.1	D181 Q183 T201 F400	D181-Q185 WeakPolarHBondContact OD2-CA 3.18Å; D181-Q185 WeakPolarHBondContact OD2-CB 3.37Å; D181-Q185 PolarHBondContact OD2-N 2.8Å; Q183-Q185 VanDerWaalsContact C-N 3.31Å; Q183-Q185 PolarHBondContact O-N 3.2Å; Q185-T201 PolarHBondContact O-N 3.13Å; Q185-T201 PolarHBondContact O-OG1 2.65Å; Q185-T201 VanDerWaalsContact O-OG1 3.1Å; Q185-F400 HydrophobicContact CG-CB 3.46Å; Q185-F400 VanDerWaalsContact CG-CB 3.46Å; Q185-F400 HydrophobicContact CG-CD2 4.24Å; Q185-F400 HydrophobicContact CG-CG 3.87Å
186	Y	96.8	Very high	96.5	Very high	52 Å²	52	14.5 Å²	14.5	20%	0.204	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	158.6	-170.4	-61.4	-70.4	0	0	0	114.3	D181 V198 Y199 A207 F208 L275	D181-Y186 WeakPolarHBondContact CB-O 3.31Å; D181-Y186 PolarHBondContact N-O 2.83Å; D181-Y186 PolarHBondContact OD2-N 2.79Å; D181-Y186 VanDerWaalsContact OD2-N 3.16Å; Y186-V198 HydrophobicContact CD1-CG1 3.85Å; Y186-V198 HydrophobicContact CG-CG1 4.13Å; Y186-Y199 CarbonylContact C-O 3.57Å; Y186-Y199 VanDerWaalsContact CA-O 3.26Å; Y186-Y199 WeakPolarHBondContact CA-O 3.4Å; Y186-A207 HydrophobicContact CE1-CB 4.4Å; Y186-F208 HydrophobicContact CE1-CE2 4.22Å; Y186-L275 HydrophobicContact CD2-CD1 4.16Å; Y186-L275 HydrophobicContact CE2-CD1 4.4Å; Y186-L275 HydrophobicContact CG-CD1 4.33Å
187	V	97.7	Very high	96.5	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.6	163.5	-162.8	0	0	0	0	107.9	I146 M156 T179 W180 V198 Y199 T201	I146-V187 HydrophobicContact CB-CG1 4.1Å; I146-V187 HydrophobicContact CD1-CB 4.46Å; I146-V187 HydrophobicContact CD1-CG1 3.43Å; I146-V187 VanDerWaalsContact CD1-CG1 3.43Å; I146-V187 HydrophobicContact CG1-CG1 4.33Å; I146-V187 HydrophobicContact CG2-CG1 3.74Å; M156-V187 HydrophobicContact CE-CG2 4.2Å; T179-V187 VanDerWaalsContact O-CG1 3.28Å; T179-V187 WeakPolarHBondContact O-CG1 3.46Å; W180-V187 HydrophobicContact CD2-CG1 4.36Å; W180-V187 HydrophobicContact CD2-CG2 3.66Å; W180-V187 HydrophobicContact CE3-CG1 4.19Å; W180-V187 HydrophobicContact CE3-CG2 3.91Å; W180-V187 HydrophobicContact CG-CG2 4.15Å; W180-V187 HydrophobicContact CH2-CG2 4.36Å; W180-V187 HydrophobicContact CZ2-CG2 4.11Å; W180-V187 HydrophobicContact CZ3-CG2 4.24Å; V187-V198 CarbonylContact O-C 3.51Å; V187-V198 WeakPolarHBondContact O-CA 3.28Å; V187-Y199 PolarHBondContact N-O 3.42Å; V187-Y199 PolarHBondContact O-N 2.95Å; V187-T201 HydrophobicContact CG2-CG2 3.6Å
188	A	98.3	Very high	96.6	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141	179.4	0	0	0	0	0	111.2	T179 R197 V198 L241 F243 L250	T179-A188 HydrophobicContact CG2-CB 3.9Å; T179-A188 PolarHBondContact N-O 3.01Å; T179-A188 PolarHBondContact O-N 2.71Å; A188-R197 VanDerWaalsContact CA-O 3.31Å; A188-R197 WeakPolarHBondContact CA-O 3.23Å; A188-V198 HydrophobicContact CB-CG2 4.14Å; A188-L241 HydrophobicContact CB-CD1 4Å; A188-F243 HydrophobicContact CB-CE2 4.33Å; A188-L250 HydrophobicContact CB-CD1 4.2Å; A188-L250 HydrophobicContact CB-CD2 3.68Å
189	T	98.4	Very high	96.5	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.6	-178.7	62.7	0	0	0	0	110.2	I146 A154 H171 G177 V178 M196 R197 Y199	I146-T189 HydrophobicContact CD1-CG2 3.78Å; A154-T189 HydrophobicContact CB-CG2 3.97Å; H171-T189 PolarHBondContact CE1-OG1 2.87Å; H171-T189 PolarHBondContact NE2-OG1 3.06Å; G177-T189 WeakPolarHBondContact O-CA 3.47Å; V178-T189 HydrophobicContact CG1-CG2 4.01Å; T189-M196 CarbonylContact O-C 3.6Å; T189-M196 WeakPolarHBondContact O-CA 3.34Å; T189-R197 PolarHBondContact N-O 2.87Å; T189-R197 PolarHBondContact O-N 2.85Å; T189-Y199 HydrophobicContact CG2-CE2 4.35Å
190	L	97.9	Very high	96.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.6	-178.6	-176.4	52.3	0	0	0	110.2	Q176 G177 M196 F229 R239 L241	Q176-L190 PolarHBondContact N-O 2.87Å; G177-L190 PolarHBondContact N-O 2.76Å; G177-L190 PolarHBondContact O-N 2.86Å; L190-M196 HydrophobicContact CD1-CB 4.09Å; L190-F229 HydrophobicContact CD1-CD1 3.9Å; L190-F229 HydrophobicContact CD1-CD2 4.4Å; L190-F229 HydrophobicContact CD1-CE1 4.1Å; L190-F229 HydrophobicContact CD1-CG 4.06Å; L190-F229 HydrophobicContact CD1-CZ 4.45Å; L190-F229 HydrophobicContact CD2-CE1 4.48Å; L190-R239 HydrophobicContact CB-CB 4.5Å; L190-R239 HydrophobicContact CD2-CB 3.82Å; L190-R239 HydrophobicContact CG-CB 3.96Å; L190-L241 HydrophobicContact CB-CD1 4.2Å; L190-L241 HydrophobicContact CB-CD2 4.12Å
191	S	97	Very high	96.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.5	-170.9	170.6	0	0	0	0	111.5	H171 S173 Y174 D193 R194	H171-S191 VanDerWaalsContact ND1-CB 3.35Å; H171-S191 WeakPolarHBondContact ND1-CB 3.43Å; S173-S191 PolarHBondContact O-OG 3.23Å; Y174-S191 WeakPolarHBondContact O-CA 3.21Å; Y174-S191 WeakPolarHBondContact O-CB 3.29Å; Y174-S191 PolarHBondContact O-OG 2.81Å; S191-D193 WeakPolarHBondContact CB-OD1 3.33Å; S191-D193 PolarHBondContact O-N 2.92Å; S191-D193 VanDerWaalsContact O-N 3.16Å; S191-D193 PolarHBondContact OG-N 3.3Å; S191-D193 VanDerWaalsContact OG-N 3.14Å; S191-D193 PolarHBondContact OG-OD1 2.66Å; S191-R194 PolarHBondContact O-N 2.95Å
192	C	95.2	Very high	95.9	Very high	4 Å²	4	20.4 Å²	20.4	3%	0.027	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-2.8	170.6	50.3	0	0	0	0	113.5	S173 Y174 R194 D231 D232	S173-C192 PolarHBondContact OG-SG 2.92Å; Y174-C192 PolarHBondContact N-SG 2.81Å; Y174-C192 VanDerWaalsContact N-SG 3.41Å; Y174-C192 PolarHBondContact O-N 3.2Å; C192-R194 PolarHBondContact O-N 2.97Å; C192-D231 VanDerWaalsContact O-CA 3.3Å; C192-D231 WeakPolarHBondContact O-CA 3.21Å; C192-D231 VanDerWaalsContact O-CB 3.25Å; C192-D231 WeakPolarHBondContact O-CB 3.5Å; C192-D232 HydrophobicContact CB-CB 4.47Å
193	D	95.9	Very high	95.9	Very high	33 Å²	33	22.8 Å²	22.8	18%	0.176	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	8.2	165	80.1	0.3	0	0	0	114.6	K172 S191 V195 R197	K172-D193 HydrophobicContact CB-CB 4.04Å; K172-D193 PolarHBondContact N-OD2 3.48Å; S191-D193 WeakPolarHBondContact CB-OD1 3.33Å; S191-D193 PolarHBondContact O-N 2.92Å; S191-D193 VanDerWaalsContact O-N 3.16Å; S191-D193 PolarHBondContact OG-N 3.3Å; S191-D193 VanDerWaalsContact OG-N 3.14Å; S191-D193 PolarHBondContact OG-OD1 2.66Å; D193-V195 VanDerWaalsContact C-N 3.3Å; D193-V195 WeakPolarHBondContact O-CG2 3.38Å; D193-V195 PolarHBondContact O-N 3.1Å; D193-V195 WeakPolarHBondContact OD1-CB 3.37Å; D193-V195 PolarHBondContact OD1-N 3.11Å; D193-R197 IonicContact OD1-CZ 3.97Å; D193-R197 IonicContact OD1-NH1 3.84Å; D193-R197 PolarHBondContact OD1-NH1 3.04Å; D193-R197 IonicContact OD1-NH2 3.23Å; D193-R197 IonicContact OD2-CZ 2.73Å; D193-R197 VanDerWaalsContact OD2-CZ 3.28Å; D193-R197 IonicContact OD2-NH1 3.23Å; D193-R197 PolarHBondContact OD2-NH1 2.71Å; D193-R197 IonicContact OD2-NH2 2.61Å; D193-R197 PolarHBondContact OD2-NH2 2.83Å
194	R	96.1	Very high	95.9	Very high	48 Å²	48	25.8 Å²	25.8	18%	0.181	13%	0.13	C	C	.	.	S	Bend	trans	66.1	21.9	-179	-49.2	-173.8	177.1	-124.3	10	114.5	S191 C192 F229 D231	S191-R194 PolarHBondContact O-N 2.95Å; C192-R194 PolarHBondContact O-N 2.97Å; R194-F229 HydrophobicContact CB-CB 4.48Å; R194-F229 WeakPolarHBondContact CD-O 3.26Å; R194-F229 WeakPolarHBondContact CG-O 3.38Å; R194-F229 PolarHBondContact NH1-O 2.82Å; R194-D231 HydrophobicContact CG-CB 3.63Å; R194-D231 IonicContact CZ-OD1 3.85Å; R194-D231 IonicContact CZ-OD2 3.84Å; R194-D231 IonicContact NE-OD1 2.65Å; R194-D231 IonicContact NE-OD2 3.32Å; R194-D231 PolarHBondContact NE-OD2 2.92Å; R194-D231 IonicContact NH2-OD1 2.79Å; R194-D231 PolarHBondContact NH2-OD1 3.03Å; R194-D231 IonicContact NH2-OD2 3.95Å; R194-D231 PolarHBondContact NH2-OD2 2.86Å
195	V	97.2	Very high	96	Very high	18 Å²	18	32.2 Å²	32.2	11%	0.109	15%	0.153	C	C	.	.			trans	-129	118.4	-177	-171.7	0	0	0	0	112	D193 R197 C209 I210	D193-V195 VanDerWaalsContact C-N 3.3Å; D193-V195 WeakPolarHBondContact O-CG2 3.38Å; D193-V195 PolarHBondContact O-N 3.1Å; D193-V195 WeakPolarHBondContact OD1-CB 3.37Å; D193-V195 PolarHBondContact OD1-N 3.11Å; V195-R197 HydrophobicContact CG1-CG 4.02Å; V195-R197 PolarHBondContact O-NH1 2.94Å; V195-C209 WeakPolarHBondContact CG1-SG 3.48Å; V195-I210 WeakPolarHBondContact CA-O 3.46Å
196	M	98	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	126.9	162.1	-170.8	-179.2	75.1	0	0	109	T189 L190 V198 I210 F229 L241 L250 A252 F270	T189-M196 CarbonylContact O-C 3.6Å; T189-M196 WeakPolarHBondContact O-CA 3.34Å; L190-M196 HydrophobicContact CD1-CB 4.09Å; M196-V198 HydrophobicContact CE-CG2 4.41Å; M196-I210 HydrophobicContact CB-CB 4.38Å; M196-I210 HydrophobicContact CE-CB 4.34Å; M196-I210 HydrophobicContact CE-CD1 3.78Å; M196-I210 HydrophobicContact CE-CG1 4.13Å; M196-I210 PolarHBondContact N-O 2.79Å; M196-I210 PolarHBondContact O-N 2.95Å; M196-F229 HydrophobicContact CB-CD2 4.5Å; M196-F229 HydrophobicContact CB-CE2 3.65Å; M196-F229 HydrophobicContact CB-CZ 3.77Å; M196-F229 HydrophobicContact SD-CZ 4.36Å; M196-L241 HydrophobicContact CG-CD1 4.28Å; M196-L241 HydrophobicContact SD-CD1 4.04Å; M196-L250 HydrophobicContact CE-CD2 3.84Å; M196-L250 HydrophobicContact SD-CD2 3.89Å; M196-A252 HydrophobicContact SD-CB 3.79Å; M196-F270 HydrophobicContact CE-CD1 4.3Å; M196-F270 HydrophobicContact CE-CD2 3.88Å; M196-F270 HydrophobicContact CE-CE1 4.03Å; M196-F270 HydrophobicContact CE-CE2 3.57Å; M196-F270 HydrophobicContact CE-CG 4.25Å; M196-F270 HydrophobicContact CE-CZ 3.66Å; M196-F270 HydrophobicContact SD-CE2 4.18Å
197	R	98.1	Very high	96	Very high	13 Å²	13	33.4 Å²	33.4	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.6	176.3	-63.7	176.2	180	66.4	-4.4	109.4	D170 H171 A188 T189 D193 V195 Y199 K206	D170-R197 VanDerWaalsContact O-CZ 3.22Å; D170-R197 PolarHBondContact O-NE 2.88Å; D170-R197 PolarHBondContact O-NH2 3.3Å; H171-R197 PolarHBondContact ND1-NH1 2.92Å; A188-R197 VanDerWaalsContact CA-O 3.31Å; A188-R197 WeakPolarHBondContact CA-O 3.23Å; T189-R197 PolarHBondContact N-O 2.87Å; T189-R197 PolarHBondContact O-N 2.85Å; D193-R197 IonicContact OD1-CZ 3.97Å; D193-R197 IonicContact OD1-NH1 3.84Å; D193-R197 PolarHBondContact OD1-NH1 3.04Å; D193-R197 IonicContact OD1-NH2 3.23Å; D193-R197 IonicContact OD2-CZ 2.73Å; D193-R197 VanDerWaalsContact OD2-CZ 3.28Å; D193-R197 IonicContact OD2-NH1 3.23Å; D193-R197 PolarHBondContact OD2-NH1 2.71Å; D193-R197 IonicContact OD2-NH2 2.61Å; D193-R197 PolarHBondContact OD2-NH2 2.83Å; V195-R197 HydrophobicContact CG1-CG 4.02Å; V195-R197 PolarHBondContact O-NH1 2.94Å; R197-Y199 HydrophobicContact CB-CD2 4.47Å; R197-Y199 HydrophobicContact CB-CE2 3.62Å; R197-Y199 WeakPolarHBondContact CD-OH 3.35Å; R197-K206 HydrophobicContact CG-CD 4.39Å
198	V	98.1	Very high	95.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	127.9	174.3	-173.9	0	0	0	0	108.5	Y186 V187 A188 M196 K206 A207 F208 I210 L250 L275	Y186-V198 HydrophobicContact CD1-CG1 3.85Å; Y186-V198 HydrophobicContact CG-CG1 4.13Å; V187-V198 CarbonylContact O-C 3.51Å; V187-V198 WeakPolarHBondContact O-CA 3.28Å; A188-V198 HydrophobicContact CB-CG2 4.14Å; M196-V198 HydrophobicContact CE-CG2 4.41Å; V198-K206 CarbonylContact O-C 3.56Å; V198-A207 PolarHBondContact O-N 2.86Å; V198-F208 HydrophobicContact CB-CB 4.1Å; V198-F208 HydrophobicContact CB-CD2 3.92Å; V198-F208 HydrophobicContact CB-CG 4.49Å; V198-F208 HydrophobicContact CG1-CD2 4.07Å; V198-F208 HydrophobicContact CG2-CB 4.36Å; V198-F208 HydrophobicContact CG2-CD2 4.38Å; V198-F208 PolarHBondContact N-O 3.32Å; V198-F208 PolarHBondContact O-N 2.89Å; V198-I210 HydrophobicContact CG2-CD1 4.04Å; V198-L250 HydrophobicContact CG2-CD2 4.45Å; V198-L275 HydrophobicContact CG1-CD1 4.11Å
199	Y	97.5	Very high	95.8	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.8	-179	-58.8	-95.6	0	0	0	109.8	L168 D170 Y186 V187 T189 R197 K205 K206	L168-Y199 HydrophobicContact CB-CE1 4.18Å; L168-Y199 HydrophobicContact CD1-CD1 4.18Å; L168-Y199 HydrophobicContact CD1-CD2 3.83Å; L168-Y199 HydrophobicContact CD1-CE1 4.31Å; L168-Y199 HydrophobicContact CD1-CE2 3.97Å; L168-Y199 HydrophobicContact CD1-CG 3.94Å; L168-Y199 HydrophobicContact CD2-CD1 3.79Å; L168-Y199 HydrophobicContact CD2-CE1 3.91Å; L168-Y199 HydrophobicContact CD2-CG 4.31Å; L168-Y199 HydrophobicContact CG-CD1 4.46Å; L168-Y199 HydrophobicContact CG-CE1 4.36Å; D170-Y199 HydrophobicContact CB-CE1 4.46Å; D170-Y199 WeakPolarHBondContact CB-OH 3.41Å; Y186-Y199 CarbonylContact C-O 3.57Å; Y186-Y199 VanDerWaalsContact CA-O 3.26Å; Y186-Y199 WeakPolarHBondContact CA-O 3.4Å; V187-Y199 PolarHBondContact N-O 3.42Å; V187-Y199 PolarHBondContact O-N 2.95Å; T189-Y199 HydrophobicContact CG2-CE2 4.35Å; R197-Y199 HydrophobicContact CB-CD2 4.47Å; R197-Y199 HydrophobicContact CB-CE2 3.62Å; R197-Y199 WeakPolarHBondContact CD-OH 3.35Å; Y199-K205 WeakPolarHBondContact CA-O 3.45Å; Y199-K206 HydrophobicContact CD1-CB 3.96Å; Y199-K206 HydrophobicContact CE1-CB 3.8Å; Y199-K206 HydrophobicContact CE1-CG 4.39Å
200	S	95.8	Very high	95.7	Very high	23 Å²	23	39.4 Å²	39.4	16%	0.161	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	127.2	166.9	155.9	0	0	0	0	109	H202 T203 K204 K205	S200-H202 PolarHBondContact O-N 3.34Å; S200-T203 WeakPolarHBondContact CB-OG1 3.37Å; S200-T203 PolarHBondContact OG-N 2.85Å; S200-T203 PolarHBondContact OG-OG1 2.98Å; S200-K204 VanDerWaalsContact O-CA 3.28Å; S200-K204 WeakPolarHBondContact O-CA 3.41Å; S200-K204 PolarHBondContact O-N 2.96Å; S200-K205 PolarHBondContact N-O 2.82Å
201	T	93.3	Very high	95.6	Very high	16 Å²	16	41.2 Å²	41.2	10%	0.098	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-48.1	179.2	49.7	0	0	0	0	111.9	M156 W180 G184 Q185 V187 K204	M156-T201 HydrophobicContact CE-CG2 4.45Å; W180-T201 HydrophobicContact CZ2-CG2 3.77Å; G184-T201 WeakPolarHBondContact O-CB 3.42Å; G184-T201 VanDerWaalsContact O-CG2 3.29Å; G184-T201 WeakPolarHBondContact O-CG2 3.43Å; G184-T201 PolarHBondContact O-OG1 2.75Å; Q185-T201 PolarHBondContact O-N 3.13Å; Q185-T201 PolarHBondContact O-OG1 2.65Å; Q185-T201 VanDerWaalsContact O-OG1 3.1Å; V187-T201 HydrophobicContact CG2-CG2 3.6Å; T201-K204 WeakPolarHBondContact O-CG 3.41Å
202	H	89.8	Confident	95.4	Very high	105 Å²	105	47 Å²	47	49%	0.486	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-50.7	-177.7	178.8	74.2	0	0	0	112.7	S200 F400	S200-H202 PolarHBondContact O-N 3.34Å; H202-F400 HydrophobicContact CB-CE1 3.95Å; H202-F400 HydrophobicContact CB-CZ 4.49Å
203	T	93.1	Very high	95.1	Very high	72 Å²	72	50.4 Å²	50.4	44%	0.442	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-13	-176.9	64.2	0	0	0	0	113.6	S200 K205	S200-T203 WeakPolarHBondContact CB-OG1 3.37Å; S200-T203 PolarHBondContact OG-N 2.85Å; S200-T203 PolarHBondContact OG-OG1 2.98Å; T203-K205 WeakPolarHBondContact O-CG 3.3Å; T203-K205 PolarHBondContact O-N 3.37Å; T203-K205 VanDerWaalsContact O-N 3.16Å
204	K	93.3	Very high	94.4	Very high	88 Å²	88	50.3 Å²	50.3	38%	0.383	26%	0.259	S	S	.	.			trans	54.8	24.5	-173.5	-61.1	175	176.7	-177.3	0	113.8	L165 C166 S200 T201	L165-K204 PolarHBondContact O-NZ 3.08Å; C166-K204 HydrophobicContact CB-CD 4Å; C166-K204 HydrophobicContact CB-CG 4.36Å; S200-K204 VanDerWaalsContact O-CA 3.28Å; S200-K204 WeakPolarHBondContact O-CA 3.41Å; S200-K204 PolarHBondContact O-N 2.96Å; T201-K204 WeakPolarHBondContact O-CG 3.41Å
205	K	94	Very high	93.4	Very high	151 Å²	151	49.1 Å²	49.1	66%	0.657	26%	0.258	S	S	*	.	S	Bend	trans	-113.5	146.7	-177.5	-72.9	170	-172.9	175.9	0	111.4	Y199 S200 T203 A207	Y199-K205 WeakPolarHBondContact CA-O 3.45Å; S200-K205 PolarHBondContact N-O 2.82Å; T203-K205 WeakPolarHBondContact O-CG 3.3Å; T203-K205 PolarHBondContact O-N 3.37Å; T203-K205 VanDerWaalsContact O-N 3.16Å; K205-A207 PolarHBondContact O-N 2.9Å; K205-A207 VanDerWaalsContact O-N 3.14Å
206	K	95.9	Very high	92	Very high	83 Å²	83	50.7 Å²	50.7	36%	0.361	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	109.3	171.7	-176.6	175.1	63	-112.2	0	109.7	D170 R197 V198 Y199 C209	D170-K206 IonicContact OD1-NZ 3.75Å; D170-K206 PolarHBondContact OD1-NZ 2.88Å; D170-K206 WeakPolarHBondContact OD2-CD 3.4Å; D170-K206 IonicContact OD2-NZ 2.65Å; D170-K206 PolarHBondContact OD2-NZ 3.22Å; R197-K206 HydrophobicContact CG-CD 4.39Å; V198-K206 CarbonylContact O-C 3.56Å; Y199-K206 HydrophobicContact CD1-CB 3.96Å; Y199-K206 HydrophobicContact CE1-CB 3.8Å; Y199-K206 HydrophobicContact CE1-CG 4.39Å; K206-C209 HydrophobicContact CD-CB 4.25Å
207	A	95.3	Very high	90.4	Very high	45 Å²	45	55.9 Å²	55.9	37%	0.372	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-43.1	176.5	0	0	0	0	0	111.2	Y186 V198 K205	Y186-A207 HydrophobicContact CE1-CB 4.4Å; V198-A207 PolarHBondContact O-N 2.86Å; K205-A207 PolarHBondContact O-N 2.9Å; K205-A207 VanDerWaalsContact O-N 3.14Å
208	F	96.1	Very high	89	Confident	43 Å²	43	57.9 Å²	57.9	19%	0.189	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.6	-178	-46.1	-57.6	0	0	0	112	Y186 V198 I210 L275 K276	Y186-F208 HydrophobicContact CE1-CE2 4.22Å; V198-F208 HydrophobicContact CB-CB 4.1Å; V198-F208 HydrophobicContact CB-CD2 3.92Å; V198-F208 HydrophobicContact CB-CG 4.49Å; V198-F208 HydrophobicContact CG1-CD2 4.07Å; V198-F208 HydrophobicContact CG2-CB 4.36Å; V198-F208 HydrophobicContact CG2-CD2 4.38Å; V198-F208 PolarHBondContact N-O 3.32Å; V198-F208 PolarHBondContact O-N 2.89Å; F208-I210 HydrophobicContact CB-CD1 3.7Å; F208-L275 HydrophobicContact CD2-CB 3.57Å; F208-L275 HydrophobicContact CD2-CD1 4.32Å; F208-L275 HydrophobicContact CE2-CB 3.73Å; F208-L275 HydrophobicContact CE2-CD1 4.15Å; F208-L275 HydrophobicContact CE2-CG 4.47Å; F208-L275 HydrophobicContact CG-CB 4.45Å; F208-K276 HydrophobicContact CD1-CD 4.13Å; F208-K276 HydrophobicContact CD1-CG 3.41Å; F208-K276 VanDerWaalsContact CD1-CG 3.41Å; F208-K276 HydrophobicContact CE1-CD 4.28Å; F208-K276 VanDerWaalsContact CE1-CE 3.5Å; F208-K276 HydrophobicContact CE1-CG 3.81Å; F208-K276 HydrophobicContact CG-CG 4.1Å
209	C	96.3	Very high	87.5	Confident	76 Å²	76	63 Å²	63	51%	0.514	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	107.6	-179.4	-177.1	0	0	0	0	107.2	V195 K206	V195-C209 WeakPolarHBondContact CG1-SG 3.48Å; K206-C209 HydrophobicContact CD-CB 4.25Å
210	I	96.5	Very high	86.4	Confident	6 Å²	6	70 Å²	70	3%	0.031	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	112.2	-169.6	-53.9	85	0	0	0	108.6	V195 M196 V198 F208 M228 F229 F270	V195-I210 WeakPolarHBondContact CA-O 3.46Å; M196-I210 HydrophobicContact CB-CB 4.38Å; M196-I210 HydrophobicContact CE-CB 4.34Å; M196-I210 HydrophobicContact CE-CD1 3.78Å; M196-I210 HydrophobicContact CE-CG1 4.13Å; M196-I210 PolarHBondContact N-O 2.79Å; M196-I210 PolarHBondContact O-N 2.95Å; V198-I210 HydrophobicContact CG2-CD1 4.04Å; F208-I210 HydrophobicContact CB-CD1 3.7Å; I210-M228 HydrophobicContact CG2-CE 3.98Å; I210-M228 HydrophobicContact CG2-SD 3.55Å; I210-M228 VanDerWaalsContact CG2-SD 3.55Å; I210-F229 HydrophobicContact CG2-CE2 4.32Å; I210-F270 HydrophobicContact CG1-CE1 4.36Å; I210-F270 HydrophobicContact CG2-CE1 3.89Å; I210-F270 HydrophobicContact CG2-CZ 3.97Å
211	S	95.2	Very high	85.4	Confident	39 Å²	39	71.3 Å²	71.3	27%	0.273	42%	0.419	S	S	.	.			trans	-140.5	-24.4	-176.2	60.4	0	0	0	0	114.4	M228	S211-M228 PolarHBondContact O-N 2.88Å
212	K	92.6	Very high	84.5	Confident	121 Å²	121	77.2 Å²	77.2	53%	0.526	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.4	-177.7	-61.4	-168.9	-174.4	-174.5	0	112.4	Q225 Y226	K212-Q225 HydrophobicContact CD-CB 4.15Å; K212-Y226 CarbonylContact C-O 3.56Å; K212-Y226 WeakPolarHBondContact CA-O 3.15Å; K212-Y226 VanDerWaalsContact CB-O 3.3Å; K212-Y226 WeakPolarHBondContact CB-O 3.49Å
213	M	88.3	Confident	83.9	Confident	75 Å²	75	75.8 Å²	75.8	37%	0.369	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130	171.2	-172.5	161.5	176.3	0	0	109.4	Y226 M228 P278	M213-Y226 PolarHBondContact N-O 3.04Å; M213-Y226 PolarHBondContact O-N 3.42Å; M213-M228 HydrophobicContact CB-CG 3.8Å; M213-M228 HydrophobicContact CB-SD 4.03Å; M213-P278 HydrophobicContact SD-CG 4.14Å
214	S	82.4	Confident	83.4	Confident	32 Å²	32	76.9 Å²	76.9	22%	0.224	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	135.7	169.6	54	0	0	0	0	109.9	R277	S214-R277 PolarHBondContact OG-NH2 3.17Å
215	S	74.2	Confident	83.1	Confident	23 Å²	23	77.3 Å²	77.3	16%	0.161	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-58.5	167.6	159	55.6	0	0	0	0	111.6	K224	S215-K224 PolarHBondContact N-O 3.02Å; S215-K224 PolarHBondContact OG-N 2.82Å; S215-K224 VanDerWaalsContact OG-N 3.13Å; S215-K224 PolarHBondContact OG-O 2.85Å
216	G	68.1	Low	82.8	Confident	50 Å²	50	72 Å²	72	52%	0.515	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-62.7	168.8	152.3	0	0	0	0	0	110.8	L218	G216-L218 PolarHBondContact O-N 2.88Å
217	P	65.2	Low	82.7	Confident	109 Å²	109	74.3 Å²	74.3	71%	0.708	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-57.9	125.8	170.8	26.2	-33.4	0	0	0	109.5
