A0A077Z558_TRITR Loading...

Putative histone h3 lys4 methyltransferase comple x and rna cleavage factor ii complex subunit swd2

AlphaFold DB , UniProt , Accession A0A077Z558, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 330 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	55	Low	79.7	Confident	154 Å²	154	65.5 Å²	65.5	76%	0.759	34%	0.341	S	S	*	.				0	141.3	0	-176.6	174.2	-91.5	0	0	108.3	L309 F311	M1-L309 HydrophobicContact SD-CD1 4.5Å; M1-F311 HydrophobicContact CE-CD1 4.14Å; M1-F311 HydrophobicContact CE-CD2 3.71Å; M1-F311 HydrophobicContact CE-CE1 3.84Å; M1-F311 HydrophobicContact CE-CE2 3.36Å; M1-F311 HydrophobicContact CE-CG 4.09Å; M1-F311 HydrophobicContact CE-CZ 3.44Å; M1-F311 VanDerWaalsContact CE-CZ 3.44Å; M1-F311 HydrophobicContact SD-CD2 3.93Å; M1-F311 HydrophobicContact SD-CE2 3.18Å; M1-F311 WeakPolarHBondContact SD-CE2 3.31Å; M1-F311 HydrophobicContact SD-CZ 3.56Å; M1-F311 VanDerWaalsContact SD-CZ 3.56Å
2	K	72.9	Confident	79.1	Confident	143 Å²	143	65 Å²	65	62%	0.622	34%	0.343	S	S	*	.			trans	-75.1	131.4	175.5	-178.6	178	173.5	-172.1	0	107.9	D4	K2-D4 PolarHBondContact O-N 2.76Å
3	I	79.8	Confident	78.5	Confident	11 Å²	11	64.2 Å²	64.2	6%	0.056	34%	0.338	C	S	.	.			trans	-73.2	121.5	169.7	-49.7	-171.1	0	0	0	106.6	L8 T248 Y253 Y295	I3-L8 HydrophobicContact CG2-CD1 4.37Å; I3-L8 HydrophobicContact CG2-CD2 3.9Å; I3-L8 HydrophobicContact CG2-CG 4.06Å; I3-T248 HydrophobicContact CD1-CG2 4Å; I3-T248 HydrophobicContact CG2-CG2 4.33Å; I3-Y253 HydrophobicContact CB-CD2 4.33Å; I3-Y253 HydrophobicContact CB-CE2 4.34Å; I3-Y253 HydrophobicContact CG2-CD2 3.57Å; I3-Y253 HydrophobicContact CG2-CE2 3.77Å; I3-Y295 HydrophobicContact CB-CE2 4.04Å; I3-Y295 HydrophobicContact CD1-CE2 4.22Å; I3-Y295 HydrophobicContact CG1-CD2 4.06Å; I3-Y295 HydrophobicContact CG1-CE2 3.48Å; I3-Y295 VanDerWaalsContact CG1-CE2 3.48Å; I3-Y295 HydrophobicContact CG2-CE2 4.22Å; I3-Y295 WeakPolarHBondContact CG2-OH 3.4Å
4	D	85.6	Confident	77.9	Confident	62 Å²	62	59.6 Å²	59.6	33%	0.332	31%	0.314	S	S	.	.			trans	-137.6	174.2	170.1	70.3	39.5	0	0	0	111.4	K2 S6 S7 L8 Y253	K2-D4 PolarHBondContact O-N 2.76Å; D4-S6 PolarHBondContact O-N 3.34Å; D4-S6 WeakPolarHBondContact OD1-CA 3.45Å; D4-S6 VanDerWaalsContact OD1-CB 3.31Å; D4-S6 WeakPolarHBondContact OD1-CB 3.4Å; D4-S6 PolarHBondContact OD1-N 3.13Å; D4-S7 PolarHBondContact N-OG 3.12Å; D4-S7 PolarHBondContact O-N 2.86Å; D4-S7 PolarHBondContact O-OG 3.14Å; D4-S7 PolarHBondContact OD1-N 3.01Å; D4-L8 WeakPolarHBondContact O-CG 3.31Å; D4-L8 PolarHBondContact O-N 2.8Å; D4-Y253 VanDerWaalsContact CA-OH 3.32Å; D4-Y253 WeakPolarHBondContact CA-OH 3.42Å
5	T	86.1	Confident	77.4	Confident	55 Å²	55	57.8 Å²	57.8	34%	0.337	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-32.7	-175.9	-55.1	0	0	0	0	112.5	L8 N9 Y253 A274	T5-L8 PolarHBondContact O-N 3Å; T5-N9 PolarHBondContact O-N 3.1Å; T5-N9 PolarHBondContact O-ND2 2.99Å; T5-Y253 PolarHBondContact N-OH 3.01Å; T5-Y253 PolarHBondContact OG1-OH 3.17Å; T5-A274 HydrophobicContact CG2-CB 4.16Å; T5-A274 WeakPolarHBondContact CG2-O 3.18Å
6	S	85.9	Confident	76.9	Confident	76 Å²	76	57.4 Å²	57.4	53%	0.531	30%	0.3	S	S	.	.	H	α-helix	trans	-69.3	-48.6	178.3	-42.3	0	0	0	0	109.7	D4 L8 N9 E10	D4-S6 PolarHBondContact O-N 3.34Å; D4-S6 WeakPolarHBondContact OD1-CA 3.45Å; D4-S6 VanDerWaalsContact OD1-CB 3.31Å; D4-S6 WeakPolarHBondContact OD1-CB 3.4Å; D4-S6 PolarHBondContact OD1-N 3.13Å; S6-L8 PolarHBondContact O-N 3.47Å; S6-N9 PolarHBondContact O-N 3.1Å; S6-N9 VanDerWaalsContact O-N 3.13Å; S6-E10 WeakPolarHBondContact O-CG 3.37Å; S6-E10 PolarHBondContact O-N 3.36Å; S6-E10 VanDerWaalsContact O-N 3.12Å
7	S	84.8	Confident	76.6	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-27.3	178.2	72.4	0	0	0	0	112.7	D4 Y295 L309	D4-S7 PolarHBondContact N-OG 3.12Å; D4-S7 PolarHBondContact O-N 2.86Å; D4-S7 PolarHBondContact O-OG 3.14Å; D4-S7 PolarHBondContact OD1-N 3.01Å; S7-Y295 PolarHBondContact OG-OH 3.23Å; S7-L309 VanDerWaalsContact O-CD1 3.31Å; S7-L309 WeakPolarHBondContact O-CD1 3.48Å; S7-L309 WeakPolarHBondContact O-CD2 3.36Å
8	L	84.5	Confident	76.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.7	-39.5	173.1	-71.3	176.2	0	0	0	113	I3 D4 T5 S6 E10 L11 Y253 F265 A275 F290	I3-L8 HydrophobicContact CG2-CD1 4.37Å; I3-L8 HydrophobicContact CG2-CD2 3.9Å; I3-L8 HydrophobicContact CG2-CG 4.06Å; D4-L8 WeakPolarHBondContact O-CG 3.31Å; D4-L8 PolarHBondContact O-N 2.8Å; T5-L8 PolarHBondContact O-N 3Å; S6-L8 PolarHBondContact O-N 3.47Å; L8-E10 PolarHBondContact O-N 2.94Å; L8-L11 HydrophobicContact CD2-CD1 3.93Å; L8-L11 WeakPolarHBondContact O-CB 3.25Å; L8-L11 PolarHBondContact O-N 3.36Å; L8-Y253 HydrophobicContact CD1-CD1 3.59Å; L8-Y253 HydrophobicContact CD1-CD2 3.96Å; L8-Y253 HydrophobicContact CD1-CE1 3.74Å; L8-Y253 HydrophobicContact CD1-CE2 4.1Å; L8-Y253 HydrophobicContact CD1-CG 3.7Å; L8-F265 HydrophobicContact CD1-CB 4.03Å; L8-F265 HydrophobicContact CD1-CD1 3.81Å; L8-F265 HydrophobicContact CD1-CG 4.09Å; L8-F265 HydrophobicContact CD2-CD1 3.64Å; L8-F265 HydrophobicContact CD2-CE1 3.5Å; L8-F265 VanDerWaalsContact CD2-CE1 3.5Å; L8-F265 HydrophobicContact CD2-CG 4.36Å; L8-F265 HydrophobicContact CD2-CZ 4.16Å; L8-F265 HydrophobicContact CG-CD1 4.29Å; L8-A275 HydrophobicContact CB-CB 3.84Å; L8-F290 HydrophobicContact CD2-CZ 4.48Å
9	N	83.1	Confident	76.1	Confident	94 Å²	94	61.2 Å²	61.2	50%	0.503	31%	0.31	S	S	.	.	H	α-helix	trans	-71.7	-19.6	177.3	-73.7	-61.3	0	0	0	112.6	T5 S6 A275	T5-N9 PolarHBondContact O-N 3.1Å; T5-N9 PolarHBondContact O-ND2 2.99Å; S6-N9 PolarHBondContact O-N 3.1Å; S6-N9 VanDerWaalsContact O-N 3.13Å; N9-A275 WeakPolarHBondContact OD1-CB 3.15Å
10	E	81.4	Confident	76	Confident	107 Å²	107	58.6 Å²	58.6	50%	0.5	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-2.5	175.3	-70.7	173.9	-176.4	0	0	113.6	S6 L8 T12 L309	S6-E10 WeakPolarHBondContact O-CG 3.37Å; S6-E10 PolarHBondContact O-N 3.36Å; S6-E10 VanDerWaalsContact O-N 3.12Å; L8-E10 PolarHBondContact O-N 2.94Å; E10-T12 PolarHBondContact O-N 3.29Å; E10-T12 VanDerWaalsContact O-N 3.1Å; E10-L309 HydrophobicContact CB-CD2 3.64Å; E10-L309 VanDerWaalsContact O-CD2 3.25Å; E10-L309 WeakPolarHBondContact O-CD2 3.35Å
11	L	77.9	Confident	76.2	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.068	32%	0.323	C	S	.	.			trans	-55.8	119.4	177.7	-86	167.3	0	0	0	110.2	L8 F265 V277 F290 Y295 L309	L8-L11 HydrophobicContact CD2-CD1 3.93Å; L8-L11 WeakPolarHBondContact O-CB 3.25Å; L8-L11 PolarHBondContact O-N 3.36Å; L11-F265 HydrophobicContact CD1-CE1 4.32Å; L11-F265 HydrophobicContact CD1-CE2 4.28Å; L11-F265 HydrophobicContact CD1-CZ 3.7Å; L11-V277 HydrophobicContact CB-CG1 4.45Å; L11-V277 HydrophobicContact CB-CG2 4.19Å; L11-V277 HydrophobicContact CD1-CG2 4.29Å; L11-F290 HydrophobicContact CD1-CZ 4.46Å; L11-Y295 HydrophobicContact CD2-CD1 4.22Å; L11-Y295 HydrophobicContact CD2-CE1 3.88Å; L11-Y295 HydrophobicContact CG-CE1 4.31Å; L11-L309 HydrophobicContact CD2-CG 3.96Å; L11-L309 HydrophobicContact CG-CG 4.32Å
12	T	72.4	Confident	77.6	Confident	59 Å²	59	53.9 Å²	53.9	36%	0.362	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	151	-178.1	39.7	0	0	0	0	110.7	E10 L14 T307 C308 L310	E10-T12 PolarHBondContact O-N 3.29Å; E10-T12 VanDerWaalsContact O-N 3.1Å; T12-L14 PolarHBondContact O-N 3.26Å; T12-T307 WeakPolarHBondContact O-CA 3.35Å; T12-T307 WeakPolarHBondContact O-CB 3.35Å; T12-C308 CarbonylContact C-O 3.59Å; T12-C308 PolarHBondContact N-O 3.12Å; T12-C308 PolarHBondContact O-N 3.41Å; T12-C308 PolarHBondContact OG1-O 3.13Å; T12-C308 VanDerWaalsContact OG1-O 3.1Å; T12-L310 PolarHBondContact OG1-N 3.2Å
13	L	71.4	Confident	78.3	Confident	54 Å²	54	50 Å²	50	28%	0.283	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	118.6	168.9	177.1	62.5	0	0	0	108.6	I16 V305 T307	L13-I16 HydrophobicContact CD1-CD1 4.32Å; L13-I16 HydrophobicContact CD1-CG1 3.72Å; L13-I16 HydrophobicContact CD2-CD1 3.72Å; L13-I16 HydrophobicContact CD2-CG1 3.83Å; L13-I16 HydrophobicContact CG-CG1 4.29Å; L13-V305 HydrophobicContact CD1-CG1 3.48Å; L13-V305 VanDerWaalsContact CD1-CG1 3.48Å; L13-T307 HydrophobicContact CB-CG2 4.41Å; L13-T307 HydrophobicContact CD1-CG2 3.93Å
14	L	70	Confident	78.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-52.2	173.4	177.1	72	0	0	0	109.5	T12 L296 I306 C308 L310 L318 I323	T12-L14 PolarHBondContact O-N 3.26Å; L14-L296 HydrophobicContact CD2-CD1 4.13Å; L14-I306 WeakPolarHBondContact CB-O 3.31Å; L14-I306 HydrophobicContact CD2-CG2 4.07Å; L14-I306 PolarHBondContact N-O 2.8Å; L14-I306 VanDerWaalsContact N-O 3.13Å; L14-C308 HydrophobicContact CB-CB 3.94Å; L14-C308 HydrophobicContact CD2-CB 4.04Å; L14-C308 HydrophobicContact CG-CB 4.42Å; L14-L310 HydrophobicContact CD1-CD2 3.79Å; L14-L310 HydrophobicContact CD1-CG 4.39Å; L14-L318 HydrophobicContact CD1-CB 4.04Å; L14-L318 HydrophobicContact CD1-CD1 3.71Å; L14-L318 HydrophobicContact CD1-CD2 4.45Å; L14-L318 HydrophobicContact CD1-CG 4.28Å; L14-L318 HydrophobicContact CD2-CD1 3.29Å; L14-L318 HydrophobicContact CD2-CD2 3.97Å; L14-L318 HydrophobicContact CD2-CG 4.2Å; L14-L318 HydrophobicContact CG-CD1 4.12Å; L14-I323 HydrophobicContact CD1-CG1 4.14Å; L14-I323 WeakPolarHBondContact O-CA 3.39Å
15	K	70.4	Confident	79.1	Confident	33 Å²	33	48.1 Å²	48.1	14%	0.143	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	146.4	-173.2	-162.8	174.3	-177.5	176.2	0	112.8	T17 G53 I306 D324	K15-T17 HydrophobicContact CD-CG2 3.82Å; K15-T17 HydrophobicContact CG-CG2 4.08Å; K15-G53 WeakPolarHBondContact CD-O 3.42Å; K15-G53 WeakPolarHBondContact CE-O 3.1Å; K15-G53 PolarHBondContact NZ-O 3.49Å; K15-I306 PolarHBondContact N-O 2.96Å; K15-I306 PolarHBondContact O-N 3.08Å; K15-D324 WeakPolarHBondContact CG-OD2 3.28Å
16	I	70	Confident	79.5	Confident	51 Å²	51	45.7 Å²	45.7	26%	0.262	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	111	167.2	-56.3	-178.3	0	0	0	108.6	L13 K18 V305	L13-I16 HydrophobicContact CD1-CD1 4.32Å; L13-I16 HydrophobicContact CD1-CG1 3.72Å; L13-I16 HydrophobicContact CD2-CD1 3.72Å; L13-I16 HydrophobicContact CD2-CG1 3.83Å; L13-I16 HydrophobicContact CG-CG1 4.29Å; I16-K18 HydrophobicContact CG2-CG 4.35Å; I16-V305 HydrophobicContact CG1-CG1 4.39Å; I16-V305 HydrophobicContact CG1-CG2 4.23Å; I16-V305 HydrophobicContact CG2-CG2 4.29Å
17	T	71.9	Confident	79.9	Confident	8 Å²	8	42.1 Å²	42.1	5%	0.049	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.5	175.5	54	0	0	0	0	110.3	K15 Y48 L304	K15-T17 HydrophobicContact CD-CG2 3.82Å; K15-T17 HydrophobicContact CG-CG2 4.08Å; T17-Y48 HydrophobicContact CG2-CD1 4.25Å; T17-Y48 HydrophobicContact CG2-CE1 4.04Å; T17-Y48 VanDerWaalsContact OG1-CE1 3.3Å; T17-Y48 WeakPolarHBondContact OG1-CE1 3.38Å; T17-L304 PolarHBondContact N-O 2.79Å; T17-L304 PolarHBondContact O-N 2.97Å; T17-L304 WeakPolarHBondContact OG1-CB 3.33Å; T17-L304 PolarHBondContact OG1-O 2.89Å
18	K	71.9	Confident	80.3	Confident	173 Å²	173	42.9 Å²	42.9	75%	0.752	23%	0.231	S	C	*	.			trans	-105.9	54	173.3	-65.4	-177.1	-179	174.3	0	111	I16	I16-K18 HydrophobicContact CG2-CG 4.35Å
19	E	71.3	Confident	80.8	Confident	63 Å²	63	43.8 Å²	43.8	29%	0.294	24%	0.235	S	C	.	.			trans	-80.4	-21.1	-178.7	-66.2	-169.2	-161.7	0	0	113.7	T46 Y48 G55 R58	E19-T46 HydrophobicContact CB-CG2 4.33Å; E19-T46 WeakPolarHBondContact OE2-CG2 3.49Å; E19-Y48 HydrophobicContact CG-CE1 4.36Å; E19-G55 WeakPolarHBondContact OE1-CA 3.32Å; E19-R58 PolarHBondContact O-NE 3.28Å; E19-R58 VanDerWaalsContact O-NE 3.14Å; E19-R58 PolarHBondContact O-NH2 2.99Å
20	S	74.5	Confident	81.3	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.063	21%	0.212	C	C	.	.			trans	-99.8	139.9	174.2	-59.7	0	0	0	0	110	D42 T44	S20-D42 WeakPolarHBondContact CA-OD2 3.09Å; S20-T44 PolarHBondContact OG-OG1 2.97Å
21	A	80.4	Confident	81.8	Confident	100 Å²	100	37.8 Å²	37.8	83%	0.826	21%	0.212	S	C	*	.	S	Bend	trans	-85.3	-13.8	178.2	0	0	0	0	0	112.7	D42	A21-D42 PolarHBondContact N-OD2 2.98Å
22	G	83.1	Confident	82.4	Confident	15 Å²	15	38.9 Å²	38.9	16%	0.155	22%	0.218	C	C	.	.	S	Bend	trans	-115.7	174.5	179.2	0	0	0	0	0	112.6
23	R	87.3	Confident	83.2	Confident	61 Å²	61	36 Å²	36	23%	0.23	20%	0.201	C	C	.	.			trans	-61	141.8	176.8	-170	-175.1	178.3	-171.5	-1.4	111.4	A40 E41 N286	R23-A40 CarbonylContact O-C 3.57Å; R23-A40 WeakPolarHBondContact O-CA 3.48Å; R23-A40 WeakPolarHBondContact O-CB 3.47Å; R23-E41 HydrophobicContact CB-CG 4.05Å; R23-E41 PolarHBondContact O-N 2.71Å; R23-N286 PolarHBondContact NE-OD1 2.75Å; R23-N286 VanDerWaalsContact NE-OD1 3.16Å; R23-N286 VanDerWaalsContact NH2-CG 3.35Å
24	I	91.1	Very high	84.2	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.9	171.4	-64.4	180	0	0	0	108.9	V27 S39 N286 A300 C301 G303 L304	I24-V27 HydrophobicContact CG2-CG1 3.58Å; I24-S39 CarbonylContact C-O 3.58Å; I24-S39 WeakPolarHBondContact CA-O 3.41Å; I24-N286 PolarHBondContact O-ND2 2.81Å; I24-A300 HydrophobicContact CB-CB 3.83Å; I24-A300 HydrophobicContact CD1-CB 4Å; I24-A300 HydrophobicContact CG1-CB 4.49Å; I24-A300 HydrophobicContact CG2-CB 3.64Å; I24-C301 PolarHBondContact N-O 3.26Å; I24-G303 VanDerWaalsContact CD1-C 3.5Å; I24-L304 HydrophobicContact CD1-CB 3.49Å; I24-L304 VanDerWaalsContact CD1-CB 3.49Å; I24-L304 HydrophobicContact CD1-CD1 4.19Å; I24-L304 HydrophobicContact CD1-CG 4.43Å
25	N	92.2	Very high	85.3	Confident	33 Å²	33	36.6 Å²	36.6	18%	0.176	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	-42	-177	-67	-34.7	0	0	0	111.9	S39 A40 E41 A66 D67 C287	N25-S39 PolarHBondContact N-O 2.81Å; N25-A40 VanDerWaalsContact ND2-C 3.31Å; N25-E41 PolarHBondContact ND2-N 2.69Å; N25-E41 WeakPolarHBondContact OD1-CG 3.15Å; N25-A66 PolarHBondContact ND2-O 2.94Å; N25-D67 WeakPolarHBondContact CB-O 3.44Å; N25-C287 PolarHBondContact O-SG 2.73Å
26	S	93.7	Very high	86.3	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	151.8	-175.1	-175.1	0	0	0	0	110.5	S38 S39 D67 V69	S26-S38 WeakPolarHBondContact O-CA 3.36Å; S26-S39 WeakPolarHBondContact CB-OG 3.35Å; S26-S39 PolarHBondContact N-OG 3.33Å; S26-S39 PolarHBondContact O-N 3.28Å; S26-S39 PolarHBondContact O-OG 3.44Å; S26-D67 WeakPolarHBondContact CB-O 3.3Å; S26-V69 PolarHBondContact OG-N 3.16Å; S26-V69 PolarHBondContact OG-O 3.04Å
27	V	94	Very high	87.5	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.7	175.9	-56.2	0	0	0	0	111.2	I24 L36 I37 C287 R289 A300 L304	I24-V27 HydrophobicContact CG2-CG1 3.58Å; V27-L36 HydrophobicContact CB-CD1 4.1Å; V27-I37 CarbonylContact C-O 3.49Å; V27-I37 WeakPolarHBondContact CA-O 3.49Å; V27-C287 HydrophobicContact CG1-CB 4.4Å; V27-C287 HydrophobicContact CG2-CB 3.84Å; V27-R289 HydrophobicContact CG2-CB 4.4Å; V27-R289 HydrophobicContact CG2-CG 3.82Å; V27-A300 HydrophobicContact CG1-CB 4.01Å; V27-L304 HydrophobicContact CG1-CD1 4.02Å
28	C	94.6	Very high	88.5	Confident	23 Å²	23	32.3 Å²	32.3	16%	0.155	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	132.9	179.7	-177.2	0	0	0	0	111	L36 I37 I70 F71	C28-L36 WeakPolarHBondContact O-CA 3.46Å; C28-L36 WeakPolarHBondContact O-CD1 3.2Å; C28-I37 HydrophobicContact CB-CG2 3.95Å; C28-I37 PolarHBondContact N-O 2.8Å; C28-I37 PolarHBondContact O-N 2.92Å; C28-I70 HydrophobicContact CB-CG2 4.47Å; C28-F71 WeakPolarHBondContact O-CD2 3.42Å; C28-F71 VanDerWaalsContact O-CE2 3.27Å; C28-F71 WeakPolarHBondContact O-CE2 3.4Å; C28-F71 PolarHBondContact SG-N 3.41Å; C28-F71 VanDerWaalsContact SG-N 3.39Å
29	F	93.9	Very high	89.6	Confident	18 Å²	18	24 Å²	24	8%	0.079	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	148.2	169.9	-74.9	-77.3	0	0	0	110.6	Y35 L36 C50 F71 R289 F290 N291 L296 A298	F29-Y35 CarbonylContact C-O 3.55Å; F29-Y35 WeakPolarHBondContact CA-O 3.37Å; F29-L36 HydrophobicContact CD1-CB 3.87Å; F29-L36 HydrophobicContact CD1-CD1 3.89Å; F29-L36 HydrophobicContact CD1-CG 4.42Å; F29-L36 HydrophobicContact CD2-CD1 4.07Å; F29-L36 HydrophobicContact CE1-CB 3.82Å; F29-L36 HydrophobicContact CE1-CD1 3.87Å; F29-L36 HydrophobicContact CE1-CD2 4.22Å; F29-L36 HydrophobicContact CE1-CG 4.2Å; F29-L36 HydrophobicContact CE2-CD1 4.03Å; F29-L36 HydrophobicContact CG-CD1 4Å; F29-L36 HydrophobicContact CZ-CD1 3.95Å; F29-L36 HydrophobicContact CZ-CD2 4.31Å; F29-C50 VanDerWaalsContact CE1-SG 3.58Å; F29-F71 VanDerWaalsContact C-CD2 3.43Å; F29-R289 HydrophobicContact CD2-CB 3.76Å; F29-R289 HydrophobicContact CE2-CB 3.69Å; F29-R289 WeakPolarHBondContact CE2-O 3.3Å; F29-F290 WeakPolarHBondContact CD2-O 3.16Å; F29-N291 HydrophobicContact CD1-CB 4.1Å; F29-N291 WeakPolarHBondContact CD1-ND2 3.28Å; F29-N291 HydrophobicContact CD2-CB 4.35Å; F29-N291 HydrophobicContact CE1-CB 3.93Å; F29-N291 WeakPolarHBondContact CE1-ND2 3.38Å; F29-N291 HydrophobicContact CE2-CB 4.2Å; F29-N291 HydrophobicContact CG-CB 4.3Å; F29-N291 HydrophobicContact CZ-CB 3.98Å; F29-L296 HydrophobicContact CE1-CD2 4Å; F29-L296 HydrophobicContact CZ-CD2 4.4Å; F29-A298 HydrophobicContact CE2-CB 3.89Å; F29-A298 HydrophobicContact CZ-CB 3.64Å
30	S	94.6	Very high	90.7	Very high	2 Å²	2	21 Å²	21	1%	0.014	13%	0.132	C	C	.	.			trans	-65.4	154.5	166.9	58.4	0	0	0	0	110	D32 G33 S34 Y35 P292	S30-D32 VanDerWaalsContact CB-OD1 3.3Å; S30-D32 WeakPolarHBondContact CB-OD1 3.39Å; S30-D32 PolarHBondContact O-N 2.99Å; S30-D32 PolarHBondContact OG-OD1 3.21Å; S30-G33 WeakPolarHBondContact O-CA 2.95Å; S30-G33 PolarHBondContact O-N 2.88Å; S30-S34 PolarHBondContact OG-N 3.34Å; S30-Y35 PolarHBondContact N-O 2.76Å; S30-Y35 PolarHBondContact OG-N 2.82Å; S30-Y35 PolarHBondContact OG-O 3.15Å; S30-P292 WeakPolarHBondContact O-CG 3.44Å
31	S	91	Very high	91.5	Very high	73 Å²	73	26.2 Å²	26.2	51%	0.51	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.9	-178.8	53.1	0	0	0	0	112.9	G33	S31-G33 VanDerWaalsContact C-N 3.27Å; S31-G33 PolarHBondContact O-N 3.26Å
32	D	90.7	Very high	92	Very high	36 Å²	36	23.1 Å²	23.1	19%	0.193	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.3	174	73.5	-10.8	0	0	0	113.8	S30 S34 N75 Q293	S30-D32 VanDerWaalsContact CB-OD1 3.3Å; S30-D32 WeakPolarHBondContact CB-OD1 3.39Å; S30-D32 PolarHBondContact O-N 2.99Å; S30-D32 PolarHBondContact OG-OD1 3.21Å; D32-S34 PolarHBondContact O-N 2.78Å; D32-S34 WeakPolarHBondContact OD1-CB 3.36Å; D32-S34 PolarHBondContact OD1-N 2.99Å; D32-S34 PolarHBondContact OD1-OG 3.08Å; D32-S34 WeakPolarHBondContact OD2-CB 3.36Å; D32-S34 PolarHBondContact OD2-OG 3.22Å; D32-N75 PolarHBondContact OD2-ND2 2.9Å; D32-Q293 VanDerWaalsContact C-CD 3.42Å; D32-Q293 PolarHBondContact O-OE1 3.13Å
33	G	90.2	Very high	92.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	65.8	-0.1	-177.4	0	0	0	0	0	115.1	S30 S31 Y35 C50 N291 Y294	S30-G33 WeakPolarHBondContact O-CA 2.95Å; S30-G33 PolarHBondContact O-N 2.88Å; S31-G33 VanDerWaalsContact C-N 3.27Å; S31-G33 PolarHBondContact O-N 3.26Å; G33-Y35 VanDerWaalsContact C-N 3.3Å; G33-Y35 PolarHBondContact O-N 3.28Å; G33-C50 VanDerWaalsContact O-CB 3.29Å; G33-C50 WeakPolarHBondContact O-CB 3.3Å; G33-C50 PolarHBondContact O-SG 3.36Å; G33-N291 WeakPolarHBondContact CA-ND2 3.34Å; G33-N291 WeakPolarHBondContact CA-OD1 3.22Å; G33-N291 PolarHBondContact O-ND2 2.78Å; G33-Y294 WeakPolarHBondContact O-CD2 3.3Å; G33-Y294 WeakPolarHBondContact O-CE2 3.28Å