218	L	67	Low	82.7	Confident	56 Å²	56	72.3 Å²	72.3	29%	0.293	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-68.7	171.1	168.8	-78.8	154.1	0	0	0	110.3	G216 D220 G221 E222 K224 W475	G216-L218 PolarHBondContact O-N 2.88Å; L218-D220 PolarHBondContact O-N 2.79Å; L218-G221 PolarHBondContact O-N 3.16Å; L218-E222 WeakPolarHBondContact CB-O 3.25Å; L218-E222 HydrophobicContact CD1-CB 4.17Å; L218-E222 PolarHBondContact N-O 2.87Å; L218-K224 HydrophobicContact CD1-CB 4.4Å; L218-W475 HydrophobicContact CD2-CE3 4.38Å; L218-W475 HydrophobicContact CD2-CH2 4.16Å; L218-W475 HydrophobicContact CD2-CZ3 3.54Å
219	A	68.4	Low	82.7	Confident	106 Å²	106	70.3 Å²	70.3	88%	0.876	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-35.7	178.8	0	0	0	0	0	112.5	G221	A219-G221 VanDerWaalsContact C-N 3.3Å; A219-G221 PolarHBondContact O-N 3.33Å
220	D	73.6	Confident	82.7	Confident	152 Å²	152	67.7 Å²	67.7	81%	0.813	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	12.1	178.5	-48.1	-61.4	0	0	0	113.3	L218 E222	L218-D220 PolarHBondContact O-N 2.79Å; D220-E222 PolarHBondContact O-N 2.87Å
221	G	74	Confident	82.5	Confident	50 Å²	50	69.5 Å²	69.5	52%	0.515	39%	0.393	S	S	.	.	S	Bend	trans	78	-8.6	179.6	0	0	0	0	0	115.7	L218 A219	L218-G221 PolarHBondContact O-N 3.16Å; A219-G221 VanDerWaalsContact C-N 3.3Å; A219-G221 PolarHBondContact O-N 3.33Å
222	E	74.3	Confident	82.3	Confident	139 Å²	139	72.3 Å²	72.3	65%	0.65	41%	0.405	S	S	*	.			trans	-61.4	146.5	177.9	-66.7	-154.2	145.6	0	0	113.1	L218 D220	L218-E222 WeakPolarHBondContact CB-O 3.25Å; L218-E222 HydrophobicContact CD1-CB 4.17Å; L218-E222 PolarHBondContact N-O 2.87Å; D220-E222 PolarHBondContact O-N 2.87Å
223	V	77.4	Confident	82.2	Confident	75 Å²	75	70.8 Å²	70.8	46%	0.455	41%	0.41	S	S	.	.			trans	-120.1	86.1	176.4	-176.1	0	0	0	0	109.3
224	K	82.6	Confident	82.2	Confident	96 Å²	96	67.9 Å²	67.9	42%	0.417	40%	0.395	S	S	.	.			trans	-64.8	135.7	177.2	-174.4	167	167.9	-174.4	0	110.3	S215 L218 Y226	S215-K224 PolarHBondContact N-O 3.02Å; S215-K224 PolarHBondContact OG-N 2.82Å; S215-K224 VanDerWaalsContact OG-N 3.13Å; S215-K224 PolarHBondContact OG-O 2.85Å; L218-K224 HydrophobicContact CD1-CB 4.4Å; K224-Y226 HydrophobicContact CB-CE2 3.85Å; K224-Y226 HydrophobicContact CD-CE1 3.86Å; K224-Y226 HydrophobicContact CD-CE2 4.21Å; K224-Y226 VanDerWaalsContact CE-CE1 3.45Å; K224-Y226 HydrophobicContact CG-CD2 4.37Å; K224-Y226 HydrophobicContact CG-CE1 4.12Å; K224-Y226 HydrophobicContact CG-CE2 3.8Å
225	Q	86.8	Confident	82.1	Confident	97 Å²	97	77.9 Å²	77.9	45%	0.453	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	107.9	-175.9	-66.7	-70	-33.3	0	0	110.2	K212	K212-Q225 HydrophobicContact CD-CB 4.15Å
226	Y	88.4	Confident	82.5	Confident	39 Å²	39	77.5 Å²	77.5	15%	0.153	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	146.6	-175.8	-64.2	-81.8	0	0	0	111.3	K212 M213 K224 E258	K212-Y226 CarbonylContact C-O 3.56Å; K212-Y226 WeakPolarHBondContact CA-O 3.15Å; K212-Y226 VanDerWaalsContact CB-O 3.3Å; K212-Y226 WeakPolarHBondContact CB-O 3.49Å; M213-Y226 PolarHBondContact N-O 3.04Å; M213-Y226 PolarHBondContact O-N 3.42Å; K224-Y226 HydrophobicContact CB-CE2 3.85Å; K224-Y226 HydrophobicContact CD-CE1 3.86Å; K224-Y226 HydrophobicContact CD-CE2 4.21Å; K224-Y226 VanDerWaalsContact CE-CE1 3.45Å; K224-Y226 HydrophobicContact CG-CD2 4.37Å; K224-Y226 HydrophobicContact CG-CE1 4.12Å; K224-Y226 HydrophobicContact CG-CE2 3.8Å; Y226-E258 HydrophobicContact CD1-CB 3.55Å; Y226-E258 VanDerWaalsContact CD1-CD 3.49Å; Y226-E258 HydrophobicContact CD1-CG 4.04Å; Y226-E258 VanDerWaalsContact CD1-OE2 3.31Å; Y226-E258 WeakPolarHBondContact CD1-OE2 3.39Å; Y226-E258 HydrophobicContact CE1-CB 3.67Å
227	R	93.6	Very high	83.2	Confident	132 Å²	132	80.3 Å²	80.3	50%	0.498	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	135.5	171.9	-74.2	170.6	167.9	172.3	-1.7	109
228	M	95.5	Very high	84.5	Confident	3 Å²	3	75.5 Å²	75.5	2%	0.015	39%	0.391	C	S	.	.			trans	-87	-30.4	-177.7	-73.8	-175.8	66.9	0	0	114	I210 S211 M213 G255 C256 Y268 F270 P278	I210-M228 HydrophobicContact CG2-CE 3.98Å; I210-M228 HydrophobicContact CG2-SD 3.55Å; I210-M228 VanDerWaalsContact CG2-SD 3.55Å; S211-M228 PolarHBondContact O-N 2.88Å; M213-M228 HydrophobicContact CB-CG 3.8Å; M213-M228 HydrophobicContact CB-SD 4.03Å; M228-G255 CarbonylContact O-C 3.54Å; M228-G255 VanDerWaalsContact O-CA 3.25Å; M228-G255 WeakPolarHBondContact O-CA 3.47Å; M228-C256 PolarHBondContact O-N 2.85Å; M228-Y268 HydrophobicContact CB-CE2 4.19Å; M228-Y268 HydrophobicContact CE-CD1 4.03Å; M228-Y268 HydrophobicContact CE-CD2 3.97Å; M228-Y268 HydrophobicContact CE-CE1 3.91Å; M228-Y268 HydrophobicContact CE-CE2 3.88Å; M228-Y268 HydrophobicContact CE-CG 4.04Å; M228-Y268 VanDerWaalsContact O-CE2 3.31Å; M228-Y268 WeakPolarHBondContact O-CE2 3.47Å; M228-F270 HydrophobicContact CE-CE1 4.3Å; M228-F270 HydrophobicContact CE-CZ 3.81Å; M228-P278 HydrophobicContact CE-CG 3.86Å
229	F	96.5	Very high	85.9	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-122.1	147.5	-174	-59.5	-78.5	0	0	0	111.1	L190 R194 M196 I210 A252 A254 C256 Y268 F270	L190-F229 HydrophobicContact CD1-CD1 3.9Å; L190-F229 HydrophobicContact CD1-CD2 4.4Å; L190-F229 HydrophobicContact CD1-CE1 4.1Å; L190-F229 HydrophobicContact CD1-CG 4.06Å; L190-F229 HydrophobicContact CD1-CZ 4.45Å; L190-F229 HydrophobicContact CD2-CE1 4.48Å; R194-F229 HydrophobicContact CB-CB 4.48Å; R194-F229 WeakPolarHBondContact CD-O 3.26Å; R194-F229 WeakPolarHBondContact CG-O 3.38Å; R194-F229 PolarHBondContact NH1-O 2.82Å; M196-F229 HydrophobicContact CB-CD2 4.5Å; M196-F229 HydrophobicContact CB-CE2 3.65Å; M196-F229 HydrophobicContact CB-CZ 3.77Å; M196-F229 HydrophobicContact SD-CZ 4.36Å; I210-F229 HydrophobicContact CG2-CE2 4.32Å; F229-A252 HydrophobicContact CE1-CB 4.13Å; F229-A252 HydrophobicContact CZ-CB 4.39Å; F229-A254 WeakPolarHBondContact CA-O 3.19Å; F229-C256 VanDerWaalsContact C-SG 3.56Å; F229-Y268 HydrophobicContact CE1-CD2 4.17Å; F229-Y268 HydrophobicContact CZ-CD2 4.45Å; F229-F270 HydrophobicContact CZ-CZ 4.45Å
230	H	95.3	Very high	87.3	Confident	22 Å²	22	67.9 Å²	67.9	10%	0.102	34%	0.336	C	S	.	.			trans	-64.1	153	168.8	-72.2	-49	0	0	0	110.8	M234 R239 A254 N265	H230-M234 HydrophobicContact CB-CB 3.69Å; H230-M234 HydrophobicContact CB-CG 4.38Å; H230-M234 HydrophobicContact CB-SD 3.81Å; H230-R239 PolarHBondContact O-NH1 2.91Å; H230-A254 PolarHBondContact N-O 2.87Å; H230-N265 PolarHBondContact NE2-OD1 3.15Å
231	D	93.5	Very high	88.4	Confident	44 Å²	44	60.8 Å²	60.8	24%	0.235	30%	0.298	C	S	.	.			trans	-95.6	-158.7	165.1	54.1	9.9	0	0	0	110.7	C192 R194 S233 M234 R239	C192-D231 VanDerWaalsContact O-CA 3.3Å; C192-D231 WeakPolarHBondContact O-CA 3.21Å; C192-D231 VanDerWaalsContact O-CB 3.25Å; C192-D231 WeakPolarHBondContact O-CB 3.5Å; R194-D231 HydrophobicContact CG-CB 3.63Å; R194-D231 IonicContact CZ-OD1 3.85Å; R194-D231 IonicContact CZ-OD2 3.84Å; R194-D231 IonicContact NE-OD1 2.65Å; R194-D231 IonicContact NE-OD2 3.32Å; R194-D231 PolarHBondContact NE-OD2 2.92Å; R194-D231 IonicContact NH2-OD1 2.79Å; R194-D231 PolarHBondContact NH2-OD1 3.03Å; R194-D231 IonicContact NH2-OD2 3.95Å; R194-D231 PolarHBondContact NH2-OD2 2.86Å; D231-S233 PolarHBondContact O-N 2.82Å; D231-S233 VanDerWaalsContact O-N 3.14Å; D231-S233 WeakPolarHBondContact OD1-CB 3.43Å; D231-S233 PolarHBondContact OD1-N 3.04Å; D231-S233 PolarHBondContact OD1-OG 2.94Å; D231-M234 WeakPolarHBondContact O-CB 3.49Å; D231-M234 PolarHBondContact O-N 2.79Å; D231-M234 VanDerWaalsContact O-N 3.11Å; D231-R239 PolarHBondContact O-NH2 3.21Å
232	D	90.5	Very high	89.6	Confident	97 Å²	97	59.2 Å²	59.2	52%	0.519	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-14.4	176.6	-146.2	55.1	0	0	0	114.4	C192 M234	C192-D232 HydrophobicContact CB-CB 4.47Å; D232-M234 PolarHBondContact O-N 3.07Å
233	S	89.8	Confident	90.7	Very high	90 Å²	90	53 Å²	53	63%	0.629	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.7	170.9	60.2	0	0	0	0	113	D231 R235	D231-S233 PolarHBondContact O-N 2.82Å; D231-S233 VanDerWaalsContact O-N 3.14Å; D231-S233 WeakPolarHBondContact OD1-CB 3.43Å; D231-S233 PolarHBondContact OD1-N 3.04Å; D231-S233 PolarHBondContact OD1-OG 2.94Å; S233-R235 PolarHBondContact O-N 2.94Å
234	M	88.4	Confident	91.7	Very high	14 Å²	14	49.5 Å²	49.5	7%	0.069	23%	0.229	C	C	.	.	S	Bend	trans	-78.2	106.6	167.2	173.4	-174.9	167	0	0	109.1	H230 D231 D232 S236 A254 A288 T289 L290	H230-M234 HydrophobicContact CB-CB 3.69Å; H230-M234 HydrophobicContact CB-CG 4.38Å; H230-M234 HydrophobicContact CB-SD 3.81Å; D231-M234 WeakPolarHBondContact O-CB 3.49Å; D231-M234 PolarHBondContact O-N 2.79Å; D231-M234 VanDerWaalsContact O-N 3.11Å; D232-M234 PolarHBondContact O-N 3.07Å; M234-S236 PolarHBondContact O-N 3.38Å; M234-A254 HydrophobicContact CE-CB 3.75Å; M234-A254 HydrophobicContact SD-CB 3.62Å; M234-A288 HydrophobicContact CE-CB 3.66Å; M234-A288 HydrophobicContact CG-CB 3.94Å; M234-A288 HydrophobicContact SD-CB 3.78Å; M234-T289 WeakPolarHBondContact CE-O 3.5Å; M234-L290 HydrophobicContact CE-CD2 3.32Å
235	R	80.3	Confident	92.3	Very high	242 Å²	242	46.2 Å²	46.2	91%	0.913	22%	0.217	S	C	*	.			trans	-71.8	68.2	-176.9	-62.6	-176.7	178.8	-172.9	-1.4	112.8	S233	S233-R235 PolarHBondContact O-N 2.94Å
236	S	83.2	Confident	92.7	Very high	14 Å²	14	41.8 Å²	41.8	10%	0.098	20%	0.197	C	C	.	.			trans	-136	136.5	172.8	-179.5	0	0	0	0	110.7	Q176 M234 F238	Q176-S236 PolarHBondContact NE2-O 3.41Å; M234-S236 PolarHBondContact O-N 3.38Å; S236-F238 VanDerWaalsContact C-N 3.3Å; S236-F238 PolarHBondContact OG-N 3.37Å; S236-F238 PolarHBondContact OG-O 3.16Å
237	F	83.1	Confident	93	Very high	109 Å²	109	39.9 Å²	39.9	48%	0.478	19%	0.189	S	C	.	.	S	Bend	trans	-74.9	-21.1	169.8	-56.5	-73.5	0	0	0	112.4	Q176	Q176-F237 WeakPolarHBondContact CB-O 3.48Å; Q176-F237 VanDerWaalsContact NE2-C 3.29Å; Q176-F237 PolarHBondContact NE2-O 3.2Å
238	F	92.9	Very high	93.1	Very high	8 Å²	8	35 Å²	35	4%	0.035	18%	0.175	C	C	.	.			trans	-122.1	141.2	-169.1	-47.8	-57.5	0	0	0	112.7	Y17 N70 Y134 S236 R240	Y17-F238 HydrophobicContact CD1-CE2 4.14Å; Y17-F238 HydrophobicContact CD1-CZ 4.11Å; Y17-F238 HydrophobicContact CG-CE2 4.46Å; Y17-F238 HydrophobicContact CG-CZ 4.05Å; N70-F238 HydrophobicContact CB-CE1 4.31Å; Y134-F238 HydrophobicContact CD1-CE1 4.49Å; S236-F238 VanDerWaalsContact C-N 3.3Å; S236-F238 PolarHBondContact OG-N 3.37Å; S236-F238 PolarHBondContact OG-O 3.16Å; F238-R240 HydrophobicContact CB-CG 4.31Å
239	R	96	Very high	93.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.177	C	C	.	.			trans	-138.9	51.7	175.9	-57.4	-173.5	-168.5	-125.7	-2.8	110.1	Q176 L190 H230 D231 L241 A254 L290	Q176-R239 HydrophobicContact CB-CB 4.14Å; Q176-R239 HydrophobicContact CB-CG 3.91Å; Q176-R239 PolarHBondContact O-N 3.43Å; L190-R239 HydrophobicContact CB-CB 4.5Å; L190-R239 HydrophobicContact CD2-CB 3.82Å; L190-R239 HydrophobicContact CG-CB 3.96Å; H230-R239 PolarHBondContact O-NH1 2.91Å; D231-R239 PolarHBondContact O-NH2 3.21Å; R239-L241 PolarHBondContact O-N 3.49Å; R239-A254 HydrophobicContact CB-CB 4.38Å; R239-A254 HydrophobicContact CG-CB 3.99Å; R239-L290 CarbonylContact C-O 3.57Å; R239-L290 VanDerWaalsContact CA-O 3.3Å; R239-L290 WeakPolarHBondContact CA-O 3.33Å
240	R	97.3	Very high	93.3	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.008	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-69.1	86	-167.8	-73.5	170	173.1	150.4	-0.1	111.7	Y17 N70 Y134 D135 F238 L290 A291 V292 S357 D358	Y17-R240 PolarHBondContact O-NH1 2.66Å; N70-R240 PolarHBondContact O-NH2 2.86Å; Y134-R240 PolarHBondContact O-NH2 2.93Å; Y134-R240 VanDerWaalsContact O-NH2 3.14Å; D135-R240 IonicContact OD1-NE 3.18Å; D135-R240 PolarHBondContact OD1-NE 2.95Å; D135-R240 VanDerWaalsContact OD1-NE 3.08Å; F238-R240 HydrophobicContact CB-CG 4.31Å; R240-L290 PolarHBondContact N-O 3.49Å; R240-A291 HydrophobicContact CB-CB 3.85Å; R240-A291 CarbonylContact O-C 3.45Å; R240-A291 WeakPolarHBondContact O-CA 3.44Å; R240-V292 PolarHBondContact O-N 3.45Å; R240-S357 PolarHBondContact NH1-O 2.89Å; R240-D358 WeakPolarHBondContact CD-OD1 3.19Å; R240-D358 IonicContact CZ-OD2 2.78Å; R240-D358 IonicContact NH1-OD1 3.65Å; R240-D358 IonicContact NH1-OD2 2.68Å; R240-D358 PolarHBondContact NH1-OD2 2.66Å
241	L	98.3	Very high	93.4	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	17%	0.173	C	C	.	.			trans	-74.6	156.5	172.3	74.8	173.1	0	0	0	111.8	G177 T179 A188 L190 M196 R239 L250 V251 A252	G177-L241 WeakPolarHBondContact O-CD2 3.44Å; T179-L241 WeakPolarHBondContact CB-O 3.39Å; T179-L241 HydrophobicContact CG2-CD1 4.01Å; T179-L241 HydrophobicContact CG2-CD2 4.28Å; T179-L241 HydrophobicContact CG2-CG 3.62Å; A188-L241 HydrophobicContact CB-CD1 4Å; L190-L241 HydrophobicContact CB-CD1 4.2Å; L190-L241 HydrophobicContact CB-CD2 4.12Å; M196-L241 HydrophobicContact CG-CD1 4.28Å; M196-L241 HydrophobicContact SD-CD1 4.04Å; R239-L241 PolarHBondContact O-N 3.49Å; L241-L250 HydrophobicContact CD1-CD1 4.19Å; L241-V251 WeakPolarHBondContact CA-O 3.41Å; L241-V251 WeakPolarHBondContact CB-O 3.17Å; L241-A252 HydrophobicContact CB-CB 4.46Å
242	S	98.3	Very high	93.6	Very high	16 Å²	16	32.5 Å²	32.5	11%	0.112	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	135.5	-178	-171	0	0	0	0	111.3	V251 V292	S242-V251 PolarHBondContact N-O 2.97Å; S242-V251 PolarHBondContact O-N 2.84Å; S242-V292 WeakPolarHBondContact CB-O 3.25Å
243	F	98	Very high	94	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.035	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	155.9	153.1	-79.9	-81.7	0	0	0	110.5	T179 W180 D181 A188 F249 L250	T179-F243 HydrophobicContact CG2-CD2 3.66Å; T179-F243 HydrophobicContact CG2-CE2 3.9Å; T179-F243 PolarHBondContact OG1-N 2.95Å; W180-F243 WeakPolarHBondContact O-CD2 3.14Å; D181-F243 HydrophobicContact CB-CD2 4.32Å; D181-F243 HydrophobicContact CB-CE2 4.01Å; D181-F243 HydrophobicContact CB-CZ 4.18Å; A188-F243 HydrophobicContact CB-CE2 4.33Å; F243-F249 CarbonylContact C-O 3.52Å; F243-F249 WeakPolarHBondContact CA-O 3.3Å; F243-F249 WeakPolarHBondContact CD1-O 3.43Å; F243-L250 HydrophobicContact CD1-CB 4.01Å; F243-L250 HydrophobicContact CD1-CD1 4.34Å; F243-L250 HydrophobicContact CD2-CD1 4.05Å; F243-L250 HydrophobicContact CE1-CB 3.84Å; F243-L250 HydrophobicContact CE1-CD1 4.37Å; F243-L250 HydrophobicContact CE2-CD1 4.07Å; F243-L250 HydrophobicContact CG-CD1 4.19Å; F243-L250 HydrophobicContact CZ-CB 4.35Å; F243-L250 HydrophobicContact CZ-CD1 4.23Å; F243-L250 HydrophobicContact CZ-CD2 4.33Å
244	T	97.4	Very high	94.3	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.018	11%	0.107	C	C	.	.			trans	-71.3	156.1	163.7	50.1	0	0	0	0	110.7	P182 D246 G247 S248 F249 V251 M324	P182-T244 WeakPolarHBondContact CG-O 3.43Å; T244-D246 VanDerWaalsContact CB-OD1 3.27Å; T244-D246 WeakPolarHBondContact CB-OD1 3.16Å; T244-D246 PolarHBondContact O-N 2.94Å; T244-D246 VanDerWaalsContact O-N 3.11Å; T244-D246 PolarHBondContact OG1-OD1 3.33Å; T244-G247 WeakPolarHBondContact O-CA 3.18Å; T244-G247 PolarHBondContact O-N 3.41Å; T244-S248 PolarHBondContact OG1-N 2.92Å; T244-F249 HydrophobicContact CG2-CB 3.95Å; T244-F249 HydrophobicContact CG2-CD2 4.29Å; T244-F249 PolarHBondContact N-O 3.38Å; T244-F249 PolarHBondContact OG1-N 2.61Å; T244-F249 PolarHBondContact OG1-O 3.01Å; T244-V251 HydrophobicContact CG2-CG2 4.48Å; T244-M324 HydrophobicContact CG2-CE 3.84Å
245	P	95.1	Very high	94.6	Very high	27 Å²	27	22.9 Å²	22.9	18%	0.175	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.4	-174.5	-25.8	36.4	0	0	0	114.3	C294 Y298	P245-C294 HydrophobicContact CG-CB 3.74Å; P245-Y298 HydrophobicContact CB-CE2 4.49Å; P245-Y298 WeakPolarHBondContact CB-OH 3.32Å; P245-Y298 PolarHBondContact O-OH 3Å
246	D	94.6	Very high	95.3	Very high	3 Å²	3	11.8 Å²	11.8	2%	0.016	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-9.8	173.2	68.2	-12.3	0	0	0	114.6	Q183 T244 S248 Y298 Y322 M324 L397	Q183-D246 PolarHBondContact NE2-O 3.21Å; T244-D246 VanDerWaalsContact CB-OD1 3.27Å; T244-D246 WeakPolarHBondContact CB-OD1 3.16Å; T244-D246 PolarHBondContact O-N 2.94Å; T244-D246 VanDerWaalsContact O-N 3.11Å; T244-D246 PolarHBondContact OG1-OD1 3.33Å; D246-S248 VanDerWaalsContact C-N 3.26Å; D246-S248 PolarHBondContact O-N 3.37Å; D246-S248 WeakPolarHBondContact OD1-CB 3.25Å; D246-S248 PolarHBondContact OD1-N 2.69Å; D246-S248 WeakPolarHBondContact OD2-CB 3.17Å; D246-S248 PolarHBondContact OD2-OG 3.33Å; D246-Y298 HydrophobicContact CB-CE1 4.18Å; D246-Y298 PolarHBondContact N-OH 2.75Å; D246-Y322 WeakPolarHBondContact CB-OH 3.24Å; D246-Y322 PolarHBondContact OD2-OH 2.86Å; D246-M324 HydrophobicContact CB-SD 4.22Å; D246-M324 WeakPolarHBondContact OD1-CE 3.26Å; D246-L397 HydrophobicContact CB-CD2 4.07Å
247	G	95.6	Very high	95.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	73.2	3.6	-172.5	0	0	0	0	0	115.3	T244 F249 R272	T244-G247 WeakPolarHBondContact O-CA 3.18Å; T244-G247 PolarHBondContact O-N 3.41Å; G247-F249 PolarHBondContact O-N 2.85Å; G247-R272 VanDerWaalsContact O-CZ 3.26Å; G247-R272 PolarHBondContact O-NE 3.25Å; G247-R272 PolarHBondContact O-NH2 3.44Å
248	S	95.4	Very high	95.9	Very high	28 Å²	28	10.8 Å²	10.8	20%	0.196	6%	0.061	C	C	.	.	S	Bend	trans	-60.9	-33.3	-178.2	-71.7	0	0	0	0	113.2	T244 D246 R272	T244-S248 PolarHBondContact OG1-N 2.92Å; D246-S248 VanDerWaalsContact C-N 3.26Å; D246-S248 PolarHBondContact O-N 3.37Å; D246-S248 WeakPolarHBondContact OD1-CB 3.25Å; D246-S248 PolarHBondContact OD1-N 2.69Å; D246-S248 WeakPolarHBondContact OD2-CB 3.17Å; D246-S248 PolarHBondContact OD2-OG 3.33Å; S248-R272 PolarHBondContact O-N 2.82Å
249	F	97.2	Very high	95.4	Very high	15 Å²	15	13.6 Å²	13.6	7%	0.066	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.9	-176	-52.6	-75.8	0	0	0	112.4	F243 T244 G247 I269 F270 I279 F318 L320	F243-F249 CarbonylContact C-O 3.52Å; F243-F249 WeakPolarHBondContact CA-O 3.3Å; F243-F249 WeakPolarHBondContact CD1-O 3.43Å; T244-F249 HydrophobicContact CG2-CB 3.95Å; T244-F249 HydrophobicContact CG2-CD2 4.29Å; T244-F249 PolarHBondContact N-O 3.38Å; T244-F249 PolarHBondContact OG1-N 2.61Å; T244-F249 PolarHBondContact OG1-O 3.01Å; G247-F249 PolarHBondContact O-N 2.85Å; F249-I269 HydrophobicContact CB-CG2 3.91Å; F249-I269 HydrophobicContact CD1-CG2 4.07Å; F249-I269 HydrophobicContact CG-CG2 4.18Å; F249-F270 CarbonylContact C-O 3.52Å; F249-F270 WeakPolarHBondContact CA-O 3.44Å; F249-I279 HydrophobicContact CD1-CD1 3.76Å; F249-I279 HydrophobicContact CE1-CD1 3.52Å; F249-F318 HydrophobicContact CD1-CD1 4.42Å; F249-F318 HydrophobicContact CD2-CD1 4.37Å; F249-F318 AromaticContact CE1-CD1 3.95Å; F249-F318 HydrophobicContact CE1-CD1 3.95Å; F249-F318 HydrophobicContact CE2-CB 4.28Å; F249-F318 AromaticContact CE2-CD1 3.87Å; F249-F318 HydrophobicContact CE2-CD1 3.87Å; F249-F318 HydrophobicContact CE2-CG 4.5Å; F249-F318 HydrophobicContact CZ-CB 4.12Å; F249-F318 AromaticContact CZ-CD1 3.66Å; F249-F318 HydrophobicContact CZ-CD1 3.66Å; F249-F318 HydrophobicContact CZ-CG 4.38Å; F249-L320 HydrophobicContact CE2-CD1 3.98Å; F249-L320 HydrophobicContact CE2-CD2 4.45Å; F249-L320 HydrophobicContact CE2-CG 4.32Å
250	L	98.4	Very high	94.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.8	167.5	173	62.1	0	0	0	107.8	T179 A188 M196 V198 L241 F243 F270 L275	T179-L250 HydrophobicContact CG2-CD1 3.6Å; A188-L250 HydrophobicContact CB-CD1 4.2Å; A188-L250 HydrophobicContact CB-CD2 3.68Å; M196-L250 HydrophobicContact CE-CD2 3.84Å; M196-L250 HydrophobicContact SD-CD2 3.89Å; V198-L250 HydrophobicContact CG2-CD2 4.45Å; L241-L250 HydrophobicContact CD1-CD1 4.19Å; F243-L250 HydrophobicContact CD1-CB 4.01Å; F243-L250 HydrophobicContact CD1-CD1 4.34Å; F243-L250 HydrophobicContact CD2-CD1 4.05Å; F243-L250 HydrophobicContact CE1-CB 3.84Å; F243-L250 HydrophobicContact CE1-CD1 4.37Å; F243-L250 HydrophobicContact CE2-CD1 4.07Å; F243-L250 HydrophobicContact CG-CD1 4.19Å; F243-L250 HydrophobicContact CZ-CB 4.35Å; F243-L250 HydrophobicContact CZ-CD1 4.23Å; F243-L250 HydrophobicContact CZ-CD2 4.33Å; L250-F270 HydrophobicContact CB-CB 4.35Å; L250-F270 PolarHBondContact N-O 2.87Å; L250-F270 PolarHBondContact O-N 3.06Å; L250-L275 HydrophobicContact CB-CD2 3.94Å; L250-L275 HydrophobicContact CD2-CD2 4.22Å
251	V	98.4	Very high	94	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.012	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.1	-176.6	-168.7	0	0	0	0	109	L241 S242 T244 T267 Y268 I269 V292 F326	L241-V251 WeakPolarHBondContact CA-O 3.41Å; L241-V251 WeakPolarHBondContact CB-O 3.17Å; S242-V251 PolarHBondContact N-O 2.97Å; S242-V251 PolarHBondContact O-N 2.84Å; T244-V251 HydrophobicContact CG2-CG2 4.48Å; V251-T267 HydrophobicContact CG1-CG2 3.43Å; V251-T267 VanDerWaalsContact CG1-CG2 3.43Å; V251-Y268 CarbonylContact C-O 3.54Å; V251-Y268 WeakPolarHBondContact CA-O 3.41Å; V251-I269 HydrophobicContact CG1-CG1 4.23Å; V251-I269 HydrophobicContact CG2-CG1 4.4Å; V251-I269 HydrophobicContact CG2-CG2 4.38Å; V251-V292 HydrophobicContact CB-CG1 3.99Å; V251-V292 HydrophobicContact CG1-CB 4.46Å; V251-V292 HydrophobicContact CG1-CG1 3.76Å; V251-V292 HydrophobicContact CG1-CG2 4.12Å; V251-F326 HydrophobicContact CG1-CE2 4.34Å