34	S	91	Very high	92.8	Very high	25 Å²	25	20.6 Å²	20.6	18%	0.175	11%	0.113	C	C	.	.	S	Bend	trans	-69.3	-29.5	-175.3	-59.1	0	0	0	0	112.6	S30 D32 C50	S30-S34 PolarHBondContact OG-N 3.34Å; D32-S34 PolarHBondContact O-N 2.78Å; D32-S34 WeakPolarHBondContact OD1-CB 3.36Å; D32-S34 PolarHBondContact OD1-N 2.99Å; D32-S34 PolarHBondContact OD1-OG 3.08Å; D32-S34 WeakPolarHBondContact OD2-CB 3.36Å; D32-S34 PolarHBondContact OD2-OG 3.22Å; S34-C50 WeakPolarHBondContact O-CB 3.36Å; S34-C50 PolarHBondContact O-N 2.86Å
35	Y	92.7	Very high	93	Very high	41 Å²	41	20.7 Å²	20.7	16%	0.161	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	156.6	-175.5	-60.6	-75.6	0	0	0	112.7	F29 S30 G33 V47 Y48 D49 H56 L76	F29-Y35 CarbonylContact C-O 3.55Å; F29-Y35 WeakPolarHBondContact CA-O 3.37Å; S30-Y35 PolarHBondContact N-O 2.76Å; S30-Y35 PolarHBondContact OG-N 2.82Å; S30-Y35 PolarHBondContact OG-O 3.15Å; G33-Y35 VanDerWaalsContact C-N 3.3Å; G33-Y35 PolarHBondContact O-N 3.28Å; Y35-V47 HydrophobicContact CD1-CG1 3.84Å; Y35-V47 HydrophobicContact CG-CG1 4.16Å; Y35-Y48 VanDerWaalsContact CA-O 3.26Å; Y35-Y48 WeakPolarHBondContact CA-O 3.2Å; Y35-D49 HydrophobicContact CD1-CB 4.38Å; Y35-D49 HydrophobicContact CE1-CB 4.21Å; Y35-H56 HydrophobicContact CD1-CB 4.42Å; Y35-H56 HydrophobicContact CE1-CB 4.26Å; Y35-H56 AromaticContact CE1-CD2 3.76Å; Y35-H56 AromaticContact CE1-CG 3.74Å; Y35-H56 AromaticContact CE1-ND1 3.97Å; Y35-L76 HydrophobicContact CD1-CD2 4.2Å; Y35-L76 HydrophobicContact CD2-CD2 3.82Å; Y35-L76 HydrophobicContact CD2-CG 4.19Å; Y35-L76 HydrophobicContact CE1-CD2 4.36Å; Y35-L76 HydrophobicContact CE2-CD1 3.94Å; Y35-L76 HydrophobicContact CE2-CD2 4Å; Y35-L76 HydrophobicContact CE2-CG 4.05Å; Y35-L76 HydrophobicContact CG-CD2 3.92Å
36	L	92.9	Very high	93	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.1	170	174	69	0	0	0	108	V27 C28 F29 V47 Y48 A298 L304 I306	V27-L36 HydrophobicContact CB-CD1 4.1Å; C28-L36 WeakPolarHBondContact O-CA 3.46Å; C28-L36 WeakPolarHBondContact O-CD1 3.2Å; F29-L36 HydrophobicContact CD1-CB 3.87Å; F29-L36 HydrophobicContact CD1-CD1 3.89Å; F29-L36 HydrophobicContact CD1-CG 4.42Å; F29-L36 HydrophobicContact CD2-CD1 4.07Å; F29-L36 HydrophobicContact CE1-CB 3.82Å; F29-L36 HydrophobicContact CE1-CD1 3.87Å; F29-L36 HydrophobicContact CE1-CD2 4.22Å; F29-L36 HydrophobicContact CE1-CG 4.2Å; F29-L36 HydrophobicContact CE2-CD1 4.03Å; F29-L36 HydrophobicContact CG-CD1 4Å; F29-L36 HydrophobicContact CZ-CD1 3.95Å; F29-L36 HydrophobicContact CZ-CD2 4.31Å; L36-V47 CarbonylContact O-C 3.59Å; L36-V47 VanDerWaalsContact O-CA 3.28Å; L36-V47 WeakPolarHBondContact O-CA 3.32Å; L36-Y48 HydrophobicContact CD2-CD2 4.42Å; L36-Y48 HydrophobicContact CG-CD2 4.45Å; L36-Y48 PolarHBondContact N-O 2.97Å; L36-Y48 PolarHBondContact O-N 3.28Å; L36-A298 HydrophobicContact CD1-CB 4.07Å; L36-A298 HydrophobicContact CD2-CB 3.51Å; L36-A298 HydrophobicContact CG-CB 4.47Å; L36-L304 HydrophobicContact CD2-CD1 4.2Å; L36-L304 HydrophobicContact CD2-CD2 3.58Å; L36-L304 HydrophobicContact CD2-CG 4.39Å; L36-I306 HydrophobicContact CD2-CD1 4.23Å; L36-I306 HydrophobicContact CD2-CG1 4.36Å
37	I	94.1	Very high	93	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141	172	-168.9	167.1	0	0	0	109.9	V27 C28 T46 V47 V69 F71 C78 L94	V27-I37 CarbonylContact C-O 3.49Å; V27-I37 WeakPolarHBondContact CA-O 3.49Å; C28-I37 HydrophobicContact CB-CG2 3.95Å; C28-I37 PolarHBondContact N-O 2.8Å; C28-I37 PolarHBondContact O-N 2.92Å; I37-T46 CarbonylContact C-O 3.53Å; I37-T46 VanDerWaalsContact CA-O 3.31Å; I37-T46 WeakPolarHBondContact CA-O 3.44Å; I37-V47 HydrophobicContact CD1-CG2 4.23Å; I37-V47 HydrophobicContact CG1-CG2 4.21Å; I37-V69 HydrophobicContact CD1-CG2 3.66Å; I37-V69 HydrophobicContact CG1-CG2 3.92Å; I37-V69 HydrophobicContact CG2-CG1 4.16Å; I37-V69 HydrophobicContact CG2-CG2 3.84Å; I37-F71 HydrophobicContact CB-CD2 4.24Å; I37-F71 HydrophobicContact CB-CE1 4.2Å; I37-F71 HydrophobicContact CB-CE2 3.61Å; I37-F71 HydrophobicContact CB-CZ 3.57Å; I37-F71 HydrophobicContact CG2-CD1 4.48Å; I37-F71 HydrophobicContact CG2-CD2 3.6Å; I37-F71 HydrophobicContact CG2-CE1 4.34Å; I37-F71 HydrophobicContact CG2-CE2 3.49Å; I37-F71 VanDerWaalsContact CG2-CE2 3.49Å; I37-F71 HydrophobicContact CG2-CG 4.15Å; I37-F71 HydrophobicContact CG2-CZ 3.88Å; I37-F71 VanDerWaalsContact N-CE2 3.33Å; I37-C78 HydrophobicContact CD1-CB 3.77Å; I37-L94 HydrophobicContact CD1-CD1 3.84Å; I37-L94 HydrophobicContact CD1-CD2 4Å
38	S	94	Very high	92.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.7	170.8	67.6	0	0	0	0	111.2	S26 L45 T46 Y48	S26-S38 WeakPolarHBondContact O-CA 3.36Å; S38-L45 CarbonylContact O-C 3.59Å; S38-L45 VanDerWaalsContact O-CA 3.31Å; S38-L45 WeakPolarHBondContact O-CA 3.44Å; S38-T46 PolarHBondContact N-O 2.8Å; S38-T46 PolarHBondContact O-N 3.11Å; S38-Y48 WeakPolarHBondContact OG-CE2 3.27Å
39	S	94.8	Very high	92.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	145.6	164.5	51.3	0	0	0	0	110.2	I24 N25 S26 T44 D67 V69	I24-S39 CarbonylContact C-O 3.58Å; I24-S39 WeakPolarHBondContact CA-O 3.41Å; N25-S39 PolarHBondContact N-O 2.81Å; S26-S39 WeakPolarHBondContact CB-OG 3.35Å; S26-S39 PolarHBondContact N-OG 3.33Å; S26-S39 PolarHBondContact O-N 3.28Å; S26-S39 PolarHBondContact O-OG 3.44Å; S39-T44 WeakPolarHBondContact CA-O 3.36Å; S39-D67 WeakPolarHBondContact CB-O 3.46Å; S39-D67 PolarHBondContact OG-O 3.32Å; S39-V69 WeakPolarHBondContact OG-CG1 3.49Å
40	A	93.4	Very high	92.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.4	-179	0	0	0	0	0	113.6	R23 N25 D42 D43 T44	R23-A40 CarbonylContact O-C 3.57Å; R23-A40 WeakPolarHBondContact O-CA 3.48Å; R23-A40 WeakPolarHBondContact O-CB 3.47Å; N25-A40 VanDerWaalsContact ND2-C 3.31Å; A40-D42 VanDerWaalsContact CB-OD1 3.3Å; A40-D42 WeakPolarHBondContact CB-OD1 3.48Å; A40-D42 PolarHBondContact O-N 2.98Å; A40-D42 VanDerWaalsContact O-N 3.14Å; A40-D43 PolarHBondContact O-N 2.9Å; A40-T44 PolarHBondContact N-O 2.97Å
41	E	91.2	Very high	91.4	Very high	117 Å²	117	25.6 Å²	25.6	55%	0.547	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.2	178.8	-70.8	-180	168.2	0	0	113.7	R23 N25 D43	R23-E41 HydrophobicContact CB-CG 4.05Å; R23-E41 PolarHBondContact O-N 2.71Å; N25-E41 PolarHBondContact ND2-N 2.69Å; N25-E41 WeakPolarHBondContact OD1-CG 3.15Å; E41-D43 PolarHBondContact O-N 3.21Å
42	D	91.6	Very high	90.8	Very high	35 Å²	35	24.2 Å²	24.2	19%	0.187	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	17.1	174.5	71.3	-9.1	0	0	0	113.4	S20 A21 A40 T44 R58	S20-D42 WeakPolarHBondContact CA-OD2 3.09Å; A21-D42 PolarHBondContact N-OD2 2.98Å; A40-D42 VanDerWaalsContact CB-OD1 3.3Å; A40-D42 WeakPolarHBondContact CB-OD1 3.48Å; A40-D42 PolarHBondContact O-N 2.98Å; A40-D42 VanDerWaalsContact O-N 3.14Å; D42-T44 PolarHBondContact O-N 3.27Å; D42-T44 VanDerWaalsContact OD1-CB 3.29Å; D42-T44 WeakPolarHBondContact OD1-CB 3.42Å; D42-T44 VanDerWaalsContact OD1-CG2 3.28Å; D42-T44 WeakPolarHBondContact OD1-CG2 3.45Å; D42-T44 PolarHBondContact OD1-N 3.34Å; D42-T44 PolarHBondContact OD1-OG1 2.84Å; D42-R58 IonicContact OD2-NH2 2.71Å
43	D	94.3	Very high	89.9	Confident	22 Å²	22	22.5 Å²	22.5	12%	0.118	11%	0.107	C	C	.	.	S	Bend	trans	66	13.2	-178.6	-42.5	-58	0	0	0	115.2	A40 E41 S61 G65 K84	A40-D43 PolarHBondContact O-N 2.9Å; E41-D43 PolarHBondContact O-N 3.21Å; D43-S61 PolarHBondContact O-N 2.92Å; D43-G65 WeakPolarHBondContact OD1-CA 3.27Å; D43-K84 WeakPolarHBondContact OD1-CE 3.39Å; D43-K84 IonicContact OD1-NZ 2.71Å; D43-K84 PolarHBondContact OD1-NZ 3.45Å; D43-K84 IonicContact OD2-NZ 3.4Å; D43-K84 PolarHBondContact OD2-NZ 2.75Å
44	T	93.9	Very high	89.2	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	143.1	-177.9	62.8	0	0	0	0	112	S20 S39 A40 D42 L59	S20-T44 PolarHBondContact OG-OG1 2.97Å; S39-T44 WeakPolarHBondContact CA-O 3.36Å; A40-T44 PolarHBondContact N-O 2.97Å; D42-T44 PolarHBondContact O-N 3.27Å; D42-T44 VanDerWaalsContact OD1-CB 3.29Å; D42-T44 WeakPolarHBondContact OD1-CB 3.42Å; D42-T44 VanDerWaalsContact OD1-CG2 3.28Å; D42-T44 WeakPolarHBondContact OD1-CG2 3.45Å; D42-T44 PolarHBondContact OD1-N 3.34Å; D42-T44 PolarHBondContact OD1-OG1 2.84Å; T44-L59 CarbonylContact C-O 3.59Å; T44-L59 WeakPolarHBondContact CA-O 3.48Å
45	L	94.7	Very high	88.5	Confident	2 Å²	2	28 Å²	28	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.9	163.5	-64.5	173.9	0	0	0	106.6	S38 L59 A66 V69 H80 L92	S38-L45 CarbonylContact O-C 3.59Å; S38-L45 VanDerWaalsContact O-CA 3.31Å; S38-L45 WeakPolarHBondContact O-CA 3.44Å; L45-L59 HydrophobicContact CB-CB 4.43Å; L45-L59 PolarHBondContact N-O 2.89Å; L45-L59 PolarHBondContact O-N 2.83Å; L45-A66 HydrophobicContact CD2-CB 3.76Å; L45-A66 HydrophobicContact CG-CB 4.23Å; L45-V69 HydrophobicContact CD2-CB 4.38Å; L45-V69 HydrophobicContact CD2-CG2 3.99Å; L45-H80 HydrophobicContact CD2-CB 4.33Å; L45-L92 HydrophobicContact CD1-CD2 3.77Å
46	T	92.7	Very high	88.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.2	-178.6	-51.4	0	0	0	0	109.2	E19 I37 S38 Y48 L57	E19-T46 HydrophobicContact CB-CG2 4.33Å; E19-T46 WeakPolarHBondContact OE2-CG2 3.49Å; I37-T46 CarbonylContact C-O 3.53Å; I37-T46 VanDerWaalsContact CA-O 3.31Å; I37-T46 WeakPolarHBondContact CA-O 3.44Å; S38-T46 PolarHBondContact N-O 2.8Å; S38-T46 PolarHBondContact O-N 3.11Å; T46-Y48 HydrophobicContact CG2-CD1 4.39Å; T46-Y48 HydrophobicContact CG2-CD2 4.36Å; T46-Y48 HydrophobicContact CG2-CE1 3.72Å; T46-Y48 HydrophobicContact CG2-CE2 3.67Å; T46-Y48 WeakPolarHBondContact CG2-OH 3.18Å; T46-L57 CarbonylContact C-O 3.59Å; T46-L57 WeakPolarHBondContact CA-O 3.29Å
47	V	92.9	Very high	88.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132	175	-175.5	0	0	0	0	107.9	Y35 L36 I37 H56 L57 F71 L76 L94	Y35-V47 HydrophobicContact CD1-CG1 3.84Å; Y35-V47 HydrophobicContact CG-CG1 4.16Å; L36-V47 CarbonylContact O-C 3.59Å; L36-V47 VanDerWaalsContact O-CA 3.28Å; L36-V47 WeakPolarHBondContact O-CA 3.32Å; I37-V47 HydrophobicContact CD1-CG2 4.23Å; I37-V47 HydrophobicContact CG1-CG2 4.21Å; V47-H56 HydrophobicContact CB-CB 4.35Å; V47-H56 HydrophobicContact CG1-CB 4.14Å; V47-H56 WeakPolarHBondContact O-CA 3.43Å; V47-H56 WeakPolarHBondContact O-CB 3.43Å; V47-H56 PolarHBondContact O-N 3.35Å; V47-L57 HydrophobicContact CB-CB 4.14Å; V47-L57 HydrophobicContact CG2-CB 4.21Å; V47-L57 PolarHBondContact N-O 2.87Å; V47-L57 PolarHBondContact O-N 2.92Å; V47-F71 HydrophobicContact CG1-CZ 4.24Å; V47-L76 HydrophobicContact CG1-CD2 3.95Å; V47-L94 HydrophobicContact CG2-CD1 3.78Å; V47-L94 HydrophobicContact CG2-CD2 4.4Å
48	Y	89.4	Confident	87.9	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.3	176.4	-52.5	-92	0	0	0	108.8	T17 E19 Y35 L36 S38 T46 Q54 L304	T17-Y48 HydrophobicContact CG2-CD1 4.25Å; T17-Y48 HydrophobicContact CG2-CE1 4.04Å; T17-Y48 VanDerWaalsContact OG1-CE1 3.3Å; T17-Y48 WeakPolarHBondContact OG1-CE1 3.38Å; E19-Y48 HydrophobicContact CG-CE1 4.36Å; Y35-Y48 VanDerWaalsContact CA-O 3.26Å; Y35-Y48 WeakPolarHBondContact CA-O 3.2Å; L36-Y48 HydrophobicContact CD2-CD2 4.42Å; L36-Y48 HydrophobicContact CG-CD2 4.45Å; L36-Y48 PolarHBondContact N-O 2.97Å; L36-Y48 PolarHBondContact O-N 3.28Å; S38-Y48 WeakPolarHBondContact OG-CE2 3.27Å; T46-Y48 HydrophobicContact CG2-CD1 4.39Å; T46-Y48 HydrophobicContact CG2-CD2 4.36Å; T46-Y48 HydrophobicContact CG2-CE1 3.72Å; T46-Y48 HydrophobicContact CG2-CE2 3.67Å; T46-Y48 WeakPolarHBondContact CG2-OH 3.18Å; Y48-Q54 WeakPolarHBondContact CA-O 3.24Å; Y48-L304 HydrophobicContact CD1-CD2 4.27Å; Y48-L304 HydrophobicContact CD2-CD2 3.49Å; Y48-L304 VanDerWaalsContact CD2-CD2 3.49Å; Y48-L304 HydrophobicContact CE1-CD2 4.08Å; Y48-L304 HydrophobicContact CE2-CD2 3.26Å; Y48-L304 HydrophobicContact CG-CD2 3.99Å
49	D	87.8	Confident	87.9	Confident	32 Å²	32	39.3 Å²	39.3	17%	0.171	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.6	168.5	177.5	-49	0	0	0	108.5	Y35 R51 T52 G53 Q54 H56	Y35-D49 HydrophobicContact CD1-CB 4.38Å; Y35-D49 HydrophobicContact CE1-CB 4.21Å; D49-R51 VanDerWaalsContact C-N 3.26Å; D49-R51 PolarHBondContact O-N 2.75Å; D49-R51 WeakPolarHBondContact OD1-CA 3.25Å; D49-R51 WeakPolarHBondContact OD1-CB 3.38Å; D49-R51 PolarHBondContact OD1-N 2.84Å; D49-T52 WeakPolarHBondContact CB-OG1 3.38Å; D49-T52 PolarHBondContact O-N 2.86Å; D49-T52 PolarHBondContact OD1-N 2.81Å; D49-T52 PolarHBondContact OD1-OG1 2.84Å; D49-G53 WeakPolarHBondContact O-CA 3.4Å; D49-G53 PolarHBondContact O-N 3.16Å; D49-Q54 PolarHBondContact N-O 2.9Å; D49-H56 HydrophobicContact CB-CB 4.43Å
50	C	85.9	Confident	87.8	Confident	4 Å²	4	42 Å²	42	3%	0.027	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-22.3	-175.9	-67.1	0	0	0	0	113.4	F29 G33 S34 L296	F29-C50 VanDerWaalsContact CE1-SG 3.58Å; G33-C50 VanDerWaalsContact O-CB 3.29Å; G33-C50 WeakPolarHBondContact O-CB 3.3Å; G33-C50 PolarHBondContact O-SG 3.36Å; S34-C50 WeakPolarHBondContact O-CB 3.36Å; S34-C50 PolarHBondContact O-N 2.86Å; C50-L296 HydrophobicContact CB-CD2 3.6Å
51	R	80.6	Confident	87.8	Confident	146 Å²	146	42.3 Å²	42.3	55%	0.551	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-25.2	-177.9	-63.3	175.9	59.2	124.8	2.6	112.8	D49 L318	D49-R51 VanDerWaalsContact C-N 3.26Å; D49-R51 PolarHBondContact O-N 2.75Å; D49-R51 WeakPolarHBondContact OD1-CA 3.25Å; D49-R51 WeakPolarHBondContact OD1-CB 3.38Å; D49-R51 PolarHBondContact OD1-N 2.84Å; R51-L318 WeakPolarHBondContact O-CD2 3.25Å; R51-L318 WeakPolarHBondContact O-CG 3.14Å
52	T	77.8	Confident	87.9	Confident	45 Å²	45	45.8 Å²	45.8	28%	0.276	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-12.8	177.5	66.9	0	0	0	0	112.6	D49 Q54 C322	D49-T52 WeakPolarHBondContact CB-OG1 3.38Å; D49-T52 PolarHBondContact O-N 2.86Å; D49-T52 PolarHBondContact OD1-N 2.81Å; D49-T52 PolarHBondContact OD1-OG1 2.84Å; T52-Q54 PolarHBondContact O-N 3.39Å; T52-Q54 VanDerWaalsContact O-N 3.08Å; T52-Q54 PolarHBondContact OG1-N 2.89Å; T52-C322 PolarHBondContact O-SG 2.74Å
53	G	72.3	Confident	88	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.239	C	C	.	.			trans	61.4	10.4	-171.3	0	0	0	0	0	113.7	K15 D49	K15-G53 WeakPolarHBondContact CD-O 3.42Å; K15-G53 WeakPolarHBondContact CE-O 3.1Å; K15-G53 PolarHBondContact NZ-O 3.49Å; D49-G53 WeakPolarHBondContact O-CA 3.4Å; D49-G53 PolarHBondContact O-N 3.16Å
54	Q	74.3	Confident	88.1	Confident	107 Å²	107	51.7 Å²	51.7	50%	0.5	24%	0.24	S	C	.	.	S	Bend	trans	-91.5	147.8	-178	-63.3	-172	1.5	0	0	111.1	Y48 D49 T52 H56	Y48-Q54 WeakPolarHBondContact CA-O 3.24Å; D49-Q54 PolarHBondContact N-O 2.9Å; T52-Q54 PolarHBondContact O-N 3.39Å; T52-Q54 VanDerWaalsContact O-N 3.08Å; T52-Q54 PolarHBondContact OG1-N 2.89Å; Q54-H56 PolarHBondContact O-N 3.49Å; Q54-H56 VanDerWaalsContact O-N 3.16Å
55	G	77.3	Confident	88.2	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	117.1	165.9	0	0	0	0	0	109.6	E19	E19-G55 WeakPolarHBondContact OE1-CA 3.32Å
56	H	85.2	Confident	88.2	Confident	73 Å²	73	51.5 Å²	51.5	34%	0.338	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-47.6	178.2	-179.8	66.7	0	0	0	110.9	Y35 V47 D49 Q54	Y35-H56 HydrophobicContact CD1-CB 4.42Å; Y35-H56 HydrophobicContact CE1-CB 4.26Å; Y35-H56 AromaticContact CE1-CD2 3.76Å; Y35-H56 AromaticContact CE1-CG 3.74Å; Y35-H56 AromaticContact CE1-ND1 3.97Å; V47-H56 HydrophobicContact CB-CB 4.35Å; V47-H56 HydrophobicContact CG1-CB 4.14Å; V47-H56 WeakPolarHBondContact O-CA 3.43Å; V47-H56 WeakPolarHBondContact O-CB 3.43Å; V47-H56 PolarHBondContact O-N 3.35Å; D49-H56 HydrophobicContact CB-CB 4.43Å; Q54-H56 PolarHBondContact O-N 3.49Å; Q54-H56 VanDerWaalsContact O-N 3.16Å
57	L	91.1	Very high	88.3	Confident	50 Å²	50	52.1 Å²	52.1	26%	0.262	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	144.2	-179.8	-67.9	170.5	0	0	0	110.6	T46 V47 L94	T46-L57 CarbonylContact C-O 3.59Å; T46-L57 WeakPolarHBondContact CA-O 3.29Å; V47-L57 HydrophobicContact CB-CB 4.14Å; V47-L57 HydrophobicContact CG2-CB 4.21Å; V47-L57 PolarHBondContact N-O 2.87Å; V47-L57 PolarHBondContact O-N 2.92Å; L57-L94 HydrophobicContact CD1-CB 4.08Å
58	R	91.8	Very high	88.5	Confident	132 Å²	132	53.7 Å²	53.7	50%	0.498	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	114.6	171	-173.6	175.5	-177.1	-91.3	6.2	110	E19 D42	E19-R58 PolarHBondContact O-NE 3.28Å; E19-R58 VanDerWaalsContact O-NE 3.14Å; E19-R58 PolarHBondContact O-NH2 2.99Å; D42-R58 IonicContact OD2-NH2 2.71Å
59	L	93.8	Very high	88.9	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.12	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149.1	179	-57	177.4	0	0	0	109.4	T44 L45 L92 L94 N97	T44-L59 CarbonylContact C-O 3.59Å; T44-L59 WeakPolarHBondContact CA-O 3.48Å; L45-L59 HydrophobicContact CB-CB 4.43Å; L45-L59 PolarHBondContact N-O 2.89Å; L45-L59 PolarHBondContact O-N 2.83Å; L59-L92 HydrophobicContact CD1-CD2 3.85Å; L59-L94 HydrophobicContact CD1-CB 4.35Å; L59-L94 HydrophobicContact CD1-CD2 3.61Å; L59-N97 HydrophobicContact CD2-CB 4.18Å
60	C	92.6	Very high	89.4	Confident	58 Å²	58	53 Å²	53	39%	0.392	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	109.2	-179.4	-168.1	0	0	0	0	109.9	R62	C60-R62 HydrophobicContact CB-CG 4.29Å; C60-R62 PolarHBondContact O-N 3.39Å; C60-R62 WeakPolarHBondContact SG-CG 3.25Å
61	S	93.2	Very high	89.9	Confident	6 Å²	6	53.2 Å²	53.2	4%	0.042	25%	0.247	C	C	.	.			trans	-82.6	43.4	-178.5	-171.8	0	0	0	0	111.4	D43 K63 Y64 G65 H80 Y99	D43-S61 PolarHBondContact O-N 2.92Å; S61-K63 PolarHBondContact O-N 3.33Å; S61-Y64 PolarHBondContact O-N 2.89Å; S61-G65 WeakPolarHBondContact CB-O 3.22Å; S61-G65 PolarHBondContact O-N 2.76Å; S61-G65 PolarHBondContact OG-O 2.93Å; S61-H80 PolarHBondContact OG-CE1 3.31Å; S61-Y99 PolarHBondContact OG-OH 2.81Å
62	R	91.9	Very high	90.7	Very high	190 Å²	190	46.6 Å²	46.6	72%	0.717	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-40.1	-167.5	-65.2	-173.2	179.7	173.3	-0.4	114.9	C60 K84	C60-R62 HydrophobicContact CB-CG 4.29Å; C60-R62 PolarHBondContact O-N 3.39Å; C60-R62 WeakPolarHBondContact SG-CG 3.25Å; R62-K84 PolarHBondContact O-NZ 2.88Å
63	K	94.5	Very high	91.5	Very high	143 Å²	143	47.4 Å²	47.4	62%	0.622	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-33.6	-177.9	-178.2	176	171.8	-173.3	0	112.6	S61	S61-K63 PolarHBondContact O-N 3.33Å
64	Y	95.6	Very high	92.4	Very high	37 Å²	37	50.6 Å²	50.6	15%	0.145	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-24.6	-167.1	-51.9	-61	0	0	0	113.1	S61 S82 T83 K84 S85 R90 Y99	S61-Y64 PolarHBondContact O-N 2.89Å; Y64-S82 CarbonylContact O-C 3.52Å; Y64-S82 WeakPolarHBondContact O-CA 3.48Å; Y64-S82 WeakPolarHBondContact O-CB 3.21Å; Y64-T83 PolarHBondContact O-N 2.88Å; Y64-K84 PolarHBondContact O-N 2.89Å; Y64-K84 VanDerWaalsContact O-N 3.08Å; Y64-S85 WeakPolarHBondContact CD1-OG 3.22Å; Y64-R90 VanDerWaalsContact CB-NE 3.34Å; Y64-R90 VanDerWaalsContact CD1-NE 3.29Å; Y64-R90 VanDerWaalsContact CE1-NH2 3.33Å; Y64-R90 VanDerWaalsContact CG-CZ 3.47Å; Y64-Y99 HydrophobicContact CD2-CE2 4.11Å; Y64-Y99 AromaticContact CD2-CZ 3.89Å; Y64-Y99 WeakPolarHBondContact CD2-OH 3.35Å; Y64-Y99 HydrophobicContact CE2-CD2 4.45Å; Y64-Y99 AromaticContact CE2-CE2 3.73Å; Y64-Y99 HydrophobicContact CE2-CE2 3.73Å; Y64-Y99 AromaticContact CE2-CZ 3.98Å
65	G	95.8	Very high	93.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.239	C	C	.	.			trans	69.1	-177.6	-166.5	0	0	0	0	0	112.8	D43 S61 H80 T83	D43-G65 WeakPolarHBondContact OD1-CA 3.27Å; S61-G65 WeakPolarHBondContact CB-O 3.22Å; S61-G65 PolarHBondContact O-N 2.76Å; S61-G65 PolarHBondContact OG-O 2.93Å; G65-H80 PolarHBondContact O-CE1 2.87Å; G65-H80 VanDerWaalsContact O-CE1 3.3Å; G65-H80 PolarHBondContact O-ND1 3.34Å; G65-T83 WeakPolarHBondContact CA-OG1 3.16Å
66	A	95.9	Very high	93.9	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	23%	0.225	C	C	.	.			trans	-152.4	125.5	176.4	0	0	0	0	0	111.2	N25 L45 S81	N25-A66 PolarHBondContact ND2-O 2.94Å; L45-A66 HydrophobicContact CD2-CB 3.76Å; L45-A66 HydrophobicContact CG-CB 4.23Å; A66-S81 WeakPolarHBondContact CA-O 3.31Å
67	D	95.7	Very high	94.4	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.07	21%	0.214	C	C	.	.			trans	-117.4	-81.7	175	-177.8	80.7	0	0	0	112	N25 S26 S39 S81 T83 K109	N25-D67 WeakPolarHBondContact CB-O 3.44Å; S26-D67 WeakPolarHBondContact CB-O 3.3Å; S39-D67 WeakPolarHBondContact CB-O 3.46Å; S39-D67 PolarHBondContact OG-O 3.32Å; D67-S81 PolarHBondContact N-O 3.3Å; D67-T83 HydrophobicContact CB-CG2 3.37Å; D67-K109 VanDerWaalsContact CG-NZ 3.32Å; D67-K109 WeakPolarHBondContact OD1-CE 3.27Å; D67-K109 IonicContact OD1-NZ 2.65Å; D67-K109 PolarHBondContact OD1-NZ 2.86Å; D67-K109 WeakPolarHBondContact OD2-CE 3.34Å; D67-K109 IonicContact OD2-NZ 3.34Å; D67-K109 PolarHBondContact OD2-NZ 3.09Å
68	Q	96.5	Very high	94.7	Very high	32 Å²	32	43.3 Å²	43.3	15%	0.15	20%	0.202	C	C	.	.	S	Bend	trans	-75.8	139.9	173.6	-59.2	-55.9	-54.9	0	0	109.4	H80 S81 L113	Q68-H80 CarbonylContact O-C 3.39Å; Q68-H80 WeakPolarHBondContact O-CA 3.43Å; Q68-H80 WeakPolarHBondContact O-CB 3.35Å; Q68-S81 PolarHBondContact N-OG 2.96Å; Q68-S81 PolarHBondContact O-N 3.24Å; Q68-L113 HydrophobicContact CB-CB 4.38Å; Q68-L113 HydrophobicContact CB-CD1 3.63Å; Q68-L113 HydrophobicContact CB-CG 3.81Å; Q68-L113 HydrophobicContact CG-CG 4.48Å
69	V	97.6	Very high	95	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.1	173.6	69.5	0	0	0	0	111.1	S26 I37 S39 L45 C78 L79 H80	S26-V69 PolarHBondContact OG-N 3.16Å; S26-V69 PolarHBondContact OG-O 3.04Å; I37-V69 HydrophobicContact CD1-CG2 3.66Å; I37-V69 HydrophobicContact CG1-CG2 3.92Å; I37-V69 HydrophobicContact CG2-CG1 4.16Å; I37-V69 HydrophobicContact CG2-CG2 3.84Å; S39-V69 WeakPolarHBondContact OG-CG1 3.49Å; L45-V69 HydrophobicContact CD2-CB 4.38Å; L45-V69 HydrophobicContact CD2-CG2 3.99Å; V69-C78 HydrophobicContact CG2-CB 4.33Å; V69-L79 WeakPolarHBondContact CA-O 3.23Å; V69-H80 HydrophobicContact CG2-CB 4.38Å
70	I	97.5	Very high	95.3	Very high	20 Å²	20	36 Å²	36	10%	0.103	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	142.3	172.8	55.4	175.3	0	0	0	110	C28 C78 L79 L113 L115	C28-I70 HydrophobicContact CB-CG2 4.47Å; I70-C78 CarbonylContact O-C 3.54Å; I70-C78 WeakPolarHBondContact O-CA 3.09Å; I70-C78 VanDerWaalsContact O-CB 3.26Å; I70-C78 WeakPolarHBondContact O-CB 3.49Å; I70-L79 HydrophobicContact CD1-CB 4.37Å; I70-L79 HydrophobicContact CD1-CD1 3.86Å; I70-L79 HydrophobicContact CG1-CB 3.83Å; I70-L79 HydrophobicContact CG1-CD1 4.15Å; I70-L79 HydrophobicContact CG1-CG 4.49Å; I70-L79 PolarHBondContact N-O 3.41Å; I70-L79 PolarHBondContact O-N 3.13Å; I70-L113 HydrophobicContact CD1-CB 3.83Å; I70-L113 HydrophobicContact CG1-CB 4.31Å; I70-L113 HydrophobicContact CG1-CD1 4.42Å; I70-L113 HydrophobicContact CG2-CB 4.4Å; I70-L115 HydrophobicContact CD1-CB 4.16Å
71	F	97.4	Very high	95.5	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.035	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	154.1	165.2	-79.8	-69.9	0	0	0	110.2	C28 F29 I37 V47 L76 N77 L94	C28-F71 WeakPolarHBondContact O-CD2 3.42Å; C28-F71 VanDerWaalsContact O-CE2 3.27Å; C28-F71 WeakPolarHBondContact O-CE2 3.4Å; C28-F71 PolarHBondContact SG-N 3.41Å; C28-F71 VanDerWaalsContact SG-N 3.39Å; F29-F71 VanDerWaalsContact C-CD2 3.43Å; I37-F71 HydrophobicContact CB-CD2 4.24Å; I37-F71 HydrophobicContact CB-CE1 4.2Å; I37-F71 HydrophobicContact CB-CE2 3.61Å; I37-F71 HydrophobicContact CB-CZ 3.57Å; I37-F71 HydrophobicContact CG2-CD1 4.48Å; I37-F71 HydrophobicContact CG2-CD2 3.6Å; I37-F71 HydrophobicContact CG2-CE1 4.34Å; I37-F71 HydrophobicContact CG2-CE2 3.49Å; I37-F71 VanDerWaalsContact CG2-CE2 3.49Å; I37-F71 HydrophobicContact CG2-CG 4.15Å; I37-F71 HydrophobicContact CG2-CZ 3.88Å; I37-F71 VanDerWaalsContact N-CE2 3.33Å; V47-F71 HydrophobicContact CG1-CZ 4.24Å; F71-L76 HydrophobicContact CE1-CD2 4.46Å; F71-N77 WeakPolarHBondContact CD1-O 3.36Å; F71-L94 HydrophobicContact CD1-CD1 4.34Å; F71-L94 HydrophobicContact CE1-CD1 3.69Å
72	T	97.4	Very high	95.7	Very high	6 Å²	6	33 Å²	33	4%	0.037	15%	0.152	C	C	.	.			trans	-96.8	177.3	164.1	70.4	0	0	0	0	110.3	T74 N77 L79 Y91 L115 L136	T72-T74 PolarHBondContact O-N 3.01Å; T72-T74 PolarHBondContact OG1-N 3.24Å; T72-N77 PolarHBondContact N-O 3.37Å; T72-N77 WeakPolarHBondContact OG1-CB 3.37Å; T72-L79 HydrophobicContact CG2-CD1 4.27Å; T72-L79 HydrophobicContact CG2-CG 3.92Å; T72-Y91 HydrophobicContact CG2-CD2 4.02Å; T72-Y91 HydrophobicContact CG2-CE2 3.47Å; T72-Y91 VanDerWaalsContact CG2-CE2 3.47Å; T72-Y91 PolarHBondContact OG1-OH 2.78Å; T72-L115 HydrophobicContact CG2-CD1 4.44Å; T72-L136 HydrophobicContact CG2-CD1 3.85Å; T72-L136 HydrophobicContact CG2-CD2 4.16Å
73	H	93.6	Very high	95.9	Very high	63 Å²	63	27.1 Å²	27.1	29%	0.292	14%	0.137	S	C	.	.	S	Bend	trans	-63.4	-23.2	175.1	-61.1	-50.5	0	0	0	113.5	L115 S116 E119 D120	H73-L115 VanDerWaalsContact CE1-CD2 3.49Å; H73-L115 WeakPolarHBondContact CE1-CD2 3.37Å; H73-S116 PolarHBondContact CE1-O 2.82Å; H73-S116 PolarHBondContact NE2-O 2.55Å; H73-E119 PolarHBondContact NE2-O 2.98Å; H73-E119 VanDerWaalsContact NE2-O 3.15Å; H73-D120 IonicContact CD2-OD1 3.8Å; H73-D120 PolarHBondContact CD2-OD1 3.33Å
74	T	92.6	Very high	95.9	Very high	67 Å²	67	25.7 Å²	25.7	41%	0.411	13%	0.131	S	C	.	.	S	Bend	trans	-80.3	121.6	174.6	-56.2	0	0	0	0	109.3	T72 L76 N77	T72-T74 PolarHBondContact O-N 3.01Å; T72-T74 PolarHBondContact OG1-N 3.24Å; T74-L76 PolarHBondContact O-N 2.87Å; T74-N77 PolarHBondContact O-N 2.89Å; T74-N77 VanDerWaalsContact O-N 3.09Å
75	N	87.4	Confident	95.7	Very high	82 Å²	82	27 Å²	27	44%	0.439	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	133.4	-179.6	-106.6	-3.9	0	0	0	111.8	D32 N77	D32-N75 PolarHBondContact OD2-ND2 2.9Å; N75-N77 PolarHBondContact O-N 2.97Å
76	L	93.9	Very high	95.7	Very high	10 Å²	10	29.8 Å²	29.8	5%	0.052	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	31.4	179.8	-61.9	165.9	0	0	0	114.1	Y35 V47 F71 T74 L94 N95	Y35-L76 HydrophobicContact CD1-CD2 4.2Å; Y35-L76 HydrophobicContact CD2-CD2 3.82Å; Y35-L76 HydrophobicContact CD2-CG 4.19Å; Y35-L76 HydrophobicContact CE1-CD2 4.36Å; Y35-L76 HydrophobicContact CE2-CD1 3.94Å; Y35-L76 HydrophobicContact CE2-CD2 4Å; Y35-L76 HydrophobicContact CE2-CG 4.05Å; Y35-L76 HydrophobicContact CG-CD2 3.92Å; V47-L76 HydrophobicContact CG1-CD2 3.95Å; F71-L76 HydrophobicContact CE1-CD2 4.46Å; T74-L76 PolarHBondContact O-N 2.87Å; L76-L94 HydrophobicContact CB-CB 4.47Å; L76-L94 WeakPolarHBondContact O-CB 3.45Å; L76-L94 WeakPolarHBondContact O-CG 3.33Å; L76-L94 PolarHBondContact O-N 3.49Å; L76-N95 VanDerWaalsContact CD1-ND2 3.26Å; L76-N95 WeakPolarHBondContact CD1-ND2 3.31Å; L76-N95 VanDerWaalsContact CD1-OD1 3.26Å; L76-N95 WeakPolarHBondContact CD1-OD1 3.3Å
77	N	96.6	Very high	95.8	Very high	19 Å²	19	32 Å²	32	10%	0.102	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	146.9	159.5	-66.2	-1.2	0	0	0	110.4	F71 T72 T74 N75 Y91 L92 S93	F71-N77 WeakPolarHBondContact CD1-O 3.36Å; T72-N77 PolarHBondContact N-O 3.37Å; T72-N77 WeakPolarHBondContact OG1-CB 3.37Å; T74-N77 PolarHBondContact O-N 2.89Å; T74-N77 VanDerWaalsContact O-N 3.09Å; N75-N77 PolarHBondContact O-N 2.97Å; N77-Y91 HydrophobicContact CB-CE2 3.58Å; N77-Y91 PolarHBondContact ND2-OH 2.9Å; N77-L92 CarbonylContact C-O 3.52Å; N77-L92 VanDerWaalsContact CA-O 3.31Å; N77-L92 WeakPolarHBondContact CA-O 3.45Å; N77-S93 VanDerWaalsContact OD1-CA 3.28Å; N77-S93 WeakPolarHBondContact OD1-CA 3.47Å; N77-S93 WeakPolarHBondContact OD1-CB 3.27Å; N77-S93 PolarHBondContact OD1-OG 2.97Å; N77-S93 VanDerWaalsContact OD1-OG 3.08Å
78	C	98.1	Very high	95.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	157.2	179.7	71.4	0	0	0	0	112.9	I37 V69 I70 Y91 L92 L94	I37-C78 HydrophobicContact CD1-CB 3.77Å; V69-C78 HydrophobicContact CG2-CB 4.33Å; I70-C78 CarbonylContact O-C 3.54Å; I70-C78 WeakPolarHBondContact O-CA 3.09Å; I70-C78 VanDerWaalsContact O-CB 3.26Å; I70-C78 WeakPolarHBondContact O-CB 3.49Å; C78-Y91 WeakPolarHBondContact O-CD2 3.3Å; C78-L92 PolarHBondContact N-O 2.84Å; C78-L92 PolarHBondContact O-N 3.17Å; C78-L94 HydrophobicContact CB-CD1 4.17Å
79	L	98.4	Very high	96	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139.9	161.4	-63	165.4	0	0	0	109.2	V69 I70 T72 I89 R90 Y91 F103 L115 F122 L136	V69-L79 WeakPolarHBondContact CA-O 3.23Å; I70-L79 HydrophobicContact CD1-CB 4.37Å; I70-L79 HydrophobicContact CD1-CD1 3.86Å; I70-L79 HydrophobicContact CG1-CB 3.83Å; I70-L79 HydrophobicContact CG1-CD1 4.15Å; I70-L79 HydrophobicContact CG1-CG 4.49Å; I70-L79 PolarHBondContact N-O 3.41Å; I70-L79 PolarHBondContact O-N 3.13Å; T72-L79 HydrophobicContact CG2-CD1 4.27Å; T72-L79 HydrophobicContact CG2-CG 3.92Å; L79-I89 HydrophobicContact CB-CG2 4.27Å; L79-I89 HydrophobicContact CD2-CG2 4.21Å; L79-R90 CarbonylContact C-O 3.59Å; L79-R90 VanDerWaalsContact CA-O 3.27Å; L79-R90 WeakPolarHBondContact CA-O 3.45Å; L79-Y91 HydrophobicContact CD2-CD2 4.04Å; L79-Y91 HydrophobicContact CD2-CG 4.21Å; L79-F103 HydrophobicContact CD2-CD2 4.18Å; L79-F103 HydrophobicContact CD2-CE2 3.51Å; L79-F103 HydrophobicContact CD2-CZ 4.43Å; L79-L115 HydrophobicContact CD1-CD1 4.47Å; L79-F122 HydrophobicContact CD1-CB 3.92Å; L79-F122 HydrophobicContact CD1-CD1 3.49Å; L79-F122 VanDerWaalsContact CD1-CD1 3.49Å; L79-F122 HydrophobicContact CD1-CD2 3.88Å; L79-F122 HydrophobicContact CD1-CE1 3.87Å; L79-F122 HydrophobicContact CD1-CE2 4.25Å; L79-F122 HydrophobicContact CD1-CG 3.49Å; L79-F122 VanDerWaalsContact CD1-CG 3.49Å; L79-F122 HydrophobicContact CD1-CZ 4.24Å; L79-F122 HydrophobicContact CD2-CD1 4.49Å; L79-F122 HydrophobicContact CD2-CE1 4.07Å; L79-F122 HydrophobicContact CD2-CZ 4.29Å; L79-L136 HydrophobicContact CD1-CD2 3.99Å; L79-L136 HydrophobicContact CD2-CD2 3.78Å; L79-L136 HydrophobicContact CG-CD2 4.18Å
80	H	98.2	Very high	96	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148	165.8	77.5	85.7	0	0	0	112	L45 S61 G65 Q68 V69 I89 R90 Y99	L45-H80 HydrophobicContact CD2-CB 4.33Å; S61-H80 PolarHBondContact OG-CE1 3.31Å; G65-H80 PolarHBondContact O-CE1 2.87Å; G65-H80 VanDerWaalsContact O-CE1 3.3Å; G65-H80 PolarHBondContact O-ND1 3.34Å; Q68-H80 CarbonylContact O-C 3.39Å; Q68-H80 WeakPolarHBondContact O-CA 3.43Å; Q68-H80 WeakPolarHBondContact O-CB 3.35Å; V69-H80 HydrophobicContact CG2-CB 4.38Å; H80-I89 CarbonylContact O-C 3.55Å; H80-I89 WeakPolarHBondContact O-CA 2.85Å; H80-R90 PolarHBondContact N-O 3.16Å; H80-R90 PolarHBondContact O-N 2.9Å; H80-Y99 AromaticContact NE2-CE1 3.59Å
81	S	98	Very high	96	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	144.2	170.5	61	0	0	0	0	111.3	A66 D67 Q68	A66-S81 WeakPolarHBondContact CA-O 3.31Å; D67-S81 PolarHBondContact N-O 3.3Å; Q68-S81 PolarHBondContact N-OG 2.96Å; Q68-S81 PolarHBondContact O-N 3.24Å
82	S	97.7	Very high	96	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.014	16%	0.161	C	C	.	.			trans	-83.4	150.3	175.3	-53.4	0	0	0	0	110.5	Y64 D86 A88 R90	Y64-S82 CarbonylContact O-C 3.52Å; Y64-S82 WeakPolarHBondContact O-CA 3.48Å; Y64-S82 WeakPolarHBondContact O-CB 3.21Å; S82-D86 WeakPolarHBondContact CB-O 3.41Å; S82-D86 WeakPolarHBondContact CB-OD1 3.4Å; S82-D86 PolarHBondContact OG-OD1 3.4Å; S82-A88 VanDerWaalsContact CB-O 3.27Å; S82-A88 WeakPolarHBondContact CB-O 3.42Å; S82-A88 PolarHBondContact N-O 3.11Å; S82-A88 PolarHBondContact OG-O 3.29Å; S82-R90 PolarHBondContact OG-NE 3.3Å
83	T	95.3	Very high	96	Very high	65 Å²	65	30 Å²	30	40%	0.399	16%	0.162	S	C	.	.	S	Bend	trans	-125.2	-6.2	-180	55.1	0	0	0	0	114.3	Y64 G65 D67	Y64-T83 PolarHBondContact O-N 2.88Å; G65-T83 WeakPolarHBondContact CA-OG1 3.16Å; D67-T83 HydrophobicContact CB-CG2 3.37Å
84	K	95.1	Very high	96.1	Very high	113 Å²	113	27.1 Å²	27.1	49%	0.491	15%	0.149	S	C	.	.	S	Bend	trans	-115.8	-75.6	-172.8	-66.5	-174.7	176.5	178.3	0	113.4	D43 R62 Y64 D86	D43-K84 WeakPolarHBondContact OD1-CE 3.39Å; D43-K84 IonicContact OD1-NZ 2.71Å; D43-K84 PolarHBondContact OD1-NZ 3.45Å; D43-K84 IonicContact OD2-NZ 3.4Å; D43-K84 PolarHBondContact OD2-NZ 2.75Å; R62-K84 PolarHBondContact O-NZ 2.88Å; Y64-K84 PolarHBondContact O-N 2.89Å; Y64-K84 VanDerWaalsContact O-N 3.08Å; K84-D86 VanDerWaalsContact C-N 3.34Å; K84-D86 PolarHBondContact O-N 2.94Å
85	S	91.7	Very high	96.1	Very high	66 Å²	66	28.7 Å²	28.7	46%	0.462	16%	0.155	S	C	.	.	S	Bend	trans	-71.1	-31.8	-169.2	52.6	0	0	0	0	113.7	Y64	Y64-S85 WeakPolarHBondContact CD1-OG 3.22Å
86	D	96	Very high	96.4	Very high	58 Å²	58	31.3 Å²	31.3	31%	0.31	17%	0.165	S	C	.	.			trans	-165.7	171.9	-171.2	51.9	15.8	0	0	0	109	S82 K84 A88 R90	S82-D86 WeakPolarHBondContact CB-O 3.41Å; S82-D86 WeakPolarHBondContact CB-OD1 3.4Å; S82-D86 PolarHBondContact OG-OD1 3.4Å; K84-D86 VanDerWaalsContact C-N 3.34Å; K84-D86 PolarHBondContact O-N 2.94Å; D86-A88 VanDerWaalsContact C-N 3.28Å; D86-A88 HydrophobicContact CB-CB 4.42Å; D86-R90 IonicContact OD1-CZ 3.46Å; D86-R90 IonicContact OD1-NH2 2.77Å; D86-R90 PolarHBondContact OD1-NH2 2.67Å; D86-R90 IonicContact OD2-NH2 3.98Å; D86-R90 PolarHBondContact OD2-NH2 3.05Å
87	D	97	Very high	96.4	Very high	46 Å²	46	35.9 Å²	35.9	25%	0.246	19%	0.189	C	C	.	.	S	Bend	trans	-95.2	24.2	174.3	-58.8	-70.1	0	0	0	112.1	H106 K108 K109	D87-H106 HydrophobicContact CB-CB 4.29Å; D87-K108 WeakPolarHBondContact CB-O 3.38Å; D87-K108 VanDerWaalsContact CG-CA 3.42Å; D87-K108 VanDerWaalsContact OD2-CA 3.24Å; D87-K108 WeakPolarHBondContact OD2-CA 3.4Å; D87-K108 PolarHBondContact OD2-N 3.35Å; D87-K109 WeakPolarHBondContact OD1-CA 3.41Å; D87-K109 PolarHBondContact OD1-N 2.97Å
88	A	97.8	Very high	96.4	Very high	2 Å²	2	41 Å²	41	2%	0.017	21%	0.211	C	C	.	.			trans	-75.9	151.8	-176.2	0	0	0	0	0	112	S82 D86 V104	S82-A88 VanDerWaalsContact CB-O 3.27Å; S82-A88 WeakPolarHBondContact CB-O 3.42Å; S82-A88 PolarHBondContact N-O 3.11Å; S82-A88 PolarHBondContact OG-O 3.29Å; D86-A88 VanDerWaalsContact C-N 3.28Å; D86-A88 HydrophobicContact CB-CB 4.42Å; A88-V104 HydrophobicContact CB-CG2 4.17Å
89	I	98.5	Very high	96.3	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137.8	171.6	-57.7	157.2	0	0	0	107.8	L79 H80 F103 V110 L113 F122 S124	L79-I89 HydrophobicContact CB-CG2 4.27Å; L79-I89 HydrophobicContact CD2-CG2 4.21Å; H80-I89 CarbonylContact O-C 3.55Å; H80-I89 WeakPolarHBondContact O-CA 2.85Å; I89-F103 HydrophobicContact CB-CB 4.19Å; I89-F103 HydrophobicContact CB-CD2 4.26Å; I89-F103 HydrophobicContact CG2-CD2 4.15Å; I89-F103 PolarHBondContact N-O 3.37Å; I89-F103 PolarHBondContact O-N 3.39Å; I89-V110 HydrophobicContact CD1-CG1 4.29Å; I89-V110 HydrophobicContact CD1-CG2 4.1Å; I89-V110 HydrophobicContact CG1-CG1 4.45Å; I89-V110 HydrophobicContact CG1-CG2 3.97Å; I89-L113 HydrophobicContact CD1-CD2 3.75Å; I89-L113 HydrophobicContact CG1-CD2 4.22Å; I89-L113 HydrophobicContact CG2-CD1 4.5Å; I89-L113 HydrophobicContact CG2-CD2 4.39Å; I89-F122 HydrophobicContact CD1-CE2 3.9Å; I89-F122 HydrophobicContact CG2-CE2 4.05Å; I89-F122 HydrophobicContact CG2-CZ 4.17Å; I89-S124 WeakPolarHBondContact CD1-OG 3.43Å
90	R	97.8	Very high	96.2	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.4	-173.4	-54.3	-166.2	178.7	-82.6	-11.7	110.3	Y64 L79 H80 S82 D86 Y99 F102	Y64-R90 VanDerWaalsContact CB-NE 3.34Å; Y64-R90 VanDerWaalsContact CD1-NE 3.29Å; Y64-R90 VanDerWaalsContact CE1-NH2 3.33Å; Y64-R90 VanDerWaalsContact CG-CZ 3.47Å; L79-R90 CarbonylContact C-O 3.59Å; L79-R90 VanDerWaalsContact CA-O 3.27Å; L79-R90 WeakPolarHBondContact CA-O 3.45Å; H80-R90 PolarHBondContact N-O 3.16Å; H80-R90 PolarHBondContact O-N 2.9Å; S82-R90 PolarHBondContact OG-NE 3.3Å; D86-R90 IonicContact OD1-CZ 3.46Å; D86-R90 IonicContact OD1-NH2 2.77Å; D86-R90 PolarHBondContact OD1-NH2 2.67Å; D86-R90 IonicContact OD2-NH2 3.98Å; D86-R90 PolarHBondContact OD2-NH2 3.05Å; R90-Y99 HydrophobicContact CB-CD1 3.92Å; R90-Y99 HydrophobicContact CB-CE1 3.72Å; R90-Y99 HydrophobicContact CG-CE1 4.33Å; R90-F102 HydrophobicContact CB-CD1 4.49Å; R90-F102 HydrophobicContact CG-CD1 4.16Å
91	Y	98	Very high	96.1	Very high	17 Å²	17	50.9 Å²	50.9	7%	0.067	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.9	172.2	-172.4	-154.1	0	0	0	109.5	T72 N77 C78 L79 Y99 V100 R101 L136	T72-Y91 HydrophobicContact CG2-CD2 4.02Å; T72-Y91 HydrophobicContact CG2-CE2 3.47Å; T72-Y91 VanDerWaalsContact CG2-CE2 3.47Å; T72-Y91 PolarHBondContact OG1-OH 2.78Å; N77-Y91 HydrophobicContact CB-CE2 3.58Å; N77-Y91 PolarHBondContact ND2-OH 2.9Å; C78-Y91 WeakPolarHBondContact O-CD2 3.3Å; L79-Y91 HydrophobicContact CD2-CD2 4.04Å; L79-Y91 HydrophobicContact CD2-CG 4.21Å; Y91-Y99 CarbonylContact O-C 3.57Å; Y91-Y99 WeakPolarHBondContact O-CA 3.45Å; Y91-V100 HydrophobicContact CD1-CB 3.52Å; Y91-V100 HydrophobicContact CD1-CG1 3.57Å; Y91-V100 HydrophobicContact CD1-CG2 4.28Å; Y91-V100 HydrophobicContact CE1-CB 3.91Å; Y91-V100 HydrophobicContact CE1-CG1 3.65Å; Y91-V100 HydrophobicContact CE1-CG2 4.32Å; Y91-V100 HydrophobicContact CG-CB 4.05Å; Y91-V100 PolarHBondContact O-N 3.2Å; Y91-R101 HydrophobicContact CD1-CB 4.29Å; Y91-R101 PolarHBondContact N-O 3.38Å; Y91-R101 PolarHBondContact O-N 2.98Å; Y91-L136 HydrophobicContact CD1-CD2 4.45Å; Y91-L136 HydrophobicContact CD2-CD2 4.44Å; Y91-L136 HydrophobicContact CG-CD2 4.44Å
92	L	97.6	Very high	96.1	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.9	-172.4	177.4	61.4	0	0	0	109.5	L45 L59 N77 C78 L94 Y99	L45-L92 HydrophobicContact CD1-CD2 3.77Å; L59-L92 HydrophobicContact CD1-CD2 3.85Å; N77-L92 CarbonylContact C-O 3.52Å; N77-L92 VanDerWaalsContact CA-O 3.31Å; N77-L92 WeakPolarHBondContact CA-O 3.45Å; C78-L92 PolarHBondContact N-O 2.84Å; C78-L92 PolarHBondContact O-N 3.17Å; L92-L94 HydrophobicContact CD2-CD2 3.99Å; L92-L94 HydrophobicContact CG-CD2 4.28Å; L92-Y99 HydrophobicContact CB-CD1 4.13Å; L92-Y99 HydrophobicContact CB-CE1 4.13Å; L92-Y99 HydrophobicContact CD1-CD1 4.02Å; L92-Y99 HydrophobicContact CD1-CE1 4.06Å; L92-Y99 HydrophobicContact CD1-CG 4.29Å; L92-Y99 HydrophobicContact CD2-CE1 4.43Å; L92-Y99 HydrophobicContact CG-CE1 4.45Å
93	S	96.9	Very high	96.1	Very high	9 Å²	9	54.8 Å²	54.8	6%	0.063	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.8	160.8	-178.4	0	0	0	0	108.4	N77 N97 K98	N77-S93 VanDerWaalsContact OD1-CA 3.28Å; N77-S93 WeakPolarHBondContact OD1-CA 3.47Å; N77-S93 WeakPolarHBondContact OD1-CB 3.27Å; N77-S93 PolarHBondContact OD1-OG 2.97Å; N77-S93 VanDerWaalsContact OD1-OG 3.08Å; S93-N97 VanDerWaalsContact O-CA 3.3Å; S93-N97 WeakPolarHBondContact O-CA 3.48Å; S93-N97 PolarHBondContact O-N 3.47Å; S93-K98 PolarHBondContact N-O 2.9Å; S93-K98 PolarHBondContact O-N 3.44Å; S93-K98 VanDerWaalsContact O-N 3.14Å