252	A	98.3	Very high	93.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.1	-169.5	0	0	0	0	0	111.6	M196 F229 L241 T267 Y268 F270	M196-A252 HydrophobicContact SD-CB 3.79Å; F229-A252 HydrophobicContact CE1-CB 4.13Å; F229-A252 HydrophobicContact CZ-CB 4.39Å; L241-A252 HydrophobicContact CB-CB 4.46Å; A252-T267 CarbonylContact O-C 3.56Å; A252-T267 WeakPolarHBondContact O-CA 3.44Å; A252-T267 WeakPolarHBondContact O-CG2 3.5Å; A252-Y268 PolarHBondContact N-O 2.86Å; A252-Y268 PolarHBondContact O-N 3.18Å; A252-F270 HydrophobicContact CB-CE2 4.09Å
253	P	97.6	Very high	92.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-169.6	175.3	35.7	-36.4	0	0	0	111.2	G255 T289 V292	P253-G255 PolarHBondContact O-N 2.84Å; P253-T289 WeakPolarHBondContact CA-OG1 3.37Å; P253-T289 WeakPolarHBondContact CB-O 3.23Å; P253-V292 HydrophobicContact CB-CG2 4.08Å; P253-V292 HydrophobicContact CG-CG2 4.23Å
254	A	96.5	Very high	92.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56.6	20.4	178.5	0	0	0	0	0	115.1	F229 H230 M234 R239 T289	F229-A254 WeakPolarHBondContact CA-O 3.19Å; H230-A254 PolarHBondContact N-O 2.87Å; M234-A254 HydrophobicContact CE-CB 3.75Å; M234-A254 HydrophobicContact SD-CB 3.62Å; R239-A254 HydrophobicContact CB-CB 4.38Å; R239-A254 HydrophobicContact CG-CB 3.99Å; A254-T289 WeakPolarHBondContact CA-O 2.96Å; A254-T289 PolarHBondContact N-O 3.25Å; A254-T289 PolarHBondContact N-OG1 2.86Å
255	G	95.8	Very high	92.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	157	176.5	0	0	0	0	0	112.3	M228 P253 N265 T266	M228-G255 CarbonylContact O-C 3.54Å; M228-G255 VanDerWaalsContact O-CA 3.25Å; M228-G255 WeakPolarHBondContact O-CA 3.47Å; P253-G255 PolarHBondContact O-N 2.84Å; G255-N265 WeakPolarHBondContact O-CA 3.47Å; G255-T266 CarbonylContact C-O 3.45Å; G255-T266 WeakPolarHBondContact CA-O 3.46Å; G255-T266 PolarHBondContact N-O 2.89Å; G255-T266 PolarHBondContact O-N 2.96Å
256	C	93.7	Very high	92.5	Very high	8 Å²	8	37.5 Å²	37.5	5%	0.054	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	151	175.6	53	0	0	0	0	112	M228 F229 I263 I264 Y268	M228-C256 PolarHBondContact O-N 2.85Å; F229-C256 VanDerWaalsContact C-SG 3.56Å; C256-I263 HydrophobicContact CB-CG2 3.64Å; C256-I264 CarbonylContact C-O 3.42Å; C256-I264 WeakPolarHBondContact CA-O 3.47Å; C256-Y268 PolarHBondContact O-OH 2.81Å
257	V	91.1	Very high	92.6	Very high	39 Å²	39	37.4 Å²	37.4	24%	0.236	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	118.2	178.1	-175.6	0	0	0	0	108.3	V259 I264 T266 Y268	V257-V259 HydrophobicContact CG1-CG2 3.88Å; V257-I264 PolarHBondContact N-O 3.37Å; V257-I264 PolarHBondContact O-N 3.46Å; V257-T266 HydrophobicContact CG2-CG2 3.8Å; V257-Y268 WeakPolarHBondContact CG2-OH 3.39Å
258	E	88	Confident	92.7	Very high	63 Å²	63	37.7 Å²	37.7	29%	0.294	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119	172	-66.3	166.5	-130.1	0	0	109.5	Y226 N262 I263	Y226-E258 HydrophobicContact CD1-CB 3.55Å; Y226-E258 VanDerWaalsContact CD1-CD 3.49Å; Y226-E258 HydrophobicContact CD1-CG 4.04Å; Y226-E258 VanDerWaalsContact CD1-OE2 3.31Å; Y226-E258 WeakPolarHBondContact CD1-OE2 3.39Å; Y226-E258 HydrophobicContact CE1-CB 3.67Å; E258-N262 CarbonylContact C-O 3.58Å; E258-N262 WeakPolarHBondContact CA-O 3.41Å; E258-I263 HydrophobicContact CG-CG1 4.27Å
259	V	82.4	Confident	92.8	Very high	67 Å²	67	36.5 Å²	36.5	41%	0.406	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	96.6	177.9	-176.2	0	0	0	0	108.6	V257 E261 N262 I264	V257-V259 HydrophobicContact CG1-CG2 3.88Å; V259-E261 PolarHBondContact O-N 2.92Å; V259-N262 PolarHBondContact N-O 3.31Å; V259-N262 PolarHBondContact O-N 3.39Å; V259-N262 VanDerWaalsContact O-N 3.16Å; V259-I264 HydrophobicContact CB-CD1 4.2Å; V259-I264 HydrophobicContact CG2-CD1 3.74Å; V259-I264 HydrophobicContact CG2-CG1 4.27Å
260	G	81.8	Confident	92.9	Very high	63 Å²	63	35.8 Å²	35.8	65%	0.649	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	-119.2	-166.9	0	0	0	0	0	110.1
261	E	81.7	Confident	92.8	Very high	198 Å²	198	36.6 Å²	36.6	93%	0.925	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-13.8	174.6	-60	-179.7	155	0	0	112.9	V259	V259-E261 PolarHBondContact O-N 2.92Å
262	N	85.7	Confident	92.6	Very high	118 Å²	118	38.4 Å²	38.4	63%	0.631	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	143.2	-175.9	-67.3	-64.2	0	0	0	111.8	E258 V259	E258-N262 CarbonylContact C-O 3.58Å; E258-N262 WeakPolarHBondContact CA-O 3.41Å; V259-N262 PolarHBondContact N-O 3.31Å; V259-N262 PolarHBondContact O-N 3.39Å; V259-N262 VanDerWaalsContact O-N 3.16Å
263	I	88.4	Confident	92.3	Very high	102 Å²	102	48 Å²	48	52%	0.523	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	115	171.5	-57.6	179.5	0	0	0	108.7	C256 E258	C256-I263 HydrophobicContact CB-CG2 3.64Å; E258-I263 HydrophobicContact CG-CG1 4.27Å
264	I	92.1	Very high	92	Very high	58 Å²	58	50.6 Å²	50.6	30%	0.297	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.8	176.3	-53.2	-179.2	0	0	0	108.2	C256 V257 V259 P283	C256-I264 CarbonylContact C-O 3.42Å; C256-I264 WeakPolarHBondContact CA-O 3.47Å; V257-I264 PolarHBondContact N-O 3.37Å; V257-I264 PolarHBondContact O-N 3.46Å; V259-I264 HydrophobicContact CB-CD1 4.2Å; V259-I264 HydrophobicContact CG2-CD1 3.74Å; V259-I264 HydrophobicContact CG2-CG1 4.27Å; I264-P283 HydrophobicContact CG2-CB 4.25Å
265	N	94.8	Very high	91.9	Very high	23 Å²	23	50.7 Å²	50.7	12%	0.123	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	148.1	173.8	-40.9	-76.9	0	0	0	110.2	H230 G255 C284 K287	H230-N265 PolarHBondContact NE2-OD1 3.15Å; G255-N265 WeakPolarHBondContact O-CA 3.47Å; N265-C284 WeakPolarHBondContact CB-O 3.39Å; N265-C284 PolarHBondContact ND2-O 2.94Å; N265-C284 PolarHBondContact O-N 2.82Å; N265-K287 WeakPolarHBondContact CB-O 3.42Å; N265-K287 VanDerWaalsContact ND2-C 3.34Å; N265-K287 PolarHBondContact ND2-O 3.34Å
266	T	95.3	Very high	91.7	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	155.5	-178.9	-154.5	0	0	0	0	112.6	G255 V257 Y268 H281 L282 T289	G255-T266 CarbonylContact C-O 3.45Å; G255-T266 WeakPolarHBondContact CA-O 3.46Å; G255-T266 PolarHBondContact N-O 2.89Å; G255-T266 PolarHBondContact O-N 2.96Å; V257-T266 HydrophobicContact CG2-CG2 3.8Å; T266-Y268 HydrophobicContact CG2-CD1 4.31Å; T266-Y268 HydrophobicContact CG2-CD2 3.95Å; T266-Y268 HydrophobicContact CG2-CE1 3.98Å; T266-Y268 HydrophobicContact CG2-CE2 3.55Å; T266-Y268 HydrophobicContact CG2-CG 4.31Å; T266-H281 HydrophobicContact CG2-CB 4.14Å; T266-H281 WeakPolarHBondContact OG1-CB 3.34Å; T266-H281 PolarHBondContact OG1-ND1 3.27Å; T266-L282 WeakPolarHBondContact CA-O 3.33Å; T266-L282 WeakPolarHBondContact CB-O 3.16Å; T266-L282 PolarHBondContact OG1-N 2.87Å; T266-L282 PolarHBondContact OG1-O 3.48Å; T266-T289 PolarHBondContact O-OG1 2.85Å
267	T	97.5	Very high	91.6	Very high	1 Å²	1	65 Å²	65	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.5	163.8	-60.1	0	0	0	0	108.4	V251 A252 H281 L282 T289 V292 V328	V251-T267 HydrophobicContact CG1-CG2 3.43Å; V251-T267 VanDerWaalsContact CG1-CG2 3.43Å; A252-T267 CarbonylContact O-C 3.56Å; A252-T267 WeakPolarHBondContact O-CA 3.44Å; A252-T267 WeakPolarHBondContact O-CG2 3.5Å; T267-H281 CarbonylContact O-C 3.54Å; T267-H281 WeakPolarHBondContact O-CA 3.4Å; T267-L282 PolarHBondContact N-O 3.18Å; T267-L282 PolarHBondContact O-N 2.94Å; T267-T289 WeakPolarHBondContact OG1-CB 3.43Å; T267-T289 WeakPolarHBondContact OG1-CG2 3.42Å; T267-T289 PolarHBondContact OG1-OG1 2.68Å; T267-V292 HydrophobicContact CG2-CG2 3.9Å; T267-V328 HydrophobicContact CG2-CG1 4.44Å; T267-V328 HydrophobicContact CG2-CG2 4.38Å; T267-V328 VanDerWaalsContact OG1-CG1 3.29Å; T267-V328 WeakPolarHBondContact OG1-CG1 3.37Å
268	Y	97.8	Very high	91.8	Very high	7 Å²	7	64.3 Å²	64.3	3%	0.027	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	145.5	179.2	-73.7	-73.4	0	0	0	111.5	M228 F229 V251 A252 C256 V257 T266 F270 P278 H281	M228-Y268 HydrophobicContact CB-CE2 4.19Å; M228-Y268 HydrophobicContact CE-CD1 4.03Å; M228-Y268 HydrophobicContact CE-CD2 3.97Å; M228-Y268 HydrophobicContact CE-CE1 3.91Å; M228-Y268 HydrophobicContact CE-CE2 3.88Å; M228-Y268 HydrophobicContact CE-CG 4.04Å; M228-Y268 VanDerWaalsContact O-CE2 3.31Å; M228-Y268 WeakPolarHBondContact O-CE2 3.47Å; F229-Y268 HydrophobicContact CE1-CD2 4.17Å; F229-Y268 HydrophobicContact CZ-CD2 4.45Å; V251-Y268 CarbonylContact C-O 3.54Å; V251-Y268 WeakPolarHBondContact CA-O 3.41Å; A252-Y268 PolarHBondContact N-O 2.86Å; A252-Y268 PolarHBondContact O-N 3.18Å; C256-Y268 PolarHBondContact O-OH 2.81Å; V257-Y268 WeakPolarHBondContact CG2-OH 3.39Å; T266-Y268 HydrophobicContact CG2-CD1 4.31Å; T266-Y268 HydrophobicContact CG2-CD2 3.95Å; T266-Y268 HydrophobicContact CG2-CE1 3.98Å; T266-Y268 HydrophobicContact CG2-CE2 3.55Å; T266-Y268 HydrophobicContact CG2-CG 4.31Å; Y268-F270 HydrophobicContact CG-CE2 4.47Å; Y268-P278 HydrophobicContact CD1-CB 3.59Å; Y268-P278 HydrophobicContact CD1-CG 3.71Å; Y268-P278 HydrophobicContact CE1-CB 4.38Å; Y268-P278 HydrophobicContact CE1-CG 4.01Å; Y268-P278 HydrophobicContact CG-CB 4.26Å; Y268-H281 HydrophobicContact CD1-CB 3.68Å; Y268-H281 HydrophobicContact CE1-CB 3.88Å
269	I	97.6	Very high	92	Very high	2 Å²	2	65 Å²	65	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.1	169.5	-51.6	175.1	0	0	0	108.8	F249 V251 P278 I279 A280 L282 F318 F326	F249-I269 HydrophobicContact CB-CG2 3.91Å; F249-I269 HydrophobicContact CD1-CG2 4.07Å; F249-I269 HydrophobicContact CG-CG2 4.18Å; V251-I269 HydrophobicContact CG1-CG1 4.23Å; V251-I269 HydrophobicContact CG2-CG1 4.4Å; V251-I269 HydrophobicContact CG2-CG2 4.38Å; I269-P278 CarbonylContact O-C 3.59Å; I269-P278 WeakPolarHBondContact O-CA 3.35Å; I269-I279 HydrophobicContact CB-CG1 4.49Å; I269-I279 HydrophobicContact CG2-CD1 4.38Å; I269-I279 HydrophobicContact CG2-CG1 4.26Å; I269-I279 VanDerWaalsContact O-CG1 3.28Å; I269-I279 WeakPolarHBondContact O-CG1 3.45Å; I269-I279 PolarHBondContact O-N 2.81Å; I269-A280 HydrophobicContact CB-CB 4.35Å; I269-A280 HydrophobicContact CD1-CB 4.41Å; I269-A280 PolarHBondContact N-O 3.4Å; I269-A280 PolarHBondContact O-N 3.16Å; I269-L282 HydrophobicContact CD1-CD1 4.17Å; I269-L282 HydrophobicContact CD1-CD2 4.16Å; I269-L282 HydrophobicContact CD1-CG 4.19Å; I269-F318 HydrophobicContact CD1-CE1 3.95Å; I269-F318 HydrophobicContact CD1-CZ 3.72Å; I269-F318 HydrophobicContact CG2-CE1 4.22Å; I269-F326 HydrophobicContact CD1-CZ 4.23Å
270	F	97.6	Very high	92.5	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.1	173.7	-58.6	-101.7	0	0	0	109	M196 I210 M228 F229 F249 L250 A252 Y268 L275 R277 P278	M196-F270 HydrophobicContact CE-CD1 4.3Å; M196-F270 HydrophobicContact CE-CD2 3.88Å; M196-F270 HydrophobicContact CE-CE1 4.03Å; M196-F270 HydrophobicContact CE-CE2 3.57Å; M196-F270 HydrophobicContact CE-CG 4.25Å; M196-F270 HydrophobicContact CE-CZ 3.66Å; M196-F270 HydrophobicContact SD-CE2 4.18Å; I210-F270 HydrophobicContact CG1-CE1 4.36Å; I210-F270 HydrophobicContact CG2-CE1 3.89Å; I210-F270 HydrophobicContact CG2-CZ 3.97Å; M228-F270 HydrophobicContact CE-CE1 4.3Å; M228-F270 HydrophobicContact CE-CZ 3.81Å; F229-F270 HydrophobicContact CZ-CZ 4.45Å; F249-F270 CarbonylContact C-O 3.52Å; F249-F270 WeakPolarHBondContact CA-O 3.44Å; L250-F270 HydrophobicContact CB-CB 4.35Å; L250-F270 PolarHBondContact N-O 2.87Å; L250-F270 PolarHBondContact O-N 3.06Å; A252-F270 HydrophobicContact CB-CE2 4.09Å; Y268-F270 HydrophobicContact CG-CE2 4.47Å; F270-L275 HydrophobicContact CB-CD2 3.82Å; F270-R277 WeakPolarHBondContact CD1-O 3.37Å; F270-P278 HydrophobicContact CD1-CB 4.33Å; F270-P278 HydrophobicContact CE1-CB 4.13Å; F270-P278 HydrophobicContact CE1-CG 4.48Å; F270-P278 HydrophobicContact CZ-CB 4.28Å
271	S	96.1	Very high	93.1	Very high	18 Å²	18	61.8 Å²	61.8	13%	0.126	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	145.5	168.5	-179.9	0	0	0	0	110.4	K273 S274 L275	S271-K273 PolarHBondContact O-N 2.97Å; S271-K273 VanDerWaalsContact O-N 3.11Å; S271-K273 PolarHBondContact OG-N 3.43Å; S271-S274 CarbonylContact O-C 3.12Å; S271-S274 PolarHBondContact O-N 3.38Å; S271-L275 PolarHBondContact O-N 3.21Å; S271-L275 VanDerWaalsContact O-N 3.16Å
272	R	94.4	Very high	93.7	Very high	39 Å²	39	53 Å²	53	15%	0.147	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-45.9	-39.6	166.7	177.6	170.4	-59.2	-91.7	-16.7	112.6	D181 Q183 G247 S248 S274	D181-R272 IonicContact OD1-CZ 2.89Å; D181-R272 IonicContact OD1-NH1 3.44Å; D181-R272 PolarHBondContact OD1-NH1 2.99Å; D181-R272 IonicContact OD1-NH2 3.33Å; D181-R272 PolarHBondContact OD1-NH2 3.23Å; D181-R272 IonicContact OD2-CZ 3.42Å; D181-R272 IonicContact OD2-NH1 2.75Å; D181-R272 PolarHBondContact OD2-NH1 2.85Å; D181-R272 IonicContact OD2-NH2 2.66Å; D181-R272 PolarHBondContact OD2-NH2 2.71Å; Q183-R272 VanDerWaalsContact CD-CZ 3.47Å; Q183-R272 VanDerWaalsContact OE1-NE 3.08Å; Q183-R272 VanDerWaalsContact OE1-NH1 3.08Å; G247-R272 VanDerWaalsContact O-CZ 3.26Å; G247-R272 PolarHBondContact O-NE 3.25Å; G247-R272 PolarHBondContact O-NH2 3.44Å; S248-R272 PolarHBondContact O-N 2.82Å; R272-S274 PolarHBondContact O-N 2.77Å; R272-S274 VanDerWaalsContact O-N 3.15Å
273	K	91.8	Very high	94	Very high	203 Å²	203	50.3 Å²	50.3	88%	0.883	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-63.6	-17.4	179.2	-61.4	179	-177.9	174.9	0	113.5	S271	S271-K273 PolarHBondContact O-N 2.97Å; S271-K273 VanDerWaalsContact O-N 3.11Å; S271-K273 PolarHBondContact OG-N 3.43Å
274	S	91.8	Very high	94.1	Very high	54 Å²	54	45.6 Å²	45.6	38%	0.378	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-157.5	65.3	179.7	175.6	0	0	0	0	112.4	S271 R272 K276 R277	S271-S274 CarbonylContact O-C 3.12Å; S271-S274 PolarHBondContact O-N 3.38Å; R272-S274 PolarHBondContact O-N 2.77Å; R272-S274 VanDerWaalsContact O-N 3.15Å; S274-K276 PolarHBondContact O-N 2.64Å; S274-R277 PolarHBondContact O-N 3.21Å
275	L	94.2	Very high	93.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-5.8	176.2	-67.6	178.1	0	0	0	114.7	Y186 V198 F208 L250 F270 S271	Y186-L275 HydrophobicContact CD2-CD1 4.16Å; Y186-L275 HydrophobicContact CE2-CD1 4.4Å; Y186-L275 HydrophobicContact CG-CD1 4.33Å; V198-L275 HydrophobicContact CG1-CD1 4.11Å; F208-L275 HydrophobicContact CD2-CB 3.57Å; F208-L275 HydrophobicContact CD2-CD1 4.32Å; F208-L275 HydrophobicContact CE2-CB 3.73Å; F208-L275 HydrophobicContact CE2-CD1 4.15Å; F208-L275 HydrophobicContact CE2-CG 4.47Å; F208-L275 HydrophobicContact CG-CB 4.45Å; L250-L275 HydrophobicContact CB-CD2 3.94Å; L250-L275 HydrophobicContact CD2-CD2 4.22Å; F270-L275 HydrophobicContact CB-CD2 3.82Å; S271-L275 PolarHBondContact O-N 3.21Å; S271-L275 VanDerWaalsContact O-N 3.16Å
276	K	92.3	Very high	92.9	Very high	144 Å²	144	50.2 Å²	50.2	63%	0.626	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-20.4	175.3	-68.5	-174.1	-179.2	-179.3	0	114.6	F208 S274	F208-K276 HydrophobicContact CD1-CD 4.13Å; F208-K276 HydrophobicContact CD1-CG 3.41Å; F208-K276 VanDerWaalsContact CD1-CG 3.41Å; F208-K276 HydrophobicContact CE1-CD 4.28Å; F208-K276 VanDerWaalsContact CE1-CE 3.5Å; F208-K276 HydrophobicContact CE1-CG 3.81Å; F208-K276 HydrophobicContact CG-CG 4.1Å; S274-K276 PolarHBondContact O-N 2.64Å
277	R	91.8	Very high	92.8	Very high	164 Å²	164	53.8 Å²	53.8	62%	0.619	27%	0.273	S	S	*	.	S	Bend	trans	-147.8	142	-175.2	-74.7	-175.5	169.8	177.4	-7	110.1	S214 F270 S274	S214-R277 PolarHBondContact OG-NH2 3.17Å; F270-R277 WeakPolarHBondContact CD1-O 3.37Å; S274-R277 PolarHBondContact O-N 3.21Å
278	P	94.6	Very high	92.5	Very high	25 Å²	25	54 Å²	54	16%	0.162	27%	0.274	C	S	.	.			trans	-66.9	145.8	175.5	30.1	-33.9	0	0	0	110.1	M213 M228 Y268 I269 F270	M213-P278 HydrophobicContact SD-CG 4.14Å; M228-P278 HydrophobicContact CE-CG 3.86Å; Y268-P278 HydrophobicContact CD1-CB 3.59Å; Y268-P278 HydrophobicContact CD1-CG 3.71Å; Y268-P278 HydrophobicContact CE1-CB 4.38Å; Y268-P278 HydrophobicContact CE1-CG 4.01Å; Y268-P278 HydrophobicContact CG-CB 4.26Å; I269-P278 CarbonylContact O-C 3.59Å; I269-P278 WeakPolarHBondContact O-CA 3.35Å; F270-P278 HydrophobicContact CD1-CB 4.33Å; F270-P278 HydrophobicContact CE1-CB 4.13Å; F270-P278 HydrophobicContact CE1-CG 4.48Å; F270-P278 HydrophobicContact CZ-CB 4.28Å
279	I	93.5	Very high	92.4	Very high	78 Å²	78	53.7 Å²	53.7	40%	0.4	27%	0.273	S	S	.	.	S	Bend	trans	-92.2	-24.3	171.1	58.3	153.7	0	0	0	112	F249 I269 F318	F249-I279 HydrophobicContact CD1-CD1 3.76Å; F249-I279 HydrophobicContact CE1-CD1 3.52Å; I269-I279 HydrophobicContact CB-CG1 4.49Å; I269-I279 HydrophobicContact CG2-CD1 4.38Å; I269-I279 HydrophobicContact CG2-CG1 4.26Å; I269-I279 VanDerWaalsContact O-CG1 3.28Å; I269-I279 WeakPolarHBondContact O-CG1 3.45Å; I269-I279 PolarHBondContact O-N 2.81Å; I279-F318 HydrophobicContact CD1-CE1 4.43Å
280	A	92.7	Very high	92.4	Very high	14 Å²	14	53.9 Å²	53.9	12%	0.116	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	164.9	178.2	0	0	0	0	0	109.8	I269 L469	I269-A280 HydrophobicContact CB-CB 4.35Å; I269-A280 HydrophobicContact CD1-CB 4.41Å; I269-A280 PolarHBondContact N-O 3.4Å; I269-A280 PolarHBondContact O-N 3.16Å; A280-L469 HydrophobicContact CB-CD1 3.96Å
281	H	93.4	Very high	92.3	Very high	47 Å²	47	53.9 Å²	53.9	22%	0.218	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	150.6	168.9	76.6	106.9	0	0	0	109.1	T266 T267 Y268	T266-H281 HydrophobicContact CG2-CB 4.14Å; T266-H281 WeakPolarHBondContact OG1-CB 3.34Å; T266-H281 PolarHBondContact OG1-ND1 3.27Å; T267-H281 CarbonylContact O-C 3.54Å; T267-H281 WeakPolarHBondContact O-CA 3.4Å; Y268-H281 HydrophobicContact CD1-CB 3.68Å; Y268-H281 HydrophobicContact CE1-CB 3.88Å
282	L	94.9	Very high	92.4	Very high	15 Å²	15	53 Å²	53	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	103.7	-176.3	-54.3	178.1	0	0	0	108	T266 T267 I269 F326 V328 Y337	T266-L282 WeakPolarHBondContact CA-O 3.33Å; T266-L282 WeakPolarHBondContact CB-O 3.16Å; T266-L282 PolarHBondContact OG1-N 2.87Å; T266-L282 PolarHBondContact OG1-O 3.48Å; T267-L282 PolarHBondContact N-O 3.18Å; T267-L282 PolarHBondContact O-N 2.94Å; I269-L282 HydrophobicContact CD1-CD1 4.17Å; I269-L282 HydrophobicContact CD1-CD2 4.16Å; I269-L282 HydrophobicContact CD1-CG 4.19Å; L282-F326 HydrophobicContact CD1-CE2 3.77Å; L282-F326 HydrophobicContact CD1-CZ 4.03Å; L282-V328 HydrophobicContact CD1-CG2 4.33Å; L282-Y337 HydrophobicContact CB-CE2 4.49Å; L282-Y337 HydrophobicContact CD1-CD1 4.27Å; L282-Y337 HydrophobicContact CD1-CD2 3.95Å; L282-Y337 HydrophobicContact CD1-CE1 4.17Å; L282-Y337 HydrophobicContact CD1-CE2 3.82Å; L282-Y337 HydrophobicContact CD1-CG 4.17Å; L282-Y337 HydrophobicContact CD2-CD1 4.19Å; L282-Y337 HydrophobicContact CD2-CE1 3.84Å; L282-Y337 HydrophobicContact CG-CE1 4.39Å
283	P	92.6	Very high	92.6	Very high	61 Å²	61	53.2 Å²	53.2	40%	0.396	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	134.5	-177.4	-21.9	33.9	0	0	0	112.5	I264	I264-P283 HydrophobicContact CG2-CB 4.25Å
284	C	89.4	Confident	92.9	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.02	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	86.2	176	-175.9	0	0	0	0	108.9	N265 S286 K287 T289	N265-C284 WeakPolarHBondContact CB-O 3.39Å; N265-C284 PolarHBondContact ND2-O 2.94Å; N265-C284 PolarHBondContact O-N 2.82Å; C284-S286 VanDerWaalsContact C-N 3.35Å; C284-S286 PolarHBondContact O-N 3.14Å; C284-K287 PolarHBondContact SG-O 2.79Å; C284-T289 HydrophobicContact CB-CG2 3.87Å
285	P	78.6	Confident	93.1	Very high	110 Å²	110	41.9 Å²	41.9	71%	0.714	22%	0.215	S	C	*	.	S	Bend	trans	-73.7	-20.6	-168.8	28.3	-35.1	0	0	0	114.3
286	S	84.3	Confident	93.1	Very high	67 Å²	67	43.5 Å²	43.5	47%	0.469	23%	0.226	S	C	.	.	S	Bend	trans	-74.7	-53.9	-179.2	52.2	0	0	0	0	112.8	C284	C284-S286 VanDerWaalsContact C-N 3.35Å; C284-S286 PolarHBondContact O-N 3.14Å
287	K	91.8	Very high	93.3	Very high	76 Å²	76	37.8 Å²	37.8	33%	0.33	20%	0.203	S	C	.	.	S	Bend	trans	-144.7	160.3	-166.4	-72.2	-58.5	-154.9	149.5	0	112.3	N265 C284 E331 D332	N265-K287 WeakPolarHBondContact CB-O 3.42Å; N265-K287 VanDerWaalsContact ND2-C 3.34Å; N265-K287 PolarHBondContact ND2-O 3.34Å; C284-K287 PolarHBondContact SG-O 2.79Å; K287-E331 HydrophobicContact CB-CB 4.08Å; K287-E331 HydrophobicContact CB-CG 4.42Å; K287-E331 HydrophobicContact CD-CB 4.27Å; K287-E331 WeakPolarHBondContact CD-OE2 3.43Å; K287-E331 WeakPolarHBondContact CE-OE2 3.46Å; K287-E331 HydrophobicContact CG-CB 4.09Å; K287-E331 IonicContact NZ-OE2 3.23Å; K287-E331 PolarHBondContact NZ-OE2 2.85Å; K287-D332 HydrophobicContact CG-CB 4.4Å; K287-D332 VanDerWaalsContact CG-CG 3.47Å; K287-D332 WeakPolarHBondContact CG-OD2 3.16Å
288	A	92.5	Very high	93.5	Very high	4 Å²	4	30.9 Å²	30.9	3%	0.033	18%	0.177	C	C	.	.			trans	-71.4	148.3	175.3	0	0	0	0	0	111	M234 S330 E331	M234-A288 HydrophobicContact CE-CB 3.66Å; M234-A288 HydrophobicContact CG-CB 3.94Å; M234-A288 HydrophobicContact SD-CB 3.78Å; A288-S330 VanDerWaalsContact O-CA 3.23Å; A288-S330 WeakPolarHBondContact O-CA 3.47Å; A288-S330 WeakPolarHBondContact O-CB 3.48Å; A288-E331 PolarHBondContact N-OE1 3.31Å; A288-E331 PolarHBondContact O-N 3.46Å