94	L	95.6	Very high	96.2	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-40.2	-173.8	-60.3	161.6	0	0	0	110.6	I37 V47 L57 L59 F71 L76 C78 L92 N97	I37-L94 HydrophobicContact CD1-CD1 3.84Å; I37-L94 HydrophobicContact CD1-CD2 4Å; V47-L94 HydrophobicContact CG2-CD1 3.78Å; V47-L94 HydrophobicContact CG2-CD2 4.4Å; L57-L94 HydrophobicContact CD1-CB 4.08Å; L59-L94 HydrophobicContact CD1-CB 4.35Å; L59-L94 HydrophobicContact CD1-CD2 3.61Å; F71-L94 HydrophobicContact CD1-CD1 4.34Å; F71-L94 HydrophobicContact CE1-CD1 3.69Å; L76-L94 HydrophobicContact CB-CB 4.47Å; L76-L94 WeakPolarHBondContact O-CB 3.45Å; L76-L94 WeakPolarHBondContact O-CG 3.33Å; L76-L94 PolarHBondContact O-N 3.49Å; C78-L94 HydrophobicContact CB-CD1 4.17Å; L92-L94 HydrophobicContact CD2-CD2 3.99Å; L92-L94 HydrophobicContact CG-CD2 4.28Å; L94-N97 PolarHBondContact O-N 3.41Å
95	N	92.1	Very high	96.3	Very high	100 Å²	100	52.2 Å²	52.2	54%	0.535	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-42.1	178.4	-76.3	-6.6	0	0	0	113	L76 N97	L76-N95 VanDerWaalsContact CD1-ND2 3.26Å; L76-N95 WeakPolarHBondContact CD1-ND2 3.31Å; L76-N95 VanDerWaalsContact CD1-OD1 3.26Å; L76-N95 WeakPolarHBondContact CD1-OD1 3.3Å; N95-N97 VanDerWaalsContact C-N 3.29Å
96	E	94.3	Very high	96.6	Very high	138 Å²	138	49.7 Å²	49.7	65%	0.645	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.8	178.4	-62.1	-174.3	-176.2	0	0	112.7	K98	E96-K98 HydrophobicContact CB-CB 3.97Å; E96-K98 PolarHBondContact O-N 2.75Å
97	N	94.7	Very high	96.6	Very high	106 Å²	106	51.9 Å²	51.9	57%	0.567	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.9	46.3	-168.6	-172.8	25.5	0	0	0	112.1	L59 S93 L94 N95	L59-N97 HydrophobicContact CD2-CB 4.18Å; S93-N97 VanDerWaalsContact O-CA 3.3Å; S93-N97 WeakPolarHBondContact O-CA 3.48Å; S93-N97 PolarHBondContact O-N 3.47Å; L94-N97 PolarHBondContact O-N 3.41Å; N95-N97 VanDerWaalsContact C-N 3.29Å
98	K	95.9	Very high	96.7	Very high	127 Å²	127	55 Å²	55	55%	0.552	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	125.7	-172.6	-174.5	179.7	175.6	-173.6	0	110.6	S93 E96 V100	S93-K98 PolarHBondContact N-O 2.9Å; S93-K98 PolarHBondContact O-N 3.44Å; S93-K98 VanDerWaalsContact O-N 3.14Å; E96-K98 HydrophobicContact CB-CB 3.97Å; E96-K98 PolarHBondContact O-N 2.75Å; K98-V100 PolarHBondContact O-N 2.73Å
99	Y	96.1	Very high	96.6	Very high	60 Å²	60	59 Å²	59	24%	0.235	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	117	169.8	-70	-71.9	0	0	0	109.5	S61 Y64 H80 R90 Y91 L92 F102	S61-Y99 PolarHBondContact OG-OH 2.81Å; Y64-Y99 HydrophobicContact CD2-CE2 4.11Å; Y64-Y99 AromaticContact CD2-CZ 3.89Å; Y64-Y99 WeakPolarHBondContact CD2-OH 3.35Å; Y64-Y99 HydrophobicContact CE2-CD2 4.45Å; Y64-Y99 AromaticContact CE2-CE2 3.73Å; Y64-Y99 HydrophobicContact CE2-CE2 3.73Å; Y64-Y99 AromaticContact CE2-CZ 3.98Å; H80-Y99 AromaticContact NE2-CE1 3.59Å; R90-Y99 HydrophobicContact CB-CD1 3.92Å; R90-Y99 HydrophobicContact CB-CE1 3.72Å; R90-Y99 HydrophobicContact CG-CE1 4.33Å; Y91-Y99 CarbonylContact O-C 3.57Å; Y91-Y99 WeakPolarHBondContact O-CA 3.45Å; L92-Y99 HydrophobicContact CB-CD1 4.13Å; L92-Y99 HydrophobicContact CB-CE1 4.13Å; L92-Y99 HydrophobicContact CD1-CD1 4.02Å; L92-Y99 HydrophobicContact CD1-CE1 4.06Å; L92-Y99 HydrophobicContact CD1-CG 4.29Å; L92-Y99 HydrophobicContact CD2-CE1 4.43Å; L92-Y99 HydrophobicContact CG-CE1 4.45Å; Y99-F102 AromaticContact CD1-CE1 3.91Å; Y99-F102 HydrophobicContact CD1-CE1 3.91Å; Y99-F102 HydrophobicContact CD2-CE1 4.17Å; Y99-F102 HydrophobicContact CD2-CZ 4.37Å; Y99-F102 AromaticContact CG-CE1 3.6Å; Y99-F102 HydrophobicContact CG-CE1 3.6Å; Y99-F102 AromaticContact CG-CZ 3.96Å; Y99-F102 HydrophobicContact CG-CZ 3.96Å
100	V	96.4	Very high	96.6	Very high	72 Å²	72	59 Å²	59	44%	0.436	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-43.3	178.3	-179.4	0	0	0	0	109.6	Y91 K98	Y91-V100 HydrophobicContact CD1-CB 3.52Å; Y91-V100 HydrophobicContact CD1-CG1 3.57Å; Y91-V100 HydrophobicContact CD1-CG2 4.28Å; Y91-V100 HydrophobicContact CE1-CB 3.91Å; Y91-V100 HydrophobicContact CE1-CG1 3.65Å; Y91-V100 HydrophobicContact CE1-CG2 4.32Å; Y91-V100 HydrophobicContact CG-CB 4.05Å; Y91-V100 PolarHBondContact O-N 3.2Å; K98-V100 PolarHBondContact O-N 2.73Å
101	R	96.6	Very high	96.5	Very high	75 Å²	75	59.5 Å²	59.5	28%	0.283	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	157.8	-177.3	-167.9	172.5	-65.1	-76.6	-0.1	112	Y91 F103 L136 R137 A138	Y91-R101 HydrophobicContact CD1-CB 4.29Å; Y91-R101 PolarHBondContact N-O 3.38Å; Y91-R101 PolarHBondContact O-N 2.98Å; R101-F103 HydrophobicContact CB-CZ 4.31Å; R101-F103 HydrophobicContact CG-CE1 4.12Å; R101-F103 HydrophobicContact CG-CZ 4.15Å; R101-L136 WeakPolarHBondContact CD-O 3.47Å; R101-L136 PolarHBondContact NE-O 2.78Å; R101-L136 VanDerWaalsContact NE-O 3.07Å; R101-R137 PolarHBondContact NH2-O 2.92Å; R101-A138 WeakPolarHBondContact CD-O 3.28Å
102	F	96.9	Very high	96.5	Very high	84 Å²	84	59.6 Å²	59.6	37%	0.368	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.4	170.8	-48.6	-73	0	0	0	109.3	R90 Y99 V104	R90-F102 HydrophobicContact CB-CD1 4.49Å; R90-F102 HydrophobicContact CG-CD1 4.16Å; Y99-F102 AromaticContact CD1-CE1 3.91Å; Y99-F102 HydrophobicContact CD1-CE1 3.91Å; Y99-F102 HydrophobicContact CD2-CE1 4.17Å; Y99-F102 HydrophobicContact CD2-CZ 4.37Å; Y99-F102 AromaticContact CG-CE1 3.6Å; Y99-F102 HydrophobicContact CG-CE1 3.6Å; Y99-F102 AromaticContact CG-CZ 3.96Å; Y99-F102 HydrophobicContact CG-CZ 3.96Å; F102-V104 HydrophobicContact CB-CG2 4.37Å
103	F	98.2	Very high	96.5	Very high	1 Å²	1	59.9 Å²	59.9	0%	0.004	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	97.4	175.2	-52.7	-79.4	0	0	0	108.1	L79 I89 R101 F122 W134 L136 A138	L79-F103 HydrophobicContact CD2-CD2 4.18Å; L79-F103 HydrophobicContact CD2-CE2 3.51Å; L79-F103 HydrophobicContact CD2-CZ 4.43Å; I89-F103 HydrophobicContact CB-CB 4.19Å; I89-F103 HydrophobicContact CB-CD2 4.26Å; I89-F103 HydrophobicContact CG2-CD2 4.15Å; I89-F103 PolarHBondContact N-O 3.37Å; I89-F103 PolarHBondContact O-N 3.39Å; R101-F103 HydrophobicContact CB-CZ 4.31Å; R101-F103 HydrophobicContact CG-CE1 4.12Å; R101-F103 HydrophobicContact CG-CZ 4.15Å; F103-F122 HydrophobicContact CB-CZ 4.35Å; F103-F122 HydrophobicContact CD1-CE1 4.23Å; F103-F122 HydrophobicContact CD1-CZ 4.1Å; F103-F122 AromaticContact CD2-CE1 3.92Å; F103-F122 HydrophobicContact CD2-CE1 3.92Å; F103-F122 AromaticContact CD2-CZ 3.52Å; F103-F122 HydrophobicContact CD2-CZ 3.52Å; F103-F122 AromaticContact CE1-CE1 3.94Å; F103-F122 HydrophobicContact CE1-CE1 3.94Å; F103-F122 HydrophobicContact CE1-CZ 4.27Å; F103-F122 AromaticContact CE2-CE1 3.59Å; F103-F122 HydrophobicContact CE2-CE1 3.59Å; F103-F122 AromaticContact CE2-CZ 3.71Å; F103-F122 HydrophobicContact CE2-CZ 3.71Å; F103-F122 HydrophobicContact CG-CE1 4.22Å; F103-F122 AromaticContact CG-CZ 3.73Å; F103-F122 HydrophobicContact CG-CZ 3.73Å; F103-F122 AromaticContact CZ-CE1 3.63Å; F103-F122 HydrophobicContact CZ-CE1 3.63Å; F103-F122 HydrophobicContact CZ-CZ 4.11Å; F103-W134 HydrophobicContact CB-CD2 4.1Å; F103-W134 HydrophobicContact CB-CE3 3.77Å; F103-W134 HydrophobicContact CB-CH2 4.14Å; F103-W134 HydrophobicContact CB-CZ2 4.43Å; F103-W134 HydrophobicContact CB-CZ3 3.8Å; F103-W134 HydrophobicContact CD1-CB 4.35Å; F103-W134 HydrophobicContact CD1-CD2 4.27Å; F103-W134 AromaticContact CD1-CE3 3.76Å; F103-W134 HydrophobicContact CD1-CE3 3.76Å; F103-W134 HydrophobicContact CD1-CZ3 4.41Å; F103-W134 HydrophobicContact CG-CD2 4.42Å; F103-W134 HydrophobicContact CG-CE3 4.14Å; F103-L136 HydrophobicContact CE2-CD2 4.4Å; F103-L136 HydrophobicContact CZ-CD2 4.06Å; F103-A138 VanDerWaalsContact CE1-O 3.28Å; F103-A138 WeakPolarHBondContact CE1-O 3.31Å
104	V	97.4	Very high	96.5	Very high	101 Å²	101	61.7 Å²	61.7	61%	0.612	31%	0.311	S	S	*	.			trans	-99.2	133.7	-177.4	-178.5	0	0	0	0	108.5	A88 F102	A88-V104 HydrophobicContact CB-CG2 4.17Å; F102-V104 HydrophobicContact CB-CG2 4.37Å
105	G	95.9	Very high	96.6	Very high	22 Å²	22	63 Å²	63	23%	0.227	32%	0.318	C	S	.	.			trans	160.6	-23.9	167.6	0	0	0	0	0	115.4	R132	G105-R132 VanDerWaalsContact C-NH1 3.26Å; G105-R132 VanDerWaalsContact CA-NH1 3.31Å; G105-R132 VanDerWaalsContact O-CZ 3.23Å; G105-R132 PolarHBondContact O-NH1 2.92Å; G105-R132 PolarHBondContact O-NH2 3.36Å
106	H	98	Very high	96.9	Very high	14 Å²	14	58.2 Å²	58.2	7%	0.065	29%	0.293	C	S	.	.			trans	-63	144.9	167.4	-80	-56.4	0	0	0	110.7	D87 V110 S124 S126 D128 T130	D87-H106 HydrophobicContact CB-CB 4.29Å; H106-V110 HydrophobicContact CB-CG2 4.25Å; H106-S124 PolarHBondContact CD2-OG 2.92Å; H106-S124 PolarHBondContact NE2-OG 3.38Å; H106-S126 WeakPolarHBondContact CE1-CB 3.35Å; H106-S126 WeakPolarHBondContact ND1-CB 3.28Å; H106-D128 VanDerWaalsContact CA-OD2 3.23Å; H106-D128 WeakPolarHBondContact CA-OD2 3.42Å; H106-D128 IonicContact CE1-OD1 3.84Å; H106-D128 IonicContact CE1-OD2 3.91Å; H106-D128 IonicContact CG-OD2 3.55Å; H106-D128 IonicContact ND1-OD1 3.35Å; H106-D128 PolarHBondContact ND1-OD1 2.87Å; H106-D128 IonicContact ND1-OD2 2.8Å; H106-D128 PolarHBondContact ND1-OD2 2.83Å; H106-T130 PolarHBondContact CE1-OG1 2.83Å; H106-T130 PolarHBondContact ND1-OG1 2.95Å
107	T	97.5	Very high	96.9	Very high	103 Å²	103	54.6 Å²	54.6	63%	0.632	28%	0.281	S	S	*	.	S	Bend	trans	-114.7	3.5	-177.3	60.6	0	0	0	0	113.6	D128	T107-D128 PolarHBondContact N-OD2 3.12Å; T107-D128 VanDerWaalsContact N-OD2 3.08Å; T107-D128 WeakPolarHBondContact OG1-CB 3.32Å
108	K	97.8	Very high	96.9	Very high	111 Å²	111	54.2 Å²	54.2	48%	0.483	28%	0.282	S	S	.	.	S	Bend	trans	-150.2	169.1	172.2	-59.2	-174.1	177.2	179.7	0	110	D87 V110 S126 L127 D128	D87-K108 WeakPolarHBondContact CB-O 3.38Å; D87-K108 VanDerWaalsContact CG-CA 3.42Å; D87-K108 VanDerWaalsContact OD2-CA 3.24Å; D87-K108 WeakPolarHBondContact OD2-CA 3.4Å; D87-K108 PolarHBondContact OD2-N 3.35Å; K108-V110 PolarHBondContact O-N 2.85Å; K108-S126 PolarHBondContact O-OG 2.97Å; K108-L127 HydrophobicContact CB-CB 3.83Å; K108-L127 HydrophobicContact CD-CB 4.17Å; K108-L127 WeakPolarHBondContact CD-O 3.41Å; K108-D128 HydrophobicContact CB-CB 4.1Å; K108-D128 HydrophobicContact CG-CB 4.15Å
109	K	97.1	Very high	96.8	Very high	86 Å²	86	51.5 Å²	51.5	37%	0.374	27%	0.272	S	S	.	.			trans	-44.6	126.7	-176.6	-175.8	175	-177.9	176.4	0	112.6	D67 D87 V111 S126 L127	D67-K109 VanDerWaalsContact CG-NZ 3.32Å; D67-K109 WeakPolarHBondContact OD1-CE 3.27Å; D67-K109 IonicContact OD1-NZ 2.65Å; D67-K109 PolarHBondContact OD1-NZ 2.86Å; D67-K109 WeakPolarHBondContact OD2-CE 3.34Å; D67-K109 IonicContact OD2-NZ 3.34Å; D67-K109 PolarHBondContact OD2-NZ 3.09Å; D87-K109 WeakPolarHBondContact OD1-CA 3.41Å; D87-K109 PolarHBondContact OD1-N 2.97Å; K109-V111 HydrophobicContact CG-CG1 4.42Å; K109-S126 WeakPolarHBondContact O-CA 3.13Å; K109-S126 PolarHBondContact O-OG 2.86Å; K109-L127 HydrophobicContact CB-CD1 4.03Å; K109-L127 HydrophobicContact CB-CG 4.35Å; K109-L127 PolarHBondContact O-N 3.29Å
110	V	98	Very high	96.8	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	123.2	167.1	179.7	0	0	0	0	108.4	I89 H106 K108 L113 A125	I89-V110 HydrophobicContact CD1-CG1 4.29Å; I89-V110 HydrophobicContact CD1-CG2 4.1Å; I89-V110 HydrophobicContact CG1-CG1 4.45Å; I89-V110 HydrophobicContact CG1-CG2 3.97Å; H106-V110 HydrophobicContact CB-CG2 4.25Å; K108-V110 PolarHBondContact O-N 2.85Å; V110-L113 HydrophobicContact CG1-CD2 3.83Å; V110-L113 HydrophobicContact CG1-CG 4.17Å; V110-A125 CarbonylContact C-O 3.51Å; V110-A125 WeakPolarHBondContact CA-O 3.26Å
111	V	96.1	Very high	96.9	Very high	19 Å²	19	48.3 Å²	48.3	12%	0.115	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-13.2	-172.3	-67.2	0	0	0	0	113.7	K109 A125 L127	K109-V111 HydrophobicContact CG-CG1 4.42Å; V111-A125 HydrophobicContact CG2-CB 4.48Å; V111-A125 WeakPolarHBondContact CG2-O 3.44Å; V111-A125 PolarHBondContact N-O 3.16Å; V111-L127 HydrophobicContact CG1-CD1 4.38Å; V111-L127 HydrophobicContact CG1-CD2 3.66Å; V111-L127 HydrophobicContact CG1-CG 3.69Å
112	N	96.8	Very high	97	Very high	18 Å²	18	44.8 Å²	44.8	10%	0.096	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	140.1	179.7	162.8	-110.3	0	0	0	109.3	S124 A125 L152 A153	N112-S124 WeakPolarHBondContact O-CA 3.27Å; N112-A125 HydrophobicContact CB-CB 4.22Å; N112-A125 PolarHBondContact N-O 3.24Å; N112-A125 PolarHBondContact O-N 3.49Å; N112-L152 HydrophobicContact CB-CD2 3.79Å; N112-A153 PolarHBondContact OD1-N 3.11Å; N112-A153 PolarHBondContact OD1-O 3.02Å
113	L	98	Very high	97.1	Very high	9 Å²	9	40.8 Å²	40.8	5%	0.047	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.9	175	-69.4	178.4	0	0	0	107.9	Q68 I70 I89 V110 F122 L123	Q68-L113 HydrophobicContact CB-CB 4.38Å; Q68-L113 HydrophobicContact CB-CD1 3.63Å; Q68-L113 HydrophobicContact CB-CG 3.81Å; Q68-L113 HydrophobicContact CG-CG 4.48Å; I70-L113 HydrophobicContact CD1-CB 3.83Å; I70-L113 HydrophobicContact CG1-CB 4.31Å; I70-L113 HydrophobicContact CG1-CD1 4.42Å; I70-L113 HydrophobicContact CG2-CB 4.4Å; I89-L113 HydrophobicContact CD1-CD2 3.75Å; I89-L113 HydrophobicContact CG1-CD2 4.22Å; I89-L113 HydrophobicContact CG2-CD1 4.5Å; I89-L113 HydrophobicContact CG2-CD2 4.39Å; V110-L113 HydrophobicContact CG1-CD2 3.83Å; V110-L113 HydrophobicContact CG1-CG 4.17Å; L113-F122 HydrophobicContact CD2-CD2 4.37Å; L113-F122 HydrophobicContact CD2-CE2 4.43Å; L113-L123 WeakPolarHBondContact CA-O 3.38Å
114	D	97.9	Very high	97.1	Very high	46 Å²	46	40.8 Å²	40.8	25%	0.246	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	133.9	172.9	-164.2	37.9	0	0	0	110.7	F122 L123 G154 F155	D114-F122 CarbonylContact O-C 3.59Å; D114-F122 VanDerWaalsContact O-CA 3.23Å; D114-F122 WeakPolarHBondContact O-CA 3.49Å; D114-F122 VanDerWaalsContact O-CB 3.31Å; D114-F122 WeakPolarHBondContact O-CB 3.47Å; D114-L123 PolarHBondContact N-O 2.9Å; D114-L123 PolarHBondContact O-N 3.16Å; D114-G154 WeakPolarHBondContact OD2-CA 3.43Å; D114-F155 HydrophobicContact CB-CD2 4.45Å; D114-F155 PolarHBondContact OD2-N 2.84Å
115	L	97.8	Very high	97.1	Very high	29 Å²	29	36 Å²	36	15%	0.152	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.7	179.4	-167.3	76.9	0	0	0	108.8	I70 T72 H73 L79 F122	I70-L115 HydrophobicContact CD1-CB 4.16Å; T72-L115 HydrophobicContact CG2-CD1 4.44Å; H73-L115 VanDerWaalsContact CE1-CD2 3.49Å; H73-L115 WeakPolarHBondContact CE1-CD2 3.37Å; L79-L115 HydrophobicContact CD1-CD1 4.47Å; L115-F122 HydrophobicContact CD1-CB 4.13Å
116	S	97.5	Very high	97.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.			trans	-61.7	135.6	168.8	173.2	0	0	0	0	109.2	H73 V118 E119 L121 F155	H73-S116 PolarHBondContact CE1-O 2.82Å; H73-S116 PolarHBondContact NE2-O 2.55Å; S116-V118 PolarHBondContact O-N 3.21Å; S116-V118 PolarHBondContact OG-N 3.18Å; S116-E119 WeakPolarHBondContact CB-O 3.35Å; S116-E119 PolarHBondContact OG-N 2.76Å; S116-L121 WeakPolarHBondContact CB-O 3.41Å; S116-L121 PolarHBondContact N-O 3.35Å; S116-F155 VanDerWaalsContact CA-CD2 3.48Å; S116-F155 VanDerWaalsContact N-CE2 3.26Å
117	P	95.3	Very high	97.2	Very high	62 Å²	62	37.4 Å²	37.4	40%	0.403	20%	0.199	S	C	.	.	S	Bend	trans	-71.8	-15.3	178.1	26.7	-32.1	0	0	0	113.2	D156 P157	P117-D156 WeakPolarHBondContact CG-O 3.43Å; P117-P157 WeakPolarHBondContact CG-O 3.47Å
118	V	94	Very high	97.2	Very high	98 Å²	98	33.5 Å²	33.5	59%	0.594	17%	0.174	S	C	*	.	S	Bend	trans	-116.3	-46.7	-171.2	179.8	0	0	0	0	112.4	S116 D158	S116-V118 PolarHBondContact O-N 3.21Å; S116-V118 PolarHBondContact OG-N 3.18Å; V118-D158 VanDerWaalsContact CG2-O 3.31Å; V118-D158 WeakPolarHBondContact CG2-O 3.34Å
119	E	94	Very high	97.2	Very high	71 Å²	71	34.6 Å²	34.6	33%	0.332	18%	0.175	S	C	.	.	S	Bend	trans	-103.5	161.3	-176.1	-60.5	-169.7	-178.8	0	0	111.2	H73 S116 L121	H73-E119 PolarHBondContact NE2-O 2.98Å; H73-E119 VanDerWaalsContact NE2-O 3.15Å; S116-E119 WeakPolarHBondContact CB-O 3.35Å; S116-E119 PolarHBondContact OG-N 2.76Å; E119-L121 HydrophobicContact CB-CB 4.38Å; E119-L121 HydrophobicContact CB-CD1 4.15Å; E119-L121 HydrophobicContact CB-CG 3.85Å; E119-L121 PolarHBondContact O-N 2.53Å; E119-L121 VanDerWaalsContact OE2-CD1 3.24Å; E119-L121 WeakPolarHBondContact OE2-CD1 3.26Å
120	D	96.4	Very high	97.2	Very high	53 Å²	53	30.8 Å²	30.8	28%	0.283	16%	0.159	S	C	.	.	S	Bend	trans	-73.6	42.5	169.9	-79.6	-36.1	0	0	0	111.7	H73 L136	H73-D120 IonicContact CD2-OD1 3.8Å; H73-D120 PolarHBondContact CD2-OD1 3.33Å; D120-L136 HydrophobicContact CB-CB 4.27Å; D120-L136 HydrophobicContact CB-CD1 4.05Å; D120-L136 HydrophobicContact CB-CG 4.39Å; D120-L136 WeakPolarHBondContact O-CG 3.27Å; D120-L136 PolarHBondContact O-N 2.77Å
121	L	97.6	Very high	97.2	Very high	12 Å²	12	30.9 Å²	30.9	6%	0.063	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	154.4	176.7	-60.9	-178.1	0	0	0	110.4	S116 E119 M133 W134 D135 F155 L176	S116-L121 WeakPolarHBondContact CB-O 3.41Å; S116-L121 PolarHBondContact N-O 3.35Å; E119-L121 HydrophobicContact CB-CB 4.38Å; E119-L121 HydrophobicContact CB-CD1 4.15Å; E119-L121 HydrophobicContact CB-CG 3.85Å; E119-L121 PolarHBondContact O-N 2.53Å; E119-L121 VanDerWaalsContact OE2-CD1 3.24Å; E119-L121 WeakPolarHBondContact OE2-CD1 3.26Å; L121-M133 HydrophobicContact CD1-SD 4.04Å; L121-W134 CarbonylContact C-O 3.6Å; L121-W134 WeakPolarHBondContact CA-O 3.32Å; L121-W134 WeakPolarHBondContact CD2-O 3.2Å; L121-D135 HydrophobicContact CD2-CB 3.67Å; L121-F155 HydrophobicContact CB-CZ 4.44Å; L121-L176 HydrophobicContact CD1-CD2 4.15Å
122	F	98.5	Very high	97.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	153.7	167.6	71.1	-87	0	0	0	111.7	L79 I89 F103 L113 D114 L115 M133 W134 L136	L79-F122 HydrophobicContact CD1-CB 3.92Å; L79-F122 HydrophobicContact CD1-CD1 3.49Å; L79-F122 VanDerWaalsContact CD1-CD1 3.49Å; L79-F122 HydrophobicContact CD1-CD2 3.88Å; L79-F122 HydrophobicContact CD1-CE1 3.87Å; L79-F122 HydrophobicContact CD1-CE2 4.25Å; L79-F122 HydrophobicContact CD1-CG 3.49Å; L79-F122 VanDerWaalsContact CD1-CG 3.49Å; L79-F122 HydrophobicContact CD1-CZ 4.24Å; L79-F122 HydrophobicContact CD2-CD1 4.49Å; L79-F122 HydrophobicContact CD2-CE1 4.07Å; L79-F122 HydrophobicContact CD2-CZ 4.29Å; I89-F122 HydrophobicContact CD1-CE2 3.9Å; I89-F122 HydrophobicContact CG2-CE2 4.05Å; I89-F122 HydrophobicContact CG2-CZ 4.17Å; F103-F122 HydrophobicContact CB-CZ 4.35Å; F103-F122 HydrophobicContact CD1-CE1 4.23Å; F103-F122 HydrophobicContact CD1-CZ 4.1Å; F103-F122 AromaticContact CD2-CE1 3.92Å; F103-F122 HydrophobicContact CD2-CE1 3.92Å; F103-F122 AromaticContact CD2-CZ 3.52Å; F103-F122 HydrophobicContact CD2-CZ 3.52Å; F103-F122 AromaticContact CE1-CE1 3.94Å; F103-F122 HydrophobicContact CE1-CE1 3.94Å; F103-F122 HydrophobicContact CE1-CZ 4.27Å; F103-F122 AromaticContact CE2-CE1 3.59Å; F103-F122 HydrophobicContact CE2-CE1 3.59Å; F103-F122 AromaticContact CE2-CZ 3.71Å; F103-F122 HydrophobicContact CE2-CZ 3.71Å; F103-F122 HydrophobicContact CG-CE1 4.22Å; F103-F122 AromaticContact CG-CZ 3.73Å; F103-F122 HydrophobicContact CG-CZ 3.73Å; F103-F122 AromaticContact CZ-CE1 3.63Å; F103-F122 HydrophobicContact CZ-CE1 3.63Å; F103-F122 HydrophobicContact CZ-CZ 4.11Å; L113-F122 HydrophobicContact CD2-CD2 4.37Å; L113-F122 HydrophobicContact CD2-CE2 4.43Å; D114-F122 CarbonylContact O-C 3.59Å; D114-F122 VanDerWaalsContact O-CA 3.23Å; D114-F122 WeakPolarHBondContact O-CA 3.49Å; D114-F122 VanDerWaalsContact O-CB 3.31Å; D114-F122 WeakPolarHBondContact O-CB 3.47Å; L115-F122 HydrophobicContact CD1-CB 4.13Å; F122-M133 WeakPolarHBondContact O-CA 3.26Å; F122-W134 HydrophobicContact CD1-CB 3.73Å; F122-W134 HydrophobicContact CD2-CB 4.29Å; F122-W134 AromaticContact CD2-CD1 3.72Å; F122-W134 HydrophobicContact CD2-CG 4.3Å; F122-W134 HydrophobicContact CE1-CB 3.24Å; F122-W134 AromaticContact CE1-CG 3.89Å; F122-W134 HydrophobicContact CE1-CG 3.89Å; F122-W134 HydrophobicContact CE2-CB 3.84Å; F122-W134 AromaticContact CE2-CD1 3.16Å; F122-W134 HydrophobicContact CE2-CD2 4.48Å; F122-W134 AromaticContact CE2-CG 3.59Å; F122-W134 HydrophobicContact CE2-CG 3.59Å; F122-W134 AromaticContact CE2-NE1 3.82Å; F122-W134 HydrophobicContact CG-CB 4.23Å; F122-W134 HydrophobicContact CZ-CB 3.29Å; F122-W134 AromaticContact CZ-CD1 3.47Å; F122-W134 VanDerWaalsContact CZ-CD1 3.47Å; F122-W134 HydrophobicContact CZ-CD2 4.15Å; F122-W134 AromaticContact CZ-CG 3.36Å; F122-W134 HydrophobicContact CZ-CG 3.36Å; F122-W134 PolarHBondContact N-O 2.93Å; F122-W134 PolarHBondContact O-N 3.3Å; F122-L136 HydrophobicContact CD1-CD2 3.81Å; F122-L136 HydrophobicContact CD1-CG 4.4Å; F122-L136 HydrophobicContact CE1-CD2 3.91Å
123	L	98.6	Very high	97.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	145.1	171.3	-68	165.8	0	0	0	109.9	L113 D114 V131 R132 M133 A153 F155 F162	L113-L123 WeakPolarHBondContact CA-O 3.38Å; D114-L123 PolarHBondContact N-O 2.9Å; D114-L123 PolarHBondContact O-N 3.16Å; L123-V131 HydrophobicContact CD2-CG1 3.98Å; L123-R132 CarbonylContact C-O 3.58Å; L123-R132 WeakPolarHBondContact CA-O 3.23Å; L123-M133 HydrophobicContact CD2-CB 3.96Å; L123-M133 HydrophobicContact CD2-CE 4.36Å; L123-M133 HydrophobicContact CD2-CG 4.1Å; L123-A153 HydrophobicContact CB-CB 4.33Å; L123-A153 HydrophobicContact CD1-CB 4.14Å; L123-F155 HydrophobicContact CB-CE2 4.12Å; L123-F155 HydrophobicContact CB-CZ 4.49Å; L123-F155 HydrophobicContact CD1-CD1 4.07Å; L123-F155 HydrophobicContact CD1-CD2 3.78Å; L123-F155 HydrophobicContact CD1-CE1 3.88Å; L123-F155 HydrophobicContact CD1-CE2 3.6Å; L123-F155 HydrophobicContact CD1-CG 4.04Å; L123-F155 HydrophobicContact CD1-CZ 3.68Å; L123-F155 HydrophobicContact CD2-CZ 4.22Å; L123-F155 HydrophobicContact CG-CD2 4.16Å; L123-F155 HydrophobicContact CG-CE1 4.08Å; L123-F155 HydrophobicContact CG-CE2 3.47Å; L123-F155 VanDerWaalsContact CG-CE2 3.47Å; L123-F155 HydrophobicContact CG-CZ 3.45Å; L123-F155 VanDerWaalsContact CG-CZ 3.45Å; L123-F162 HydrophobicContact CD1-CB 3.61Å; L123-F162 HydrophobicContact CD1-CD2 4.22Å; L123-F162 HydrophobicContact CD1-CG 4.05Å; L123-F162 HydrophobicContact CD2-CD2 4.46Å
124	S	98.5	Very high	97.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.9	166.5	65.7	0	0	0	0	110.9	I89 H106 N112 V131 R132 W134	I89-S124 WeakPolarHBondContact CD1-OG 3.43Å; H106-S124 PolarHBondContact CD2-OG 2.92Å; H106-S124 PolarHBondContact NE2-OG 3.38Å; N112-S124 WeakPolarHBondContact O-CA 3.27Å; S124-V131 CarbonylContact O-C 3.56Å; S124-V131 VanDerWaalsContact O-CA 3.3Å; S124-V131 WeakPolarHBondContact O-CA 3.4Å; S124-R132 PolarHBondContact N-O 2.8Å; S124-R132 PolarHBondContact O-N 3.14Å; S124-W134 PolarHBondContact OG-NE1 3.21Å
125	A	98.2	Very high	97.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	134.7	174.7	0	0	0	0	0	109.6	V110 V111 N112 V131 P151	V110-A125 CarbonylContact C-O 3.51Å; V110-A125 WeakPolarHBondContact CA-O 3.26Å; V111-A125 HydrophobicContact CG2-CB 4.48Å; V111-A125 WeakPolarHBondContact CG2-O 3.44Å; V111-A125 PolarHBondContact N-O 3.16Å; N112-A125 HydrophobicContact CB-CB 4.22Å; N112-A125 PolarHBondContact N-O 3.24Å; N112-A125 PolarHBondContact O-N 3.49Å; A125-V131 HydrophobicContact CB-CG2 4.09Å; A125-P151 HydrophobicContact CB-CB 4.44Å; A125-P151 HydrophobicContact CB-CG 4.13Å; A125-P151 WeakPolarHBondContact CB-O 3.39Å
126	S	98.1	Very high	97.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	154.8	-174.6	167.3	0	0	0	0	112.9	H106 K108 K109 D128 R129 T130 P151	H106-S126 WeakPolarHBondContact CE1-CB 3.35Å; H106-S126 WeakPolarHBondContact ND1-CB 3.28Å; K108-S126 PolarHBondContact O-OG 2.97Å; K109-S126 WeakPolarHBondContact O-CA 3.13Å; K109-S126 PolarHBondContact O-OG 2.86Å; S126-D128 VanDerWaalsContact CB-OD1 3.29Å; S126-D128 WeakPolarHBondContact CB-OD1 3.34Å; S126-D128 PolarHBondContact O-N 2.83Å; S126-D128 VanDerWaalsContact O-N 3.09Å; S126-D128 PolarHBondContact OG-N 3.16Å; S126-D128 PolarHBondContact OG-OD1 3.33Å; S126-R129 PolarHBondContact O-N 2.74Å; S126-T130 PolarHBondContact N-O 3.01Å; S126-T130 VanDerWaalsContact N-O 3.09Å; S126-P151 WeakPolarHBondContact O-CD 3.15Å
127	L	97	Very high	97.3	Very high	67 Å²	67	36.2 Å²	36.2	35%	0.351	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-10.7	169.5	-62	-173	0	0	0	113.6	K108 K109 V111 R129 R150	K108-L127 HydrophobicContact CB-CB 3.83Å; K108-L127 HydrophobicContact CD-CB 4.17Å; K108-L127 WeakPolarHBondContact CD-O 3.41Å; K109-L127 HydrophobicContact CB-CD1 4.03Å; K109-L127 HydrophobicContact CB-CG 4.35Å; K109-L127 PolarHBondContact O-N 3.29Å; V111-L127 HydrophobicContact CG1-CD1 4.38Å; V111-L127 HydrophobicContact CG1-CD2 3.66Å; V111-L127 HydrophobicContact CG1-CG 3.69Å; L127-R129 PolarHBondContact O-N 3.25Å; L127-R150 HydrophobicContact CD2-CB 4.41Å; L127-R150 HydrophobicContact CD2-CG 3.8Å
128	D	97.7	Very high	97.4	Very high	20 Å²	20	34.1 Å²	34.1	11%	0.107	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	0.8	170.2	72.4	9.6	0	0	0	113.3	H106 T107 K108 S126 T130	H106-D128 VanDerWaalsContact CA-OD2 3.23Å; H106-D128 WeakPolarHBondContact CA-OD2 3.42Å; H106-D128 IonicContact CE1-OD1 3.84Å; H106-D128 IonicContact CE1-OD2 3.91Å; H106-D128 IonicContact CG-OD2 3.55Å; H106-D128 IonicContact ND1-OD1 3.35Å; H106-D128 PolarHBondContact ND1-OD1 2.87Å; H106-D128 IonicContact ND1-OD2 2.8Å; H106-D128 PolarHBondContact ND1-OD2 2.83Å; T107-D128 PolarHBondContact N-OD2 3.12Å; T107-D128 VanDerWaalsContact N-OD2 3.08Å; T107-D128 WeakPolarHBondContact OG1-CB 3.32Å; K108-D128 HydrophobicContact CB-CB 4.1Å; K108-D128 HydrophobicContact CG-CB 4.15Å; S126-D128 VanDerWaalsContact CB-OD1 3.29Å; S126-D128 WeakPolarHBondContact CB-OD1 3.34Å; S126-D128 PolarHBondContact O-N 2.83Å; S126-D128 VanDerWaalsContact O-N 3.09Å; S126-D128 PolarHBondContact OG-N 3.16Å; S126-D128 PolarHBondContact OG-OD1 3.33Å; D128-T130 VanDerWaalsContact C-N 3.35Å; D128-T130 WeakPolarHBondContact OD1-CB 3.49Å; D128-T130 PolarHBondContact OD1-N 2.98Å; D128-T130 PolarHBondContact OD1-OG1 3.36Å; D128-T130 PolarHBondContact OD2-OG1 2.92Å
129	R	97.7	Very high	97.3	Very high	134 Å²	134	33 Å²	33	51%	0.506	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	32.2	179.3	-50.3	176	-82.4	-174.6	-4.7	113.1	S126 L127 L147 P148	S126-R129 PolarHBondContact O-N 2.74Å; L127-R129 PolarHBondContact O-N 3.25Å; R129-L147 VanDerWaalsContact CB-O 3.25Å; R129-L147 WeakPolarHBondContact CB-O 3.5Å; R129-L147 PolarHBondContact O-N 2.88Å; R129-P148 VanDerWaalsContact CD-O 3.28Å; R129-P148 WeakPolarHBondContact CD-O 3.49Å
130	T	98.1	Very high	97.4	Very high	6 Å²	6	33.7 Å²	33.7	4%	0.037	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	143.6	172	69.1	0	0	0	0	111.6	H106 S126 D128 R132 M144 V145	H106-T130 PolarHBondContact CE1-OG1 2.83Å; H106-T130 PolarHBondContact ND1-OG1 2.95Å; S126-T130 PolarHBondContact N-O 3.01Å; S126-T130 VanDerWaalsContact N-O 3.09Å; D128-T130 VanDerWaalsContact C-N 3.35Å; D128-T130 WeakPolarHBondContact OD1-CB 3.49Å; D128-T130 PolarHBondContact OD1-N 2.98Å; D128-T130 PolarHBondContact OD1-OG1 3.36Å; D128-T130 PolarHBondContact OD2-OG1 2.92Å; T130-R132 PolarHBondContact OG1-NE 2.83Å; T130-M144 HydrophobicContact CG2-CG 4.31Å; T130-M144 HydrophobicContact CG2-SD 4.08Å; T130-V145 VanDerWaalsContact CA-O 3.31Å; T130-V145 WeakPolarHBondContact CA-O 3.29Å
131	V	98.4	Very high	97.4	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128	156.8	175.1	0	0	0	0	106.8	L123 S124 A125 M144 V145 L147 P151 A153 V164	L123-V131 HydrophobicContact CD2-CG1 3.98Å; S124-V131 CarbonylContact O-C 3.56Å; S124-V131 VanDerWaalsContact O-CA 3.3Å; S124-V131 WeakPolarHBondContact O-CA 3.4Å; A125-V131 HydrophobicContact CB-CG2 4.09Å; V131-M144 WeakPolarHBondContact O-CA 3.31Å; V131-V145 PolarHBondContact N-O 2.84Å; V131-V145 PolarHBondContact O-N 2.78Å; V131-L147 HydrophobicContact CB-CD1 4.45Å; V131-L147 HydrophobicContact CG2-CD1 3.75Å; V131-P151 HydrophobicContact CG2-CB 3.67Å; V131-P151 HydrophobicContact CG2-CG 3.93Å; V131-A153 HydrophobicContact CG1-CB 3.65Å; V131-A153 HydrophobicContact CG2-CB 3.99Å; V131-V164 HydrophobicContact CG2-CG1 4Å; V131-V164 HydrophobicContact CG2-CG2 4.35Å
132	R	98.4	Very high	97.4	Very high	32 Å²	32	36.6 Å²	36.6	12%	0.121	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139.5	178.3	-67.4	179.9	-177.3	-140.5	4.1	109.7	G105 L123 S124 T130 W134 A141 A143 M144	G105-R132 VanDerWaalsContact C-NH1 3.26Å; G105-R132 VanDerWaalsContact CA-NH1 3.31Å; G105-R132 VanDerWaalsContact O-CZ 3.23Å; G105-R132 PolarHBondContact O-NH1 2.92Å; G105-R132 PolarHBondContact O-NH2 3.36Å; L123-R132 CarbonylContact C-O 3.58Å; L123-R132 WeakPolarHBondContact CA-O 3.23Å; S124-R132 PolarHBondContact N-O 2.8Å; S124-R132 PolarHBondContact O-N 3.14Å; T130-R132 PolarHBondContact OG1-NE 2.83Å; R132-W134 HydrophobicContact CB-CZ2 3.88Å; R132-W134 VanDerWaalsContact CB-NE1 3.34Å; R132-W134 HydrophobicContact CG-CZ2 4.27Å; R132-A141 HydrophobicContact CB-CB 4.3Å; R132-A141 HydrophobicContact CG-CB 4.49Å; R132-A143 WeakPolarHBondContact CA-O 3.31Å; R132-M144 HydrophobicContact CG-CB 4.44Å; R132-M144 HydrophobicContact CG-CE 4.2Å; R132-M144 HydrophobicContact CG-CG 4.01Å
133	M	98.3	Very high	97.3	Very high	13 Å²	13	37 Å²	37	6%	0.064	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134.6	170	-165.9	-170.8	-60	0	0	108.5	L121 F122 L123 A141 Q142 A143 F162 L176	L121-M133 HydrophobicContact CD1-SD 4.04Å; F122-M133 WeakPolarHBondContact O-CA 3.26Å; L123-M133 HydrophobicContact CD2-CB 3.96Å; L123-M133 HydrophobicContact CD2-CE 4.36Å; L123-M133 HydrophobicContact CD2-CG 4.1Å; M133-A141 CarbonylContact O-C 3.59Å; M133-A141 WeakPolarHBondContact O-CA 3.36Å; M133-Q142 PolarHBondContact O-N 3.45Å; M133-A143 HydrophobicContact CB-CB 3.76Å; M133-A143 HydrophobicContact CE-CB 4.24Å; M133-A143 PolarHBondContact N-O 3Å; M133-A143 PolarHBondContact O-N 3.34Å; M133-A143 HydrophobicContact SD-CB 4.44Å; M133-F162 HydrophobicContact CE-CD1 4.18Å; M133-F162 HydrophobicContact CE-CE1 3.78Å; M133-F162 HydrophobicContact CE-CZ 4.36Å; M133-L176 HydrophobicContact CE-CD1 3.34Å; M133-L176 HydrophobicContact CE-CG 4.18Å; M133-L176 HydrophobicContact SD-CD1 3.75Å; M133-L176 HydrophobicContact SD-CG 4.4Å
134	W	98.3	Very high	97.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148.3	-175.7	-53.6	89	0	0	0	109.3	F103 L121 F122 S124 R132 A141	F103-W134 HydrophobicContact CB-CD2 4.1Å; F103-W134 HydrophobicContact CB-CE3 3.77Å; F103-W134 HydrophobicContact CB-CH2 4.14Å; F103-W134 HydrophobicContact CB-CZ2 4.43Å; F103-W134 HydrophobicContact CB-CZ3 3.8Å; F103-W134 HydrophobicContact CD1-CB 4.35Å; F103-W134 HydrophobicContact CD1-CD2 4.27Å; F103-W134 AromaticContact CD1-CE3 3.76Å; F103-W134 HydrophobicContact CD1-CE3 3.76Å; F103-W134 HydrophobicContact CD1-CZ3 4.41Å; F103-W134 HydrophobicContact CG-CD2 4.42Å; F103-W134 HydrophobicContact CG-CE3 4.14Å; L121-W134 CarbonylContact C-O 3.6Å; L121-W134 WeakPolarHBondContact CA-O 3.32Å; L121-W134 WeakPolarHBondContact CD2-O 3.2Å; F122-W134 HydrophobicContact CD1-CB 3.73Å; F122-W134 HydrophobicContact CD2-CB 4.29Å; F122-W134 AromaticContact CD2-CD1 3.72Å; F122-W134 HydrophobicContact CD2-CG 4.3Å; F122-W134 HydrophobicContact CE1-CB 3.24Å; F122-W134 AromaticContact CE1-CG 3.89Å; F122-W134 HydrophobicContact CE1-CG 3.89Å; F122-W134 HydrophobicContact CE2-CB 3.84Å; F122-W134 AromaticContact CE2-CD1 3.16Å; F122-W134 HydrophobicContact CE2-CD2 4.48Å; F122-W134 AromaticContact CE2-CG 3.59Å; F122-W134 HydrophobicContact CE2-CG 3.59Å; F122-W134 AromaticContact CE2-NE1 3.82Å; F122-W134 HydrophobicContact CG-CB 4.23Å; F122-W134 HydrophobicContact CZ-CB 3.29Å; F122-W134 AromaticContact CZ-CD1 3.47Å; F122-W134 VanDerWaalsContact CZ-CD1 3.47Å; F122-W134 HydrophobicContact CZ-CD2 4.15Å; F122-W134 AromaticContact CZ-CG 3.36Å; F122-W134 HydrophobicContact CZ-CG 3.36Å; F122-W134 PolarHBondContact N-O 2.93Å; F122-W134 PolarHBondContact O-N 3.3Å; S124-W134 PolarHBondContact OG-NE1 3.21Å; R132-W134 HydrophobicContact CB-CZ2 3.88Å; R132-W134 VanDerWaalsContact CB-NE1 3.34Å; R132-W134 HydrophobicContact CG-CZ2 4.27Å; W134-A141 HydrophobicContact CD2-CB 4.04Å; W134-A141 VanDerWaalsContact CE3-CA 3.41Å; W134-A141 HydrophobicContact CE3-CB 3.77Å; W134-A141 VanDerWaalsContact CE3-N 3.27Å; W134-A141 HydrophobicContact CH2-CB 3.99Å; W134-A141 HydrophobicContact CZ2-CB 4.24Å; W134-A141 HydrophobicContact CZ3-CB 3.74Å
135	D	97.6	Very high	97.1	Very high	22 Å²	22	40.5 Å²	40.5	12%	0.118	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.6	167.8	-177.6	-36.2	0	0	0	107.8	L121 R137 A138 Q142	L121-D135 HydrophobicContact CD2-CB 3.67Å; D135-R137 PolarHBondContact O-N 3.46Å; D135-R137 WeakPolarHBondContact OD1-CA 3.42Å; D135-R137 WeakPolarHBondContact OD1-CB 3.29Å; D135-R137 WeakPolarHBondContact OD1-CG 3.33Å; D135-R137 IonicContact OD1-CZ 3.87Å; D135-R137 PolarHBondContact OD1-N 2.85Å; D135-R137 IonicContact OD1-NE 2.73Å; D135-R137 PolarHBondContact OD1-NE 2.65Å; D135-R137 IonicContact OD1-NH2 2.84Å; D135-R137 IonicContact OD2-CZ 2.77Å; D135-R137 IonicContact OD2-NE 3.53Å; D135-R137 PolarHBondContact OD2-NE 2.91Å; D135-R137 IonicContact OD2-NH2 3.46Å; D135-R137 PolarHBondContact OD2-NH2 2.91Å; D135-A138 HydrophobicContact CB-CB 4.16Å; D135-A138 PolarHBondContact O-N 2.63Å; D135-Q142 HydrophobicContact CB-CG 3.79Å
136	L	97.4	Very high	97.1	Very high	8 Å²	8	47.4 Å²	47.4	4%	0.042	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.9	-179.9	-69.5	177.8	0	0	0	113	T72 L79 Y91 R101 F103 D120 F122	T72-L136 HydrophobicContact CG2-CD1 3.85Å; T72-L136 HydrophobicContact CG2-CD2 4.16Å; L79-L136 HydrophobicContact CD1-CD2 3.99Å; L79-L136 HydrophobicContact CD2-CD2 3.78Å; L79-L136 HydrophobicContact CG-CD2 4.18Å; Y91-L136 HydrophobicContact CD1-CD2 4.45Å; Y91-L136 HydrophobicContact CD2-CD2 4.44Å; Y91-L136 HydrophobicContact CG-CD2 4.44Å; R101-L136 WeakPolarHBondContact CD-O 3.47Å; R101-L136 PolarHBondContact NE-O 2.78Å; R101-L136 VanDerWaalsContact NE-O 3.07Å; F103-L136 HydrophobicContact CE2-CD2 4.4Å; F103-L136 HydrophobicContact CZ-CD2 4.06Å; D120-L136 HydrophobicContact CB-CB 4.27Å; D120-L136 HydrophobicContact CB-CD1 4.05Å; D120-L136 HydrophobicContact CB-CG 4.39Å; D120-L136 WeakPolarHBondContact O-CG 3.27Å; D120-L136 PolarHBondContact O-N 2.77Å; F122-L136 HydrophobicContact CD1-CD2 3.81Å; F122-L136 HydrophobicContact CD1-CG 4.4Å; F122-L136 HydrophobicContact CE1-CD2 3.91Å
137	R	96.3	Very high	97	Very high	158 Å²	158	48.3 Å²	48.3	60%	0.596	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-12.9	-177.6	-52.7	165.9	-65.2	-167.6	3.4	112.5	R101 D135	R101-R137 PolarHBondContact NH2-O 2.92Å; D135-R137 PolarHBondContact O-N 3.46Å; D135-R137 WeakPolarHBondContact OD1-CA 3.42Å; D135-R137 WeakPolarHBondContact OD1-CB 3.29Å; D135-R137 WeakPolarHBondContact OD1-CG 3.33Å; D135-R137 IonicContact OD1-CZ 3.87Å; D135-R137 PolarHBondContact OD1-N 2.85Å; D135-R137 IonicContact OD1-NE 2.73Å; D135-R137 PolarHBondContact OD1-NE 2.65Å; D135-R137 IonicContact OD1-NH2 2.84Å; D135-R137 IonicContact OD2-CZ 2.77Å; D135-R137 IonicContact OD2-NE 3.53Å; D135-R137 PolarHBondContact OD2-NE 2.91Å; D135-R137 IonicContact OD2-NH2 3.46Å; D135-R137 PolarHBondContact OD2-NH2 2.91Å
138	A	96.5	Very high	96.8	Very high	18 Å²	18	49.9 Å²	49.9	15%	0.149	25%	0.254	C	S	.	.			trans	-117.4	140.9	-177.3	0	0	0	0	0	112.4	R101 F103 D135 T140	R101-A138 WeakPolarHBondContact CD-O 3.28Å; F103-A138 VanDerWaalsContact CE1-O 3.28Å; F103-A138 WeakPolarHBondContact CE1-O 3.31Å; D135-A138 HydrophobicContact CB-CB 4.16Å; D135-A138 PolarHBondContact O-N 2.63Å; A138-T140 VanDerWaalsContact C-N 3.33Å; A138-T140 PolarHBondContact O-N 2.71Å
139	P	91.3	Very high	96.6	Very high	74 Å²	74	49.9 Å²	49.9	48%	0.481	26%	0.256	S	S	.	.	S	Bend	trans	-77.6	-16.2	-179.6	30.9	-33.5	0	0	0	114
140	T	96	Very high	96.4	Very high	86 Å²	86	47.6 Å²	47.6	53%	0.528	25%	0.247	S	C	.	.	S	Bend	trans	-108	152.4	-176	56.9	0	0	0	0	111.3	A138 Q142	A138-T140 VanDerWaalsContact C-N 3.33Å; A138-T140 PolarHBondContact O-N 2.71Å; T140-Q142 PolarHBondContact O-N 3.33Å; T140-Q142 PolarHBondContact O-NE2 2.95Å
141	A	97.4	Very high	96.4	Very high	29 Å²	29	47.3 Å²	47.3	24%	0.24	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	133.7	171.5	0	0	0	0	0	109.5	R132 M133 W134	R132-A141 HydrophobicContact CB-CB 4.3Å; R132-A141 HydrophobicContact CG-CB 4.49Å; M133-A141 CarbonylContact O-C 3.59Å; M133-A141 WeakPolarHBondContact O-CA 3.36Å; W134-A141 HydrophobicContact CD2-CB 4.04Å; W134-A141 VanDerWaalsContact CE3-CA 3.41Å; W134-A141 HydrophobicContact CE3-CB 3.77Å; W134-A141 VanDerWaalsContact CE3-N 3.27Å; W134-A141 HydrophobicContact CH2-CB 3.99Å; W134-A141 HydrophobicContact CZ2-CB 4.24Å; W134-A141 HydrophobicContact CZ3-CB 3.74Å
142	Q	96.6	Very high	96.3	Very high	98 Å²	98	47.2 Å²	47.2	46%	0.458	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-27.7	177.7	-58.4	-53.5	-62.6	0	0	111.4	M133 D135 T140	M133-Q142 PolarHBondContact O-N 3.45Å; D135-Q142 HydrophobicContact CB-CG 3.79Å; T140-Q142 PolarHBondContact O-N 3.33Å; T140-Q142 PolarHBondContact O-NE2 2.95Å
143	A	96.3	Very high	96.3	Very high	7 Å²	7	45.7 Å²	45.7	6%	0.058	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.6	172.9	0	0	0	0	0	111.1	R132 M133 Y179	R132-A143 WeakPolarHBondContact CA-O 3.31Å; M133-A143 HydrophobicContact CB-CB 3.76Å; M133-A143 HydrophobicContact CE-CB 4.24Å; M133-A143 PolarHBondContact N-O 3Å; M133-A143 PolarHBondContact O-N 3.34Å; M133-A143 HydrophobicContact SD-CB 4.44Å; A143-Y179 HydrophobicContact CB-CD1 3.89Å; A143-Y179 HydrophobicContact CB-CD2 4.32Å; A143-Y179 HydrophobicContact CB-CE1 3.35Å; A143-Y179 HydrophobicContact CB-CE2 3.85Å; A143-Y179 HydrophobicContact CB-CG 4.35Å
144	M	97.1	Very high	96.3	Very high	60 Å²	60	45.1 Å²	45.1	30%	0.296	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	131.1	174.5	-172.8	177.7	-45.7	0	0	110	T130 V131 R132 H146	T130-M144 HydrophobicContact CG2-CG 4.31Å; T130-M144 HydrophobicContact CG2-SD 4.08Å; V131-M144 WeakPolarHBondContact O-CA 3.31Å; R132-M144 HydrophobicContact CG-CB 4.44Å; R132-M144 HydrophobicContact CG-CE 4.2Å; R132-M144 HydrophobicContact CG-CG 4.01Å; M144-H146 VanDerWaalsContact SD-CE1 3.57Å