289	T	95.6	Very high	93.6	Very high	1 Å²	1	30 Å²	30	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	135.6	179.4	54.4	0	0	0	0	110.7	M234 P253 A254 T266 T267 C284 V328 A329	M234-T289 WeakPolarHBondContact CE-O 3.5Å; P253-T289 WeakPolarHBondContact CA-OG1 3.37Å; P253-T289 WeakPolarHBondContact CB-O 3.23Å; A254-T289 WeakPolarHBondContact CA-O 2.96Å; A254-T289 PolarHBondContact N-O 3.25Å; A254-T289 PolarHBondContact N-OG1 2.86Å; T266-T289 PolarHBondContact O-OG1 2.85Å; T267-T289 WeakPolarHBondContact OG1-CB 3.43Å; T267-T289 WeakPolarHBondContact OG1-CG2 3.42Å; T267-T289 PolarHBondContact OG1-OG1 2.68Å; C284-T289 HydrophobicContact CB-CG2 3.87Å; T289-V328 HydrophobicContact CG2-CG1 3.73Å; T289-A329 CarbonylContact C-O 3.59Å; T289-A329 VanDerWaalsContact CA-O 3.27Å; T289-A329 WeakPolarHBondContact CA-O 3.35Å
290	L	95.8	Very high	93.7	Very high	6 Å²	6	30.2 Å²	30.2	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-43.8	-166.4	-50.5	-171.8	0	0	0	112.5	M234 R239 R240 A329 E331 L356	M234-L290 HydrophobicContact CE-CD2 3.32Å; R239-L290 CarbonylContact C-O 3.57Å; R239-L290 VanDerWaalsContact CA-O 3.3Å; R239-L290 WeakPolarHBondContact CA-O 3.33Å; R240-L290 PolarHBondContact N-O 3.49Å; L290-A329 PolarHBondContact N-O 3Å; L290-E331 HydrophobicContact CD1-CB 4.46Å; L290-E331 HydrophobicContact CD1-CG 4.06Å; L290-E331 HydrophobicContact CD2-CG 4.15Å; L290-E331 HydrophobicContact CG-CG 4.4Å; L290-L356 WeakPolarHBondContact CD1-O 3.41Å
291	A	97.2	Very high	93.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	151.6	-173.8	0	0	0	0	0	111.9	R240 A329	R240-A291 HydrophobicContact CB-CB 3.85Å; R240-A291 CarbonylContact O-C 3.45Å; R240-A291 WeakPolarHBondContact O-CA 3.44Å; A291-A329 HydrophobicContact CB-CB 4.38Å; A291-A329 PolarHBondContact O-N 2.76Å
292	V	98.2	Very high	93.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.5	174.8	-174.2	0	0	0	0	109.4	R240 S242 V251 P253 T267 F326 A327 V328	R240-V292 PolarHBondContact O-N 3.45Å; S242-V292 WeakPolarHBondContact CB-O 3.25Å; V251-V292 HydrophobicContact CB-CG1 3.99Å; V251-V292 HydrophobicContact CG1-CB 4.46Å; V251-V292 HydrophobicContact CG1-CG1 3.76Å; V251-V292 HydrophobicContact CG1-CG2 4.12Å; P253-V292 HydrophobicContact CB-CG2 4.08Å; P253-V292 HydrophobicContact CG-CG2 4.23Å; T267-V292 HydrophobicContact CG2-CG2 3.9Å; V292-F326 HydrophobicContact CG1-CD2 4.19Å; V292-A327 WeakPolarHBondContact CA-O 3.39Å; V292-V328 HydrophobicContact CG1-CG2 4.25Å; V292-V328 HydrophobicContact CG2-CG1 4.49Å; V292-V328 HydrophobicContact CG2-CG2 4.28Å
293	R	98.1	Very high	93.3	Very high	43 Å²	43	36.9 Å²	36.9	16%	0.162	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.9	174.3	-70.2	-70.5	-176	-146.4	-21.9	111.9	F326 A327 D358 L359 W361	R293-F326 CarbonylContact O-C 3.48Å; R293-F326 WeakPolarHBondContact O-CA 3.4Å; R293-A327 PolarHBondContact N-O 2.78Å; R293-A327 PolarHBondContact O-N 2.7Å; R293-D358 IonicContact CZ-OD1 2.84Å; R293-D358 IonicContact NE-OD1 3.62Å; R293-D358 IonicContact NH2-OD1 3.2Å; R293-D358 PolarHBondContact NH2-OD1 2.8Å; R293-D358 IonicContact NH2-OD2 3.29Å; R293-L359 HydrophobicContact CB-CB 4.17Å; R293-L359 WeakPolarHBondContact CD-O 3.27Å; R293-L359 HydrophobicContact CG-CB 3.62Å; R293-L359 WeakPolarHBondContact CG-O 3.23Å; R293-L359 PolarHBondContact NE-O 3.18Å; R293-W361 PolarHBondContact O-NE1 3.23Å
294	C	97.6	Very high	92.8	Very high	18 Å²	18	39.6 Å²	39.6	12%	0.122	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	142.6	169.8	-56.2	0	0	0	0	110.4	P245 F326 W361	P245-C294 HydrophobicContact CG-CB 3.74Å; C294-F326 HydrophobicContact CB-CB 4.27Å; C294-W361 VanDerWaalsContact C-CD1 3.42Å
295	C	97.1	Very high	92.2	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.5	166.1	-174.1	0	0	0	0	108.4	V297 V325 W361	C295-V297 PolarHBondContact O-N 3.11Å; C295-V325 HydrophobicContact CB-CB 4.07Å; C295-V325 HydrophobicContact CB-CG1 4.37Å; C295-V325 WeakPolarHBondContact CB-O 3.35Å; C295-V325 PolarHBondContact N-O 3.02Å; C295-W361 HydrophobicContact CB-CD2 3.82Å; C295-W361 HydrophobicContact CB-CE3 4.11Å; C295-W361 HydrophobicContact CB-CG 4.18Å; C295-W361 HydrophobicContact CB-CH2 4.49Å; C295-W361 HydrophobicContact CB-CZ2 4.22Å; C295-W361 HydrophobicContact CB-CZ3 4.43Å
296	P	94.3	Very high	92	Very high	37 Å²	37	43 Å²	43	24%	0.24	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	-17.7	178.5	27.9	-34.9	0	0	0	113	S362	P296-S362 VanDerWaalsContact CG-O 3.28Å; P296-S362 WeakPolarHBondContact CG-O 3.4Å
297	V	95.3	Very high	91.6	Very high	24 Å²	24	49.2 Å²	49.2	15%	0.145	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.4	-179.3	179.2	0	0	0	0	111.4	C295 F299 D364 P390	C295-V297 PolarHBondContact O-N 3.11Å; V297-F299 HydrophobicContact CB-CE2 3.97Å; V297-F299 HydrophobicContact CB-CZ 3.88Å; V297-F299 HydrophobicContact CG1-CD1 4.31Å; V297-F299 HydrophobicContact CG1-CD2 4.37Å; V297-F299 HydrophobicContact CG1-CE1 3.85Å; V297-F299 HydrophobicContact CG1-CE2 3.92Å; V297-F299 HydrophobicContact CG1-CZ 3.63Å; V297-F299 WeakPolarHBondContact O-CD2 3.47Å; V297-F299 VanDerWaalsContact O-CE2 3.22Å; V297-F299 WeakPolarHBondContact O-CE2 3.31Å; V297-D364 VanDerWaalsContact CG2-C 3.44Å; V297-D364 WeakPolarHBondContact CG2-O 3.36Å; V297-P390 HydrophobicContact CG1-CB 3.92Å; V297-P390 HydrophobicContact CG1-CG 4.36Å
298	Y	96.6	Very high	90.9	Very high	18 Å²	18	53 Å²	53	7%	0.071	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	142.3	166.5	-62.5	-90.7	0	0	0	109.5	P245 D246 Y322 M324 P390 L391 P394 P395	P245-Y298 HydrophobicContact CB-CE2 4.49Å; P245-Y298 WeakPolarHBondContact CB-OH 3.32Å; P245-Y298 PolarHBondContact O-OH 3Å; D246-Y298 HydrophobicContact CB-CE1 4.18Å; D246-Y298 PolarHBondContact N-OH 2.75Å; Y298-Y322 AromaticContact CD1-CD2 3.7Å; Y298-Y322 HydrophobicContact CD1-CD2 3.7Å; Y298-Y322 AromaticContact CD1-CE2 3.89Å; Y298-Y322 HydrophobicContact CD1-CE2 3.89Å; Y298-Y322 HydrophobicContact CD1-CG 4.22Å; Y298-Y322 HydrophobicContact CE1-CD2 4.21Å; Y298-Y322 AromaticContact CE1-CE2 3.9Å; Y298-Y322 HydrophobicContact CE1-CE2 3.9Å; Y298-M324 HydrophobicContact CD1-CG 3.85Å; Y298-M324 HydrophobicContact CD1-SD 4.25Å; Y298-M324 HydrophobicContact CE1-CG 3.99Å; Y298-M324 HydrophobicContact CE1-SD 3.76Å; Y298-P390 CarbonylContact O-C 3.41Å; Y298-P390 WeakPolarHBondContact O-CA 3.42Å; Y298-L391 PolarHBondContact O-N 3.32Å; Y298-P394 HydrophobicContact CD2-CB 3.91Å; Y298-P394 HydrophobicContact CE2-CB 3.95Å; Y298-P395 HydrophobicContact CD1-CG 3.74Å; Y298-P395 HydrophobicContact CD2-CG 4.46Å; Y298-P395 HydrophobicContact CE1-CG 3.36Å; Y298-P395 HydrophobicContact CE2-CG 4.14Å; Y298-P395 HydrophobicContact CG-CG 4.26Å
299	F	96.3	Very high	90	Very high	7 Å²	7	55 Å²	55	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	154.2	-178.5	-61.4	-88.6	0	0	0	111.5	V297 R323 V325 L387 T389	V297-F299 HydrophobicContact CB-CE2 3.97Å; V297-F299 HydrophobicContact CB-CZ 3.88Å; V297-F299 HydrophobicContact CG1-CD1 4.31Å; V297-F299 HydrophobicContact CG1-CD2 4.37Å; V297-F299 HydrophobicContact CG1-CE1 3.85Å; V297-F299 HydrophobicContact CG1-CE2 3.92Å; V297-F299 HydrophobicContact CG1-CZ 3.63Å; V297-F299 WeakPolarHBondContact O-CD2 3.47Å; V297-F299 VanDerWaalsContact O-CE2 3.22Å; V297-F299 WeakPolarHBondContact O-CE2 3.31Å; F299-R323 HydrophobicContact CB-CB 4.18Å; F299-R323 PolarHBondContact N-O 2.71Å; F299-R323 PolarHBondContact O-N 3.42Å; F299-V325 HydrophobicContact CD2-CG2 3.93Å; F299-V325 HydrophobicContact CE2-CB 4.18Å; F299-V325 HydrophobicContact CE2-CG2 3.82Å; F299-L387 HydrophobicContact CD1-CB 4.46Å; F299-L387 HydrophobicContact CE1-CB 3.63Å; F299-L387 HydrophobicContact CE2-CB 4.43Å; F299-L387 HydrophobicContact CZ-CB 3.62Å; F299-L387 HydrophobicContact CZ-CD1 4.09Å; F299-T389 CarbonylContact C-O 3.57Å; F299-T389 WeakPolarHBondContact CA-O 3.45Å; F299-T389 WeakPolarHBondContact CB-O 3.07Å
300	E	95.4	Very high	89.1	Confident	83 Å²	83	57.7 Å²	57.7	39%	0.388	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-62.1	152.8	167.6	-63.8	-178.3	154.3	0	0	111.1	R302 T389 L391	E300-R302 PolarHBondContact O-N 3.05Å; E300-T389 HydrophobicContact CG-CG2 4.4Å; E300-T389 PolarHBondContact N-O 2.62Å; E300-T389 WeakPolarHBondContact OE2-CB 3.2Å; E300-T389 WeakPolarHBondContact OE2-CG2 3.44Å; E300-T389 PolarHBondContact OE2-OG1 3.02Å; E300-L391 HydrophobicContact CG-CD1 4.31Å
301	L	94.4	Very high	88.2	Confident	66 Å²	66	62.6 Å²	62.6	35%	0.346	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-69.1	124.8	174.5	-67.1	175	0	0	0	110	R323 Q340	L301-R323 HydrophobicContact CD2-CB 4.3Å; L301-Q340 HydrophobicContact CD2-CG 3.78Å
302	R	90.2	Very high	87.4	Confident	79 Å²	79	68.1 Å²	68.1	30%	0.298	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-67.9	132.1	-179.6	-62	-168.8	-71.5	158.6	-0.8	110.7	E300 L314 D338 Q340	E300-R302 PolarHBondContact O-N 3.05Å; R302-L314 HydrophobicContact CB-CD1 3.93Å; R302-L314 WeakPolarHBondContact O-CB 3.45Å; R302-L314 WeakPolarHBondContact O-CG 3.48Å; R302-L314 PolarHBondContact O-N 2.73Å; R302-D338 IonicContact CZ-OD2 3.28Å; R302-D338 IonicContact NE-OD2 2.68Å; R302-D338 IonicContact NH2-OD2 3.38Å; R302-D338 PolarHBondContact NH2-OD2 2.85Å; R302-Q340 PolarHBondContact O-NE2 3Å
303	S	87.8	Confident	86.4	Confident	70 Å²	70	71 Å²	71	49%	0.49	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.2	174	59.4	0	0	0	0	111.3	Q312	S303-Q312 CarbonylContact C-O 3.59Å; S303-Q312 WeakPolarHBondContact CA-O 3.25Å; S303-Q312 WeakPolarHBondContact CB-O 3.47Å
304	K	82.1	Confident	85.8	Confident	118 Å²	118	72.6 Å²	72.6	51%	0.513	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	145.8	165.2	-166.5	-163.8	168.2	-167.1	0	108.5	Q312 L314	K304-Q312 PolarHBondContact N-O 2.8Å; K304-Q312 WeakPolarHBondContact O-CA 3.44Å; K304-Q312 PolarHBondContact O-N 3.29Å; K304-Q312 VanDerWaalsContact O-O 3.11Å; K304-L314 HydrophobicContact CB-CD2 4.08Å
305	K	77.3	Confident	85.2	Confident	167 Å²	167	76.7 Å²	76.7	73%	0.726	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.1	161.4	-69.6	-170	177.2	-172.7	0	109	S310	K305-S310 WeakPolarHBondContact CA-O 3.47Å
306	G	74.2	Confident	84.9	Confident	18 Å²	18	79 Å²	79	19%	0.186	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-69	173	167.1	0	0	0	0	0	111.2	D308 G309 S310	G306-D308 VanDerWaalsContact C-N 3.28Å; G306-D308 PolarHBondContact O-N 2.87Å; G306-G309 WeakPolarHBondContact O-CA 3.46Å; G306-G309 PolarHBondContact O-N 2.81Å; G306-S310 PolarHBondContact N-O 3.01Å
307	E	75.6	Confident	84.6	Confident	198 Å²	198	79 Å²	79	93%	0.925	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-33.4	-179.5	-67.4	172.9	174.3	0	0	110.9	G309	E307-G309 PolarHBondContact O-N 3.25Å; E307-G309 VanDerWaalsContact O-N 3.12Å
308	D	77.2	Confident	84.3	Confident	155 Å²	155	79.1 Å²	79.1	83%	0.829	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	10.2	170	-40.7	-66.6	0	0	0	114.1	G306 S310	G306-D308 VanDerWaalsContact C-N 3.28Å; G306-D308 PolarHBondContact O-N 2.87Å; D308-S310 PolarHBondContact O-N 3.18Å
309	G	73.7	Confident	84.1	Confident	46 Å²	46	85 Å²	85	47%	0.474	47%	0.467	S	S	.	.	S	Bend	trans	73.4	-11.3	-177.3	0	0	0	0	0	116	G306 E307	G306-G309 WeakPolarHBondContact O-CA 3.46Å; G306-G309 PolarHBondContact O-N 2.81Å; E307-G309 PolarHBondContact O-N 3.25Å; E307-G309 VanDerWaalsContact O-N 3.12Å
310	S	77.4	Confident	83.9	Confident	58 Å²	58	85.5 Å²	85.5	41%	0.406	47%	0.47	S	S	.	.			trans	-60.6	149.7	177.5	68.6	0	0	0	0	113.6	K305 G306 D308 Q312	K305-S310 WeakPolarHBondContact CA-O 3.47Å; G306-S310 PolarHBondContact N-O 3.01Å; D308-S310 PolarHBondContact O-N 3.18Å; S310-Q312 PolarHBondContact O-N 3Å
311	P	76.6	Confident	83.8	Confident	109 Å²	109	86.4 Å²	86.4	71%	0.708	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	105.5	177.8	30.7	-33.1	0	0	0	111.6
312	Q	79.1	Confident	83.8	Confident	115 Å²	115	84.5 Å²	84.5	54%	0.537	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	118.3	173.6	-168	178.6	40.3	0	0	110	S303 K304 S310 L314	S303-Q312 CarbonylContact C-O 3.59Å; S303-Q312 WeakPolarHBondContact CA-O 3.25Å; S303-Q312 WeakPolarHBondContact CB-O 3.47Å; K304-Q312 PolarHBondContact N-O 2.8Å; K304-Q312 WeakPolarHBondContact O-CA 3.44Å; K304-Q312 PolarHBondContact O-N 3.29Å; K304-Q312 VanDerWaalsContact O-O 3.11Å; S310-Q312 PolarHBondContact O-N 3Å; Q312-L314 PolarHBondContact O-N 3Å
313	G	78.7	Confident	84.1	Confident	61 Å²	61	80.8 Å²	80.8	63%	0.629	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	134.3	177.1	0	0	0	0	0	112.2
314	L	85.6	Confident	84.5	Confident	76 Å²	76	77.6 Å²	77.6	40%	0.398	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-73.3	157.7	169.3	-68.1	174.7	0	0	0	110.5	R302 K304 Q312 N316	R302-L314 HydrophobicContact CB-CD1 3.93Å; R302-L314 WeakPolarHBondContact O-CB 3.45Å; R302-L314 WeakPolarHBondContact O-CG 3.48Å; R302-L314 PolarHBondContact O-N 2.73Å; K304-L314 HydrophobicContact CB-CD2 4.08Å; Q312-L314 PolarHBondContact O-N 3Å; L314-N316 PolarHBondContact O-N 2.82Å
315	P	85.4	Confident	85.2	Confident	105 Å²	105	72 Å²	72	68%	0.682	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-48.5	139.4	171.7	-28.4	36.1	0	0	0	112.3	Q340	P315-Q340 WeakPolarHBondContact O-CB 3.47Å; P315-Q340 VanDerWaalsContact O-O 3.1Å
316	N	89.4	Confident	86.2	Confident	48 Å²	48	64.3 Å²	64.3	26%	0.257	38%	0.377	S	S	.	.			trans	-118.5	80	-178.8	-176.9	-5.9	0	0	0	108.9	L314 F318 Q319 L320	L314-N316 PolarHBondContact O-N 2.82Å; N316-F318 VanDerWaalsContact C-N 3.31Å; N316-F318 PolarHBondContact O-N 3.29Å; N316-Q319 PolarHBondContact O-N 3.11Å; N316-Q319 VanDerWaalsContact O-N 3.11Å; N316-Q319 WeakPolarHBondContact OD1-CA 3.35Å; N316-Q319 PolarHBondContact OD1-N 3.14Å; N316-Q319 VanDerWaalsContact OD1-N 3.1Å; N316-L320 PolarHBondContact ND2-O 2.79Å; N316-L320 PolarHBondContact OD1-N 2.58Å
317	L	89.1	Confident	87.4	Confident	37 Å²	37	63.5 Å²	63.5	19%	0.194	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-37	-169.1	178.3	61.1	0	0	0	113.8	Q340 I467 L469	L317-Q340 WeakPolarHBondContact CB-O 3.45Å; L317-Q340 PolarHBondContact N-O 2.74Å; L317-I467 HydrophobicContact CD1-CG2 4.09Å; L317-L469 HydrophobicContact CD1-CD1 4.01Å; L317-L469 HydrophobicContact CD1-CG 4.06Å; L317-L469 HydrophobicContact CD2-CD1 4.18Å; L317-L469 HydrophobicContact CD2-CD2 4.1Å; L317-L469 HydrophobicContact CD2-CG 4.26Å; L317-L469 HydrophobicContact CG-CD1 4.38Å
318	F	89.1	Confident	88.4	Confident	27 Å²	27	54.2 Å²	54.2	12%	0.118	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-2.9	-179.6	-66.9	-104.4	0	0	0	113.2	F249 I269 I279 N316 L320 T339	F249-F318 HydrophobicContact CD1-CD1 4.42Å; F249-F318 HydrophobicContact CD2-CD1 4.37Å; F249-F318 AromaticContact CE1-CD1 3.95Å; F249-F318 HydrophobicContact CE1-CD1 3.95Å; F249-F318 HydrophobicContact CE2-CB 4.28Å; F249-F318 AromaticContact CE2-CD1 3.87Å; F249-F318 HydrophobicContact CE2-CD1 3.87Å; F249-F318 HydrophobicContact CE2-CG 4.5Å; F249-F318 HydrophobicContact CZ-CB 4.12Å; F249-F318 AromaticContact CZ-CD1 3.66Å; F249-F318 HydrophobicContact CZ-CD1 3.66Å; F249-F318 HydrophobicContact CZ-CG 4.38Å; I269-F318 HydrophobicContact CD1-CE1 3.95Å; I269-F318 HydrophobicContact CD1-CZ 3.72Å; I269-F318 HydrophobicContact CG2-CE1 4.22Å; I279-F318 HydrophobicContact CD1-CE1 4.43Å; N316-F318 VanDerWaalsContact C-N 3.31Å; N316-F318 PolarHBondContact O-N 3.29Å; F318-L320 VanDerWaalsContact C-N 3.26Å; F318-L320 PolarHBondContact O-N 3.31Å; F318-T339 WeakPolarHBondContact CB-O 3.33Å; F318-T339 VanDerWaalsContact CD2-O 3.26Å; F318-T339 WeakPolarHBondContact CD2-O 3.29Å; F318-T339 HydrophobicContact CG-CG2 4.44Å; F318-T339 PolarHBondContact N-O 3.26Å
319	Q	90.9	Very high	89.4	Confident	142 Å²	142	46.9 Å²	46.9	66%	0.664	29%	0.286	S	S	*	.			trans	57.3	33.6	176.4	-56.1	179.9	4.4	0	0	114.1	N316 I467	N316-Q319 PolarHBondContact O-N 3.11Å; N316-Q319 VanDerWaalsContact O-N 3.11Å; N316-Q319 WeakPolarHBondContact OD1-CA 3.35Å; N316-Q319 PolarHBondContact OD1-N 3.14Å; N316-Q319 VanDerWaalsContact OD1-N 3.1Å; Q319-I467 HydrophobicContact CG-CD1 4Å
320	L	92.5	Very high	90.4	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.094	26%	0.263	C	S	.	.			trans	-87.7	148.5	173.2	-69.4	178.7	0	0	0	111	F249 N316 F318 Y322 M324 T339	F249-L320 HydrophobicContact CE2-CD1 3.98Å; F249-L320 HydrophobicContact CE2-CD2 4.45Å; F249-L320 HydrophobicContact CE2-CG 4.32Å; N316-L320 PolarHBondContact ND2-O 2.79Å; N316-L320 PolarHBondContact OD1-N 2.58Å; F318-L320 VanDerWaalsContact C-N 3.26Å; F318-L320 PolarHBondContact O-N 3.31Å; L320-Y322 HydrophobicContact CB-CD2 4.43Å; L320-Y322 HydrophobicContact CB-CE2 4.36Å; L320-Y322 VanDerWaalsContact CB-O 3.29Å; L320-Y322 WeakPolarHBondContact CB-O 3.47Å; L320-Y322 HydrophobicContact CD1-CD2 4.32Å; L320-Y322 HydrophobicContact CD1-CE2 3.8Å; L320-Y322 HydrophobicContact CD2-CE2 4.46Å; L320-Y322 HydrophobicContact CG-CE2 4.46Å; L320-Y322 PolarHBondContact O-N 3.09Å; L320-M324 HydrophobicContact CD1-CE 3.59Å; L320-T339 HydrophobicContact CD1-CG2 4.1Å
321	P	93.3	Very high	91.2	Very high	102 Å²	102	43.9 Å²	43.9	66%	0.662	25%	0.253	S	S	*	.	S	Bend	trans	-72.5	-8	175.7	28.8	-31.7	0	0	0	113.6
322	Y	95.1	Very high	92	Very high	25 Å²	25	40.6 Å²	40.6	10%	0.098	23%	0.229	C	C	.	.	S	Bend	trans	-135.1	164.1	178.8	47.8	-101.1	0	0	0	110.5	D246 Y298 L320 M324 P395	D246-Y322 WeakPolarHBondContact CB-OH 3.24Å; D246-Y322 PolarHBondContact OD2-OH 2.86Å; Y298-Y322 AromaticContact CD1-CD2 3.7Å; Y298-Y322 HydrophobicContact CD1-CD2 3.7Å; Y298-Y322 AromaticContact CD1-CE2 3.89Å; Y298-Y322 HydrophobicContact CD1-CE2 3.89Å; Y298-Y322 HydrophobicContact CD1-CG 4.22Å; Y298-Y322 HydrophobicContact CE1-CD2 4.21Å; Y298-Y322 AromaticContact CE1-CE2 3.9Å; Y298-Y322 HydrophobicContact CE1-CE2 3.9Å; L320-Y322 HydrophobicContact CB-CD2 4.43Å; L320-Y322 HydrophobicContact CB-CE2 4.36Å; L320-Y322 VanDerWaalsContact CB-O 3.29Å; L320-Y322 WeakPolarHBondContact CB-O 3.47Å; L320-Y322 HydrophobicContact CD1-CD2 4.32Å; L320-Y322 HydrophobicContact CD1-CE2 3.8Å; L320-Y322 HydrophobicContact CD2-CE2 4.46Å; L320-Y322 HydrophobicContact CG-CE2 4.46Å; L320-Y322 PolarHBondContact O-N 3.09Å; Y322-M324 HydrophobicContact CD2-CG 4.01Å; Y322-M324 HydrophobicContact CE2-CE 4.34Å; Y322-M324 HydrophobicContact CE2-CG 4.03Å; Y322-M324 HydrophobicContact CE2-SD 4.01Å; Y322-P395 HydrophobicContact CD1-CB 4.06Å; Y322-P395 HydrophobicContact CD1-CG 4.09Å; Y322-P395 HydrophobicContact CE1-CB 3.48Å; Y322-P395 VanDerWaalsContact CE1-CB 3.48Å; Y322-P395 HydrophobicContact CE1-CG 3.61Å; Y322-P395 HydrophobicContact CE2-CG 4.36Å
323	R	95.5	Very high	92.7	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.1	174.4	177	170.5	167.9	-81.3	1.2	110.5	F299 L301 D338 T339 Q340 L387	F299-R323 HydrophobicContact CB-CB 4.18Å; F299-R323 PolarHBondContact N-O 2.71Å; F299-R323 PolarHBondContact O-N 3.42Å; L301-R323 HydrophobicContact CD2-CB 4.3Å; R323-D338 HydrophobicContact CG-CB 4.02Å; R323-D338 IonicContact CZ-OD2 2.68Å; R323-D338 VanDerWaalsContact CZ-OD2 3.23Å; R323-D338 VanDerWaalsContact NE-CB 3.33Å; R323-D338 IonicContact NE-OD1 2.77Å; R323-D338 IonicContact NE-OD2 3.7Å; R323-D338 PolarHBondContact NE-OD2 3.32Å; R323-D338 IonicContact NH2-OD2 3.18Å; R323-D338 PolarHBondContact NH2-OD2 2.89Å; R323-T339 WeakPolarHBondContact CA-OG1 3.14Å; R323-Q340 VanDerWaalsContact CD-OE1 3.28Å; R323-L387 PolarHBondContact NH1-O 3.18Å
324	M	96.8	Very high	93.6	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	149	166.7	-62.9	-178.9	-61.3	0	0	109.5	T244 D246 Y298 L320 Y322 D338 T339	T244-M324 HydrophobicContact CG2-CE 3.84Å; D246-M324 HydrophobicContact CB-SD 4.22Å; D246-M324 WeakPolarHBondContact OD1-CE 3.26Å; Y298-M324 HydrophobicContact CD1-CG 3.85Å; Y298-M324 HydrophobicContact CD1-SD 4.25Å; Y298-M324 HydrophobicContact CE1-CG 3.99Å; Y298-M324 HydrophobicContact CE1-SD 3.76Å; L320-M324 HydrophobicContact CD1-CE 3.59Å; Y322-M324 HydrophobicContact CD2-CG 4.01Å; Y322-M324 HydrophobicContact CE2-CE 4.34Å; Y322-M324 HydrophobicContact CE2-CG 4.03Å; Y322-M324 HydrophobicContact CE2-SD 4.01Å; M324-D338 WeakPolarHBondContact O-CA 3.29Å; M324-D338 VanDerWaalsContact O-CB 3.27Å; M324-D338 WeakPolarHBondContact O-CB 3.45Å; M324-T339 HydrophobicContact CB-CG2 4.05Å; M324-T339 HydrophobicContact CE-CG2 3.95Å; M324-T339 PolarHBondContact N-OG1 3.08Å; M324-T339 PolarHBondContact O-N 2.85Å
325	V	97.8	Very high	94.2	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141	174.3	170.9	0	0	0	0	109.2	C295 F299 Y337 D338 F345 W361	C295-V325 HydrophobicContact CB-CB 4.07Å; C295-V325 HydrophobicContact CB-CG1 4.37Å; C295-V325 WeakPolarHBondContact CB-O 3.35Å; C295-V325 PolarHBondContact N-O 3.02Å; F299-V325 HydrophobicContact CD2-CG2 3.93Å; F299-V325 HydrophobicContact CE2-CB 4.18Å; F299-V325 HydrophobicContact CE2-CG2 3.82Å; V325-Y337 WeakPolarHBondContact CA-O 3.2Å; V325-D338 HydrophobicContact CG2-CB 4.38Å; V325-F345 HydrophobicContact CG1-CE1 4.2Å; V325-F345 HydrophobicContact CG1-CZ 3.83Å; V325-F345 HydrophobicContact CG2-CE1 4.32Å; V325-F345 HydrophobicContact CG2-CZ 4.27Å; V325-W361 HydrophobicContact CG1-CH2 3.98Å; V325-W361 HydrophobicContact CG1-CZ2 3.95Å
326	F	98.1	Very high	94.7	Very high	6 Å²	6	25 Å²	25	3%	0.026	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	150.1	172.4	64.5	-81.7	0	0	0	112.1	V251 I269 L282 V292 R293 C294 V328 Y337	V251-F326 HydrophobicContact CG1-CE2 4.34Å; I269-F326 HydrophobicContact CD1-CZ 4.23Å; L282-F326 HydrophobicContact CD1-CE2 3.77Å; L282-F326 HydrophobicContact CD1-CZ 4.03Å; V292-F326 HydrophobicContact CG1-CD2 4.19Å; R293-F326 CarbonylContact O-C 3.48Å; R293-F326 WeakPolarHBondContact O-CA 3.4Å; C294-F326 HydrophobicContact CB-CB 4.27Å; F326-V328 HydrophobicContact CD2-CG2 3.96Å; F326-V328 HydrophobicContact CE2-CG2 3.95Å; F326-Y337 HydrophobicContact CE2-CD2 4.11Å; F326-Y337 HydrophobicContact CE2-CG 4.09Å; F326-Y337 HydrophobicContact CZ-CG 4.05Å; F326-Y337 PolarHBondContact N-O 3Å; F326-Y337 PolarHBondContact O-N 2.87Å
327	A	98.3	Very high	95.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.1	176.8	0	0	0	0	0	110	V292 R293 I334 F335 L336 L359 W361 L368	V292-A327 WeakPolarHBondContact CA-O 3.39Å; R293-A327 PolarHBondContact N-O 2.78Å; R293-A327 PolarHBondContact O-N 2.7Å; A327-I334 HydrophobicContact CB-CG2 4.16Å; A327-F335 WeakPolarHBondContact CA-O 3.16Å; A327-L336 HydrophobicContact CB-CD2 3.79Å; A327-L359 HydrophobicContact CB-CD1 3.82Å; A327-W361 HydrophobicContact CB-CZ2 4.09Å; A327-L368 HydrophobicContact CB-CD1 4.44Å; A327-L368 HydrophobicContact CB-CD2 3.62Å
328	V	97.9	Very high	95.4	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.018	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.3	173.9	177.9	0	0	0	0	107.9	T267 L282 T289 V292 F326 I334 F335 Y337	T267-V328 HydrophobicContact CG2-CG1 4.44Å; T267-V328 HydrophobicContact CG2-CG2 4.38Å; T267-V328 VanDerWaalsContact OG1-CG1 3.29Å; T267-V328 WeakPolarHBondContact OG1-CG1 3.37Å; L282-V328 HydrophobicContact CD1-CG2 4.33Å; T289-V328 HydrophobicContact CG2-CG1 3.73Å; V292-V328 HydrophobicContact CG1-CG2 4.25Å; V292-V328 HydrophobicContact CG2-CG1 4.49Å; V292-V328 HydrophobicContact CG2-CG2 4.28Å; F326-V328 HydrophobicContact CD2-CG2 3.96Å; F326-V328 HydrophobicContact CE2-CG2 3.95Å; V328-I334 WeakPolarHBondContact O-CA 3.42Å; V328-F335 HydrophobicContact CB-CB 4.47Å; V328-F335 PolarHBondContact N-O 3.42Å; V328-F335 PolarHBondContact O-N 3.23Å; V328-Y337 HydrophobicContact CB-CE2 4.39Å; V328-Y337 HydrophobicContact CG2-CD2 3.98Å; V328-Y337 HydrophobicContact CG2-CE2 4.15Å
329	A	97	Very high	95.7	Very high	2 Å²	2	20.5 Å²	20.5	2%	0.017	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.9	172.6	0	0	0	0	0	111	T289 L290 A291 S333 L359	T289-A329 CarbonylContact C-O 3.59Å; T289-A329 VanDerWaalsContact CA-O 3.27Å; T289-A329 WeakPolarHBondContact CA-O 3.35Å; L290-A329 PolarHBondContact N-O 3Å; A291-A329 HydrophobicContact CB-CB 4.38Å; A291-A329 PolarHBondContact O-N 2.76Å; A329-S333 CarbonylContact C-O 3.52Å; A329-S333 WeakPolarHBondContact CA-O 3.32Å; A329-L359 HydrophobicContact CB-CD1 3.86Å; A329-L359 HydrophobicContact CB-CG 4.13Å
330	S	95.3	Very high	95.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-177.3	153	61.1	0	0	0	0	110.5	A288 D332 S333	A288-S330 VanDerWaalsContact O-CA 3.23Å; A288-S330 WeakPolarHBondContact O-CA 3.47Å; A288-S330 WeakPolarHBondContact O-CB 3.48Å; S330-D332 PolarHBondContact O-N 2.85Å; S330-D332 PolarHBondContact OG-N 2.8Å; S330-D332 PolarHBondContact OG-OD1 2.84Å; S330-S333 PolarHBondContact N-O 2.83Å; S330-S333 WeakPolarHBondContact OG-CA 3.34Å; S330-S333 VanDerWaalsContact OG-CB 3.23Å; S330-S333 WeakPolarHBondContact OG-CB 3.46Å; S330-S333 PolarHBondContact OG-N 2.94Å; S330-S333 PolarHBondContact OG-O 2.98Å
331	E	93.2	Very high	95.7	Very high	41 Å²	41	16 Å²	16	19%	0.192	8%	0.084	C	C	.	.	S	Bend	trans	-52.2	-32.8	169.8	-68.4	164.7	-124	0	0	113.5	K287 A288 L290 T355 L356	K287-E331 HydrophobicContact CB-CB 4.08Å; K287-E331 HydrophobicContact CB-CG 4.42Å; K287-E331 HydrophobicContact CD-CB 4.27Å; K287-E331 WeakPolarHBondContact CD-OE2 3.43Å; K287-E331 WeakPolarHBondContact CE-OE2 3.46Å; K287-E331 HydrophobicContact CG-CB 4.09Å; K287-E331 IonicContact NZ-OE2 3.23Å; K287-E331 PolarHBondContact NZ-OE2 2.85Å; A288-E331 PolarHBondContact N-OE1 3.31Å; A288-E331 PolarHBondContact O-N 3.46Å; L290-E331 HydrophobicContact CD1-CB 4.46Å; L290-E331 HydrophobicContact CD1-CG 4.06Å; L290-E331 HydrophobicContact CD2-CG 4.15Å; L290-E331 HydrophobicContact CG-CG 4.4Å; E331-T355 HydrophobicContact CB-CG2 4.04Å; E331-T355 HydrophobicContact CG-CG2 4.2Å; E331-T355 VanDerWaalsContact O-CA 3.27Å; E331-T355 WeakPolarHBondContact O-CA 3.44Å; E331-L356 PolarHBondContact O-N 3.22Å
332	D	93.4	Very high	95.4	Very high	39 Å²	39	14.3 Å²	14.3	21%	0.209	8%	0.075	C	C	.	.	S	Bend	trans	-126.8	-10.7	-166.6	60.2	-0	0	0	0	115.1	K287 S330 S349 N350	K287-D332 HydrophobicContact CG-CB 4.4Å; K287-D332 VanDerWaalsContact CG-CG 3.47Å; K287-D332 WeakPolarHBondContact CG-OD2 3.16Å; S330-D332 PolarHBondContact O-N 2.85Å; S330-D332 PolarHBondContact OG-N 2.8Å; S330-D332 PolarHBondContact OG-OD1 2.84Å; D332-S349 WeakPolarHBondContact O-CA 3.47Å; D332-N350 PolarHBondContact O-N 2.92Å
333	S	95.3	Very high	95.2	Very high	7 Å²	7	17.4 Å²	17.4	5%	0.049	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	157.3	-163.4	-47.1	0	0	0	0	113.1	A329 S330 V348 S349	A329-S333 CarbonylContact C-O 3.52Å; A329-S333 WeakPolarHBondContact CA-O 3.32Å; S330-S333 PolarHBondContact N-O 2.83Å; S330-S333 WeakPolarHBondContact OG-CA 3.34Å; S330-S333 VanDerWaalsContact OG-CB 3.23Å; S330-S333 WeakPolarHBondContact OG-CB 3.46Å; S330-S333 PolarHBondContact OG-N 2.94Å; S330-S333 PolarHBondContact OG-O 2.98Å; S333-V348 CarbonylContact C-O 3.41Å; S333-V348 VanDerWaalsContact CA-O 3.32Å; S333-V348 WeakPolarHBondContact CA-O 3.14Å; S333-S349 WeakPolarHBondContact OG-CB 3.2Å
334	I	96.8	Very high	95.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.6	177.2	-53	170.9	0	0	0	108.2	A327 V328 L336 L347 V348 I351 L356 L359 L368 V370 L380	A327-I334 HydrophobicContact CB-CG2 4.16Å; V328-I334 WeakPolarHBondContact O-CA 3.42Å; I334-L336 HydrophobicContact CG2-CD2 4.23Å; I334-L347 WeakPolarHBondContact O-CA 3.41Å; I334-V348 PolarHBondContact N-O 2.88Å; I334-V348 PolarHBondContact O-N 2.88Å; I334-I351 HydrophobicContact CD1-CD1 4.03Å; I334-L356 HydrophobicContact CD1-CD1 4.28Å; I334-L356 HydrophobicContact CG1-CD1 3.7Å; I334-L359 HydrophobicContact CD1-CD2 3.98Å; I334-L359 HydrophobicContact CG1-CD2 4.34Å; I334-L368 HydrophobicContact CG2-CD2 4.21Å; I334-V370 HydrophobicContact CD1-CB 4.25Å; I334-V370 HydrophobicContact CD1-CG1 3.84Å; I334-V370 HydrophobicContact CD1-CG2 3.37Å; I334-L380 HydrophobicContact CD1-CD1 4.25Å
335	F	97.2	Very high	95	Very high	22 Å²	22	20.5 Å²	20.5	10%	0.096	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.9	178.5	-58.2	-99.7	0	0	0	109.2	A327 V328 Y337 P344 L347	A327-F335 WeakPolarHBondContact CA-O 3.16Å; V328-F335 HydrophobicContact CB-CB 4.47Å; V328-F335 PolarHBondContact N-O 3.42Å; V328-F335 PolarHBondContact O-N 3.23Å; F335-Y337 HydrophobicContact CB-CD2 4.01Å; F335-Y337 HydrophobicContact CB-CE2 3.41Å; F335-Y337 VanDerWaalsContact CB-CE2 3.41Å; F335-Y337 HydrophobicContact CG-CE2 4.33Å; F335-P344 HydrophobicContact CB-CB 4.4Å; F335-P344 HydrophobicContact CD1-CG 4.38Å; F335-L347 HydrophobicContact CD1-CD1 3.8Å; F335-L347 HydrophobicContact CD2-CD1 4.5Å; F335-L347 HydrophobicContact CE1-CD1 3.66Å; F335-L347 HydrophobicContact CE2-CD1 4.37Å; F335-L347 HydrophobicContact CG-CD1 4.22Å; F335-L347 HydrophobicContact CZ-CD1 3.96Å
336	L	97.5	Very high	94.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.2	178.5	-58.4	-179.5	0	0	0	110	M1 A327 I334 P344 F345 G346 W361 L368 F382	M1-L336 HydrophobicContact SD-CD1 3.97Å; A327-L336 HydrophobicContact CB-CD2 3.79Å; I334-L336 HydrophobicContact CG2-CD2 4.23Å; L336-P344 CarbonylContact O-C 3.6Å; L336-P344 WeakPolarHBondContact O-CA 3.15Å; L336-P344 WeakPolarHBondContact O-CB 3.23Å; L336-F345 HydrophobicContact CB-CD2 4.21Å; L336-F345 HydrophobicContact CB-CE1 4.13Å; L336-F345 HydrophobicContact CB-CE2 3.76Å; L336-F345 HydrophobicContact CB-CZ 3.72Å; L336-F345 HydrophobicContact CD1-CE2 4.04Å; L336-F345 WeakPolarHBondContact O-CD1 3.27Å; L336-F345 PolarHBondContact O-N 2.87Å; L336-G346 PolarHBondContact N-O 2.77Å; L336-W361 HydrophobicContact CD2-CH2 4.42Å; L336-W361 HydrophobicContact CD2-CZ2 4.25Å; L336-L368 HydrophobicContact CD2-CD2 3.81Å; L336-F382 HydrophobicContact CD1-CE1 3.97Å; L336-F382 HydrophobicContact CD1-CZ 3.91Å
337	Y	97.3	Very high	94.6	Very high	13 Å²	13	24.7 Å²	24.7	5%	0.051	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	162.3	-177.4	-71.4	-84.7	0	0	0	111.6	L282 V325 F326 V328 F335 P344 F345	L282-Y337 HydrophobicContact CB-CE2 4.49Å; L282-Y337 HydrophobicContact CD1-CD1 4.27Å; L282-Y337 HydrophobicContact CD1-CD2 3.95Å; L282-Y337 HydrophobicContact CD1-CE1 4.17Å; L282-Y337 HydrophobicContact CD1-CE2 3.82Å; L282-Y337 HydrophobicContact CD1-CG 4.17Å; L282-Y337 HydrophobicContact CD2-CD1 4.19Å; L282-Y337 HydrophobicContact CD2-CE1 3.84Å; L282-Y337 HydrophobicContact CG-CE1 4.39Å; V325-Y337 WeakPolarHBondContact CA-O 3.2Å; F326-Y337 HydrophobicContact CE2-CD2 4.11Å; F326-Y337 HydrophobicContact CE2-CG 4.09Å; F326-Y337 HydrophobicContact CZ-CG 4.05Å; F326-Y337 PolarHBondContact N-O 3Å; F326-Y337 PolarHBondContact O-N 2.87Å; V328-Y337 HydrophobicContact CB-CE2 4.39Å; V328-Y337 HydrophobicContact CG2-CD2 3.98Å; V328-Y337 HydrophobicContact CG2-CE2 4.15Å; F335-Y337 HydrophobicContact CB-CD2 4.01Å; F335-Y337 HydrophobicContact CB-CE2 3.41Å; F335-Y337 VanDerWaalsContact CB-CE2 3.41Å; F335-Y337 HydrophobicContact CG-CE2 4.33Å; Y337-P344 HydrophobicContact CD1-CB 4.15Å; Y337-P344 HydrophobicContact CE1-CB 3.88Å; Y337-P344 HydrophobicContact CE1-CG 4.2Å; Y337-P344 HydrophobicContact CE2-CB 4.31Å; Y337-P344 HydrophobicContact CG-CB 4.48Å; Y337-F345 WeakPolarHBondContact O-CE1 3.15Å
338	D	95.6	Very high	94.5	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.011	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	176.7	170.5	71.7	50.7	0	0	0	112.9	R302 R323 M324 V325 Q340 Q341 F345	R302-D338 IonicContact CZ-OD2 3.28Å; R302-D338 IonicContact NE-OD2 2.68Å; R302-D338 IonicContact NH2-OD2 3.38Å; R302-D338 PolarHBondContact NH2-OD2 2.85Å; R323-D338 HydrophobicContact CG-CB 4.02Å; R323-D338 IonicContact CZ-OD2 2.68Å; R323-D338 VanDerWaalsContact CZ-OD2 3.23Å; R323-D338 VanDerWaalsContact NE-CB 3.33Å; R323-D338 IonicContact NE-OD1 2.77Å; R323-D338 IonicContact NE-OD2 3.7Å; R323-D338 PolarHBondContact NE-OD2 3.32Å; R323-D338 IonicContact NH2-OD2 3.18Å; R323-D338 PolarHBondContact NH2-OD2 2.89Å; M324-D338 WeakPolarHBondContact O-CA 3.29Å; M324-D338 VanDerWaalsContact O-CB 3.27Å; M324-D338 WeakPolarHBondContact O-CB 3.45Å; V325-D338 HydrophobicContact CG2-CB 4.38Å; D338-Q340 WeakPolarHBondContact OD1-CA 3.38Å; D338-Q340 WeakPolarHBondContact OD1-CB 3.4Å; D338-Q340 PolarHBondContact OD1-N 2.9Å; D338-Q341 WeakPolarHBondContact OD1-CG 3.32Å; D338-Q341 PolarHBondContact OD1-N 3.26Å; D338-Q341 VanDerWaalsContact OD1-N 3.12Å; D338-F345 HydrophobicContact CB-CD1 4.37Å; D338-F345 HydrophobicContact CB-CE1 4.08Å
339	T	94.9	Very high	94.3	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	15%	0.153	C	C	.	.	S	Bend	trans	-89.9	10.4	-176.7	57.4	0	0	0	0	115.4	F318 L320 R323 M324	F318-T339 WeakPolarHBondContact CB-O 3.33Å; F318-T339 VanDerWaalsContact CD2-O 3.26Å; F318-T339 WeakPolarHBondContact CD2-O 3.29Å; F318-T339 HydrophobicContact CG-CG2 4.44Å; F318-T339 PolarHBondContact N-O 3.26Å; L320-T339 HydrophobicContact CD1-CG2 4.1Å; R323-T339 WeakPolarHBondContact CA-OG1 3.14Å; M324-T339 HydrophobicContact CB-CG2 4.05Å; M324-T339 HydrophobicContact CE-CG2 3.95Å; M324-T339 PolarHBondContact N-OG1 3.08Å; M324-T339 PolarHBondContact O-N 2.85Å
340	Q	92	Very high	94	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.033	19%	0.185	C	C	.	.	S	Bend	trans	-104.1	-42	172.6	-78.8	-171.3	-88.5	0	0	113.2	L301 R302 P315 L317 R323 D338	L301-Q340 HydrophobicContact CD2-CG 3.78Å; R302-Q340 PolarHBondContact O-NE2 3Å; P315-Q340 WeakPolarHBondContact O-CB 3.47Å; P315-Q340 VanDerWaalsContact O-O 3.1Å; L317-Q340 WeakPolarHBondContact CB-O 3.45Å; L317-Q340 PolarHBondContact N-O 2.74Å; R323-Q340 VanDerWaalsContact CD-OE1 3.28Å; D338-Q340 WeakPolarHBondContact OD1-CA 3.38Å; D338-Q340 WeakPolarHBondContact OD1-CB 3.4Å; D338-Q340 PolarHBondContact OD1-N 2.9Å
341	Q	91	Very high	93.9	Very high	58 Å²	58	35.1 Å²	35.1	27%	0.271	19%	0.192	S	C	.	.			trans	-106.7	162.3	-172.4	63	179.4	60.4	0	0	113.8	D338 L343	D338-Q341 WeakPolarHBondContact OD1-CG 3.32Å; D338-Q341 PolarHBondContact OD1-N 3.26Å; D338-Q341 VanDerWaalsContact OD1-N 3.12Å; Q341-L343 WeakPolarHBondContact CG-O 3.33Å; Q341-L343 PolarHBondContact NE2-O 3.08Å
342	S	87.9	Confident	94	Very high	67 Å²	67	34.3 Å²	34.3	47%	0.469	19%	0.189	S	C	.	.	S	Bend	trans	-90.8	-18.1	-179.8	50.9	0	0	0	0	115.1
343	L	91.2	Very high	93.8	Very high	90 Å²	90	43.1 Å²	43.1	47%	0.471	22%	0.221	S	C	.	.	S	Bend	trans	-105	162.8	-178.5	-63.7	179.4	0	0	0	110.6	Q341 L560	Q341-L343 WeakPolarHBondContact CG-O 3.33Å; Q341-L343 PolarHBondContact NE2-O 3.08Å; L343-L560 HydrophobicContact CD1-CB 4.43Å; L343-L560 HydrophobicContact CD1-CD1 4.34Å
344	P	94.3	Very high	93.8	Very high	28 Å²	28	48.6 Å²	48.6	18%	0.182	25%	0.245	C	C	.	.			trans	-67.9	143.5	165.7	29.5	-33.6	0	0	0	110.5	F335 L336 Y337	F335-P344 HydrophobicContact CB-CB 4.4Å; F335-P344 HydrophobicContact CD1-CG 4.38Å; L336-P344 CarbonylContact O-C 3.6Å; L336-P344 WeakPolarHBondContact O-CA 3.15Å; L336-P344 WeakPolarHBondContact O-CB 3.23Å; Y337-P344 HydrophobicContact CD1-CB 4.15Å; Y337-P344 HydrophobicContact CE1-CB 3.88Å; Y337-P344 HydrophobicContact CE1-CG 4.2Å; Y337-P344 HydrophobicContact CE2-CB 4.31Å; Y337-P344 HydrophobicContact CG-CB 4.48Å
345	F	93.6	Very high	93.6	Very high	42 Å²	42	51 Å²	51	18%	0.184	26%	0.26	C	S	.	.	S	Bend	trans	-90.8	-13.3	171.1	64	-98.3	0	0	0	112.9	V325 L336 Y337 D338 L387	V325-F345 HydrophobicContact CG1-CE1 4.2Å; V325-F345 HydrophobicContact CG1-CZ 3.83Å; V325-F345 HydrophobicContact CG2-CE1 4.32Å; V325-F345 HydrophobicContact CG2-CZ 4.27Å; L336-F345 HydrophobicContact CB-CD2 4.21Å; L336-F345 HydrophobicContact CB-CE1 4.13Å; L336-F345 HydrophobicContact CB-CE2 3.76Å; L336-F345 HydrophobicContact CB-CZ 3.72Å; L336-F345 HydrophobicContact CD1-CE2 4.04Å; L336-F345 WeakPolarHBondContact O-CD1 3.27Å; L336-F345 PolarHBondContact O-N 2.87Å; Y337-F345 WeakPolarHBondContact O-CE1 3.15Å; D338-F345 HydrophobicContact CB-CD1 4.37Å; D338-F345 HydrophobicContact CB-CE1 4.08Å; F345-L387 HydrophobicContact CE2-CD2 3.98Å; F345-L387 HydrophobicContact CZ-CD2 4.01Å
346	G	93.6	Very high	93.5	Very high	6 Å²	6	50.1 Å²	50.1	6%	0.062	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	145.1	175.9	0	0	0	0	0	111.3	L336	L336-G346 PolarHBondContact N-O 2.77Å
347	L	94.4	Very high	93.5	Very high	89 Å²	89	50.3 Å²	50.3	47%	0.466	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.6	170.8	172.4	58.7	0	0	0	107.6	I334 F335	I334-L347 WeakPolarHBondContact O-CA 3.41Å; F335-L347 HydrophobicContact CD1-CD1 3.8Å; F335-L347 HydrophobicContact CD2-CD1 4.5Å; F335-L347 HydrophobicContact CE1-CD1 3.66Å; F335-L347 HydrophobicContact CE2-CD1 4.37Å; F335-L347 HydrophobicContact CG-CD1 4.22Å; F335-L347 HydrophobicContact CZ-CD1 3.96Å
348	V	95.1	Very high	93.5	Very high	10 Å²	10	49.7 Å²	49.7	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	121	171.6	175.1	0	0	0	0	107	M1 V3 S333 I334 I351 L380	M1-V348 HydrophobicContact CE-CG2 3.43Å; M1-V348 VanDerWaalsContact CE-CG2 3.43Å; M1-V348 HydrophobicContact SD-CG2 4.12Å; V3-V348 HydrophobicContact CG1-CG1 4.23Å; V3-V348 HydrophobicContact CG2-CG1 4.13Å; V3-V348 HydrophobicContact CG2-CG2 4.17Å; S333-V348 CarbonylContact C-O 3.41Å; S333-V348 VanDerWaalsContact CA-O 3.32Å; S333-V348 WeakPolarHBondContact CA-O 3.14Å; I334-V348 PolarHBondContact N-O 2.88Å; I334-V348 PolarHBondContact O-N 2.88Å; V348-I351 HydrophobicContact CG1-CD1 4.14Å; V348-I351 HydrophobicContact CG1-CG1 4.39Å; V348-I351 HydrophobicContact CG1-CG2 3.47Å; V348-I351 VanDerWaalsContact CG1-CG2 3.47Å; V348-L380 HydrophobicContact CB-CD2 4.34Å; V348-L380 HydrophobicContact CG2-CD2 3.88Å; V348-L380 HydrophobicContact CG2-CG 4.46Å
349	S	94.2	Very high	93.6	Very high	52 Å²	52	49.6 Å²	49.6	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	159.3	-175.2	58.7	0	0	0	0	111.7	D332 S333 I351	D332-S349 WeakPolarHBondContact O-CA 3.47Å; S333-S349 WeakPolarHBondContact OG-CB 3.2Å; S349-I351 PolarHBondContact O-N 2.79Å
350	N	90	Very high	93.7	Very high	129 Å²	129	49.7 Å²	49.7	69%	0.69	26%	0.255	S	S	*	.	S	Bend	trans	55.5	38.3	178.4	-55.4	-25.9	0	0	0	113.2	D332	D332-N350 PolarHBondContact O-N 2.92Å
351	I	93.9	Very high	94	Very high	32 Å²	32	49.5 Å²	49.5	16%	0.164	25%	0.254	C	S	.	.			trans	-89.9	-5.8	175.6	53.3	159.9	0	0	0	113.5	V3 I334 V348 S349 V370	V3-I351 HydrophobicContact CG1-CG2 3.96Å; I334-I351 HydrophobicContact CD1-CD1 4.03Å; V348-I351 HydrophobicContact CG1-CD1 4.14Å; V348-I351 HydrophobicContact CG1-CG1 4.39Å; V348-I351 HydrophobicContact CG1-CG2 3.47Å; V348-I351 VanDerWaalsContact CG1-CG2 3.47Å; S349-I351 PolarHBondContact O-N 2.79Å; I351-V370 HydrophobicContact CD1-CG1 4.41Å
352	H	94.3	Very high	94.2	Very high	25 Å²	25	46.8 Å²	46.8	12%	0.116	24%	0.241	C	C	.	.	S	Bend	trans	-142.3	155	-177.6	-83.5	-74.3	0	0	0	108.8	L356 S372 D374 Y376 S378	H352-L356 HydrophobicContact CB-CD2 3.94Å; H352-S372 WeakPolarHBondContact ND1-CB 3.41Å; H352-S372 PolarHBondContact ND1-OG 3.28Å; H352-D374 WeakPolarHBondContact CA-OD2 3.37Å; H352-D374 WeakPolarHBondContact CB-OD2 3.15Å; H352-D374 IonicContact CE1-OD1 3.12Å; H352-D374 IonicContact CG-OD1 2.66Å; H352-D374 IonicContact CG-OD2 3.21Å; H352-D374 IonicContact ND1-OD1 2.91Å; H352-D374 PolarHBondContact ND1-OD1 3.41Å; H352-D374 IonicContact ND1-OD2 3.91Å; H352-D374 PolarHBondContact ND1-OD2 2.87Å; H352-Y376 PolarHBondContact CE1-O 2.72Å; H352-Y376 VanDerWaalsContact CE1-O 3.29Å; H352-S378 PolarHBondContact CE1-OG 3.02Å; H352-S378 WeakPolarHBondContact NE2-CB 3.13Å; H352-S378 PolarHBondContact NE2-OG 3.44Å
353	Y	91	Very high	94.4	Very high	224 Å²	224	45.8 Å²	45.8	88%	0.878	23%	0.234	S	C	*	.	S	Bend	trans	-88.8	-28.1	-178.9	-74.1	-78.7	0	0	0	112.8	D374	Y353-D374 PolarHBondContact N-OD2 3.28Å
354	H	93.3	Very high	94.4	Very high	122 Å²	122	45.2 Å²	45.2	57%	0.565	23%	0.232	S	C	*	.	S	Bend	trans	-115.8	-173.1	174	-64.5	94.9	0	0	0	110.7	T373 D374	H354-T373 VanDerWaalsContact CB-OG1 3.3Å; H354-T373 WeakPolarHBondContact CB-OG1 3.45Å; H354-D374 HydrophobicContact CB-CB 3.97Å; H354-D374 PolarHBondContact N-OD2 3.44Å
355	T	93.6	Very high	94.4	Very high	51 Å²	51	44 Å²	44	31%	0.313	23%	0.225	S	C	.	.			trans	-71.7	136.8	-170.5	52.3	0	0	0	0	113.2	E331 T373	E331-T355 HydrophobicContact CB-CG2 4.04Å; E331-T355 HydrophobicContact CG-CG2 4.2Å; E331-T355 VanDerWaalsContact O-CA 3.27Å; E331-T355 WeakPolarHBondContact O-CA 3.44Å; T355-T373 PolarHBondContact N-OG1 3.29Å; T355-T373 PolarHBondContact O-N 2.78Å; T355-T373 PolarHBondContact O-OG1 3Å; T355-T373 PolarHBondContact OG1-OG1 3.44Å
356	L	95.8	Very high	94.3	Very high	3 Å²	3	43 Å²	43	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	139.6	167.7	-51.6	-174.4	0	0	0	110.1	L290 E331 I334 H352 V370 S371	L290-L356 WeakPolarHBondContact CD1-O 3.41Å; E331-L356 PolarHBondContact O-N 3.22Å; I334-L356 HydrophobicContact CD1-CD1 4.28Å; I334-L356 HydrophobicContact CG1-CD1 3.7Å; H352-L356 HydrophobicContact CB-CD2 3.94Å; L356-V370 HydrophobicContact CD1-CG1 4.26Å; L356-V370 HydrophobicContact CD2-CG1 3.87Å; L356-V370 HydrophobicContact CG-CG1 4.48Å; L356-S371 WeakPolarHBondContact CA-O 3.35Å
357	S	95.8	Very high	94.4	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.028	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-34.9	-173.1	57.1	0	0	0	0	114.3	V16 R240 S371	V16-S357 WeakPolarHBondContact O-CB 3.5Å; V16-S357 PolarHBondContact O-OG 3Å; R240-S357 PolarHBondContact NH1-O 2.89Å; S357-S371 PolarHBondContact N-O 2.92Å; S357-S371 VanDerWaalsContact OG-C 3.3Å; S357-S371 WeakPolarHBondContact OG-CB 3.15Å; S357-S371 PolarHBondContact OG-O 2.98Å; S357-S371 PolarHBondContact OG-OG 2.7Å
358	D	97.6	Very high	94.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	167.1	179.6	-148.2	-7.5	0	0	0	111.2	S18 L19 R73 R240 R293 S371	S18-D358 WeakPolarHBondContact CA-OD2 3.33Å; S18-D358 WeakPolarHBondContact CB-OD2 3.2Å; S18-D358 PolarHBondContact OG-OD2 3.22Å; L19-D358 PolarHBondContact N-OD2 2.84Å; R73-D358 IonicContact CZ-OD2 2.7Å; R73-D358 VanDerWaalsContact CZ-OD2 3.23Å; R73-D358 IonicContact NH1-OD1 3.82Å; R73-D358 IonicContact NH1-OD2 3.81Å; R73-D358 PolarHBondContact NH1-OD2 3.2Å; R73-D358 IonicContact NH2-OD1 3Å; R73-D358 IonicContact NH2-OD2 3.5Å; R73-D358 PolarHBondContact NH2-OD2 3.3Å; R240-D358 WeakPolarHBondContact CD-OD1 3.19Å; R240-D358 IonicContact CZ-OD2 2.78Å; R240-D358 IonicContact NH1-OD1 3.65Å; R240-D358 IonicContact NH1-OD2 2.68Å; R240-D358 PolarHBondContact NH1-OD2 2.66Å; R293-D358 IonicContact CZ-OD1 2.84Å; R293-D358 IonicContact NE-OD1 3.62Å; R293-D358 IonicContact NH2-OD1 3.2Å; R293-D358 PolarHBondContact NH2-OD1 2.8Å; R293-D358 IonicContact NH2-OD2 3.29Å; D358-S371 WeakPolarHBondContact CB-OG 3.36Å; D358-S371 PolarHBondContact N-OG 3Å; D358-S371 PolarHBondContact O-N 3.48Å