145	V	97.3	Very high	96.3	Very high	16 Å²	16	45.6 Å²	45.6	10%	0.097	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.3	173.2	-175.3	0	0	0	0	108.2	T130 V131 L147 F162 Y174 Y179	T130-V145 VanDerWaalsContact CA-O 3.31Å; T130-V145 WeakPolarHBondContact CA-O 3.29Å; V131-V145 PolarHBondContact N-O 2.84Å; V131-V145 PolarHBondContact O-N 2.78Å; V145-L147 HydrophobicContact CG1-CD1 4.46Å; V145-L147 HydrophobicContact CG1-CD2 3.7Å; V145-L147 HydrophobicContact CG1-CG 4.03Å; V145-F162 HydrophobicContact CG2-CZ 4.47Å; V145-Y174 HydrophobicContact CG1-CE1 4.4Å; V145-Y179 HydrophobicContact CG2-CD2 4.14Å
146	H	96.8	Very high	96.3	Very high	145 Å²	145	45.2 Å²	45.2	67%	0.671	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.8	174.9	-70.1	-79.3	0	0	0	110.5	M144	M144-H146 VanDerWaalsContact SD-CE1 3.57Å
147	L	95.7	Very high	96.3	Very high	18 Å²	18	46.9 Å²	46.9	9%	0.094	25%	0.247	C	C	.	.			trans	-130.7	155.8	-169.6	-60.9	166.6	0	0	0	110.4	R129 V131 V145 P151 V164 I166	R129-L147 VanDerWaalsContact CB-O 3.25Å; R129-L147 WeakPolarHBondContact CB-O 3.5Å; R129-L147 PolarHBondContact O-N 2.88Å; V131-L147 HydrophobicContact CB-CD1 4.45Å; V131-L147 HydrophobicContact CG2-CD1 3.75Å; V145-L147 HydrophobicContact CG1-CD1 4.46Å; V145-L147 HydrophobicContact CG1-CD2 3.7Å; V145-L147 HydrophobicContact CG1-CG 4.03Å; L147-P151 HydrophobicContact CD1-CB 3.39Å; L147-P151 HydrophobicContact CD1-CG 3.98Å; L147-V164 HydrophobicContact CD1-CG1 3.46Å; L147-V164 VanDerWaalsContact CD1-CG1 3.46Å; L147-V164 HydrophobicContact CD2-CG1 4.3Å; L147-I166 HydrophobicContact CD1-CG1 4.46Å; L147-I166 HydrophobicContact CD2-CD1 3.58Å; L147-I166 HydrophobicContact CD2-CG1 4.11Å
148	P	93.8	Very high	96.3	Very high	100 Å²	100	44.6 Å²	44.6	65%	0.649	25%	0.247	S	C	*	.	S	Bend	trans	-74.5	-24.9	-177.4	28.1	-34.3	0	0	0	113.3	R129 I166	R129-P148 VanDerWaalsContact CD-O 3.28Å; R129-P148 WeakPolarHBondContact CD-O 3.49Å; P148-I166 HydrophobicContact CG-CG2 3.93Å
149	S	93.1	Very high	96.3	Very high	21 Å²	21	44 Å²	44	15%	0.147	24%	0.242	C	C	.	.	S	Bend	trans	-141.5	-173.1	-172.5	72.3	0	0	0	0	112.7	P151 I166 N167	S149-P151 VanDerWaalsContact O-CD 3.3Å; S149-P151 WeakPolarHBondContact O-CD 3.49Å; S149-I166 WeakPolarHBondContact OG-CG2 3.48Å; S149-N167 WeakPolarHBondContact OG-CA 3.29Å; S149-N167 WeakPolarHBondContact OG-CB 3.32Å; S149-N167 PolarHBondContact OG-N 3.45Å
150	R	94.2	Very high	96.6	Very high	85 Å²	85	45.1 Å²	45.1	32%	0.321	24%	0.244	S	C	.	.			trans	-60.6	120.5	179.2	175.3	175.4	178.5	-81.2	-0.1	110	L127 W197	L127-R150 HydrophobicContact CD2-CB 4.41Å; L127-R150 HydrophobicContact CD2-CG 3.8Å; R150-W197 PolarHBondContact NH1-O 2.87Å
151	P	96.7	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	161	180	35.3	-27.4	0	0	0	113.3	A125 S126 V131 L147 S149 V164 A165	A125-P151 HydrophobicContact CB-CB 4.44Å; A125-P151 HydrophobicContact CB-CG 4.13Å; A125-P151 WeakPolarHBondContact CB-O 3.39Å; S126-P151 WeakPolarHBondContact O-CD 3.15Å; V131-P151 HydrophobicContact CG2-CB 3.67Å; V131-P151 HydrophobicContact CG2-CG 3.93Å; L147-P151 HydrophobicContact CD1-CB 3.39Å; L147-P151 HydrophobicContact CD1-CG 3.98Å; S149-P151 VanDerWaalsContact O-CD 3.3Å; S149-P151 WeakPolarHBondContact O-CD 3.49Å; P151-V164 HydrophobicContact CB-CG1 4.42Å; P151-A165 VanDerWaalsContact CA-O 3.28Å; P151-A165 WeakPolarHBondContact CA-O 3.4Å
152	L	97.3	Very high	96.7	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.6	159.5	-61.2	168	0	0	0	107.7	N112 V164 A165 W197 T198 L200	N112-L152 HydrophobicContact CB-CD2 3.79Å; L152-V164 CarbonylContact O-C 3.59Å; L152-V164 VanDerWaalsContact O-CA 3.31Å; L152-V164 WeakPolarHBondContact O-CA 3.48Å; L152-A165 HydrophobicContact CB-CB 3.99Å; L152-A165 HydrophobicContact CD1-CB 4.48Å; L152-A165 PolarHBondContact N-O 2.83Å; L152-A165 PolarHBondContact O-N 3.05Å; L152-W197 HydrophobicContact CD1-CB 3.86Å; L152-T198 WeakPolarHBondContact CD2-O 3.48Å; L152-L200 HydrophobicContact CB-CB 4.19Å
153	A	98.1	Very high	96.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155	177.1	0	0	0	0	0	112.3	N112 L123 V131 A163 V164	N112-A153 PolarHBondContact OD1-N 3.11Å; N112-A153 PolarHBondContact OD1-O 3.02Å; L123-A153 HydrophobicContact CB-CB 4.33Å; L123-A153 HydrophobicContact CD1-CB 4.14Å; V131-A153 HydrophobicContact CG1-CB 3.65Å; V131-A153 HydrophobicContact CG2-CB 3.99Å; A153-A163 WeakPolarHBondContact CA-O 3.4Å; A153-V164 HydrophobicContact CB-CG2 4.4Å
154	G	98.1	Very high	96.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	147.4	174.5	0	0	0	0	0	111.8	D114 F162 A163	D114-G154 WeakPolarHBondContact OD2-CA 3.43Å; G154-F162 CarbonylContact O-C 3.55Å; G154-F162 VanDerWaalsContact O-CA 3.27Å; G154-F162 WeakPolarHBondContact O-CA 3.42Å; G154-F162 WeakPolarHBondContact O-CB 3.46Å; G154-A163 PolarHBondContact N-O 2.95Å; G154-A163 VanDerWaalsContact N-O 3.08Å; G154-A163 PolarHBondContact O-N 3.25Å
155	F	98.4	Very high	96.9	Very high	10 Å²	10	34 Å²	34	4%	0.044	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	150.6	174.4	-68.6	-77.8	0	0	0	111.2	D114 S116 L121 L123 F162 L176 F202	D114-F155 HydrophobicContact CB-CD2 4.45Å; D114-F155 PolarHBondContact OD2-N 2.84Å; S116-F155 VanDerWaalsContact CA-CD2 3.48Å; S116-F155 VanDerWaalsContact N-CE2 3.26Å; L121-F155 HydrophobicContact CB-CZ 4.44Å; L123-F155 HydrophobicContact CB-CE2 4.12Å; L123-F155 HydrophobicContact CB-CZ 4.49Å; L123-F155 HydrophobicContact CD1-CD1 4.07Å; L123-F155 HydrophobicContact CD1-CD2 3.78Å; L123-F155 HydrophobicContact CD1-CE1 3.88Å; L123-F155 HydrophobicContact CD1-CE2 3.6Å; L123-F155 HydrophobicContact CD1-CG 4.04Å; L123-F155 HydrophobicContact CD1-CZ 3.68Å; L123-F155 HydrophobicContact CD2-CZ 4.22Å; L123-F155 HydrophobicContact CG-CD2 4.16Å; L123-F155 HydrophobicContact CG-CE1 4.08Å; L123-F155 HydrophobicContact CG-CE2 3.47Å; L123-F155 VanDerWaalsContact CG-CE2 3.47Å; L123-F155 HydrophobicContact CG-CZ 3.45Å; L123-F155 VanDerWaalsContact CG-CZ 3.45Å; F155-F162 HydrophobicContact CD1-CB 4.17Å; F155-L176 HydrophobicContact CD1-CD1 4.31Å; F155-L176 HydrophobicContact CE1-CD1 3.56Å; F155-F202 VanDerWaalsContact C-CD2 3.5Å; F155-F202 WeakPolarHBondContact O-CD2 3.3Å
156	D	98.1	Very high	96.8	Very high	14 Å²	14	33.8 Å²	33.8	8%	0.075	18%	0.179	C	C	.	.			trans	-73.6	163.8	162.6	80.9	-61.4	0	0	0	110.9	P117 D158 G159 L160 I161 F202	P117-D156 WeakPolarHBondContact CG-O 3.43Å; D156-D158 PolarHBondContact O-N 3.27Å; D156-D158 WeakPolarHBondContact OD2-CB 3.31Å; D156-D158 PolarHBondContact OD2-N 3.34Å; D156-G159 PolarHBondContact O-N 2.77Å; D156-G159 WeakPolarHBondContact OD1-CA 3.21Å; D156-G159 PolarHBondContact OD1-N 2.87Å; D156-G159 VanDerWaalsContact OD1-N 3.11Å; D156-L160 PolarHBondContact OD1-N 3.09Å; D156-I161 HydrophobicContact CB-CD1 3.99Å; D156-I161 HydrophobicContact CB-CG1 3.4Å; D156-I161 PolarHBondContact N-O 2.98Å; D156-I161 WeakPolarHBondContact OD1-CG1 3.37Å; D156-I161 PolarHBondContact OD1-N 3.37Å; D156-F202 HydrophobicContact CB-CD1 4.13Å; D156-F202 HydrophobicContact CB-CD2 4.36Å; D156-F202 HydrophobicContact CB-CE1 4.12Å; D156-F202 HydrophobicContact CB-CE2 4.34Å; D156-F202 HydrophobicContact CB-CG 4.23Å; D156-F202 HydrophobicContact CB-CZ 4.21Å
157	P	96.9	Very high	96.4	Very high	43 Å²	43	30.4 Å²	30.4	28%	0.279	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.6	-176.6	24.7	-34.8	0	0	0	114.5	P117 G159	P117-P157 WeakPolarHBondContact CG-O 3.47Å; P157-G159 VanDerWaalsContact C-N 3.35Å
158	D	97.3	Very high	96.2	Very high	111 Å²	111	30.1 Å²	30.1	59%	0.594	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.4	175.9	-63.5	-38.4	0	0	0	112.6	V118 D156 L160	V118-D158 VanDerWaalsContact CG2-O 3.31Å; V118-D158 WeakPolarHBondContact CG2-O 3.34Å; D156-D158 PolarHBondContact O-N 3.27Å; D156-D158 WeakPolarHBondContact OD2-CB 3.31Å; D156-D158 PolarHBondContact OD2-N 3.34Å; D158-L160 HydrophobicContact CB-CD1 4.16Å; D158-L160 HydrophobicContact CB-CG 4.1Å; D158-L160 PolarHBondContact O-N 3.39Å
159	G	96.8	Very high	96.2	Very high	4 Å²	4	28.4 Å²	28.4	4%	0.041	15%	0.148	C	C	.	.	S	Bend	trans	65	22.7	-179.7	0	0	0	0	0	114.1	D156 P157 L176	D156-G159 PolarHBondContact O-N 2.77Å; D156-G159 WeakPolarHBondContact OD1-CA 3.21Å; D156-G159 PolarHBondContact OD1-N 2.87Å; D156-G159 VanDerWaalsContact OD1-N 3.11Å; P157-G159 VanDerWaalsContact C-N 3.35Å; G159-L176 WeakPolarHBondContact O-CD2 3.32Å
160	L	97.4	Very high	96.3	Very high	99 Å²	99	27.9 Å²	27.9	52%	0.518	15%	0.145	S	C	.	.	S	Bend	trans	-96.8	-25.1	-178.4	-64.2	178.8	0	0	0	112.7	D156 D158 L176	D156-L160 PolarHBondContact OD1-N 3.09Å; D158-L160 HydrophobicContact CB-CD1 4.16Å; D158-L160 HydrophobicContact CB-CG 4.1Å; D158-L160 PolarHBondContact O-N 3.39Å; L160-L176 VanDerWaalsContact O-CB 3.23Å; L160-L176 WeakPolarHBondContact O-CB 3.49Å; L160-L176 PolarHBondContact O-N 2.82Å
161	I	97.4	Very high	96.5	Very high	40 Å²	40	23.9 Å²	23.9	21%	0.205	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	163.5	178.3	70.1	171.2	0	0	0	109.9	D156 Y174 F184 F202	D156-I161 HydrophobicContact CB-CD1 3.99Å; D156-I161 HydrophobicContact CB-CG1 3.4Å; D156-I161 PolarHBondContact N-O 2.98Å; D156-I161 WeakPolarHBondContact OD1-CG1 3.37Å; D156-I161 PolarHBondContact OD1-N 3.37Å; I161-Y174 CarbonylContact C-O 3.49Å; I161-Y174 WeakPolarHBondContact CA-O 3.36Å; I161-Y174 WeakPolarHBondContact CB-O 3.26Å; I161-F184 HydrophobicContact CB-CE1 4.34Å; I161-F184 HydrophobicContact CD1-CZ 4.44Å; I161-F184 HydrophobicContact CG2-CE1 3.94Å; I161-F184 HydrophobicContact CG2-CZ 4.07Å; I161-F202 HydrophobicContact CD1-CE1 4.2Å; I161-F202 HydrophobicContact CD1-CZ 4.12Å; I161-F202 HydrophobicContact CG1-CZ 4.48Å
162	F	98.1	Very high	96.5	Very high	3 Å²	3	24.7 Å²	24.7	1%	0.013	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	143.3	165.6	63.2	-83.7	0	0	0	110.3	L123 M133 V145 G154 F155 V164 Y174 L176	L123-F162 HydrophobicContact CD1-CB 3.61Å; L123-F162 HydrophobicContact CD1-CD2 4.22Å; L123-F162 HydrophobicContact CD1-CG 4.05Å; L123-F162 HydrophobicContact CD2-CD2 4.46Å; M133-F162 HydrophobicContact CE-CD1 4.18Å; M133-F162 HydrophobicContact CE-CE1 3.78Å; M133-F162 HydrophobicContact CE-CZ 4.36Å; V145-F162 HydrophobicContact CG2-CZ 4.47Å; G154-F162 CarbonylContact O-C 3.55Å; G154-F162 VanDerWaalsContact O-CA 3.27Å; G154-F162 WeakPolarHBondContact O-CA 3.42Å; G154-F162 WeakPolarHBondContact O-CB 3.46Å; F155-F162 HydrophobicContact CD1-CB 4.17Å; F162-V164 HydrophobicContact CD2-CG2 3.7Å; F162-V164 HydrophobicContact CE2-CG2 3.66Å; F162-Y174 HydrophobicContact CD2-CD2 4.18Å; F162-Y174 HydrophobicContact CD2-CG 4.46Å; F162-Y174 VanDerWaalsContact CE1-CB 3.41Å; F162-Y174 HydrophobicContact CE1-CG 4.26Å; F162-Y174 AromaticContact CE2-CD2 3.63Å; F162-Y174 HydrophobicContact CE2-CD2 3.63Å; F162-Y174 HydrophobicContact CE2-CE2 4.43Å; F162-Y174 AromaticContact CE2-CG 3.71Å; F162-Y174 HydrophobicContact CE2-CG 3.71Å; F162-Y174 HydrophobicContact CZ-CD1 4.21Å; F162-Y174 HydrophobicContact CZ-CD2 4.04Å; F162-Y174 AromaticContact CZ-CG 3.6Å; F162-Y174 HydrophobicContact CZ-CG 3.6Å; F162-Y174 PolarHBondContact N-O 2.91Å; F162-Y174 PolarHBondContact O-N 2.87Å; F162-L176 HydrophobicContact CD1-CD1 4.11Å
163	A	98.4	Very high	96.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	144.7	172.7	0	0	0	0	0	110.2	A153 G154 L171 N172 L173 L200 F202 I209	A153-A163 WeakPolarHBondContact CA-O 3.4Å; G154-A163 PolarHBondContact N-O 2.95Å; G154-A163 VanDerWaalsContact N-O 3.08Å; G154-A163 PolarHBondContact O-N 3.25Å; A163-L171 HydrophobicContact CB-CD2 3.72Å; A163-N172 CarbonylContact C-O 3.55Å; A163-N172 WeakPolarHBondContact CA-O 3.49Å; A163-L173 HydrophobicContact CB-CD2 3.64Å; A163-L200 HydrophobicContact CB-CD1 3.99Å; A163-L200 HydrophobicContact CB-CD2 3.9Å; A163-F202 HydrophobicContact CB-CE2 3.52Å; A163-F202 HydrophobicContact CB-CZ 3.7Å; A163-I209 HydrophobicContact CB-CD1 4.15Å
164	V	98.3	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.3	172.1	179.1	0	0	0	0	108.8	V131 L147 P151 L152 A153 F162 I166 N172 Y174	V131-V164 HydrophobicContact CG2-CG1 4Å; V131-V164 HydrophobicContact CG2-CG2 4.35Å; L147-V164 HydrophobicContact CD1-CG1 3.46Å; L147-V164 VanDerWaalsContact CD1-CG1 3.46Å; L147-V164 HydrophobicContact CD2-CG1 4.3Å; P151-V164 HydrophobicContact CB-CG1 4.42Å; L152-V164 CarbonylContact O-C 3.59Å; L152-V164 VanDerWaalsContact O-CA 3.31Å; L152-V164 WeakPolarHBondContact O-CA 3.48Å; A153-V164 HydrophobicContact CB-CG2 4.4Å; F162-V164 HydrophobicContact CD2-CG2 3.7Å; F162-V164 HydrophobicContact CE2-CG2 3.66Å; V164-I166 HydrophobicContact CG1-CD1 4.34Å; V164-I166 HydrophobicContact CG1-CG1 3.96Å; V164-N172 HydrophobicContact CB-CB 4.36Å; V164-N172 PolarHBondContact N-O 3.17Å; V164-N172 PolarHBondContact O-N 3.45Å; V164-Y174 HydrophobicContact CB-CD2 4.39Å; V164-Y174 HydrophobicContact CB-CE2 3.93Å; V164-Y174 HydrophobicContact CG2-CD2 3.84Å; V164-Y174 HydrophobicContact CG2-CE2 3.69Å
165	A	97.1	Very high	96.5	Very high	3 Å²	3	28.7 Å²	28.7	3%	0.025	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	133.8	176.3	0	0	0	0	0	110.3	P151 L152 A170 W197 L200	P151-A165 VanDerWaalsContact CA-O 3.28Å; P151-A165 WeakPolarHBondContact CA-O 3.4Å; L152-A165 HydrophobicContact CB-CB 3.99Å; L152-A165 HydrophobicContact CD1-CB 4.48Å; L152-A165 PolarHBondContact N-O 2.83Å; L152-A165 PolarHBondContact O-N 3.05Å; A165-A170 CarbonylContact C-O 3.49Å; A165-A170 WeakPolarHBondContact CA-O 3.16Å; A165-W197 HydrophobicContact CB-CE3 3.42Å; A165-W197 VanDerWaalsContact CB-CE3 3.42Å; A165-W197 HydrophobicContact CB-CZ3 3.62Å; A165-L200 HydrophobicContact CB-CD1 3.6Å
166	I	94.5	Very high	96.5	Very high	12 Å²	12	28.9 Å²	28.9	6%	0.062	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	133.4	-172.8	-52.4	162.1	0	0	0	109.5	L147 P148 S149 V164 S168 E169 A170 N172	L147-I166 HydrophobicContact CD1-CG1 4.46Å; L147-I166 HydrophobicContact CD2-CD1 3.58Å; L147-I166 HydrophobicContact CD2-CG1 4.11Å; P148-I166 HydrophobicContact CG-CG2 3.93Å; S149-I166 WeakPolarHBondContact OG-CG2 3.48Å; V164-I166 HydrophobicContact CG1-CD1 4.34Å; V164-I166 HydrophobicContact CG1-CG1 3.96Å; I166-S168 PolarHBondContact O-N 3.26Å; I166-E169 PolarHBondContact O-N 2.83Å; I166-E169 VanDerWaalsContact O-N 3.15Å; I166-A170 HydrophobicContact CB-CB 4.39Å; I166-A170 PolarHBondContact N-O 2.87Å; I166-A170 PolarHBondContact O-N 2.84Å; I166-N172 VanDerWaalsContact CD1-ND2 3.33Å; I166-N172 WeakPolarHBondContact CD1-ND2 3.37Å
167	N	88.6	Confident	96.3	Very high	73 Å²	73	37.7 Å²	37.7	39%	0.39	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	23.7	171.8	-156.4	43.2	0	0	0	115.7	S149 E169	S149-N167 WeakPolarHBondContact OG-CA 3.29Å; S149-N167 WeakPolarHBondContact OG-CB 3.32Å; S149-N167 PolarHBondContact OG-N 3.45Å; N167-E169 HydrophobicContact CB-CG 4.14Å; N167-E169 PolarHBondContact ND2-OE1 3.04Å; N167-E169 PolarHBondContact O-N 3.44Å; N167-E169 VanDerWaalsContact O-N 3.12Å
168	S	92.4	Very high	96.3	Very high	13 Å²	13	37.3 Å²	37.3	9%	0.091	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	24.8	-176.7	-49.8	0	0	0	0	114.5	I166 D196 W197	I166-S168 PolarHBondContact O-N 3.26Å; S168-D196 WeakPolarHBondContact OG-CA 3.42Å; S168-W197 VanDerWaalsContact CA-CE2 3.5Å; S168-W197 VanDerWaalsContact O-CE2 3.31Å; S168-W197 VanDerWaalsContact O-CZ2 3.27Å; S168-W197 WeakPolarHBondContact O-CZ2 3.42Å; S168-W197 PolarHBondContact O-NE1 3.05Å; S168-W197 PolarHBondContact OG-N 3.32Å
169	E	92.5	Very high	96.2	Very high	63 Å²	63	34.1 Å²	34.1	29%	0.294	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.8	-24.4	-176	75.3	-167.5	161.4	0	0	113.7	I166 N167 L189 Q191	I166-E169 PolarHBondContact O-N 2.83Å; I166-E169 VanDerWaalsContact O-N 3.15Å; N167-E169 HydrophobicContact CB-CG 4.14Å; N167-E169 PolarHBondContact ND2-OE1 3.04Å; N167-E169 PolarHBondContact O-N 3.44Å; N167-E169 VanDerWaalsContact O-N 3.12Å; E169-L189 PolarHBondContact O-N 2.9Å; E169-Q191 HydrophobicContact CB-CB 4.22Å; E169-Q191 HydrophobicContact CB-CG 4.39Å; E169-Q191 PolarHBondContact OE2-NE2 3.43Å
170	A	95.6	Very high	96.2	Very high	11 Å²	11	41.4 Å²	41.4	9%	0.091	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.3	-175.5	0	0	0	0	0	111.8	A165 I166 F187 L188 W197	A165-A170 CarbonylContact C-O 3.49Å; A165-A170 WeakPolarHBondContact CA-O 3.16Å; I166-A170 HydrophobicContact CB-CB 4.39Å; I166-A170 PolarHBondContact N-O 2.87Å; I166-A170 PolarHBondContact O-N 2.84Å; A170-F187 CarbonylContact C-O 3.53Å; A170-F187 WeakPolarHBondContact CA-O 3.42Å; A170-L188 HydrophobicContact CB-CD2 4.01Å; A170-W197 WeakPolarHBondContact O-CZ3 3.45Å
171	L	97.5	Very high	96.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	105.2	178.1	-128.8	160.7	0	0	0	108.6	A163 L173 T186 F187 L189 W197 L200 I209 I211 I221	A163-L171 HydrophobicContact CB-CD2 3.72Å; L171-L173 HydrophobicContact CD2-CD2 4.34Å; L171-T186 WeakPolarHBondContact O-CA 3.32Å; L171-F187 HydrophobicContact CB-CB 4.18Å; L171-F187 HydrophobicContact CB-CD2 4.44Å; L171-F187 PolarHBondContact N-O 3.33Å; L171-F187 PolarHBondContact O-N 3.16Å; L171-L189 HydrophobicContact CB-CD1 4.07Å; L171-L189 HydrophobicContact CD1-CD1 3.84Å; L171-W197 HydrophobicContact CD1-CZ3 4.33Å; L171-W197 HydrophobicContact CG-CZ3 4.27Å; L171-L200 HydrophobicContact CD2-CD1 4.09Å; L171-I209 HydrophobicContact CD1-CD1 4.41Å; L171-I209 HydrophobicContact CD1-CG2 4.1Å; L171-I209 HydrophobicContact CD2-CD1 3.66Å; L171-I209 HydrophobicContact CD2-CG2 4.42Å; L171-I211 HydrophobicContact CD1-CD1 4.2Å; L171-I211 HydrophobicContact CD1-CG1 4.44Å; L171-I221 HydrophobicContact CD1-CD1 3.57Å
172	N	97.8	Very high	96.1	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.091	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132	-179.6	-76.3	1.3	0	0	0	109.9	A163 V164 I166 Y174 P183 S185 T186	A163-N172 CarbonylContact C-O 3.55Å; A163-N172 WeakPolarHBondContact CA-O 3.49Å; V164-N172 HydrophobicContact CB-CB 4.36Å; V164-N172 PolarHBondContact N-O 3.17Å; V164-N172 PolarHBondContact O-N 3.45Å; I166-N172 VanDerWaalsContact CD1-ND2 3.33Å; I166-N172 WeakPolarHBondContact CD1-ND2 3.37Å; N172-Y174 HydrophobicContact CB-CD2 4.27Å; N172-Y174 HydrophobicContact CB-CE2 3.51Å; N172-Y174 PolarHBondContact ND2-OH 3.28Å; N172-P183 HydrophobicContact CB-CB 3.85Å; N172-P183 HydrophobicContact CB-CG 4.39Å; N172-S185 WeakPolarHBondContact CA-O 3.37Å; N172-T186 WeakPolarHBondContact OD1-CG2 3.3Å; N172-T186 PolarHBondContact OD1-OG1 3.14Å; N172-T186 VanDerWaalsContact OD1-OG1 3.11Å
173	L	98.3	Very high	96	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.9	172.9	-57.7	-175.6	0	0	0	110.3	A163 L171 P183 F184 S185 F187 F202 I209 A223	A163-L173 HydrophobicContact CB-CD2 3.64Å; L171-L173 HydrophobicContact CD2-CD2 4.34Å; L173-P183 CarbonylContact O-C 3.52Å; L173-P183 WeakPolarHBondContact O-CA 3.44Å; L173-P183 WeakPolarHBondContact O-CB 3.31Å; L173-F184 HydrophobicContact CB-CD1 4.4Å; L173-F184 HydrophobicContact CB-CE1 3.75Å; L173-F184 HydrophobicContact CB-CE2 3.85Å; L173-F184 HydrophobicContact CB-CZ 3.43Å; L173-F184 VanDerWaalsContact CB-CZ 3.43Å; L173-F184 HydrophobicContact CD1-CE2 4.14Å; L173-F184 HydrophobicContact CD1-CZ 4.08Å; L173-F184 HydrophobicContact CG-CZ 4.41Å; L173-F184 VanDerWaalsContact O-CD1 3.27Å; L173-F184 WeakPolarHBondContact O-CD1 3.29Å; L173-F184 PolarHBondContact O-N 3.28Å; L173-S185 PolarHBondContact N-O 3.43Å; L173-F187 HydrophobicContact CD1-CE2 3.71Å; L173-F187 HydrophobicContact CD1-CZ 4.09Å; L173-F187 HydrophobicContact CG-CE2 4.2Å; L173-F202 HydrophobicContact CD2-CZ 4.21Å; L173-I209 HydrophobicContact CD2-CD1 4Å; L173-A223 WeakPolarHBondContact CD1-O 3.4Å