359	L	97.9	Very high	94.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.2	171.7	-68	177.7	0	0	0	108.2	R293 A327 A329 I334 L368 A369 V370	R293-L359 HydrophobicContact CB-CB 4.17Å; R293-L359 WeakPolarHBondContact CD-O 3.27Å; R293-L359 HydrophobicContact CG-CB 3.62Å; R293-L359 WeakPolarHBondContact CG-O 3.23Å; R293-L359 PolarHBondContact NE-O 3.18Å; A327-L359 HydrophobicContact CB-CD1 3.82Å; A329-L359 HydrophobicContact CB-CD1 3.86Å; A329-L359 HydrophobicContact CB-CG 4.13Å; I334-L359 HydrophobicContact CD1-CD2 3.98Å; I334-L359 HydrophobicContact CG1-CD2 4.34Å; L359-L368 HydrophobicContact CB-CD1 4.12Å; L359-L368 HydrophobicContact CD2-CD1 4.15Å; L359-A369 WeakPolarHBondContact CA-O 3.31Å; L359-V370 HydrophobicContact CD2-CB 4.19Å; L359-V370 HydrophobicContact CD2-CG1 3.97Å; L359-V370 HydrophobicContact CD2-CG2 3.83Å
360	T	98.1	Very high	94.9	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	152.8	158.6	-164.9	0	0	0	0	112.2	L19 D20 F21 L32 L368 A369	L19-T360 HydrophobicContact CD1-CG2 3.52Å; D20-T360 VanDerWaalsContact CA-CG2 3.5Å; D20-T360 WeakPolarHBondContact OD1-CB 3.37Å; D20-T360 PolarHBondContact OD1-OG1 2.93Å; F21-T360 HydrophobicContact CB-CG2 4.19Å; F21-T360 HydrophobicContact CD2-CG2 3.49Å; F21-T360 VanDerWaalsContact CD2-CG2 3.49Å; F21-T360 HydrophobicContact CE2-CG2 4.23Å; F21-T360 HydrophobicContact CG-CG2 4.06Å; L32-T360 HydrophobicContact CD1-CG2 3.95Å; T360-L368 WeakPolarHBondContact O-CA 3.21Å; T360-L368 WeakPolarHBondContact O-CD1 3.46Å; T360-A369 HydrophobicContact CG2-CB 4.31Å; T360-A369 PolarHBondContact N-O 2.73Å; T360-A369 PolarHBondContact O-N 3.37Å
361	W	97.6	Very high	95.2	Very high	3 Å²	3	29.5 Å²	29.5	1%	0.011	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138.7	177.8	-71.3	93.9	0	0	0	110.4	F21 H23 R293 C294 C295 V325 A327 L336 L368 F382 L387	F21-W361 VanDerWaalsContact CD2-C 3.44Å; H23-W361 PolarHBondContact NE2-O 3.14Å; R293-W361 PolarHBondContact O-NE1 3.23Å; C294-W361 VanDerWaalsContact C-CD1 3.42Å; C295-W361 HydrophobicContact CB-CD2 3.82Å; C295-W361 HydrophobicContact CB-CE3 4.11Å; C295-W361 HydrophobicContact CB-CG 4.18Å; C295-W361 HydrophobicContact CB-CH2 4.49Å; C295-W361 HydrophobicContact CB-CZ2 4.22Å; C295-W361 HydrophobicContact CB-CZ3 4.43Å; V325-W361 HydrophobicContact CG1-CH2 3.98Å; V325-W361 HydrophobicContact CG1-CZ2 3.95Å; A327-W361 HydrophobicContact CB-CZ2 4.09Å; L336-W361 HydrophobicContact CD2-CH2 4.42Å; L336-W361 HydrophobicContact CD2-CZ2 4.25Å; W361-L368 HydrophobicContact CD2-CB 4.04Å; W361-L368 HydrophobicContact CD2-CD1 4.1Å; W361-L368 HydrophobicContact CE3-CB 3.83Å; W361-L368 HydrophobicContact CG-CD1 4.22Å; W361-L368 HydrophobicContact CH2-CB 4.17Å; W361-L368 HydrophobicContact CH2-CD2 4.14Å; W361-L368 HydrophobicContact CZ2-CB 4.36Å; W361-L368 HydrophobicContact CZ2-CD2 3.83Å; W361-L368 HydrophobicContact CZ2-CG 4.48Å; W361-L368 HydrophobicContact CZ3-CB 3.9Å; W361-F382 AromaticContact CH2-CE2 3.84Å; W361-F382 HydrophobicContact CH2-CE2 3.84Å; W361-F382 HydrophobicContact CH2-CZ 4.03Å; W361-F382 HydrophobicContact CZ3-CD2 4.01Å; W361-F382 AromaticContact CZ3-CE2 3.48Å; W361-F382 HydrophobicContact CZ3-CE2 3.48Å; W361-F382 VanDerWaalsContact CZ3-CE2 3.48Å; W361-F382 HydrophobicContact CZ3-CZ 4.15Å; W361-L387 HydrophobicContact CH2-CD1 4.2Å; W361-L387 HydrophobicContact CZ3-CD1 3.84Å
362	S	95.4	Very high	95.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.			trans	-59	153.4	164.2	50.1	0	0	0	0	111	P296 D364 G365 S366 F367	P296-S362 VanDerWaalsContact CG-O 3.28Å; P296-S362 WeakPolarHBondContact CG-O 3.4Å; S362-D364 VanDerWaalsContact CB-OD1 3.28Å; S362-D364 WeakPolarHBondContact CB-OD1 3.38Å; S362-D364 PolarHBondContact O-N 3.37Å; S362-D364 PolarHBondContact OG-OD1 2.81Å; S362-D364 VanDerWaalsContact OG-OD1 3.04Å; S362-G365 PolarHBondContact O-N 2.96Å; S362-S366 PolarHBondContact OG-N 2.91Å; S362-F367 PolarHBondContact N-O 2.85Å; S362-F367 WeakPolarHBondContact OG-CA 3.44Å; S362-F367 PolarHBondContact OG-N 3.03Å; S362-F367 PolarHBondContact OG-O 3.32Å
363	S	92.4	Very high	95.3	Very high	46 Å²	46	28.2 Å²	28.2	32%	0.322	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.8	-175.2	49.9	0	0	0	0	114.5
364	D	91.2	Very high	95.5	Very high	78 Å²	78	18.5 Å²	18.5	42%	0.417	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-3	176.9	69	-29.2	0	0	0	113.3	H30 V297 S362 S366	H30-D364 IonicContact CE1-OD1 3.88Å; H30-D364 PolarHBondContact CE1-OD1 3.32Å; H30-D364 IonicContact CE1-OD2 3.78Å; H30-D364 IonicContact NE2-OD1 3.76Å; H30-D364 IonicContact NE2-OD2 3.58Å; V297-D364 VanDerWaalsContact CG2-C 3.44Å; V297-D364 WeakPolarHBondContact CG2-O 3.36Å; S362-D364 VanDerWaalsContact CB-OD1 3.28Å; S362-D364 WeakPolarHBondContact CB-OD1 3.38Å; S362-D364 PolarHBondContact O-N 3.37Å; S362-D364 PolarHBondContact OG-OD1 2.81Å; S362-D364 VanDerWaalsContact OG-OD1 3.04Å; D364-S366 VanDerWaalsContact C-N 3.25Å; D364-S366 PolarHBondContact O-N 3.18Å; D364-S366 PolarHBondContact OD1-N 2.61Å; D364-S366 PolarHBondContact OD1-OG 2.68Å; D364-S366 WeakPolarHBondContact OD2-CB 3.27Å; D364-S366 PolarHBondContact OD2-OG 2.84Å
365	G	92.9	Very high	95.5	Very high	4 Å²	4	12.7 Å²	12.7	4%	0.041	8%	0.077	C	C	.	.	S	Bend	trans	70.3	9.7	-177.9	0	0	0	0	0	115.7	S362 F367	S362-G365 PolarHBondContact O-N 2.96Å; G365-F367 VanDerWaalsContact C-N 3.32Å
366	S	92.6	Very high	95.6	Very high	21 Å²	21	13.3 Å²	13.3	15%	0.147	7%	0.074	C	C	.	.	S	Bend	trans	-72.8	-26.1	179.6	63.9	0	0	0	0	113.1	S362 D364 S381 F382	S362-S366 PolarHBondContact OG-N 2.91Å; D364-S366 VanDerWaalsContact C-N 3.25Å; D364-S366 PolarHBondContact O-N 3.18Å; D364-S366 PolarHBondContact OD1-N 2.61Å; D364-S366 PolarHBondContact OD1-OG 2.68Å; D364-S366 WeakPolarHBondContact OD2-CB 3.27Å; D364-S366 PolarHBondContact OD2-OG 2.84Å; S366-S381 WeakPolarHBondContact O-CA 3.32Å; S366-F382 PolarHBondContact O-N 2.87Å
367	F	95.3	Very high	95.7	Very high	1 Å²	1	13.2 Å²	13.2	0%	0.004	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.4	173.2	-61.1	-87.1	0	0	0	113	F21 H30 V46 Q48 A54 S362 G365 F379 L380 S381	F21-F367 HydrophobicContact CE2-CB 4.13Å; F21-F367 HydrophobicContact CZ-CB 4.12Å; H30-F367 AromaticContact CD2-CD2 3.9Å; H30-F367 AromaticContact CD2-CE2 3.84Å; H30-F367 AromaticContact NE2-CD2 3.99Å; H30-F367 AromaticContact NE2-CE2 3.95Å; V46-F367 HydrophobicContact CG1-CD1 4.48Å; V46-F367 HydrophobicContact CG1-CE1 4.38Å; V46-F367 HydrophobicContact CG1-CZ 4.44Å; Q48-F367 HydrophobicContact CB-CE2 4.47Å; Q48-F367 HydrophobicContact CB-CZ 3.95Å; A54-F367 HydrophobicContact CB-CD1 4.22Å; A54-F367 HydrophobicContact CB-CE1 3.71Å; S362-F367 PolarHBondContact N-O 2.85Å; S362-F367 WeakPolarHBondContact OG-CA 3.44Å; S362-F367 PolarHBondContact OG-N 3.03Å; S362-F367 PolarHBondContact OG-O 3.32Å; G365-F367 VanDerWaalsContact C-N 3.32Å; F367-F379 HydrophobicContact CD1-CB 4.42Å; F367-F379 HydrophobicContact CD1-CD1 4.35Å; F367-L380 WeakPolarHBondContact CA-O 3.3Å; F367-S381 WeakPolarHBondContact CD1-OG 3.42Å; F367-S381 WeakPolarHBondContact CE1-OG 3.45Å
368	L	97.8	Very high	95.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.3	156.4	168	59.2	0	0	0	108	A327 I334 L336 L359 T360 W361 L380 F382	A327-L368 HydrophobicContact CB-CD1 4.44Å; A327-L368 HydrophobicContact CB-CD2 3.62Å; I334-L368 HydrophobicContact CG2-CD2 4.21Å; L336-L368 HydrophobicContact CD2-CD2 3.81Å; L359-L368 HydrophobicContact CB-CD1 4.12Å; L359-L368 HydrophobicContact CD2-CD1 4.15Å; T360-L368 WeakPolarHBondContact O-CA 3.21Å; T360-L368 WeakPolarHBondContact O-CD1 3.46Å; W361-L368 HydrophobicContact CD2-CB 4.04Å; W361-L368 HydrophobicContact CD2-CD1 4.1Å; W361-L368 HydrophobicContact CE3-CB 3.83Å; W361-L368 HydrophobicContact CG-CD1 4.22Å; W361-L368 HydrophobicContact CH2-CB 4.17Å; W361-L368 HydrophobicContact CH2-CD2 4.14Å; W361-L368 HydrophobicContact CZ2-CB 4.36Å; W361-L368 HydrophobicContact CZ2-CD2 3.83Å; W361-L368 HydrophobicContact CZ2-CG 4.48Å; W361-L368 HydrophobicContact CZ3-CB 3.9Å; L368-L380 HydrophobicContact CB-CB 4.19Å; L368-L380 HydrophobicContact CD2-CD2 4.17Å; L368-L380 PolarHBondContact N-O 3.1Å; L368-L380 PolarHBondContact O-N 3.43Å; L368-F382 HydrophobicContact CB-CE2 4.05Å
369	A	98	Very high	95.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	150.9	176.2	0	0	0	0	0	111	L19 F21 L32 L359 T360 F379	L19-A369 HydrophobicContact CD1-CB 4.16Å; L19-A369 HydrophobicContact CD2-CB 4.08Å; F21-A369 HydrophobicContact CD2-CB 4.49Å; F21-A369 HydrophobicContact CE2-CB 3.72Å; F21-A369 HydrophobicContact CZ-CB 4.23Å; L32-A369 HydrophobicContact CD1-CB 4.27Å; L359-A369 WeakPolarHBondContact CA-O 3.31Å; T360-A369 HydrophobicContact CG2-CB 4.31Å; T360-A369 PolarHBondContact N-O 2.73Å; T360-A369 PolarHBondContact O-N 3.37Å; A369-F379 HydrophobicContact CB-CD1 3.73Å; A369-F379 HydrophobicContact CB-CE1 3.55Å; A369-F379 HydrophobicContact CB-CZ 4.4Å
370	V	97.9	Very high	95.6	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128	-170.6	-169.7	0	0	0	0	108.4	I334 I351 L356 L359 C377 S378 L380	I334-V370 HydrophobicContact CD1-CB 4.25Å; I334-V370 HydrophobicContact CD1-CG1 3.84Å; I334-V370 HydrophobicContact CD1-CG2 3.37Å; I351-V370 HydrophobicContact CD1-CG1 4.41Å; L356-V370 HydrophobicContact CD1-CG1 4.26Å; L356-V370 HydrophobicContact CD2-CG1 3.87Å; L356-V370 HydrophobicContact CG-CG1 4.48Å; L359-V370 HydrophobicContact CD2-CB 4.19Å; L359-V370 HydrophobicContact CD2-CG1 3.97Å; L359-V370 HydrophobicContact CD2-CG2 3.83Å; V370-C377 CarbonylContact O-C 3.41Å; V370-C377 WeakPolarHBondContact O-CA 3.49Å; V370-C377 WeakPolarHBondContact O-CB 3.43Å; V370-S378 WeakPolarHBondContact CB-O 3.46Å; V370-S378 PolarHBondContact N-O 2.8Å; V370-S378 PolarHBondContact O-N 3.12Å; V370-L380 HydrophobicContact CG2-CD1 3.92Å
371	S	97	Very high	95.4	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	153	171	54.2	0	0	0	0	111.4	L356 S357 D358	L356-S371 WeakPolarHBondContact CA-O 3.35Å; S357-S371 PolarHBondContact N-O 2.92Å; S357-S371 VanDerWaalsContact OG-C 3.3Å; S357-S371 WeakPolarHBondContact OG-CB 3.15Å; S357-S371 PolarHBondContact OG-O 2.98Å; S357-S371 PolarHBondContact OG-OG 2.7Å; D358-S371 WeakPolarHBondContact CB-OG 3.36Å; D358-S371 PolarHBondContact N-OG 3Å; D358-S371 PolarHBondContact O-N 3.48Å
372	S	96	Very high	95.2	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.3	179.4	176.6	0	0	0	0	111.9	V16 H352 D374 G375 Y376	V16-S372 PolarHBondContact N-O 2.87Å; H352-S372 WeakPolarHBondContact ND1-CB 3.41Å; H352-S372 PolarHBondContact ND1-OG 3.28Å; S372-D374 VanDerWaalsContact CB-OD1 3.25Å; S372-D374 WeakPolarHBondContact CB-OD1 2.94Å; S372-D374 PolarHBondContact O-N 3.12Å; S372-D374 PolarHBondContact OG-N 3.07Å; S372-D374 PolarHBondContact OG-OD1 2.94Å; S372-D374 VanDerWaalsContact OG-OD1 3.06Å; S372-D374 PolarHBondContact OG-OD2 3.44Å; S372-D374 VanDerWaalsContact OG-OD2 3.06Å; S372-G375 PolarHBondContact O-N 2.88Å; S372-Y376 PolarHBondContact N-O 3.06Å
373	T	95.1	Very high	95	Very high	31 Å²	31	16 Å²	16	19%	0.19	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	2.7	172.1	62.4	0	0	0	0	113.6	P15 Y17 H354 T355 G375	P15-T373 HydrophobicContact CB-CG2 4.46Å; Y17-T373 HydrophobicContact CD1-CG2 4.44Å; Y17-T373 HydrophobicContact CE1-CG2 4.39Å; H354-T373 VanDerWaalsContact CB-OG1 3.3Å; H354-T373 WeakPolarHBondContact CB-OG1 3.45Å; T355-T373 PolarHBondContact N-OG1 3.29Å; T355-T373 PolarHBondContact O-N 2.78Å; T355-T373 PolarHBondContact O-OG1 3Å; T355-T373 PolarHBondContact OG1-OG1 3.44Å; T373-G375 VanDerWaalsContact C-N 3.28Å
374	D	94.1	Very high	94.8	Very high	20 Å²	20	19.9 Å²	19.9	11%	0.107	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	3.8	166.5	60.6	29	0	0	0	114	H352 Y353 H354 S372 Y376	H352-D374 WeakPolarHBondContact CA-OD2 3.37Å; H352-D374 WeakPolarHBondContact CB-OD2 3.15Å; H352-D374 IonicContact CE1-OD1 3.12Å; H352-D374 IonicContact CG-OD1 2.66Å; H352-D374 IonicContact CG-OD2 3.21Å; H352-D374 IonicContact ND1-OD1 2.91Å; H352-D374 PolarHBondContact ND1-OD1 3.41Å; H352-D374 IonicContact ND1-OD2 3.91Å; H352-D374 PolarHBondContact ND1-OD2 2.87Å; Y353-D374 PolarHBondContact N-OD2 3.28Å; H354-D374 HydrophobicContact CB-CB 3.97Å; H354-D374 PolarHBondContact N-OD2 3.44Å; S372-D374 VanDerWaalsContact CB-OD1 3.25Å; S372-D374 WeakPolarHBondContact CB-OD1 2.94Å; S372-D374 PolarHBondContact O-N 3.12Å; S372-D374 PolarHBondContact OG-N 3.07Å; S372-D374 PolarHBondContact OG-OD1 2.94Å; S372-D374 VanDerWaalsContact OG-OD1 3.06Å; S372-D374 PolarHBondContact OG-OD2 3.44Å; S372-D374 VanDerWaalsContact OG-OD2 3.06Å; D374-Y376 VanDerWaalsContact O-CD2 3.23Å; D374-Y376 WeakPolarHBondContact O-CD2 3.16Å; D374-Y376 WeakPolarHBondContact O-CE2 3.24Å; D374-Y376 PolarHBondContact OD1-N 3.46Å
375	G	94.3	Very high	94.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	85.1	7.8	174.9	0	0	0	0	0	115.1	E14 S372 T373	E14-G375 WeakPolarHBondContact O-CA 3.25Å; S372-G375 PolarHBondContact O-N 2.88Å; T373-G375 VanDerWaalsContact C-N 3.28Å
376	Y	95.6	Very high	94.7	Very high	64 Å²	64	22 Å²	22	25%	0.251	14%	0.138	S	C	.	.			trans	-113.9	157	175.9	-59.3	-85.4	0	0	0	112.4	H352 S372 D374	H352-Y376 PolarHBondContact CE1-O 2.72Å; H352-Y376 VanDerWaalsContact CE1-O 3.29Å; S372-Y376 PolarHBondContact N-O 3.06Å; D374-Y376 VanDerWaalsContact O-CD2 3.23Å; D374-Y376 WeakPolarHBondContact O-CD2 3.16Å; D374-Y376 WeakPolarHBondContact O-CE2 3.24Å; D374-Y376 PolarHBondContact OD1-N 3.46Å
377	C	96.7	Very high	94.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.9	165.8	-56.5	0	0	0	0	111.1	C6 W10 L19 V370	C6-C377 PolarHBondContact N-O 3.07Å; C6-C377 VanDerWaalsContact N-O 3.12Å; W10-C377 HydrophobicContact CD2-CB 3.86Å; W10-C377 HydrophobicContact CE3-CB 4.21Å; W10-C377 HydrophobicContact CG-CB 4.43Å; W10-C377 HydrophobicContact CH2-CB 4.13Å; W10-C377 HydrophobicContact CZ2-CB 3.79Å; W10-C377 HydrophobicContact CZ3-CB 4.33Å; L19-C377 HydrophobicContact CD2-CB 4.25Å; V370-C377 CarbonylContact O-C 3.41Å; V370-C377 WeakPolarHBondContact O-CA 3.49Å; V370-C377 WeakPolarHBondContact O-CB 3.43Å
378	S	96.9	Very high	94.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.1	176.2	-65.6	0	0	0	0	111.4	V4 T5 H352 V370	V4-S378 CarbonylContact O-C 3.53Å; V4-S378 VanDerWaalsContact O-CA 3.31Å; V4-S378 WeakPolarHBondContact O-CA 3.29Å; T5-S378 WeakPolarHBondContact CA-OG 3.39Å; T5-S378 WeakPolarHBondContact CB-OG 3.33Å; T5-S378 WeakPolarHBondContact CG2-OG 3.44Å; T5-S378 PolarHBondContact OG1-OG 3.1Å; H352-S378 PolarHBondContact CE1-OG 3.02Å; H352-S378 WeakPolarHBondContact NE2-CB 3.13Å; H352-S378 PolarHBondContact NE2-OG 3.44Å; V370-S378 WeakPolarHBondContact CB-O 3.46Å; V370-S378 PolarHBondContact N-O 2.8Å; V370-S378 PolarHBondContact O-N 3.12Å
379	F	96.9	Very high	94.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.6	177.9	-63.8	-92	0	0	0	111.2	V3 V4 W10 F21 L32 V46 A54 V56 F367 A369	V3-F379 WeakPolarHBondContact CA-O 3.42Å; V4-F379 PolarHBondContact N-O 3.34Å; V4-F379 PolarHBondContact O-N 3.49Å; W10-F379 AromaticContact CH2-CE2 3.76Å; W10-F379 HydrophobicContact CH2-CE2 3.76Å; W10-F379 AromaticContact CH2-CZ 3.79Å; W10-F379 HydrophobicContact CH2-CZ 3.79Å; W10-F379 AromaticContact CZ2-CE2 3.82Å; W10-F379 HydrophobicContact CZ2-CE2 3.82Å; W10-F379 HydrophobicContact CZ2-CZ 4.33Å; F21-F379 HydrophobicContact CZ-CD1 4.49Å; F21-F379 HydrophobicContact CZ-CE1 4.03Å; L32-F379 HydrophobicContact CD2-CE1 4.03Å; L32-F379 HydrophobicContact CD2-CZ 3.75Å; V46-F379 HydrophobicContact CG1-CD1 4.17Å; V46-F379 HydrophobicContact CG1-CE1 3.82Å; V46-F379 HydrophobicContact CG1-CZ 4.31Å; V46-F379 HydrophobicContact CG2-CE1 3.96Å; V46-F379 HydrophobicContact CG2-CZ 4Å; A54-F379 HydrophobicContact CB-CB 3.63Å; A54-F379 HydrophobicContact CB-CD1 4.14Å; A54-F379 HydrophobicContact CB-CD2 3.74Å; A54-F379 HydrophobicContact CB-CE2 4.45Å; A54-F379 HydrophobicContact CB-CG 3.55Å; V56-F379 HydrophobicContact CG2-CD2 4.48Å; V56-F379 HydrophobicContact CG2-CE2 3.73Å; V56-F379 HydrophobicContact CG2-CZ 4.03Å; F367-F379 HydrophobicContact CD1-CB 4.42Å; F367-F379 HydrophobicContact CD1-CD1 4.35Å; A369-F379 HydrophobicContact CB-CD1 3.73Å; A369-F379 HydrophobicContact CB-CE1 3.55Å; A369-F379 HydrophobicContact CB-CZ 4.4Å
380	L	96.2	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	108.7	166.2	-78.9	63.7	0	0	0	107.4	M1 K2 V3 I334 V348 F367 L368 V370 F382	M1-L380 HydrophobicContact SD-CD2 4.21Å; K2-L380 CarbonylContact O-C 3.54Å; K2-L380 WeakPolarHBondContact O-CA 3.35Å; V3-L380 HydrophobicContact CG1-CD1 4.2Å; V3-L380 HydrophobicContact CG2-CG 4.3Å; I334-L380 HydrophobicContact CD1-CD1 4.25Å; V348-L380 HydrophobicContact CB-CD2 4.34Å; V348-L380 HydrophobicContact CG2-CD2 3.88Å; V348-L380 HydrophobicContact CG2-CG 4.46Å; F367-L380 WeakPolarHBondContact CA-O 3.3Å; L368-L380 HydrophobicContact CB-CB 4.19Å; L368-L380 HydrophobicContact CD2-CD2 4.17Å; L368-L380 PolarHBondContact N-O 3.1Å; L368-L380 PolarHBondContact O-N 3.43Å; V370-L380 HydrophobicContact CG2-CD1 3.92Å; L380-F382 HydrophobicContact CB-CE2 4.11Å; L380-F382 HydrophobicContact CB-CZ 4.11Å; L380-F382 WeakPolarHBondContact O-CE2 3.42Å
381	S	94.1	Very high	94.1	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.9	177.2	-55.9	0	0	0	0	111	M1 K2 S366 F367	M1-S381 CarbonylContact C-O 3.55Å; M1-S381 WeakPolarHBondContact CA-O 3.31Å; K2-S381 PolarHBondContact N-O 3.43Å; K2-S381 PolarHBondContact O-N 3.23Å; S366-S381 WeakPolarHBondContact O-CA 3.32Å; F367-S381 WeakPolarHBondContact CD1-OG 3.42Å; F367-S381 WeakPolarHBondContact CE1-OG 3.45Å
382	F	93.2	Very high	93.7	Very high	9 Å²	9	41.6 Å²	41.6	4%	0.039	24%	0.242	C	C	.	.			trans	-105	143.4	178.2	-58.6	-81.8	0	0	0	110.6	M1 L336 W361 S366 L368 L380 L387	M1-F382 HydrophobicContact CB-CD1 4.26Å; M1-F382 HydrophobicContact CB-CE1 4.22Å; M1-F382 HydrophobicContact CG-CD1 4.15Å; M1-F382 HydrophobicContact CG-CE1 3.72Å; M1-F382 HydrophobicContact CG-CZ 4.31Å; M1-F382 HydrophobicContact SD-CE1 3.77Å; M1-F382 HydrophobicContact SD-CZ 4.24Å; L336-F382 HydrophobicContact CD1-CE1 3.97Å; L336-F382 HydrophobicContact CD1-CZ 3.91Å; W361-F382 AromaticContact CH2-CE2 3.84Å; W361-F382 HydrophobicContact CH2-CE2 3.84Å; W361-F382 HydrophobicContact CH2-CZ 4.03Å; W361-F382 HydrophobicContact CZ3-CD2 4.01Å; W361-F382 AromaticContact CZ3-CE2 3.48Å; W361-F382 HydrophobicContact CZ3-CE2 3.48Å; W361-F382 VanDerWaalsContact CZ3-CE2 3.48Å; W361-F382 HydrophobicContact CZ3-CZ 4.15Å; S366-F382 PolarHBondContact O-N 2.87Å; L368-F382 HydrophobicContact CB-CE2 4.05Å; L380-F382 HydrophobicContact CB-CE2 4.11Å; L380-F382 HydrophobicContact CB-CZ 4.11Å; L380-F382 WeakPolarHBondContact O-CE2 3.42Å; F382-L387 HydrophobicContact CB-CD1 4.32Å; F382-L387 HydrophobicContact CB-CG 4.21Å; F382-L387 HydrophobicContact CD1-CD1 4.27Å; F382-L387 HydrophobicContact CD1-CD2 3.71Å; F382-L387 HydrophobicContact CD1-CG 3.87Å; F382-L387 HydrophobicContact CD2-CD1 4.02Å; F382-L387 HydrophobicContact CD2-CG 4.5Å; F382-L387 HydrophobicContact CE1-CD2 3.81Å; F382-L387 HydrophobicContact CE1-CG 4.42Å; F382-L387 HydrophobicContact CE2-CD1 4.47Å; F382-L387 HydrophobicContact CG-CD1 3.92Å; F382-L387 HydrophobicContact CG-CD2 4.22Å; F382-L387 HydrophobicContact CG-CG 3.92Å; F382-L387 HydrophobicContact CZ-CD2 4.4Å
383	S	90.7	Very high	93.4	Very high	60 Å²	60	49 Å²	49	42%	0.42	28%	0.277	S	S	.	.			trans	-79.5	153.5	174.2	-46.8	0	0	0	0	110.1	G385 E386	S383-G385 PolarHBondContact O-N 3.26Å; S383-E386 PolarHBondContact N-OE2 3.33Å; S383-E386 WeakPolarHBondContact O-CB 3.34Å; S383-E386 PolarHBondContact O-N 3.2Å; S383-E386 PolarHBondContact OG-OE2 3.22Å
384	P	89.4	Confident	93	Very high	126 Å²	126	51.7 Å²	51.7	82%	0.818	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	129.1	172.5	-28.6	36.2	0	0	0	111.9	E386	P384-E386 VanDerWaalsContact C-N 3.25Å; P384-E386 PolarHBondContact O-N 3.06Å
385	G	88.8	Confident	92.7	Very high	55 Å²	55	52.1 Å²	52.1	57%	0.567	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-5.4	-176.6	0	0	0	0	0	116.2	S383 L387 G388	S383-G385 PolarHBondContact O-N 3.26Å; G385-L387 PolarHBondContact O-N 3.06Å; G385-G388 WeakPolarHBondContact O-CA 3.26Å; G385-G388 PolarHBondContact O-N 2.7Å
386	E	91.6	Very high	92.3	Very high	71 Å²	71	59.1 Å²	59.1	33%	0.332	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-37.5	-177.3	-179.2	168.6	-162.1	0	0	113.2	M1 S383 P384 G388	M1-E386 PolarHBondContact N-OE1 3.24Å; M1-E386 PolarHBondContact N-OE2 3.2Å; S383-E386 PolarHBondContact N-OE2 3.33Å; S383-E386 WeakPolarHBondContact O-CB 3.34Å; S383-E386 PolarHBondContact O-N 3.2Å; S383-E386 PolarHBondContact OG-OE2 3.22Å; P384-E386 VanDerWaalsContact C-N 3.25Å; P384-E386 PolarHBondContact O-N 3.06Å; E386-G388 PolarHBondContact O-N 3.12Å
387	L	93.2	Very high	91.8	Very high	11 Å²	11	57.3 Å²	57.3	6%	0.058	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.3	170.8	-67.5	177.3	0	0	0	112.6	F299 R323 F345 W361 F382 G385	F299-L387 HydrophobicContact CD1-CB 4.46Å; F299-L387 HydrophobicContact CE1-CB 3.63Å; F299-L387 HydrophobicContact CE2-CB 4.43Å; F299-L387 HydrophobicContact CZ-CB 3.62Å; F299-L387 HydrophobicContact CZ-CD1 4.09Å; R323-L387 PolarHBondContact NH1-O 3.18Å; F345-L387 HydrophobicContact CE2-CD2 3.98Å; F345-L387 HydrophobicContact CZ-CD2 4.01Å; W361-L387 HydrophobicContact CH2-CD1 4.2Å; W361-L387 HydrophobicContact CZ3-CD1 3.84Å; F382-L387 HydrophobicContact CB-CD1 4.32Å; F382-L387 HydrophobicContact CB-CG 4.21Å; F382-L387 HydrophobicContact CD1-CD1 4.27Å; F382-L387 HydrophobicContact CD1-CD2 3.71Å; F382-L387 HydrophobicContact CD1-CG 3.87Å; F382-L387 HydrophobicContact CD2-CD1 4.02Å; F382-L387 HydrophobicContact CD2-CG 4.5Å; F382-L387 HydrophobicContact CE1-CD2 3.81Å; F382-L387 HydrophobicContact CE1-CG 4.42Å; F382-L387 HydrophobicContact CE2-CD1 4.47Å; F382-L387 HydrophobicContact CG-CD1 3.92Å; F382-L387 HydrophobicContact CG-CD2 4.22Å; F382-L387 HydrophobicContact CG-CG 3.92Å; F382-L387 HydrophobicContact CZ-CD2 4.4Å; G385-L387 PolarHBondContact O-N 3.06Å
388	G	92.3	Very high	91.1	Very high	16 Å²	16	65 Å²	65	17%	0.165	37%	0.372	C	S	.	.			trans	110.9	175.8	-171.9	0	0	0	0	0	112.7	G385 E386 P390	G385-G388 WeakPolarHBondContact O-CA 3.26Å; G385-G388 PolarHBondContact O-N 2.7Å; E386-G388 PolarHBondContact O-N 3.12Å; G388-P390 WeakPolarHBondContact O-CD 3.47Å
389	T	94.3	Very high	90.4	Very high	77 Å²	77	69.8 Å²	69.8	47%	0.472	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-69.8	127.1	172.7	-32.6	0	0	0	0	110.3	F299 E300	F299-T389 CarbonylContact C-O 3.57Å; F299-T389 WeakPolarHBondContact CA-O 3.45Å; F299-T389 WeakPolarHBondContact CB-O 3.07Å; E300-T389 HydrophobicContact CG-CG2 4.4Å; E300-T389 PolarHBondContact N-O 2.62Å; E300-T389 WeakPolarHBondContact OE2-CB 3.2Å; E300-T389 WeakPolarHBondContact OE2-CG2 3.44Å; E300-T389 PolarHBondContact OE2-OG1 3.02Å
390	P	95.1	Very high	89.4	Confident	73 Å²	73	74 Å²	74	47%	0.474	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-62.8	141.2	167.6	-22.7	35.2	0	0	0	111.5	V297 Y298 G388	V297-P390 HydrophobicContact CG1-CB 3.92Å; V297-P390 HydrophobicContact CG1-CG 4.36Å; Y298-P390 CarbonylContact O-C 3.41Å; Y298-P390 WeakPolarHBondContact O-CA 3.42Å; G388-P390 WeakPolarHBondContact O-CD 3.47Å
391	L	93.9	Very high	88	Confident	62 Å²	62	79 Å²	79	33%	0.325	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-73.4	131.5	174.9	-169.4	68.7	0	0	0	109.5	Y298 E300 E393	Y298-L391 PolarHBondContact O-N 3.32Å; E300-L391 HydrophobicContact CG-CD1 4.31Å; L391-E393 VanDerWaalsContact C-N 3.3Å; L391-E393 VanDerWaalsContact CD2-O 3.22Å; L391-E393 WeakPolarHBondContact CD2-O 3.23Å; L391-E393 WeakPolarHBondContact CG-O 3.38Å; L391-E393 PolarHBondContact O-N 3.38Å
392	K	90.1	Very high	85.8	Confident	195 Å²	195	82.3 Å²	82.3	85%	0.848	47%	0.466	S	S	*	.	S	Bend	trans	-59.7	-37.3	-173.7	-65	-179	-179.2	178.2	0	114.1
393	E	88.5	Confident	83.2	Confident	157 Å²	157	88.8 Å²	88.8	73%	0.734	50%	0.501	S	S	*	.	S	Bend	trans	-129.3	130.6	179	-69.3	173.3	-159.5	0	0	108.2	L391	L391-E393 VanDerWaalsContact C-N 3.3Å; L391-E393 VanDerWaalsContact CD2-O 3.22Å; L391-E393 WeakPolarHBondContact CD2-O 3.23Å; L391-E393 WeakPolarHBondContact CG-O 3.38Å; L391-E393 PolarHBondContact O-N 3.38Å
394	P	86.5	Confident	80.6	Confident	86 Å²	86	91.6 Å²	91.6	56%	0.558	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-68.6	150.3	176	29.9	-34.7	0	0	0	110.6	Y298 V396	Y298-P394 HydrophobicContact CD2-CB 3.91Å; Y298-P394 HydrophobicContact CE2-CB 3.95Å; P394-V396 PolarHBondContact O-N 2.68Å
395	P	89.3	Confident	77.9	Confident	29 Å²	29	88.5 Å²	88.5	19%	0.188	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-61.4	137.1	177.7	27.3	-35.5	0	0	0	111.6	Y298 Y322 L397	Y298-P395 HydrophobicContact CD1-CG 3.74Å; Y298-P395 HydrophobicContact CD2-CG 4.46Å; Y298-P395 HydrophobicContact CE1-CG 3.36Å; Y298-P395 HydrophobicContact CE2-CG 4.14Å; Y298-P395 HydrophobicContact CG-CG 4.26Å; Y322-P395 HydrophobicContact CD1-CB 4.06Å; Y322-P395 HydrophobicContact CD1-CG 4.09Å; Y322-P395 HydrophobicContact CE1-CB 3.48Å; Y322-P395 VanDerWaalsContact CE1-CB 3.48Å; Y322-P395 HydrophobicContact CE1-CG 3.61Å; Y322-P395 HydrophobicContact CE2-CG 4.36Å; P395-L397 WeakPolarHBondContact O-CD2 3.17Å; P395-L397 PolarHBondContact O-N 2.8Å
396	V	85.8	Confident	75.5	Confident	147 Å²	147	92 Å²	92	89%	0.891	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-63.4	130	174.6	-178.2	0	0	0	0	109.5	P394	P394-V396 PolarHBondContact O-N 2.68Å
397	L	84.3	Confident	72.7	Confident	27 Å²	27	97.7 Å²	97.7	14%	0.141	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-102.1	131.8	-180	-52.7	-174	0	0	0	110.5	P182 D246 P395 I399	P182-L397 HydrophobicContact CB-CD1 4.49Å; D246-L397 HydrophobicContact CB-CD2 4.07Å; P395-L397 WeakPolarHBondContact O-CD2 3.17Å; P395-L397 PolarHBondContact O-N 2.8Å; L397-I399 VanDerWaalsContact C-N 3.31Å; L397-I399 HydrophobicContact CB-CG1 4.4Å; L397-I399 PolarHBondContact O-N 3.07Å
398	E	82.3	Confident	69.9	Low	162 Å²	162	106.3 Å²	106.3	76%	0.757	59%	0.586	S	S	*	*			trans	-74	83.3	170.6	-68.4	-177.9	-177.8	0	0	109.9	F400	E398-F400 PolarHBondContact O-N 3.38Å
399	I	82.9	Confident	67.4	Low	100 Å²	100	115.8 Å²	115.8	51%	0.513	62%	0.622	S	S	.	*			trans	-71.4	118.5	178.3	-58.3	176.7	0	0	0	109.5	L397 V401	L397-I399 VanDerWaalsContact C-N 3.31Å; L397-I399 HydrophobicContact CB-CG1 4.4Å; L397-I399 PolarHBondContact O-N 3.07Å; I399-V401 HydrophobicContact CG2-CG2 4.46Å; I399-V401 PolarHBondContact O-N 2.94Å; I399-V401 VanDerWaalsContact O-N 3.14Å
400	F	75.3	Confident	64.4	Low	87 Å²	87	115.5 Å²	115.5	38%	0.382	64%	0.635	S	S	.	*			trans	-77.3	96.7	173.9	-174.4	-89.1	0	0	0	110.4	Q183 Q185 H202 E398 P402	Q183-F400 VanDerWaalsContact O-CB 3.31Å; Q183-F400 WeakPolarHBondContact O-CB 3.48Å; Q183-F400 PolarHBondContact O-N 3.15Å; Q185-F400 HydrophobicContact CG-CB 3.46Å; Q185-F400 VanDerWaalsContact CG-CB 3.46Å; Q185-F400 HydrophobicContact CG-CD2 4.24Å; Q185-F400 HydrophobicContact CG-CG 3.87Å; H202-F400 HydrophobicContact CB-CE1 3.95Å; H202-F400 HydrophobicContact CB-CZ 4.49Å; E398-F400 PolarHBondContact O-N 3.38Å; F400-P402 HydrophobicContact CD1-CG 4.47Å; F400-P402 HydrophobicContact CE1-CB 4.47Å; F400-P402 HydrophobicContact CE1-CG 4.42Å; F400-P402 WeakPolarHBondContact O-CD 3.46Å
401	V	65.9	Low	61.2	Low	107 Å²	107	122 Å²	122	65%	0.648	66%	0.656	S	S	*	*			trans	-79.3	121.4	169.6	-176.8	0	0	0	0	109	I399 N403	I399-V401 HydrophobicContact CG2-CG2 4.46Å; I399-V401 PolarHBondContact O-N 2.94Å; I399-V401 VanDerWaalsContact O-N 3.14Å; V401-N403 PolarHBondContact O-N 3.22Å
402	P	49.5	Very low	58.2	Low	71 Å²	71	129.4 Å²	129.4	46%	0.461	69%	0.685	S	S	.	*			trans	-70.4	113.9	176.6	-17.4	32	0	0	0	110.8	F400 S404	F400-P402 HydrophobicContact CD1-CG 4.47Å; F400-P402 HydrophobicContact CE1-CB 4.47Å; F400-P402 HydrophobicContact CE1-CG 4.42Å; F400-P402 WeakPolarHBondContact O-CD 3.46Å; P402-S404 PolarHBondContact O-N 3.01Å; P402-S404 VanDerWaalsContact O-N 3.14Å
403	N	37.1	Very low	55.3	Low	145 Å²	145	126.1 Å²	126.1	78%	0.775	69%	0.686	S	S	*	*			trans	-57.1	119.8	169.5	-87.6	-8.8	0	0	0	110	V401 G405	V401-N403 PolarHBondContact O-N 3.22Å; N403-G405 PolarHBondContact O-N 3.33Å
404	S	37.8	Very low	52.4	Low	119 Å²	119	124.1 Å²	124.1	83%	0.832	69%	0.69	S	S	*	*			trans	-76.8	42.5	179.1	48.3	0	0	0	0	112.9	P402 V406	P402-S404 PolarHBondContact O-N 3.01Å; P402-S404 VanDerWaalsContact O-N 3.14Å; S404-V406 PolarHBondContact O-N 3.22Å; S404-V406 VanDerWaalsContact O-N 3.08Å
405	G	32.6	Very low	49.6	Very low	61 Å²	61	124.9 Å²	124.9	63%	0.629	70%	0.703	S	S	*	*			trans	-66	105.1	176.9	0	0	0	0	0	111.3	N403 E407	N403-G405 PolarHBondContact O-N 3.33Å; G405-E407 VanDerWaalsContact C-N 3.35Å; G405-E407 PolarHBondContact O-N 2.66Å
406	V	37.3	Very low	46.6	Very low	129 Å²	129	128.5 Å²	128.5	78%	0.782	73%	0.73	S	S	*	*			trans	-72.3	90.5	172.4	-178.7	0	0	0	0	108.8	S404 K408	S404-V406 PolarHBondContact O-N 3.22Å; S404-V406 VanDerWaalsContact O-N 3.08Å; V406-K408 VanDerWaalsContact C-N 3.33Å; V406-K408 PolarHBondContact O-N 2.99Å
407	E	33.1	Very low	43.8	Very low	190 Å²	190	130.3 Å²	130.3	89%	0.888	73%	0.725	S	S	*	*			trans	-63.4	92.2	171.3	-73.5	-159.4	144.7	0	0	110.5	G405 K409	G405-E407 VanDerWaalsContact C-N 3.35Å; G405-E407 PolarHBondContact O-N 2.66Å; E407-K409 PolarHBondContact O-N 2.86Å
408	K	34.9	Very low	41	Very low	193 Å²	193	135.8 Å²	135.8	84%	0.839	76%	0.755	S	S	*	*			trans	-61.4	111.9	168.8	-79.8	-175.6	176	177	0	108.8	V406 G410	V406-K408 VanDerWaalsContact C-N 3.33Å; V406-K408 PolarHBondContact O-N 2.99Å; K408-G410 VanDerWaalsContact C-N 3.34Å; K408-G410 PolarHBondContact O-N 3.12Å
409	K	38.6	Very low	38.4	Very low	215 Å²	215	133.5 Å²	133.5	94%	0.935	76%	0.757	S	S	*	*			trans	-60.8	83.3	-177	-164.5	176	-173.8	178	0	112.4	E407	E407-K409 PolarHBondContact O-N 2.86Å
410	G	31.1	Very low	35.9	Very low	71 Å²	71	134.1 Å²	134.1	73%	0.732	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-70.3	149.8	179.2	0	0	0	0	0	113.7	K408	K408-G410 VanDerWaalsContact C-N 3.34Å; K408-G410 PolarHBondContact O-N 3.12Å
411	K	29.5	Very low	34.1	Very low	210 Å²	210	136.1 Å²	136.1	91%	0.913	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.5	147.6	-177.3	-73.8	177.7	175.2	175.9	0	112.5
412	K	30.6	Very low	32.3	Very low	217 Å²	217	137.4 Å²	137.4	94%	0.943	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.3	140.7	157.9	-69.8	-176.3	176.5	-177.4	0	110.2
413	S	27.7	Very low	31.2	Very low	125 Å²	125	139.6 Å²	139.6	87%	0.874	82%	0.817	S	S	*	*			trans	-142.8	173.6	153.9	60.1	0	0	0	0	108.5
414	S	28.6	Very low	30.6	Very low	115 Å²	115	141.6 Å²	141.6	80%	0.804	82%	0.821	S	S	*	*			trans	-127.2	136.2	-149.1	53.8	0	0	0	0	117
415	A	28	Very low	31.3	Very low	102 Å²	102	141.4 Å²	141.4	84%	0.843	82%	0.817	S	S	*	*			trans	76.8	148.8	142.5	0	0	0	0	0	122.1
416	S	25.3	Very low	31	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	82%	0.823	S	S	*	*			trans	93.4	95.8	149.9	-158.5	0	0	0	0	121.8
417	K	27.9	Very low	30.4	Very low	184 Å²	184	142.7 Å²	142.7	80%	0.8	82%	0.823	S	S	*	*				61.7	128.6	128.8	-67.5	-175.5	177.2	-179.4	0	123.4
418	N	25.9	Very low	30.1	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	82%	0.82	S	S	*	*			trans	90.2	141.8	132.4	-76.6	24.7	0	0	0	123.4
419	S	26.7	Very low	29.8	Very low	113 Å²	113	134.5 Å²	134.5	79%	0.79	82%	0.816	S	S	*	*			trans	65.7	119.5	151	43.9	0	0	0	0	121.6
420	S	30.6	Very low	30.2	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	81%	0.807	S	S	*	*			trans	-64.5	164.3	151	-32.9	0	0	0	0	111.2
421	P	37.8	Very low	30	Very low	129 Å²	129	133.8 Å²	133.8	84%	0.838	81%	0.812	S	S	*	*				-149.6	177	83.9	40.3	-21.8	0	0	0	117.9
422	V	28	Very low	31	Very low	134 Å²	134	129.4 Å²	129.4	81%	0.812	81%	0.805	S	S	*	*			trans	-55.2	145.8	177.2	173	0	0	0	0	116.3
423	S	25.7	Very low	31	Very low	118 Å²	118	123.5 Å²	123.5	83%	0.825	80%	0.797	S	S	*	*				-177.2	164.1	129.4	32.2	0	0	0	0	114.7
424	Q	24.7	Very low	31.2	Very low	186 Å²	186	122 Å²	122	87%	0.869	79%	0.787	S	S	*	*			trans	-115.8	-151.8	179.9	-67.1	-175.4	-61.4	0	0	110.5
425	P	53.4	Low	31.3	Very low	115 Å²	115	124.9 Å²	124.9	75%	0.747	79%	0.787	S	S	*	*				-128.1	176.2	-83.2	38.6	-22.5	0	0	0	115.3
426	S	24.8	Very low	31.3	Very low	107 Å²	107	125.4 Å²	125.4	75%	0.748	78%	0.78	S	S	*	*			trans	-168.2	133.3	159.5	24.5	0	0	0	0	108.6
427	S	26.1	Very low	31.6	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	78%	0.78	S	S	*	*				68.4	131.6	58.4	73.8	0	0	0	0	113.4
428	S	26	Very low	31.6	Very low	119 Å²	119	122.3 Å²	122.3	83%	0.832	78%	0.781	S	S	*	*			cis	-163.3	-178	9.7	33.3	0	0	0	0	112.8
429	A	28.4	Very low	31.8	Very low	92 Å²	92	118.5 Å²	118.5	76%	0.76	78%	0.776	S	S	*	*			trans	-79.2	-166.8	-176	0	0	0	0	0	113.6
430	P	46.7	Very low	32	Very low	116 Å²	116	123.2 Å²	123.2	75%	0.753	78%	0.783	S	S	*	*			cis	-148.2	169.4	24.3	45.2	-24.2	0	0	0	121
431	N	27.7	Very low	32	Very low	154 Å²	154	125.8 Å²	125.8	82%	0.824	78%	0.78	S	S	*	*			trans	16.6	166.1	135.1	-70.7	4.2	0	0	0	123
432	P	50.2	Low	31.5	Very low	118 Å²	118	125 Å²	125	77%	0.766	77%	0.768	S	S	*	*			cis	-148.7	-174.8	27.4	44.7	-23.9	0	0	0	120.6
433	A	31.1	Very low	31.5	Very low	93 Å²	93	123.6 Å²	123.6	77%	0.769	76%	0.764	S	S	*	*			trans	78.1	144.8	151.6	0	0	0	0	0	120.5
434	S	32.2	Very low	32.2	Very low	95 Å²	95	124.2 Å²	124.2	66%	0.664	77%	0.765	S	S	*	*			cis	-171.4	150.5	-12.3	52.1	0	0	0	0	115.2
435	Q	31.2	Very low	32.3	Very low	174 Å²	174	120.4 Å²	120.4	81%	0.813	76%	0.758	S	S	*	*			trans	70.3	151.4	154.5	-68.9	177.4	41	0	0	118.8
436	T	27.4	Very low	31.6	Very low	113 Å²	113	120.8 Å²	120.8	69%	0.693	76%	0.761	S	S	*	*			cis	-155.7	149.6	1.9	-3.2	0	0	0	0	113.9
437	S	30.2	Very low	31.7	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	76%	0.762	S	S	*	*			trans	50.5	142.3	150.5	57	0	0	0	0	122.2
438	S	29.9	Very low	32.7	Very low	119 Å²	119	121.8 Å²	121.8	83%	0.832	76%	0.76	S	S	*	*			cis	-177.8	166.9	-7.8	46.8	0	0	0	0	109
439	G	28.2	Very low	32.7	Very low	64 Å²	64	122.1 Å²	122.1	66%	0.66	76%	0.757	S	S	*	*			cis	136.1	138.5	-2.7	0	0	0	0	0	113.3
440	K	32.3	Very low	32.8	Very low	212 Å²	212	124.6 Å²	124.6	92%	0.922	76%	0.758	S	S	*	*			trans	81.1	140.6	-174.4	-56.7	172.3	179	174.7	0	113.9
441	K	29.1	Very low	31.9	Very low	167 Å²	167	127 Å²	127	73%	0.726	76%	0.759	S	S	*	*			cis	-149.4	177.8	-0.5	-123	173.7	163.1	-74.6	0	106.4
442	D	27.2	Very low	32	Very low	113 Å²	113	130 Å²	130	60%	0.604	76%	0.764	S	S	*	*			cis	-156.3	-167.3	9.7	-134.6	-23.1	0	0	0	111.3
443	S	29.5	Very low	30.9	Very low	104 Å²	104	133.3 Å²	133.3	73%	0.727	77%	0.767	S	S	*	*			trans	-151	-175.9	167	-44.5	0	0	0	0	109.2
444	P	40.6	Very low	30.6	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	77%	0.77	S	S	*	*			cis	-138.5	-168.5	19.2	44.7	-24.3	0	0	0	116.7
445	C	25.7	Very low	30.4	Very low	107 Å²	107	136.8 Å²	136.8	72%	0.723	78%	0.777	S	S	*	*			trans	-123.8	153.3	174.5	174.3	0	0	0	0	110
446	P	39.2	Very low	30.5	Very low	122 Å²	122	133 Å²	133	79%	0.792	77%	0.767	S	S	*	*			trans	-120.3	153.3	156.1	37	-26.6	0	0	0	114
447	T	26.4	Very low	30.5	Very low	128 Å²	128	136.8 Å²	136.8	79%	0.785	77%	0.774	S	S	*	*			trans	-118	-163.3	173.4	59	0	0	0	0	109.1
448	P	46.6	Very low	30.4	Very low	111 Å²	111	137.4 Å²	137.4	72%	0.721	78%	0.776	S	S	*	*			cis	-124.7	178	-40.7	34	-18.4	0	0	0	112.7
449	T	27.6	Very low	30.2	Very low	127 Å²	127	144 Å²	144	78%	0.779	78%	0.783	S	S	*	*			trans	-156.7	121.3	148.1	45.2	0	0	0	0	112.9
450	D	29.1	Very low	30.1	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	79%	0.789	S	S	*	*				42.1	110.3	129.4	-56.6	-11.3	0	0	0	119.8
451	E	27.7	Very low	30	Very low	167 Å²	167	142 Å²	142	78%	0.78	78%	0.78	S	S	*	*				94.4	108.4	75.3	-93.1	-126.7	121.7	0	0	114.4
452	K	29.7	Very low	29.8	Very low	216 Å²	216	140.3 Å²	140.3	94%	0.939	79%	0.786	S	S	*	*				-158.5	155.1	124.3	-116.3	165.5	-173.5	167.8	0	113.8
453	K	27.1	Very low	29.7	Very low	188 Å²	188	143 Å²	143	82%	0.817	80%	0.795	S	S	*	*			trans	-116.8	121.6	-147.2	173.2	-176.7	-176	172.8	0	112.5
454	A	26.5	Very low	29.6	Very low	100 Å²	100	144.3 Å²	144.3	83%	0.826	80%	0.801	S	S	*	*			trans	-156.6	146.6	165.2	0	0	0	0	0	112.7
455	I	26.7	Very low	29	Very low	161 Å²	161	149.3 Å²	149.3	83%	0.826	80%	0.803	S	S	*	*			trans	-152.9	153.9	-169.8	-72.7	177.5	0	0	0	105.8
456	P	34.4	Very low	29	Very low	93 Å²	93	154.7 Å²	154.7	60%	0.604	81%	0.808	S	S	*	*			cis	-136.7	175.6	9.5	26.2	-1.8	0	0	0	118.3
457	K	27.8	Very low	28.6	Very low	194 Å²	194	152.3 Å²	152.3	84%	0.843	79%	0.788	S	S	*	*			trans	65.2	161.8	147	-74.2	160.7	-176.3	178	0	119.3
458	P	27.1	Very low	28.4	Very low	119 Å²	119	150.6 Å²	150.6	77%	0.773	78%	0.778	S	S	*	*			cis	-126.4	164.7	-46.5	37.4	-23.3	0	0	0	112.2	S460	P458-S460 PolarHBondContact O-N 2.66Å
459	R	25.3	Very low	27.4	Very low	258 Å²	258	147.8 Å²	147.8	97%	0.974	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-63.9	124.4	175	-89.5	179.6	168.2	167.2	-4.4	111.9
460	S	26.9	Very low	27.6	Very low	112 Å²	112	148.5 Å²	148.5	78%	0.783	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-88.8	134.9	159.3	52.3	0	0	0	0	110.5	P458	P458-S460 PolarHBondContact O-N 2.66Å
461	T	29.1	Very low	27.9	Very low	121 Å²	121	145.5 Å²	145.5	74%	0.742	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-76.3	137.4	170.8	46.5	0	0	0	0	110.2	Q463	T461-Q463 PolarHBondContact O-N 3.37Å; T461-Q463 VanDerWaalsContact O-N 3.1Å
462	P	25	Very low	28.2	Very low	131 Å²	131	144.3 Å²	144.3	85%	0.851	74%	0.741	S	S	*	*			trans	-65.7	112.1	177.6	-18.5	31.4	0	0	0	111.3
463	Q	26.1	Very low	28.4	Very low	170 Å²	170	142.7 Å²	142.7	79%	0.794	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-68.5	139.9	166.1	-69.8	-176.5	-10.6	0	0	109.4	T461 R465	T461-Q463 PolarHBondContact O-N 3.37Å; T461-Q463 VanDerWaalsContact O-N 3.1Å; Q463-R465 PolarHBondContact O-N 2.79Å
464	P	26.7	Very low	28.5	Very low	131 Å²	131	137.4 Å²	137.4	85%	0.851	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-64.9	118.6	177.7	26.5	-33.5	0	0	0	110	R466	P464-R466 PolarHBondContact O-N 2.9Å
465	R	27.8	Very low	28.7	Very low	236 Å²	236	142 Å²	142	89%	0.891	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-65.4	130.4	-179.6	-71	-176	176	-177.1	-1.2	110.5	Q463 I467	Q463-R465 PolarHBondContact O-N 2.79Å; R465-I467 PolarHBondContact O-N 3.34Å
466	R	27	Very low	28.7	Very low	220 Å²	220	137.8 Å²	137.8	83%	0.83	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-64.3	119.4	172.1	178.9	-178.7	179.7	-173.7	-2.5	109.4	P464 T468	P464-R466 PolarHBondContact O-N 2.9Å; R466-T468 HydrophobicContact CG-CG2 4.36Å; R466-T468 PolarHBondContact O-N 3.19Å
467	I	29.5	Very low	28.4	Very low	72 Å²	72	143.2 Å²	143.2	37%	0.369	74%	0.741	S	S	.	*			trans	-78.2	114	170.4	-55.4	177.2	0	0	0	107.5	L317 Q319 R465	L317-I467 HydrophobicContact CD1-CG2 4.09Å; Q319-I467 HydrophobicContact CG-CD1 4Å; R465-I467 PolarHBondContact O-N 3.34Å
468	T	23.2	Very low	28.4	Very low	92 Å²	92	140.3 Å²	140.3	56%	0.564	74%	0.742	S	S	*	*			trans	-93.5	104.4	174.5	44.7	0	0	0	0	109.7	R466	R466-T468 HydrophobicContact CG-CG2 4.36Å; R466-T468 PolarHBondContact O-N 3.19Å
469	L	24.9	Very low	28.4	Very low	52 Å²	52	139.6 Å²	139.6	27%	0.272	75%	0.746	S	S	.	*			trans	-69.2	128.4	154.5	-90.6	109.7	0	0	0	108.5	A280 L317 T471	A280-L469 HydrophobicContact CB-CD1 3.96Å; L317-L469 HydrophobicContact CD1-CD1 4.01Å; L317-L469 HydrophobicContact CD1-CG 4.06Å; L317-L469 HydrophobicContact CD2-CD1 4.18Å; L317-L469 HydrophobicContact CD2-CD2 4.1Å; L317-L469 HydrophobicContact CD2-CG 4.26Å; L317-L469 HydrophobicContact CG-CD1 4.38Å; L469-T471 VanDerWaalsContact C-N 3.29Å; L469-T471 PolarHBondContact O-N 3.24Å
470	N	32.3	Very low	28.6	Very low	141 Å²	141	133.9 Å²	133.9	75%	0.754	74%	0.74	S	S	*	*	S	Bend	trans	-77.1	81.5	174.5	-75.6	16.9	0	0	0	110.5
471	T	35.6	Very low	28.8	Very low	82 Å²	82	134.4 Å²	134.4	50%	0.503	74%	0.74	S	S	.	*	S	Bend	trans	-136.8	15.1	170.4	-31.5	0	0	0	0	111.4	L469	L469-T471 VanDerWaalsContact C-N 3.29Å; L469-T471 PolarHBondContact O-N 3.24Å
472	L	33.1	Very low	28.8	Very low	142 Å²	142	138.7 Å²	138.7	74%	0.743	75%	0.749	S	S	*	*	S	Bend	trans	-141.7	14.1	-168.7	-107.9	163.3	0	0	0	114.6
473	E	33.7	Very low	28.7	Very low	182 Å²	182	138.9 Å²	138.9	85%	0.85	75%	0.748	S	S	*	*			trans	-119.7	124.8	167.4	-69.1	-172.7	178.7	0	0	108.9
474	G	30	Very low	28.7	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	75%	0.748	S	S	*	*			trans	161.4	21.3	-172	0	0	0	0	0	115.7
475	W	29.9	Very low	28.8	Very low	198 Å²	198	136.1 Å²	136.1	75%	0.75	75%	0.745	S	S	*	*			trans	-112.4	108.2	177.8	-80.2	4.2	0	0	0	110.4	L218	L218-W475 HydrophobicContact CD2-CE3 4.38Å; L218-W475 HydrophobicContact CD2-CH2 4.16Å; L218-W475 HydrophobicContact CD2-CZ3 3.54Å
476	G	26.5	Very low	29.4	Very low	71 Å²	71	130.5 Å²	130.5	73%	0.732	74%	0.739	S	S	*	*			trans	159.4	100.1	169.3	0	0	0	0	0	117.2
477	K	28.1	Very low	29.3	Very low	207 Å²	207	125.8 Å²	125.8	90%	0.9	74%	0.74	S	S	*	*			trans	92.5	125.1	157	-56.6	-179.8	179.3	-180	0	118.8
478	P	29.1	Very low	29.2	Very low	134 Å²	134	126.5 Å²	126.5	87%	0.87	76%	0.757	S	S	*	*			trans	-88.2	163.5	165.5	37	-34	0	0	0	112.2
479	A	27.8	Very low	29.4	Very low	103 Å²	103	125.8 Å²	125.8	85%	0.851	76%	0.76	S	S	*	*			trans	-134.5	145.2	166.7	0	0	0	0	0	110
480	T	28.6	Very low	29.6	Very low	138 Å²	138	132.7 Å²	132.7	85%	0.847	79%	0.791	S	S	*	*			trans	-89.9	154.7	-172	40.3	0	0	0	0	113.4
481	P	31.4	Very low	29.3	Very low	123 Å²	123	132.2 Å²	132.2	80%	0.799	79%	0.794	S	S	*	*			trans	-79.3	161.3	-174.7	33.2	-36.9	0	0	0	113.4