174	Y	98.2	Very high	96	Very high	12 Å²	12	50.6 Å²	50.6	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.8	-179.6	-67.2	-97	0	0	0	110.3	V145 I161 F162 V164 N172 P183	V145-Y174 HydrophobicContact CG1-CE1 4.4Å; I161-Y174 CarbonylContact C-O 3.49Å; I161-Y174 WeakPolarHBondContact CA-O 3.36Å; I161-Y174 WeakPolarHBondContact CB-O 3.26Å; F162-Y174 HydrophobicContact CD2-CD2 4.18Å; F162-Y174 HydrophobicContact CD2-CG 4.46Å; F162-Y174 VanDerWaalsContact CE1-CB 3.41Å; F162-Y174 HydrophobicContact CE1-CG 4.26Å; F162-Y174 AromaticContact CE2-CD2 3.63Å; F162-Y174 HydrophobicContact CE2-CD2 3.63Å; F162-Y174 HydrophobicContact CE2-CE2 4.43Å; F162-Y174 AromaticContact CE2-CG 3.71Å; F162-Y174 HydrophobicContact CE2-CG 3.71Å; F162-Y174 HydrophobicContact CZ-CD1 4.21Å; F162-Y174 HydrophobicContact CZ-CD2 4.04Å; F162-Y174 AromaticContact CZ-CG 3.6Å; F162-Y174 HydrophobicContact CZ-CG 3.6Å; F162-Y174 PolarHBondContact N-O 2.91Å; F162-Y174 PolarHBondContact O-N 2.87Å; V164-Y174 HydrophobicContact CB-CD2 4.39Å; V164-Y174 HydrophobicContact CB-CE2 3.93Å; V164-Y174 HydrophobicContact CG2-CD2 3.84Å; V164-Y174 HydrophobicContact CG2-CE2 3.69Å; N172-Y174 HydrophobicContact CB-CD2 4.27Å; N172-Y174 HydrophobicContact CB-CE2 3.51Å; N172-Y174 PolarHBondContact ND2-OH 3.28Å; Y174-P183 HydrophobicContact CD1-CB 4.41Å; Y174-P183 HydrophobicContact CD2-CB 4.45Å; Y174-P183 HydrophobicContact CE1-CB 4.06Å; Y174-P183 HydrophobicContact CE1-CG 4.41Å; Y174-P183 VanDerWaalsContact CE1-N 3.33Å; Y174-P183 HydrophobicContact CE2-CB 4.11Å
175	D	97.6	Very high	95.9	Very high	69 Å²	69	52 Å²	52	37%	0.369	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	130.6	164.9	178.8	-56.4	0	0	0	107.6	R177 A178 Y179 F184	D175-R177 VanDerWaalsContact C-N 3.28Å; D175-R177 PolarHBondContact O-N 3.46Å; D175-R177 WeakPolarHBondContact OD1-CA 3.43Å; D175-R177 PolarHBondContact OD1-N 3.37Å; D175-A178 HydrophobicContact CB-CB 4.07Å; D175-A178 CarbonylContact O-C 3.28Å; D175-A178 PolarHBondContact O-N 3.15Å; D175-A178 PolarHBondContact OD1-N 3.03Å; D175-Y179 VanDerWaalsContact O-CA 3.32Å; D175-Y179 WeakPolarHBondContact O-CA 3.26Å; D175-Y179 WeakPolarHBondContact O-CB 3.28Å; D175-Y179 PolarHBondContact O-N 2.77Å; D175-F184 HydrophobicContact CB-CD1 4.29Å
176	L	96.6	Very high	96	Very high	15 Å²	15	55.3 Å²	55.3	8%	0.079	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-44	-177.4	-172.1	79.8	0	0	0	112.4	L121 M133 F155 G159 L160 F162	L121-L176 HydrophobicContact CD1-CD2 4.15Å; M133-L176 HydrophobicContact CE-CD1 3.34Å; M133-L176 HydrophobicContact CE-CG 4.18Å; M133-L176 HydrophobicContact SD-CD1 3.75Å; M133-L176 HydrophobicContact SD-CG 4.4Å; F155-L176 HydrophobicContact CD1-CD1 4.31Å; F155-L176 HydrophobicContact CE1-CD1 3.56Å; G159-L176 WeakPolarHBondContact O-CD2 3.32Å; L160-L176 VanDerWaalsContact O-CB 3.23Å; L160-L176 WeakPolarHBondContact O-CB 3.49Å; L160-L176 PolarHBondContact O-N 2.82Å; F162-L176 HydrophobicContact CD1-CD1 4.11Å
177	R	95.5	Very high	96.1	Very high	199 Å²	199	55.6 Å²	55.6	75%	0.751	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-23.1	-172.9	-63.8	179.2	175.7	172.1	1	112.2	D175	D175-R177 VanDerWaalsContact C-N 3.28Å; D175-R177 PolarHBondContact O-N 3.46Å; D175-R177 WeakPolarHBondContact OD1-CA 3.43Å; D175-R177 PolarHBondContact OD1-N 3.37Å
178	A	96.6	Very high	96.5	Very high	34 Å²	34	58.9 Å²	58.9	28%	0.281	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	22.3	-177.5	0	0	0	0	0	113.8	D175 Q180 N181	D175-A178 HydrophobicContact CB-CB 4.07Å; D175-A178 CarbonylContact O-C 3.28Å; D175-A178 PolarHBondContact O-N 3.15Å; D175-A178 PolarHBondContact OD1-N 3.03Å; A178-Q180 PolarHBondContact O-N 3.33Å; A178-N181 WeakPolarHBondContact O-CB 3.21Å; A178-N181 PolarHBondContact O-N 3.01Å
179	Y	95.9	Very high	96.5	Very high	44 Å²	44	59 Å²	59	17%	0.173	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-54.4	-27.5	-174.3	84.3	-88.8	0	0	0	114.3	A143 V145 D175 N181 G182	A143-Y179 HydrophobicContact CB-CD1 3.89Å; A143-Y179 HydrophobicContact CB-CD2 4.32Å; A143-Y179 HydrophobicContact CB-CE1 3.35Å; A143-Y179 HydrophobicContact CB-CE2 3.85Å; A143-Y179 HydrophobicContact CB-CG 4.35Å; V145-Y179 HydrophobicContact CG2-CD2 4.14Å; D175-Y179 VanDerWaalsContact O-CA 3.32Å; D175-Y179 WeakPolarHBondContact O-CA 3.26Å; D175-Y179 WeakPolarHBondContact O-CB 3.28Å; D175-Y179 PolarHBondContact O-N 2.77Å; Y179-N181 PolarHBondContact O-N 3.11Å; Y179-G182 PolarHBondContact O-N 3.22Å
180	Q	95.2	Very high	96.1	Very high	157 Å²	157	60.8 Å²	60.8	73%	0.734	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-64.8	-21.1	179	-62.1	-172.7	6.8	0	0	113.1	A178 G182	A178-Q180 PolarHBondContact O-N 3.33Å; Q180-G182 PolarHBondContact O-N 3.19Å
181	N	96.5	Very high	95.3	Very high	144 Å²	144	64.9 Å²	64.9	77%	0.77	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-71.7	-4	173.8	-65.1	-19.1	0	0	0	112.6	A178 Y179	A178-N181 WeakPolarHBondContact O-CB 3.21Å; A178-N181 PolarHBondContact O-N 3.01Å; Y179-N181 PolarHBondContact O-N 3.11Å
182	G	96.1	Very high	94.2	Very high	25 Å²	25	67.1 Å²	67.1	26%	0.258	35%	0.348	S	S	.	.			trans	85.8	-175.7	-171.6	0	0	0	0	0	111.8	Y179 Q180 F184	Y179-G182 PolarHBondContact O-N 3.22Å; Q180-G182 PolarHBondContact O-N 3.19Å; G182-F184 PolarHBondContact O-N 3.31Å
183	P	97.2	Very high	93.3	Very high	46 Å²	46	76.7 Å²	76.7	30%	0.299	38%	0.383	S	S	.	.			trans	-68.2	133.1	177.1	29.7	-33.4	0	0	0	110.1	N172 L173 Y174 S185	N172-P183 HydrophobicContact CB-CB 3.85Å; N172-P183 HydrophobicContact CB-CG 4.39Å; L173-P183 CarbonylContact O-C 3.52Å; L173-P183 WeakPolarHBondContact O-CA 3.44Å; L173-P183 WeakPolarHBondContact O-CB 3.31Å; Y174-P183 HydrophobicContact CD1-CB 4.41Å; Y174-P183 HydrophobicContact CD2-CB 4.45Å; Y174-P183 HydrophobicContact CE1-CB 4.06Å; Y174-P183 HydrophobicContact CE1-CG 4.41Å; Y174-P183 VanDerWaalsContact CE1-N 3.33Å; Y174-P183 HydrophobicContact CE2-CB 4.11Å; P183-S185 VanDerWaalsContact C-N 3.27Å
184	F	97.4	Very high	92.6	Very high	120 Å²	120	83.7 Å²	83.7	53%	0.526	42%	0.421	S	S	.	.	S	Bend	trans	-77.8	-18.9	173.6	67.3	-99.7	0	0	0	111.9	I161 L173 D175 G182	I161-F184 HydrophobicContact CB-CE1 4.34Å; I161-F184 HydrophobicContact CD1-CZ 4.44Å; I161-F184 HydrophobicContact CG2-CE1 3.94Å; I161-F184 HydrophobicContact CG2-CZ 4.07Å; L173-F184 HydrophobicContact CB-CD1 4.4Å; L173-F184 HydrophobicContact CB-CE1 3.75Å; L173-F184 HydrophobicContact CB-CE2 3.85Å; L173-F184 HydrophobicContact CB-CZ 3.43Å; L173-F184 VanDerWaalsContact CB-CZ 3.43Å; L173-F184 HydrophobicContact CD1-CE2 4.14Å; L173-F184 HydrophobicContact CD1-CZ 4.08Å; L173-F184 HydrophobicContact CG-CZ 4.41Å; L173-F184 VanDerWaalsContact O-CD1 3.27Å; L173-F184 WeakPolarHBondContact O-CD1 3.29Å; L173-F184 PolarHBondContact O-N 3.28Å; D175-F184 HydrophobicContact CB-CD1 4.29Å; G182-F184 PolarHBondContact O-N 3.31Å
185	S	97.5	Very high	92.2	Very high	31 Å²	31	83.5 Å²	83.5	22%	0.217	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	145.9	172.5	-170.7	0	0	0	0	110.8	N172 L173 P183 F187	N172-S185 WeakPolarHBondContact CA-O 3.37Å; L173-S185 PolarHBondContact N-O 3.43Å; P183-S185 VanDerWaalsContact C-N 3.27Å; S185-F187 WeakPolarHBondContact OG-CE1 3.21Å; S185-F187 WeakPolarHBondContact OG-CZ 3.26Å
186	T	97.6	Very high	92	Very high	71 Å²	71	84.6 Å²	84.6	44%	0.436	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	117.9	174.7	-62.2	0	0	0	0	108.8	L171 N172 L188	L171-T186 WeakPolarHBondContact O-CA 3.32Å; N172-T186 WeakPolarHBondContact OD1-CG2 3.3Å; N172-T186 PolarHBondContact OD1-OG1 3.14Å; N172-T186 VanDerWaalsContact OD1-OG1 3.11Å; T186-L188 HydrophobicContact CG2-CD2 4.44Å
187	F	97.2	Very high	91.9	Very high	19 Å²	19	84.5 Å²	84.5	8%	0.083	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.1	176	-53.4	-45.6	0	0	0	109.7	A170 L171 L173 S185 A223 Y224 T225 G226	A170-F187 CarbonylContact C-O 3.53Å; A170-F187 WeakPolarHBondContact CA-O 3.42Å; L171-F187 HydrophobicContact CB-CB 4.18Å; L171-F187 HydrophobicContact CB-CD2 4.44Å; L171-F187 PolarHBondContact N-O 3.33Å; L171-F187 PolarHBondContact O-N 3.16Å; L173-F187 HydrophobicContact CD1-CE2 3.71Å; L173-F187 HydrophobicContact CD1-CZ 4.09Å; L173-F187 HydrophobicContact CG-CE2 4.2Å; S185-F187 WeakPolarHBondContact OG-CE1 3.21Å; S185-F187 WeakPolarHBondContact OG-CZ 3.26Å; F187-A223 WeakPolarHBondContact CE2-O 3.36Å; F187-Y224 WeakPolarHBondContact CZ-O 3.37Å; F187-T225 VanDerWaalsContact CE1-C 3.43Å; F187-G226 VanDerWaalsContact CD1-CA 3.46Å
188	L	96.2	Very high	91.9	Very high	141 Å²	141	76.1 Å²	76.1	74%	0.738	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	120	173	-63.3	178.6	0	0	0	108.6	A170 T186	A170-L188 HydrophobicContact CB-CD2 4.01Å; T186-L188 HydrophobicContact CG2-CD2 4.44Å
189	L	92.4	Very high	91.9	Very high	17 Å²	17	75.2 Å²	75.2	9%	0.089	39%	0.39	C	S	.	.			trans	-105.1	151.5	-177.8	-70.1	138.1	0	0	0	109.7	E169 L171 Q191 W197 I221 L228	E169-L189 PolarHBondContact O-N 2.9Å; L171-L189 HydrophobicContact CB-CD1 4.07Å; L171-L189 HydrophobicContact CD1-CD1 3.84Å; L189-Q191 PolarHBondContact O-N 3.34Å; L189-Q191 VanDerWaalsContact O-N 3.09Å; L189-W197 HydrophobicContact CB-CH2 4.41Å; L189-W197 HydrophobicContact CB-CZ2 4.22Å; L189-W197 HydrophobicContact CD1-CH2 3.45Å; L189-W197 VanDerWaalsContact CD1-CH2 3.45Å; L189-W197 HydrophobicContact CD1-CZ2 3.9Å; L189-W197 HydrophobicContact CD1-CZ3 4.47Å; L189-I221 HydrophobicContact CD1-CD1 3.54Å; L189-I221 HydrophobicContact CD1-CG1 4.45Å; L189-I221 HydrophobicContact CD2-CD1 3.69Å; L189-I221 HydrophobicContact CD2-CG1 3.74Å; L189-I221 HydrophobicContact CD2-CG2 4.24Å; L189-I221 HydrophobicContact CG-CD1 4.26Å; L189-L228 HydrophobicContact CD2-CB 4.04Å
190	P	85.8	Confident	91.9	Very high	100 Å²	100	73.3 Å²	73.3	65%	0.649	38%	0.383	S	S	*	.			trans	-55.7	119.4	174.6	-23.4	33.5	0	0	0	110.4	D192	P190-D192 PolarHBondContact O-N 3.24Å
191	Q	78.5	Confident	92	Very high	96 Å²	96	68 Å²	68	45%	0.449	36%	0.358	S	S	.	.			trans	-68.3	122.5	179.1	-173.2	178.2	48.6	0	0	109.8	E169 L189	E169-Q191 HydrophobicContact CB-CB 4.22Å; E169-Q191 HydrophobicContact CB-CG 4.39Å; E169-Q191 PolarHBondContact OE2-NE2 3.43Å; L189-Q191 PolarHBondContact O-N 3.34Å; L189-Q191 VanDerWaalsContact O-N 3.09Å
192	D	74.7	Confident	92.1	Very high	47 Å²	47	62.1 Å²	62.1	25%	0.251	33%	0.325	S	S	.	.			trans	-91	107.7	169.5	-167.7	-19.7	0	0	0	108.1	P190 D194 C195 R219	P190-D192 PolarHBondContact O-N 3.24Å; D192-D194 PolarHBondContact O-N 2.56Å; D192-D194 PolarHBondContact OD1-N 3.19Å; D192-C195 VanDerWaalsContact CG-SG 3.57Å; D192-C195 PolarHBondContact O-N 3.29Å; D192-C195 PolarHBondContact OD2-SG 2.84Å; D192-R219 IonicContact OD2-CZ 3.28Å; D192-R219 IonicContact OD2-NH2 3.24Å; D192-R219 PolarHBondContact OD2-NH2 3.06Å
193	R	78.7	Confident	92.2	Very high	218 Å²	218	61 Å²	61	82%	0.823	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-17.2	-173	-67.8	-173.7	178.7	-174.2	1.2	113.2
194	D	83.1	Confident	92	Very high	153 Å²	153	61.9 Å²	61.9	82%	0.818	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	7.2	-172.3	-59.4	-38.6	0	0	0	112.5	D192	D192-D194 PolarHBondContact O-N 2.56Å; D192-D194 PolarHBondContact OD1-N 3.19Å
195	C	89.6	Confident	92	Very high	8 Å²	8	60.1 Å²	60.1	5%	0.054	32%	0.315	C	S	.	.			trans	-145.1	148.1	173.9	83.6	0	0	0	0	114.6	D192 N214	D192-C195 VanDerWaalsContact CG-SG 3.57Å; D192-C195 PolarHBondContact O-N 3.29Å; D192-C195 PolarHBondContact OD2-SG 2.84Å; C195-N214 WeakPolarHBondContact CA-OD1 3.26Å
196	D	93.4	Very high	92	Very high	92 Å²	92	59.1 Å²	59.1	49%	0.492	31%	0.31	S	S	.	.			trans	-100.5	143.6	170.7	-65.6	-55.9	0	0	0	111	S168 T213 N214	S168-D196 WeakPolarHBondContact OG-CA 3.42Å; D196-T213 CarbonylContact O-C 3.6Å; D196-T213 WeakPolarHBondContact O-CA 3.28Å; D196-T213 WeakPolarHBondContact O-CB 3.43Å; D196-N214 PolarHBondContact N-OD1 3.14Å; D196-N214 PolarHBondContact O-N 2.92Å; D196-N214 PolarHBondContact O-OD1 3.08Å; D196-N214 PolarHBondContact OD2-ND2 3.23Å
197	W	95.6	Very high	92	Very high	13 Å²	13	58.6 Å²	58.6	5%	0.049	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.6	166.6	-61	3.1	0	0	0	109.3	R150 L152 A165 S168 A170 L171 L189 I211 S212	R150-W197 PolarHBondContact NH1-O 2.87Å; L152-W197 HydrophobicContact CD1-CB 3.86Å; A165-W197 HydrophobicContact CB-CE3 3.42Å; A165-W197 VanDerWaalsContact CB-CE3 3.42Å; A165-W197 HydrophobicContact CB-CZ3 3.62Å; S168-W197 VanDerWaalsContact CA-CE2 3.5Å; S168-W197 VanDerWaalsContact O-CE2 3.31Å; S168-W197 VanDerWaalsContact O-CZ2 3.27Å; S168-W197 WeakPolarHBondContact O-CZ2 3.42Å; S168-W197 PolarHBondContact O-NE1 3.05Å; S168-W197 PolarHBondContact OG-N 3.32Å; A170-W197 WeakPolarHBondContact O-CZ3 3.45Å; L171-W197 HydrophobicContact CD1-CZ3 4.33Å; L171-W197 HydrophobicContact CG-CZ3 4.27Å; L189-W197 HydrophobicContact CB-CH2 4.41Å; L189-W197 HydrophobicContact CB-CZ2 4.22Å; L189-W197 HydrophobicContact CD1-CH2 3.45Å; L189-W197 VanDerWaalsContact CD1-CH2 3.45Å; L189-W197 HydrophobicContact CD1-CZ2 3.9Å; L189-W197 HydrophobicContact CD1-CZ3 4.47Å; W197-I211 HydrophobicContact CB-CG2 3.72Å; W197-I211 HydrophobicContact CD2-CG1 4.48Å; W197-I211 HydrophobicContact CD2-CG2 3.51Å; W197-I211 HydrophobicContact CE3-CD1 4.06Å; W197-I211 HydrophobicContact CE3-CG1 4.38Å; W197-I211 HydrophobicContact CE3-CG2 4.08Å; W197-I211 HydrophobicContact CG-CG2 3.31Å; W197-I211 HydrophobicContact CZ3-CD1 4.42Å; W197-S212 CarbonylContact C-O 3.56Å
198	T	95.3	Very high	92	Very high	23 Å²	23	59.3 Å²	59.3	14%	0.141	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	-19	-173.2	56.7	0	0	0	0	113.9	L152 S212 T213 N214 P242	L152-T198 WeakPolarHBondContact CD2-O 3.48Å; T198-S212 PolarHBondContact N-O 3.01Å; T198-S212 PolarHBondContact OG1-O 3.05Å; T198-T213 PolarHBondContact OG1-N 2.8Å; T198-N214 HydrophobicContact CG2-CB 3.95Å; T198-P242 HydrophobicContact CG2-CB 3.75Å; T198-P242 HydrophobicContact CG2-CG 3.89Å
199	G	95.6	Very high	92.1	Very high	14 Å²	14	52.6 Å²	52.6	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	153.2	174.2	0	0	0	0	0	111.3	I211 S212	G199-I211 WeakPolarHBondContact O-CA 3.47Å; G199-S212 PolarHBondContact N-O 2.99Å; G199-S212 PolarHBondContact O-N 3.17Å
200	L	97.3	Very high	92.4	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	133.7	178.3	-179.2	152	0	0	0	108.3	L152 A163 A165 L171 I209 L210 I211	L152-L200 HydrophobicContact CB-CB 4.19Å; A163-L200 HydrophobicContact CB-CD1 3.99Å; A163-L200 HydrophobicContact CB-CD2 3.9Å; A165-L200 HydrophobicContact CB-CD1 3.6Å; L171-L200 HydrophobicContact CD2-CD1 4.09Å; L200-I209 HydrophobicContact CD1-CG2 4.2Å; L200-I209 HydrophobicContact CD2-CG2 4.33Å; L200-I209 HydrophobicContact CG-CG2 3.91Å; L200-L210 WeakPolarHBondContact CA-O 3.36Å; L200-I211 HydrophobicContact CB-CD1 4.03Å; L200-I211 HydrophobicContact CD1-CD1 3.8Å; L200-I211 HydrophobicContact CG-CD1 3.85Å
201	K	97	Very high	93	Very high	45 Å²	45	47 Å²	47	20%	0.196	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	145.6	173.6	-67.8	178.8	-177	160.1	0	110.8	I209 L210 A245 S246	K201-I209 CarbonylContact O-C 3.57Å; K201-I209 WeakPolarHBondContact O-CA 3.4Å; K201-L210 PolarHBondContact N-O 3.45Å; K201-L210 PolarHBondContact O-N 3.16Å; K201-A245 PolarHBondContact NZ-O 2.82Å; K201-S246 PolarHBondContact NZ-OG 2.82Å; K201-S246 VanDerWaalsContact NZ-OG 3.09Å
202	F	97.9	Very high	93.8	Very high	20 Å²	20	42.7 Å²	42.7	9%	0.088	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	155.1	164.5	-77.1	-99.8	0	0	0	111.1	F155 D156 I161 A163 L173 F208 I209 A223	F155-F202 VanDerWaalsContact C-CD2 3.5Å; F155-F202 WeakPolarHBondContact O-CD2 3.3Å; D156-F202 HydrophobicContact CB-CD1 4.13Å; D156-F202 HydrophobicContact CB-CD2 4.36Å; D156-F202 HydrophobicContact CB-CE1 4.12Å; D156-F202 HydrophobicContact CB-CE2 4.34Å; D156-F202 HydrophobicContact CB-CG 4.23Å; D156-F202 HydrophobicContact CB-CZ 4.21Å; I161-F202 HydrophobicContact CD1-CE1 4.2Å; I161-F202 HydrophobicContact CD1-CZ 4.12Å; I161-F202 HydrophobicContact CG1-CZ 4.48Å; A163-F202 HydrophobicContact CB-CE2 3.52Å; A163-F202 HydrophobicContact CB-CZ 3.7Å; L173-F202 HydrophobicContact CD2-CZ 4.21Å; F202-F208 CarbonylContact C-O 3.54Å; F202-F208 WeakPolarHBondContact CA-O 3.21Å; F202-I209 HydrophobicContact CD1-CD1 4.49Å; F202-I209 HydrophobicContact CD1-CG1 3.83Å; F202-I209 HydrophobicContact CE1-CD1 3.79Å; F202-I209 HydrophobicContact CE1-CG1 3.62Å; F202-I209 HydrophobicContact CE2-CD1 4.45Å; F202-I209 HydrophobicContact CE2-CG1 4.43Å; F202-I209 HydrophobicContact CG-CG1 4.33Å; F202-I209 HydrophobicContact CZ-CD1 3.78Å; F202-I209 HydrophobicContact CZ-CG1 3.96Å; F202-A223 HydrophobicContact CD1-CB 4.43Å; F202-A223 HydrophobicContact CE1-CB 4.14Å
203	S	97.3	Very high	94.8	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.021	21%	0.206	C	C	.	.			trans	-68.3	154.8	164.5	56.4	0	0	0	0	110.6	D205 G206 N207 F208 F247	S203-D205 VanDerWaalsContact CB-OD1 3.23Å; S203-D205 WeakPolarHBondContact CB-OD1 3.34Å; S203-D205 PolarHBondContact O-N 2.85Å; S203-D205 VanDerWaalsContact O-N 3.11Å; S203-D205 PolarHBondContact OG-OD1 2.56Å; S203-G206 PolarHBondContact O-N 2.85Å; S203-N207 PolarHBondContact OG-N 3.49Å; S203-F208 PolarHBondContact N-O 2.96Å; S203-F208 PolarHBondContact OG-N 3.11Å; S203-F208 PolarHBondContact OG-O 3.02Å; S203-F247 VanDerWaalsContact CA-CE2 3.44Å
204	P	94.8	Very high	95.6	Very high	63 Å²	63	31.5 Å²	31.5	41%	0.409	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.8	179.9	-26.6	35.2	0	0	0	114.4	F247	P204-F247 HydrophobicContact CG-CB 4.29Å
205	D	96.5	Very high	96.1	Very high	83 Å²	83	24.8 Å²	24.8	44%	0.444	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-0.3	176.8	67	-6.4	0	0	0	113.8	S203 N207	S203-D205 VanDerWaalsContact CB-OD1 3.23Å; S203-D205 WeakPolarHBondContact CB-OD1 3.34Å; S203-D205 PolarHBondContact O-N 2.85Å; S203-D205 VanDerWaalsContact O-N 3.11Å; S203-D205 PolarHBondContact OG-OD1 2.56Å; D205-N207 PolarHBondContact O-N 3.46Å; D205-N207 PolarHBondContact OD1-N 3.47Å; D205-N207 VanDerWaalsContact OD1-N 3.16Å; D205-N207 PolarHBondContact OD2-ND2 3.33Å
206	G	97.3	Very high	96.2	Very high	11 Å²	11	29.6 Å²	29.6	11%	0.113	16%	0.163	C	C	.	.	S	Bend	trans	74.3	-3.1	178.3	0	0	0	0	0	115.4	S203 F208 A223	S203-G206 PolarHBondContact O-N 2.85Å; G206-F208 VanDerWaalsContact C-N 3.34Å; G206-F208 PolarHBondContact O-N 3.22Å; G206-A223 VanDerWaalsContact O-CB 3.26Å; G206-A223 WeakPolarHBondContact O-CB 3.27Å