482	K	28	Very low	29.4	Very low	211 Å²	211	134.1 Å²	134.1	92%	0.917	81%	0.807	S	S	*	*			trans	-132.3	152.1	163	-78.6	-167.7	175	-176.1	0	111.5
483	T	24.1	Very low	29.2	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	80%	0.803	S	S	*	*			trans	-103.2	146.3	-164.3	-17.2	0	0	0	0	112.7
484	S	26.2	Very low	29	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	81%	0.806	S	S	*	*			trans	-157.5	151.3	146.1	51.6	0	0	0	0	109.9
485	T	27.2	Very low	28.9	Very low	128 Å²	128	128.9 Å²	128.9	79%	0.785	81%	0.808	S	S	*	*			trans	-126.6	-158.2	-174.6	54.7	0	0	0	0	109.8
486	P	41.3	Very low	28.8	Very low	119 Å²	119	124.5 Å²	124.5	77%	0.773	81%	0.808	S	S	*	*				-123	-179.9	-111.3	37	-17.9	0	0	0	114.2
487	S	24.5	Very low	28.9	Very low	120 Å²	120	127.2 Å²	127.2	84%	0.839	81%	0.81	S	S	*	*			trans	-148.9	148	151	-157	0	0	0	0	114.5
488	A	27.5	Very low	29	Very low	88 Å²	88	123.4 Å²	123.4	73%	0.727	81%	0.81	S	S	*	*			trans	-49.4	178.3	170	0	0	0	0	0	116.3
489	A	26.8	Very low	28.9	Very low	77 Å²	77	121.4 Å²	121.4	64%	0.636	80%	0.804	S	S	*	*			cis	175.8	154.1	-29.4	0	0	0	0	0	107.4
490	Q	29.5	Very low	29.6	Very low	196 Å²	196	122.5 Å²	122.5	92%	0.916	80%	0.803	S	S	*	*			trans	178.2	146.5	143.6	-102.2	151.1	102.6	0	0	113.6
491	T	25.9	Very low	29.6	Very low	132 Å²	132	120.2 Å²	120.2	81%	0.81	79%	0.792	S	S	*	*			trans	-144.6	157.7	161.6	-11.4	0	0	0	0	105.4
492	P	37.9	Very low	29.5	Very low	121 Å²	121	120.3 Å²	120.3	79%	0.786	79%	0.791	S	S	*	*				-158.4	-178.2	77.8	42.2	-21.4	0	0	0	117.9
493	A	28.4	Very low	29.8	Very low	80 Å²	80	116 Å²	116	66%	0.661	78%	0.784	S	S	*	*			trans	94.7	114	137.6	0	0	0	0	0	122.9
494	S	29.9	Very low	29.9	Very low	131 Å²	131	118.5 Å²	118.5	92%	0.916	79%	0.787	S	S	*	*			trans	82.7	146.4	132.2	74	0	0	0	0	122.1
495	G	27.8	Very low	30.2	Very low	79 Å²	79	118.7 Å²	118.7	81%	0.814	79%	0.785	S	S	*	*			trans	141.3	135.3	-176.3	0	0	0	0	0	110.6
496	S	28.6	Very low	30.1	Very low	107 Å²	107	118.5 Å²	118.5	75%	0.748	79%	0.789	S	S	*	*			trans	-139.3	158.7	-161.4	68.9	0	0	0	0	117.3
497	T	27.6	Very low	29.6	Very low	127 Å²	127	118.3 Å²	118.3	78%	0.779	79%	0.785	S	S	*	*			trans	59.6	107.6	148.2	48	0	0	0	0	121.2
498	S	30.2	Very low	29.7	Very low	128 Å²	128	118.6 Å²	118.6	90%	0.895	78%	0.782	S	S	*	*				-173	154.6	118	48.8	0	0	0	0	112.2
499	A	27	Very low	30.3	Very low	92 Å²	92	119.5 Å²	119.5	76%	0.76	78%	0.781	S	S	*	*			trans	-140.2	-175.8	-177.3	0	0	0	0	0	108.5
500	P	43.5	Very low	30.3	Very low	126 Å²	126	123.6 Å²	123.6	82%	0.818	79%	0.791	S	S	*	*			cis	-125.2	-142.7	5.2	30.3	-3.2	0	0	0	111
501	S	28.9	Very low	30.3	Very low	89 Å²	89	120.1 Å²	120.1	62%	0.622	78%	0.784	S	S	*	*			cis	-164.6	154.5	7.9	59	0	0	0	0	114.3
502	T	29.2	Very low	31.4	Very low	126 Å²	126	119.2 Å²	119.2	77%	0.773	78%	0.78	S	S	*	*			trans	54.7	157.3	142	51.5	0	0	0	0	123.3
503	P	33.1	Very low	30.9	Very low	120 Å²	120	120.8 Å²	120.8	78%	0.779	79%	0.788	S	S	*	*			cis	-134	-175.5	-35.8	38.3	-20.9	0	0	0	113.8
504	Q	27.9	Very low	30.8	Very low	187 Å²	187	120.2 Å²	120.2	87%	0.874	79%	0.789	S	S	*	*			trans	-88.4	160.9	177.1	-67.3	178.6	-70	0	0	114.5
505	P	31.2	Very low	30.7	Very low	120 Å²	120	119.5 Å²	119.5	78%	0.779	78%	0.784	S	S	*	*			trans	-88.2	160	166.5	36.6	-34.8	0	0	0	113.6
506	S	26.4	Very low	30.7	Very low	123 Å²	123	120.7 Å²	120.7	86%	0.86	78%	0.78	S	S	*	*			trans	-111.3	171.9	172.1	59.1	0	0	0	0	112.3
507	V	29.5	Very low	30.7	Very low	115 Å²	115	126.7 Å²	126.7	70%	0.697	79%	0.786	S	S	*	*			trans	-139.1	126.4	-150.2	-177.3	0	0	0	0	113.9
508	T	27	Very low	30.7	Very low	127 Å²	127	128.4 Å²	128.4	78%	0.779	79%	0.791	S	S	*	*			trans	63.9	174.1	157.7	59	0	0	0	0	119.5
509	P	41	Very low	30.6	Very low	106 Å²	106	130.9 Å²	130.9	69%	0.688	79%	0.788	S	S	*	*			cis	-131.2	-175.5	-45.6	34.5	-18.6	0	0	0	112.2
510	L	26.5	Very low	31.7	Very low	163 Å²	163	131.4 Å²	131.4	85%	0.853	78%	0.784	S	S	*	*				178.9	163.6	127.2	-98.6	166.4	0	0	0	114.1
511	T	28.4	Very low	30.8	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	79%	0.787	S	S	*	*			trans	-152.2	176.9	177	50.1	0	0	0	0	108.4
512	P	48.6	Very low	30.8	Very low	113 Å²	113	139.8 Å²	139.8	73%	0.734	80%	0.796	S	S	*	*				-131.7	160.4	-50.8	37.5	-23.3	0	0	0	112.8
513	T	27.8	Very low	30.7	Very low	154 Å²	154	137.9 Å²	137.9	95%	0.945	79%	0.794	S	S	*	*			trans	-153.4	171.6	161	43.1	0	0	0	0	110.7
514	G	26.9	Very low	30.8	Very low	68 Å²	68	137.6 Å²	137.6	70%	0.701	79%	0.792	S	S	*	*			trans	-165.1	-168.6	175	0	0	0	0	0	112.9
515	S	28.4	Very low	30.7	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	80%	0.795	S	S	*	*			trans	127.1	146.5	167.1	68.4	0	0	0	0	116.3
516	S	26.8	Very low	30.7	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	80%	0.797	S	S	*	*			trans	50.8	97.7	159.8	55.6	0	0	0	0	122.5
517	R	28.8	Very low	31.2	Very low	233 Å²	233	137.9 Å²	137.9	88%	0.879	79%	0.794	S	S	*	*				51.3	113.1	103.9	-168.4	-173.4	-158.1	177	6.9	119.2
518	N	27.6	Very low	31.1	Very low	163 Å²	163	138 Å²	138	87%	0.872	80%	0.8	S	S	*	*			trans	-160.8	161.8	133.1	-104.2	-20.6	0	0	0	113.5
519	Q	28.5	Very low	31.1	Very low	179 Å²	179	138.1 Å²	138.1	84%	0.836	80%	0.801	S	S	*	*			trans	-146.7	177.8	-177.9	-111.9	-168.5	2.1	0	0	107.5
520	P	49.4	Very low	30.4	Very low	104 Å²	104	138.1 Å²	138.1	68%	0.675	80%	0.803	S	S	*	*			cis	-133.5	173.9	-31	38.5	-23.9	0	0	0	112.9
521	R	25.3	Very low	30.5	Very low	234 Å²	234	139.9 Å²	139.9	88%	0.883	80%	0.804	S	S	*	*			trans	-171	122.6	137.5	-113.5	178.7	179.9	-139.4	-1.5	116.8
522	L	28.6	Very low	30.5	Very low	156 Å²	156	139.7 Å²	139.7	82%	0.817	80%	0.803	S	S	*	*			trans	8.4	114.6	143.3	-59	165.8	0	0	0	120.5
523	A	26.1	Very low	29.4	Very low	87 Å²	87	142.4 Å²	142.4	72%	0.719	81%	0.81	S	S	*	*				45.1	165.3	103.8	0	0	0	0	0	121.9
524	P	36.8	Very low	29.3	Very low	114 Å²	114	141.9 Å²	141.9	74%	0.74	80%	0.801	S	S	*	*			cis	-136.4	170.2	-39.8	38	-22.8	0	0	0	113.7
525	L	25.8	Very low	29.4	Very low	179 Å²	179	145.6 Å²	145.6	94%	0.937	81%	0.81	S	S	*	*			trans	-146.9	151.6	157.1	-84.7	-173.9	0	0	0	113.3
526	T	30.6	Very low	29.4	Very low	133 Å²	133	145.4 Å²	145.4	82%	0.816	82%	0.816	S	S	*	*			trans	-114.4	169	-172.1	36.1	0	0	0	0	112.5
527	P	36.7	Very low	29.4	Very low	124 Å²	124	144.2 Å²	144.2	81%	0.805	82%	0.82	S	S	*	*			trans	-87.8	168.5	-156.2	35.4	-37.5	0	0	0	115.4
528	S	27.3	Very low	29.3	Very low	118 Å²	118	139 Å²	139	83%	0.825	82%	0.82	S	S	*	*			trans	-121.7	156.1	168.1	57.6	0	0	0	0	111.3
529	T	26.8	Very low	29.3	Very low	129 Å²	129	137.7 Å²	137.7	79%	0.791	82%	0.818	S	S	*	*			trans	-133.9	-179.7	-174.8	55.8	0	0	0	0	111.4
530	S	26.8	Very low	29.3	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	82%	0.818	S	S	*	*			trans	82.5	154.4	-178.4	88.5	0	0	0	0	114.9
531	K	28.4	Very low	28.7	Very low	200 Å²	200	136.3 Å²	136.3	87%	0.87	82%	0.822	S	S	*	*			cis	-148.2	162.5	10.5	-144.7	153.6	-170.7	175.7	0	112.4
532	V	27.7	Very low	28.9	Very low	120 Å²	120	135.2 Å²	135.2	73%	0.727	82%	0.823	S	S	*	*			trans	-82.6	149	179.5	174.2	0	0	0	0	111.4
533	L	26	Very low	29.1	Very low	169 Å²	169	131.1 Å²	131.1	89%	0.885	82%	0.819	S	S	*	*			trans	-139.1	136.7	153.5	-160.4	73.1	0	0	0	110.4
534	N	26.7	Very low	29.3	Very low	144 Å²	144	133 Å²	133	77%	0.77	82%	0.824	S	S	*	*			trans	-106.2	142.2	176.5	-79.9	-17.5	0	0	0	110.8
535	T	28.8	Very low	29	Very low	145 Å²	145	134.2 Å²	134.2	89%	0.89	83%	0.829	S	S	*	*			trans	-137.8	141.9	153	33	0	0	0	0	109.2
536	A	27.9	Very low	29.3	Very low	113 Å²	113	131.5 Å²	131.5	93%	0.934	82%	0.821	S	S	*	*			trans	-94.8	142.7	-172.4	0	0	0	0	0	112.3
537	G	27.4	Very low	29.3	Very low	79 Å²	79	131.2 Å²	131.2	81%	0.814	82%	0.821	S	S	*	*			trans	-155.9	111.7	172.8	0	0	0	0	0	110.5
538	S	26.5	Very low	29.1	Very low	124 Å²	124	135 Å²	135	87%	0.867	83%	0.825	S	S	*	*			trans	-97	106	-173.1	165.6	0	0	0	0	112.4
539	T	27.8	Very low	29.5	Very low	135 Å²	135	132 Å²	132	83%	0.828	81%	0.812	S	S	*	*			trans	-151.4	139.4	153.4	43.3	0	0	0	0	111.7
540	T	28.5	Very low	29.9	Very low	138 Å²	138	132.2 Å²	132.2	85%	0.847	82%	0.816	S	S	*	*			trans	-138.3	168.9	164	61.1	0	0	0	0	108.1
541	P	36.7	Very low	30.1	Very low	115 Å²	115	133.1 Å²	133.1	75%	0.747	82%	0.817	S	S	*	*			cis	-126.4	149.7	-9.2	36.7	-22.1	0	0	0	114.1
542	K	28.2	Very low	30.1	Very low	211 Å²	211	129.3 Å²	129.3	92%	0.917	81%	0.812	S	S	*	*			trans	-142.1	127	146.8	-73.9	-165.6	177.7	177.4	0	109
543	G	33	Very low	30.2	Very low	71 Å²	71	134.8 Å²	134.8	73%	0.732	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-78.5	140.2	-176.4	0	0	0	0	0	112.6
544	P	30.4	Very low	30.2	Very low	126 Å²	126	138 Å²	138	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.4	131.1	176.2	30.8	-33.4	0	0	0	111.3	T546	P544-T546 PolarHBondContact O-N 3.09Å
545	T	30.8	Very low	30.3	Very low	139 Å²	139	135.5 Å²	135.5	85%	0.853	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.4	120.8	171.9	48.8	0	0	0	0	110.7
546	T	33.1	Very low	30.1	Very low	123 Å²	123	132.5 Å²	132.5	76%	0.755	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.8	137.4	170.5	49.2	0	0	0	0	111	P544 K548	P544-T546 PolarHBondContact O-N 3.09Å; T546-K548 PolarHBondContact O-N 3.44Å
547	P	29.8	Very low	30.1	Very low	127 Å²	127	130.7 Å²	130.7	83%	0.825	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-64.4	133.1	175.1	27.5	-33.8	0	0	0	110.4	G549	P547-G549 PolarHBondContact O-N 3.31Å
548	K	33	Very low	30.1	Very low	204 Å²	204	132.2 Å²	132.2	89%	0.887	76%	0.763	S	S	*	*			trans	-72.6	113.7	176.9	-69.3	-178.9	179.9	176.9	0	109.6	T546	T546-K548 PolarHBondContact O-N 3.44Å
549	G	34.3	Very low	30	Very low	54 Å²	54	131.8 Å²	131.8	56%	0.557	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-60.6	164.6	164	0	0	0	0	0	111.9	P547 T551	P547-G549 PolarHBondContact O-N 3.31Å; G549-T551 PolarHBondContact O-N 3.29Å
550	P	35.7	Very low	30.1	Very low	134 Å²	134	130.9 Å²	130.9	87%	0.87	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-58.3	126.7	-175.3	23.8	-33.9	0	0	0	112.1
551	T	32.3	Very low	30.2	Very low	124 Å²	124	127.2 Å²	127.2	76%	0.761	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-63.9	131.2	-176.4	45.8	0	0	0	0	111.6	G549 R553	G549-T551 PolarHBondContact O-N 3.29Å; T551-R553 PolarHBondContact O-N 3.03Å
552	P	27.2	Very low	29.9	Very low	120 Å²	120	128.1 Å²	128.1	78%	0.779	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-67	129.1	-172.6	26.5	-34.9	0	0	0	112	R554	P552-R554 PolarHBondContact O-N 3.44Å
553	R	29.4	Very low	29.8	Very low	236 Å²	236	128.2 Å²	128.2	89%	0.891	74%	0.74	S	S	*	*			trans	-75.5	89.5	-179.6	-157.6	-179.7	-159.7	-173.6	6.9	110.4	T551 V555	T551-R553 PolarHBondContact O-N 3.03Å; R553-V555 PolarHBondContact O-N 2.8Å
554	R	26.2	Very low	29.6	Very low	236 Å²	236	130 Å²	130	89%	0.891	74%	0.739	S	S	*	*			trans	-63.5	96.6	173.4	-175.8	-174.5	-175.6	-170.5	2.9	110	P552 S556	P552-R554 PolarHBondContact O-N 3.44Å; R554-S556 PolarHBondContact O-N 3.22Å; R554-S556 VanDerWaalsContact O-N 3.08Å
555	V	29.6	Very low	29.5	Very low	91 Å²	91	129.7 Å²	129.7	55%	0.552	74%	0.737	S	S	*	*			trans	-70.2	102.8	169.2	-177.5	0	0	0	0	108.2	R553	R553-V555 PolarHBondContact O-N 2.8Å
556	S	24.4	Very low	29.3	Very low	83 Å²	83	126.9 Å²	126.9	58%	0.58	73%	0.727	S	S	*	*			trans	-65.5	134.3	165	49.1	0	0	0	0	109.5	R554 T558	R554-S556 PolarHBondContact O-N 3.22Å; R554-S556 VanDerWaalsContact O-N 3.08Å; S556-T558 PolarHBondContact O-N 3.45Å
557	L	27.3	Very low	29.5	Very low	75 Å²	75	128.2 Å²	128.2	39%	0.393	74%	0.735	S	S	.	*			trans	-60.9	107.1	166.4	-67.1	172	0	0	0	108.2	M1 P559	M1-L557 HydrophobicContact CE-CD2 3.78Å; M1-L557 HydrophobicContact SD-CD2 4.42Å; L557-P559 WeakPolarHBondContact O-CD 3.31Å
558	T	28	Very low	29.4	Very low	111 Å²	111	126.5 Å²	126.5	68%	0.681	73%	0.726	S	S	*	*			trans	-67.1	114.8	175	-57.5	0	0	0	0	108.8	S556 L560	S556-T558 PolarHBondContact O-N 3.45Å; T558-L560 PolarHBondContact O-N 3.01Å
559	P	25	Very low	29.5	Very low	115 Å²	115	122 Å²	122	75%	0.747	72%	0.721	S	S	*	*			trans	-68.5	122.2	173.5	-13.3	30	0	0	0	108	L557 G561	L557-P559 WeakPolarHBondContact O-CD 3.31Å; P559-G561 PolarHBondContact O-N 2.83Å
560	L	30.4	Very low	29.2	Very low	116 Å²	116	127.6 Å²	127.6	61%	0.607	74%	0.737	S	S	*	*			trans	-68.9	89.8	168.1	-69.5	176	0	0	0	108.1	L343 T558	L343-L560 HydrophobicContact CD1-CB 4.43Å; L343-L560 HydrophobicContact CD1-CD1 4.34Å; T558-L560 PolarHBondContact O-N 3.01Å
561	G	29.3	Very low	28.7	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	74%	0.737	S	S	*	*			trans	-58.7	144.8	-177.5	0	0	0	0	0	112	P559 R563	P559-G561 PolarHBondContact O-N 2.83Å; G561-R563 VanDerWaalsContact C-N 3.26Å; G561-R563 PolarHBondContact O-N 2.85Å
562	S	31.4	Very low	28.4	Very low	134 Å²	134	130.3 Å²	130.3	94%	0.937	74%	0.74	S	S	*	*	S	Bend	trans	-73.3	73.7	-177.1	57	0	0	0	0	112.3
563	R	25	Very low	28.4	Very low	213 Å²	213	131.9 Å²	131.9	80%	0.804	74%	0.742	S	S	*	*			trans	-138.3	124.1	169.8	-177.2	173.5	176.4	174.5	-1.7	108.8	G561	G561-R563 VanDerWaalsContact C-N 3.26Å; G561-R563 PolarHBondContact O-N 2.85Å
564	P	28.8	Very low	28.3	Very low	109 Å²	109	125.8 Å²	125.8	71%	0.708	74%	0.741	S	S	*	*			trans	-63.7	138.2	174.2	27.5	-33.7	0	0	0	109.5	A566	P564-A566 PolarHBondContact O-N 3.28Å; P564-A566 VanDerWaalsContact O-N 3.13Å
565	P	27.9	Very low	28.3	Very low	119 Å²	119	119 Å²	119	77%	0.773	74%	0.735	S	S	*	*			trans	-67.7	112.9	175.1	27.4	-32.7	0	0	0	109.3	V567	P565-V567 PolarHBondContact O-N 3.45Å
566	A	27.2	Very low	28.1	Very low	79 Å²	79	119.6 Å²	119.6	65%	0.653	75%	0.75	S	S	*	*			trans	-66.9	120	165.9	0	0	0	0	0	108.1	P564 S568	P564-A566 PolarHBondContact O-N 3.28Å; P564-A566 VanDerWaalsContact O-N 3.13Å; A566-S568 VanDerWaalsContact C-N 3.28Å; A566-S568 PolarHBondContact O-N 3.16Å
567	V	36.6	Very low	28.3	Very low	151 Å²	151	121.8 Å²	121.8	92%	0.915	76%	0.76	S	S	*	*			trans	-80.1	78.1	-177	-175.1	0	0	0	0	109.6	P565	P565-V567 PolarHBondContact O-N 3.45Å
568	S	29.7	Very low	28.3	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	79%	0.785	S	S	*	*			trans	-155.3	149.2	172.3	55.3	0	0	0	0	111.1	A566	A566-S568 VanDerWaalsContact C-N 3.28Å; A566-S568 PolarHBondContact O-N 3.16Å
569	S	33.7	Very low	28.4	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	79%	0.793	S	S	*	*			trans	56.9	60.8	170.7	68.4	0	0	0	0	118.4
570	L	27.4	Very low	28.4	Very low	171 Å²	171	130.3 Å²	130.3	90%	0.895	79%	0.793	S	S	*	*			trans	-137.9	52.2	145.6	-85.6	-173.7	0	0	0	111.5
571	F	26.9	Very low	28.1	Very low	198 Å²	198	133.9 Å²	133.9	87%	0.868	80%	0.804	S	S	*	*			trans	-132.3	115.9	162.3	-79	-73	0	0	0	109
572	S	25.8	Very low	27.9	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	81%	0.807	S	S	*	*			trans	-138.9	80.5	173.2	58.4	0	0	0	0	109.1	A574	S572-A574 PolarHBondContact O-N 3.25Å
573	N	27.2	Very low	27.6	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	80%	0.8	S	S	*	*			trans	-69.1	109.7	173.5	-79.3	-5.8	0	0	0	109.7	A575	N573-A575 PolarHBondContact O-N 3.44Å; N573-A575 VanDerWaalsContact O-N 3.16Å
574	A	26.5	Very low	27.8	Very low	107 Å²	107	139.7 Å²	139.7	88%	0.884	80%	0.799	S	S	*	*			trans	-80.4	85.3	164.1	0	0	0	0	0	109.2	S572	S572-A574 PolarHBondContact O-N 3.25Å
575	A	26.2	Very low	27.8	Very low	93 Å²	93	140.1 Å²	140.1	77%	0.769	80%	0.802	S	S	*	*			trans	-87.4	115.5	169.5	0	0	0	0	0	109.5	N573	N573-A575 PolarHBondContact O-N 3.44Å; N573-A575 VanDerWaalsContact O-N 3.16Å
576	A	26.4	Very low	28.3	Very low	104 Å²	104	139.3 Å²	139.3	86%	0.86	80%	0.799	S	S	*	*			trans	-115.5	99.3	173.5	0	0	0	0	0	109.5
577	T	27.7	Very low	28.9	Very low	129 Å²	129	140.8 Å²	140.8	79%	0.791	80%	0.802	S	S	*	*			trans	-107.7	121.1	168.4	52.1	0	0	0	0	109.8
578	E	27.9	Very low	28.9	Very low	197 Å²	197	139.8 Å²	139.8	92%	0.921	80%	0.799	S	S	*	*			trans	-111.9	159.3	156.8	-163.7	156.4	-153.5	0	0	109
579	K	29.2	Very low	29.1	Very low	192 Å²	192	140.4 Å²	140.4	84%	0.835	80%	0.803	S	S	*	*			trans	-139.8	163.2	-161.1	-92.6	-173.7	176.1	178.4	0	113
580	A	25.1	Very low	29	Very low	91 Å²	91	142.6 Å²	142.6	75%	0.752	81%	0.806	S	S	*	*			trans	83.1	144.5	165.8	0	0	0	0	0	114.9
581	K	24.6	Very low	29.8	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.835	80%	0.796	S	S	*	*			cis	-158.7	168.4	-3.2	-130.4	173	-173.8	-179.4	0	111.9
582	H	25.3	Very low	30.2	Very low	150 Å²	150	136.7 Å²	136.7	69%	0.694	80%	0.795	S	S	*	*			trans	104.1	136.4	147	-108.7	32.6	0	0	0	121.8
583	E	25.3	Very low	30.6	Very low	168 Å²	168	137.1 Å²	137.1	79%	0.785	80%	0.797	S	S	*	*			trans	43.7	137.4	159.9	-66.7	178.4	132.7	0	0	123.6
584	R	28	Very low	31.2	Very low	212 Å²	212	138.7 Å²	138.7	80%	0.8	80%	0.799	S	S	*	*			trans	-134	115.2	173.2	175.3	-169.7	-175.1	-168.6	4	108.3
585	P	30.1	Very low	31.7	Very low	118 Å²	118	139 Å²	139	77%	0.766	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.2	140.5	159.6	-10.8	27.4	0	0	0	109.8
586	S	37.8	Very low	32.2	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-97.5	128.2	175.1	-64.2	0	0	0	0	111.3
587	P	38.6	Very low	32.7	Very low	111 Å²	111	145 Å²	145	72%	0.721	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-85.5	162.8	158.1	-9.8	28.7	0	0	0	111.6
588	P	36.6	Very low	33	Very low	129 Å²	129	144.4 Å²	144.4	84%	0.838	80%	0.799	S	S	*	*			trans	-91.6	175.8	-161.7	36.8	-38.1	0	0	0	115.7
589	S	34.3	Very low	33.3	Very low	104 Å²	104	145.2 Å²	145.2	73%	0.727	80%	0.799	S	S	*	*			trans	-77.5	145.7	171.1	50.9	0	0	0	0	113.5
590	D	33	Very low	33.5	Very low	156 Å²	156	147.5 Å²	147.5	83%	0.834	80%	0.803	S	S	*	*				-163.9	165.1	120.7	-116.8	19.1	0	0	0	112.2
591	P	42.3	Very low	34	Very low	107 Å²	107	147.5 Å²	147.5	70%	0.695	80%	0.803	S	S	*	*			trans	-117.4	137.2	-158.1	38.9	-28.9	0	0	0	116.1
592	V	35.7	Very low	34.3	Very low	138 Å²	138	148 Å²	148	84%	0.836	81%	0.805	S	S	*	*			trans	-139.6	110.6	159.5	-178	0	0	0	0	111.7
593	C	34.3	Very low	34.8	Very low	128 Å²	128	148 Å²	148	87%	0.865	82%	0.816	S	S	*	*			trans	40.1	150.7	150	-64.3	0	0	0	0	124
594	Q	39.6	Very low	35.2	Very low	185 Å²	185	144.8 Å²	144.8	86%	0.864	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.6	163.8	-175.7	-76.3	-178.9	-4.5	0	0	114.4
595	P	36.9	Very low	35.4	Very low	113 Å²	113	142.2 Å²	142.2	73%	0.734	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.5	156.5	179.7	29.6	-37.7	0	0	0	114.1
596	P	37.4	Very low	35.9	Very low	132 Å²	132	143.1 Å²	143.1	86%	0.857	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.8	141.1	-179.6	32.3	-35.1	0	0	0	113.7
597	E	37	Very low	36.2	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-88	170.8	178.5	-75.3	-159.2	130.9	0	0	115.2
598	S	33.4	Very low	35.9	Very low	116 Å²	116	144.8 Å²	144.8	81%	0.811	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-69.5	152.5	-172.6	71.7	0	0	0	0	115.8
599	K	35.5	Very low	35.9	Very low	214 Å²	214	148.4 Å²	148.4	93%	0.93	83%	0.826	S	S	*	*			trans	-113.6	110.7	167.6	-71.5	-175.7	178.2	177.3	0	112
600	R	32.9	Very low	35.9	Very low	240 Å²	240	149.5 Å²	149.5	91%	0.906	83%	0.828	S	S	*	*			trans	-149.5	114.1	152.3	-171.2	174.8	-174.7	169.8	5	110.9
601	A	34.6	Very low	36.1	Very low	91 Å²	91	154 Å²	154	75%	0.752	83%	0.834	S	S	*	*			trans	-80.9	149.4	176.1	0	0	0	0	0	112.3
602	K	31.6	Very low	36.2	Very low	204 Å²	204	155.4 Å²	155.4	89%	0.887	84%	0.84	S	S	*	*			trans	-127.9	125.9	156.8	-80.7	-176.5	177.2	178.3	0	107.7
603	T	36.4	Very low	36.3	Very low	149 Å²	149	155 Å²	155	91%	0.914	84%	0.842	S	S	*	*			trans	-138.8	142.7	160.8	39.6	0	0	0	0	108.6
604	S	32.8	Very low	37	Very low	101 Å²	101	157.7 Å²	157.7	71%	0.706	84%	0.839	S	S	*	*			trans	-110.5	143.4	175.1	52.8	0	0	0	0	109.5
605	N	33.4	Very low	37.3	Very low	158 Å²	158	159.7 Å²	159.7	85%	0.845	86%	0.856	S	S	*	*				-177.2	151.8	124	-90.3	-9	0	0	0	111.9
606	T	40.8	Very low	37.3	Very low	137 Å²	137	162 Å²	162	84%	0.84	86%	0.862	S	S	*	*			trans	-94.4	149.1	177.3	-27.4	0	0	0	0	110.4
607	P	42.6	Very low	37.3	Very low	115 Å²	115	163.6 Å²	163.6	75%	0.747	86%	0.862	S	S	*	*			trans	-112.7	146.2	150.7	34.6	-27.8	0	0	0	111.9
608	V	32.7	Very low	37.4	Very low	132 Å²	132	162 Å²	162	80%	0.8	86%	0.86	S	S	*	*			trans	-74.1	144.6	178.2	175.3	0	0	0	0	110.6
609	K	37.3	Very low	37.6	Very low	204 Å²	204	164.7 Å²	164.7	89%	0.887	86%	0.863	S	S	*	*			trans	-118.1	116	160.2	-79.9	-167.2	174.6	-175.3	0	110.6
610	T	33.7	Very low	37.7	Very low	128 Å²	128	161.6 Å²	161.6	79%	0.785	86%	0.859	S	S	*	*			trans	-68.6	147	166.6	32.7	0	0	0	0	110.9
611	R	38.2	Very low	38	Very low	251 Å²	251	156.4 Å²	156.4	95%	0.947	86%	0.856	S	S	*	*			trans	-127.6	116.7	162.1	-97.1	-174.3	167.6	-175.8	-4.2	107.8
612	T	43.5	Very low	38.3	Very low	135 Å²	135	161.1 Å²	161.1	83%	0.828	86%	0.863	S	S	*	*			trans	-110.3	121.2	167.9	45.1	0	0	0	0	108
613	C	38.8	Very low	38.8	Very low	131 Å²	131	157.8 Å²	157.8	89%	0.885	86%	0.861	S	S	*	*			trans	-78.6	142.2	163.6	-66.7	0	0	0	0	109.2
614	K	48.2	Very low	39	Very low	184 Å²	184	158.5 Å²	158.5	80%	0.8	86%	0.857	S	S	*	*			trans	-129.8	145.3	147.5	-94.4	-162.6	168.5	-162.5	0	106.9
615	D	46.1	Very low	39.6	Very low	226 Å²	226	163.7 Å²	163.7	100%	1.209	87%	0.87	S	S	*	*			trans	54.6	0	167.1	-42	-27.7	0	0	0	115.5

Retrieved 615 of 615 residues in 330.5 ms (Link to these results)

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