207	N	97.9	Very high	96.3	Very high	59 Å²	59	25.5 Å²	25.5	32%	0.316	14%	0.142	S	C	.	.	S	Bend	trans	-75.4	-21.5	-173.6	-69.1	-42.4	0	0	0	113.9	S203 D205 A223 Y224	S203-N207 PolarHBondContact OG-N 3.49Å; D205-N207 PolarHBondContact O-N 3.46Å; D205-N207 PolarHBondContact OD1-N 3.47Å; D205-N207 VanDerWaalsContact OD1-N 3.16Å; D205-N207 PolarHBondContact OD2-ND2 3.33Å; N207-A223 WeakPolarHBondContact O-CB 3.37Å; N207-A223 PolarHBondContact O-N 2.85Å; N207-Y224 WeakPolarHBondContact OD1-CE2 3.42Å
208	F	98.3	Very high	96.3	Very high	34 Å²	34	25 Å²	25	15%	0.149	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.4	-173.9	-54.1	-79.2	0	0	0	112.5	F202 S203 G206 M220 I221 I229 F247 Q268	F202-F208 CarbonylContact C-O 3.54Å; F202-F208 WeakPolarHBondContact CA-O 3.21Å; S203-F208 PolarHBondContact N-O 2.96Å; S203-F208 PolarHBondContact OG-N 3.11Å; S203-F208 PolarHBondContact OG-O 3.02Å; G206-F208 VanDerWaalsContact C-N 3.34Å; G206-F208 PolarHBondContact O-N 3.22Å; F208-M220 HydrophobicContact CB-CG 3.97Å; F208-M220 HydrophobicContact CB-SD 4.26Å; F208-M220 HydrophobicContact CD1-CE 3.9Å; F208-M220 HydrophobicContact CD1-CG 4.17Å; F208-M220 HydrophobicContact CD1-SD 4.09Å; F208-M220 HydrophobicContact CE1-CE 4.01Å; F208-M220 HydrophobicContact CG-CE 4.42Å; F208-M220 HydrophobicContact CG-CG 4.23Å; F208-M220 HydrophobicContact CG-SD 4.05Å; F208-I221 CarbonylContact C-O 3.52Å; F208-I221 WeakPolarHBondContact CA-O 3.31Å; F208-I229 HydrophobicContact CD1-CG1 4.45Å; F208-I229 HydrophobicContact CE1-CG1 4.27Å; F208-F247 HydrophobicContact CB-CZ 4.29Å; F208-Q268 VanDerWaalsContact CD2-NE2 3.26Å
209	I	98.2	Very high	96.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.5	168.7	-59.3	173.4	0	0	0	107.9	A163 L171 L173 L200 K201 F202 I211 I221 A223	A163-I209 HydrophobicContact CB-CD1 4.15Å; L171-I209 HydrophobicContact CD1-CD1 4.41Å; L171-I209 HydrophobicContact CD1-CG2 4.1Å; L171-I209 HydrophobicContact CD2-CD1 3.66Å; L171-I209 HydrophobicContact CD2-CG2 4.42Å; L173-I209 HydrophobicContact CD2-CD1 4Å; L200-I209 HydrophobicContact CD1-CG2 4.2Å; L200-I209 HydrophobicContact CD2-CG2 4.33Å; L200-I209 HydrophobicContact CG-CG2 3.91Å; K201-I209 CarbonylContact O-C 3.57Å; K201-I209 WeakPolarHBondContact O-CA 3.4Å; F202-I209 HydrophobicContact CD1-CD1 4.49Å; F202-I209 HydrophobicContact CD1-CG1 3.83Å; F202-I209 HydrophobicContact CE1-CD1 3.79Å; F202-I209 HydrophobicContact CE1-CG1 3.62Å; F202-I209 HydrophobicContact CE2-CD1 4.45Å; F202-I209 HydrophobicContact CE2-CG1 4.43Å; F202-I209 HydrophobicContact CG-CG1 4.33Å; F202-I209 HydrophobicContact CZ-CD1 3.78Å; F202-I209 HydrophobicContact CZ-CG1 3.96Å; I209-I211 HydrophobicContact CG2-CD1 4Å; I209-I221 PolarHBondContact N-O 2.76Å; I209-I221 PolarHBondContact O-N 3.34Å; I209-A223 HydrophobicContact CD1-CB 4.33Å; I209-A223 HydrophobicContact CG1-CB 4Å
210	L	98.1	Very high	96.4	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.4	176.6	-170.3	71.1	0	0	0	110	L200 K201 V218 R219 M220 A245 F247 I254	L200-L210 WeakPolarHBondContact CA-O 3.36Å; K201-L210 PolarHBondContact N-O 3.45Å; K201-L210 PolarHBondContact O-N 3.16Å; L210-V218 HydrophobicContact CD1-CG1 3.51Å; L210-V218 HydrophobicContact CG-CG1 3.99Å; L210-R219 WeakPolarHBondContact CA-O 3.27Å; L210-M220 HydrophobicContact CD1-CB 4.39Å; L210-A245 HydrophobicContact CD2-CB 3.74Å; L210-A245 HydrophobicContact CG-CB 4.29Å; L210-F247 HydrophobicContact CB-CD2 4.4Å; L210-F247 HydrophobicContact CB-CE2 3.48Å; L210-F247 VanDerWaalsContact CB-CE2 3.48Å; L210-F247 HydrophobicContact CB-CZ 3.81Å; L210-F247 HydrophobicContact CD1-CZ 4.32Å; L210-F247 HydrophobicContact CD2-CD2 4.2Å; L210-F247 HydrophobicContact CD2-CE2 4Å; L210-F247 HydrophobicContact CD2-CZ 4.37Å; L210-F247 HydrophobicContact CG-CE2 4.26Å; L210-F247 HydrophobicContact CG-CZ 4.42Å; L210-I254 HydrophobicContact CD1-CD1 3.95Å; L210-I254 HydrophobicContact CD1-CG1 4.22Å; L210-I254 HydrophobicContact CD1-CG2 3.86Å; L210-I254 HydrophobicContact CD2-CG2 4.03Å
211	I	97.2	Very high	96.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.1	177.3	-58.3	-61.2	0	0	0	109.3	L171 W197 G199 L200 I209 T213 V218 R219 I221	L171-I211 HydrophobicContact CD1-CD1 4.2Å; L171-I211 HydrophobicContact CD1-CG1 4.44Å; W197-I211 HydrophobicContact CB-CG2 3.72Å; W197-I211 HydrophobicContact CD2-CG1 4.48Å; W197-I211 HydrophobicContact CD2-CG2 3.51Å; W197-I211 HydrophobicContact CE3-CD1 4.06Å; W197-I211 HydrophobicContact CE3-CG1 4.38Å; W197-I211 HydrophobicContact CE3-CG2 4.08Å; W197-I211 HydrophobicContact CG-CG2 3.31Å; W197-I211 HydrophobicContact CZ3-CD1 4.42Å; G199-I211 WeakPolarHBondContact O-CA 3.47Å; L200-I211 HydrophobicContact CB-CD1 4.03Å; L200-I211 HydrophobicContact CD1-CD1 3.8Å; L200-I211 HydrophobicContact CG-CD1 3.85Å; I209-I211 HydrophobicContact CG2-CD1 4Å; I211-T213 HydrophobicContact CG2-CG2 4.25Å; I211-V218 WeakPolarHBondContact O-CG1 3.49Å; I211-R219 HydrophobicContact CB-CB 4.17Å; I211-R219 PolarHBondContact N-O 2.9Å; I211-R219 PolarHBondContact O-N 2.77Å; I211-I221 HydrophobicContact CG1-CD1 3.76Å
212	S	96.4	Very high	96.5	Very high	5 Å²	5	24.7 Å²	24.7	4%	0.035	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	144	170	-53.9	0	0	0	0	109.4	W197 T198 G199 L243 A245	W197-S212 CarbonylContact C-O 3.56Å; T198-S212 PolarHBondContact N-O 3.01Å; T198-S212 PolarHBondContact OG1-O 3.05Å; G199-S212 PolarHBondContact N-O 2.99Å; G199-S212 PolarHBondContact O-N 3.17Å; S212-L243 WeakPolarHBondContact CB-O 3.33Å; S212-A245 PolarHBondContact OG-N 2.99Å
213	T	95.6	Very high	96.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	161.7	-177.3	76.9	0	0	0	0	111.6	D196 T198 I211 G215 A217 R235	D196-T213 CarbonylContact O-C 3.6Å; D196-T213 WeakPolarHBondContact O-CA 3.28Å; D196-T213 WeakPolarHBondContact O-CB 3.43Å; T198-T213 PolarHBondContact OG1-N 2.8Å; I211-T213 HydrophobicContact CG2-CG2 4.25Å; T213-G215 VanDerWaalsContact C-N 3.25Å; T213-G215 PolarHBondContact OG1-N 2.91Å; T213-G215 VanDerWaalsContact OG1-N 3.11Å; T213-A217 VanDerWaalsContact CG2-O 3.29Å; T213-A217 WeakPolarHBondContact CG2-O 3.2Å; T213-A217 PolarHBondContact OG1-O 2.92Å; T213-R235 PolarHBondContact OG1-NH2 2.74Å; T213-R235 VanDerWaalsContact OG1-NH2 3.12Å
214	N	94.8	Very high	96.5	Very high	29 Å²	29	31.6 Å²	31.6	16%	0.155	16%	0.161	C	C	.	.	S	Bend	trans	-82.4	-2.2	165.2	69.2	-2.1	0	0	0	113.3	C195 D196 T198 N237 G240 I241	C195-N214 WeakPolarHBondContact CA-OD1 3.26Å; D196-N214 PolarHBondContact N-OD1 3.14Å; D196-N214 PolarHBondContact O-N 2.92Å; D196-N214 PolarHBondContact O-OD1 3.08Å; D196-N214 PolarHBondContact OD2-ND2 3.23Å; T198-N214 HydrophobicContact CG2-CB 3.95Å; N214-N237 VanDerWaalsContact C-ND2 3.28Å; N214-N237 PolarHBondContact O-ND2 3.2Å; N214-G240 CarbonylContact O-C 3.56Å; N214-G240 VanDerWaalsContact O-C 3.28Å; N214-G240 WeakPolarHBondContact O-CA 3.23Å; N214-I241 VanDerWaalsContact CA-O 3.26Å; N214-I241 WeakPolarHBondContact CA-O 2.98Å
215	G	93.9	Very high	96.7	Very high	13 Å²	13	32.6 Å²	32.6	13%	0.134	17%	0.166	C	C	.	.	S	Bend	trans	-86.7	-160.6	172.3	0	0	0	0	0	111.5	T213 R235 N237	T213-G215 VanDerWaalsContact C-N 3.25Å; T213-G215 PolarHBondContact OG1-N 2.91Å; T213-G215 VanDerWaalsContact OG1-N 3.11Å; G215-R235 PolarHBondContact O-NH1 3.4Å; G215-R235 PolarHBondContact O-NH2 3.38Å; G215-N237 WeakPolarHBondContact O-CB 3.48Å; G215-N237 PolarHBondContact O-ND2 2.88Å
216	Q	92.3	Very high	96.6	Very high	108 Å²	108	29.1 Å²	29.1	51%	0.505	15%	0.15	S	C	.	.	S	Bend	trans	-86	-25.5	175.8	-68.1	-176.7	-13.3	0	0	113.3	R235	Q216-R235 VanDerWaalsContact O-CG 3.31Å; Q216-R235 WeakPolarHBondContact O-CG 3.33Å; Q216-R235 PolarHBondContact O-NE 2.84Å; Q216-R235 PolarHBondContact O-NH2 3.46Å
217	A	94.4	Very high	96.6	Very high	7 Å²	7	34.2 Å²	34.2	6%	0.058	17%	0.17	C	C	.	.			trans	-82.3	137.3	-175	0	0	0	0	0	112.5	T213 L232 T233 R235	T213-A217 VanDerWaalsContact CG2-O 3.29Å; T213-A217 WeakPolarHBondContact CG2-O 3.2Å; T213-A217 PolarHBondContact OG1-O 2.92Å; A217-L232 CarbonylContact C-O 3.41Å; A217-L232 WeakPolarHBondContact CA-O 3.47Å; A217-T233 HydrophobicContact CB-CG2 4.05Å; A217-R235 PolarHBondContact O-NH2 3.33Å
218	V	96.4	Very high	96.6	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.5	154.4	-171.6	0	0	0	0	107.1	L210 I211 S231 L232 A245	L210-V218 HydrophobicContact CD1-CG1 3.51Å; L210-V218 HydrophobicContact CG-CG1 3.99Å; I211-V218 WeakPolarHBondContact O-CG1 3.49Å; V218-S231 WeakPolarHBondContact O-CA 3.43Å; V218-L232 HydrophobicContact CB-CB 4.24Å; V218-L232 HydrophobicContact CB-CD1 4.41Å; V218-L232 PolarHBondContact N-O 2.82Å; V218-L232 PolarHBondContact O-N 2.55Å; V218-A245 HydrophobicContact CG1-CB 3.55Å; V218-A245 HydrophobicContact CG2-CB 4.09Å
219	R	96.4	Very high	96.5	Very high	47 Å²	47	34.7 Å²	34.7	18%	0.177	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	131.8	-178.1	-50.8	-76.4	-176.8	172.8	-0	109.5	D192 L210 I211 L228 Y230 S231	D192-R219 IonicContact OD2-CZ 3.28Å; D192-R219 IonicContact OD2-NH2 3.24Å; D192-R219 PolarHBondContact OD2-NH2 3.06Å; L210-R219 WeakPolarHBondContact CA-O 3.27Å; I211-R219 HydrophobicContact CB-CB 4.17Å; I211-R219 PolarHBondContact N-O 2.9Å; I211-R219 PolarHBondContact O-N 2.77Å; R219-L228 HydrophobicContact CB-CD1 3.81Å; R219-L228 HydrophobicContact CG-CD1 4.34Å; R219-Y230 WeakPolarHBondContact CA-O 3.37Å; R219-S231 WeakPolarHBondContact CD-OG 3.38Å; R219-S231 VanDerWaalsContact NH1-CB 3.34Å; R219-S231 PolarHBondContact NH1-OG 3.03Å
220	M	97.6	Very high	96.4	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.9	169.9	-172.4	-177.5	79.1	0	0	109.1	F208 L210 I229 Y230 F247 I254 Q268	F208-M220 HydrophobicContact CB-CG 3.97Å; F208-M220 HydrophobicContact CB-SD 4.26Å; F208-M220 HydrophobicContact CD1-CE 3.9Å; F208-M220 HydrophobicContact CD1-CG 4.17Å; F208-M220 HydrophobicContact CD1-SD 4.09Å; F208-M220 HydrophobicContact CE1-CE 4.01Å; F208-M220 HydrophobicContact CG-CE 4.42Å; F208-M220 HydrophobicContact CG-CG 4.23Å; F208-M220 HydrophobicContact CG-SD 4.05Å; L210-M220 HydrophobicContact CD1-CB 4.39Å; M220-I229 HydrophobicContact CE-CB 3.73Å; M220-I229 HydrophobicContact CE-CG1 4.35Å; M220-I229 HydrophobicContact CE-CG2 3.5Å; M220-I229 VanDerWaalsContact CE-CG2 3.5Å; M220-I229 PolarHBondContact O-N 3.05Å; M220-Y230 HydrophobicContact CE-CD2 3.34Å; M220-Y230 HydrophobicContact CE-CE2 3.59Å; M220-Y230 HydrophobicContact CE-CG 4.39Å; M220-Y230 PolarHBondContact N-O 3.35Å; M220-Y230 PolarHBondContact O-N 2.97Å; M220-Y230 HydrophobicContact SD-CD2 4.43Å; M220-F247 HydrophobicContact SD-CE1 4.43Å; M220-I254 HydrophobicContact CB-CD1 4.28Å; M220-I254 HydrophobicContact CG-CD1 4.32Å; M220-I254 HydrophobicContact SD-CD1 3.66Å; M220-Q268 HydrophobicContact SD-CG 3.87Å; M220-Q268 PolarHBondContact SD-NE2 3.38Å
221	I	97.8	Very high	96.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140.2	-171.5	-61	157.5	0	0	0	108.2	L171 L189 F208 I209 I211 A223 E227 L228	L171-I221 HydrophobicContact CD1-CD1 3.57Å; L189-I221 HydrophobicContact CD1-CD1 3.54Å; L189-I221 HydrophobicContact CD1-CG1 4.45Å; L189-I221 HydrophobicContact CD2-CD1 3.69Å; L189-I221 HydrophobicContact CD2-CG1 3.74Å; L189-I221 HydrophobicContact CD2-CG2 4.24Å; L189-I221 HydrophobicContact CG-CD1 4.26Å; F208-I221 CarbonylContact C-O 3.52Å; F208-I221 WeakPolarHBondContact CA-O 3.31Å; I209-I221 PolarHBondContact N-O 2.76Å; I209-I221 PolarHBondContact O-N 3.34Å; I211-I221 HydrophobicContact CG1-CD1 3.76Å; I221-A223 PolarHBondContact O-N 2.99Å; I221-E227 CarbonylContact C-O 3.53Å; I221-E227 VanDerWaalsContact CA-O 3.32Å; I221-E227 WeakPolarHBondContact CA-O 3.43Å; I221-L228 HydrophobicContact CG1-CD1 4.1Å
222	N	97.9	Very high	96.3	Very high	33 Å²	33	40 Å²	40	18%	0.176	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	122.6	170.9	-176.5	-52.2	0	0	0	109.8	Y224 T225 G226 E227 I229	N222-Y224 PolarHBondContact O-N 3.47Å; N222-Y224 WeakPolarHBondContact OD1-CA 3.07Å; N222-Y224 WeakPolarHBondContact OD1-CB 3.45Å; N222-Y224 PolarHBondContact OD1-N 2.78Å; N222-T225 VanDerWaalsContact CB-OG1 3.29Å; N222-T225 WeakPolarHBondContact CB-OG1 3.23Å; N222-T225 PolarHBondContact OD1-N 2.76Å; N222-T225 PolarHBondContact OD1-OG1 3.2Å; N222-G226 WeakPolarHBondContact O-CA 3.16Å; N222-G226 PolarHBondContact O-N 2.87Å; N222-E227 HydrophobicContact CB-CB 4.28Å; N222-E227 PolarHBondContact N-O 3.17Å; N222-I229 HydrophobicContact CB-CD1 4.12Å; N222-I229 HydrophobicContact CB-CG1 4.14Å
223	A	97.9	Very high	96.3	Very high	7 Å²	7	43.6 Å²	43.6	6%	0.058	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-21.5	-174.6	0	0	0	0	0	113.6	L173 F187 F202 G206 N207 I209 I221	L173-A223 WeakPolarHBondContact CD1-O 3.4Å; F187-A223 WeakPolarHBondContact CE2-O 3.36Å; F202-A223 HydrophobicContact CD1-CB 4.43Å; F202-A223 HydrophobicContact CE1-CB 4.14Å; G206-A223 VanDerWaalsContact O-CB 3.26Å; G206-A223 WeakPolarHBondContact O-CB 3.27Å; N207-A223 WeakPolarHBondContact O-CB 3.37Å; N207-A223 PolarHBondContact O-N 2.85Å; I209-A223 HydrophobicContact CD1-CB 4.33Å; I209-A223 HydrophobicContact CG1-CB 4Å; I221-A223 PolarHBondContact O-N 2.99Å
224	Y	97.6	Very high	96.3	Very high	162 Å²	162	47.2 Å²	47.2	64%	0.635	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-36.5	-178.5	-59.4	-79.9	0	0	0	113.2	F187 N207 N222	F187-Y224 WeakPolarHBondContact CZ-O 3.37Å; N207-Y224 WeakPolarHBondContact OD1-CE2 3.42Å; N222-Y224 PolarHBondContact O-N 3.47Å; N222-Y224 WeakPolarHBondContact OD1-CA 3.07Å; N222-Y224 WeakPolarHBondContact OD1-CB 3.45Å; N222-Y224 PolarHBondContact OD1-N 2.78Å
225	T	97.3	Very high	96.3	Very high	83 Å²	83	45.9 Å²	45.9	51%	0.509	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-19.3	-174.2	67.5	0	0	0	0	113.5	F187 N222 E227	F187-T225 VanDerWaalsContact CE1-C 3.43Å; N222-T225 VanDerWaalsContact CB-OG1 3.29Å; N222-T225 WeakPolarHBondContact CB-OG1 3.23Å; N222-T225 PolarHBondContact OD1-N 2.76Å; N222-T225 PolarHBondContact OD1-OG1 3.2Å; T225-E227 PolarHBondContact O-N 2.82Å; T225-E227 VanDerWaalsContact OG1-CB 3.32Å; T225-E227 WeakPolarHBondContact OG1-CB 3.36Å; T225-E227 PolarHBondContact OG1-N 3.39Å
226	G	96.3	Very high	96.3	Very high	10 Å²	10	48 Å²	48	10%	0.103	25%	0.246	C	C	.	.			trans	75	5.2	-172.7	0	0	0	0	0	114.5	F187 N222 L228	F187-G226 VanDerWaalsContact CD1-CA 3.46Å; N222-G226 WeakPolarHBondContact O-CA 3.16Å; N222-G226 PolarHBondContact O-N 2.87Å; G226-L228 PolarHBondContact O-N 2.81Å
227	E	96.8	Very high	96.3	Very high	118 Å²	118	43.2 Å²	43.2	55%	0.551	22%	0.223	S	C	*	.			trans	-66.2	128.9	178.6	-174.9	179.6	-176.9	0	0	110.7	I221 N222 T225 I229	I221-E227 CarbonylContact C-O 3.53Å; I221-E227 VanDerWaalsContact CA-O 3.32Å; I221-E227 WeakPolarHBondContact CA-O 3.43Å; N222-E227 HydrophobicContact CB-CB 4.28Å; N222-E227 PolarHBondContact N-O 3.17Å; T225-E227 PolarHBondContact O-N 2.82Å; T225-E227 VanDerWaalsContact OG1-CB 3.32Å; T225-E227 WeakPolarHBondContact OG1-CB 3.36Å; T225-E227 PolarHBondContact OG1-N 3.39Å; E227-I229 HydrophobicContact CB-CD1 4.34Å; E227-I229 HydrophobicContact CG-CD1 4.13Å; E227-I229 PolarHBondContact O-N 2.83Å; E227-I229 VanDerWaalsContact O-N 3.17Å
228	L	96.8	Very high	96	Very high	53 Å²	53	46.1 Å²	46.1	28%	0.277	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	105.2	170.3	176.9	64	0	0	0	108.9	L189 R219 I221 G226 Y230	L189-L228 HydrophobicContact CD2-CB 4.04Å; R219-L228 HydrophobicContact CB-CD1 3.81Å; R219-L228 HydrophobicContact CG-CD1 4.34Å; I221-L228 HydrophobicContact CG1-CD1 4.1Å; G226-L228 PolarHBondContact O-N 2.81Å; L228-Y230 WeakPolarHBondContact CD1-O 3.08Å
229	I	97.3	Very high	95.7	Very high	50 Å²	50	55 Å²	55	26%	0.256	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-53.8	-178.2	-56.4	-61.9	0	0	0	110.3	F208 M220 N222 E227	F208-I229 HydrophobicContact CD1-CG1 4.45Å; F208-I229 HydrophobicContact CE1-CG1 4.27Å; M220-I229 HydrophobicContact CE-CB 3.73Å; M220-I229 HydrophobicContact CE-CG1 4.35Å; M220-I229 HydrophobicContact CE-CG2 3.5Å; M220-I229 VanDerWaalsContact CE-CG2 3.5Å; M220-I229 PolarHBondContact O-N 3.05Å; N222-I229 HydrophobicContact CB-CD1 4.12Å; N222-I229 HydrophobicContact CB-CG1 4.14Å; E227-I229 HydrophobicContact CB-CD1 4.34Å; E227-I229 HydrophobicContact CG-CD1 4.13Å; E227-I229 PolarHBondContact O-N 2.83Å; E227-I229 VanDerWaalsContact O-N 3.17Å
230	Y	96.5	Very high	95.4	Very high	64 Å²	64	54.7 Å²	54.7	25%	0.251	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148.4	-179.2	-60.3	-50.4	0	0	0	113	R219 M220 L228 L232 Q268 N269 D270	R219-Y230 WeakPolarHBondContact CA-O 3.37Å; M220-Y230 HydrophobicContact CE-CD2 3.34Å; M220-Y230 HydrophobicContact CE-CE2 3.59Å; M220-Y230 HydrophobicContact CE-CG 4.39Å; M220-Y230 PolarHBondContact N-O 3.35Å; M220-Y230 PolarHBondContact O-N 2.97Å; M220-Y230 HydrophobicContact SD-CD2 4.43Å; L228-Y230 WeakPolarHBondContact CD1-O 3.08Å; Y230-L232 HydrophobicContact CG-CD2 4.36Å; Y230-Q268 WeakPolarHBondContact CE2-O 3.39Å; Y230-N269 PolarHBondContact OH-O 2.96Å; Y230-D270 WeakPolarHBondContact CE1-O 3.39Å; Y230-D270 VanDerWaalsContact OH-CA 3.27Å; Y230-D270 WeakPolarHBondContact OH-CA 3.44Å
231	S	95.8	Very high	95.2	Very high	45 Å²	45	56.1 Å²	56.1	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	101.1	164	-57.8	0	0	0	0	107.5	V218 R219	V218-S231 WeakPolarHBondContact O-CA 3.43Å; R219-S231 WeakPolarHBondContact CD-OG 3.38Å; R219-S231 VanDerWaalsContact NH1-CB 3.34Å; R219-S231 PolarHBondContact NH1-OG 3.03Å
232	L	97	Very high	94.9	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	111.4	-173.2	-51.6	172.7	0	0	0	108.4	A217 V218 Y230 I254 W266 G271	A217-L232 CarbonylContact C-O 3.41Å; A217-L232 WeakPolarHBondContact CA-O 3.47Å; V218-L232 HydrophobicContact CB-CB 4.24Å; V218-L232 HydrophobicContact CB-CD1 4.41Å; V218-L232 PolarHBondContact N-O 2.82Å; V218-L232 PolarHBondContact O-N 2.55Å; Y230-L232 HydrophobicContact CG-CD2 4.36Å; L232-I254 HydrophobicContact CD1-CB 4.09Å; L232-I254 HydrophobicContact CD1-CD1 3.7Å; L232-I254 HydrophobicContact CD1-CG2 3.83Å; L232-W266 HydrophobicContact CB-CD2 3.89Å; L232-W266 HydrophobicContact CB-CE3 4.42Å; L232-W266 HydrophobicContact CB-CG 4.15Å; L232-W266 HydrophobicContact CB-CZ2 4.1Å; L232-W266 HydrophobicContact CD1-CB 3.93Å; L232-W266 HydrophobicContact CD1-CD2 3.8Å; L232-W266 HydrophobicContact CD1-CE3 3.89Å; L232-W266 HydrophobicContact CD1-CG 3.82Å; L232-W266 HydrophobicContact CD2-CB 4.01Å; L232-W266 HydrophobicContact CD2-CD2 4.43Å; L232-W266 HydrophobicContact CD2-CG 3.81Å; L232-W266 HydrophobicContact CG-CD2 4.25Å; L232-W266 HydrophobicContact CG-CG 4.13Å; L232-G271 WeakPolarHBondContact CD2-O 3.33Å
233	T	95.6	Very high	94.8	Very high	81 Å²	81	58.1 Å²	58.1	50%	0.497	32%	0.321	S	S	.	.			trans	-119.5	5.5	-165.7	53.6	0	0	0	0	114.7	A217 R235	A217-T233 HydrophobicContact CB-CG2 4.05Å; T233-R235 VanDerWaalsContact C-N 3.32Å; T233-R235 PolarHBondContact O-N 3.35Å
234	D	96.3	Very high	94.6	Very high	75 Å²	75	59.4 Å²	59.4	40%	0.401	33%	0.326	S	S	.	.			trans	-69.5	-28	-177.1	-54	-95.7	0	0	0	113.2	Y264 W266 L273	D234-Y264 HydrophobicContact CB-CD1 3.98Å; D234-Y264 HydrophobicContact CB-CE1 4.1Å; D234-Y264 VanDerWaalsContact O-CE1 3.32Å; D234-Y264 WeakPolarHBondContact O-CE1 3.46Å; D234-W266 HydrophobicContact CB-CZ2 4.13Å; D234-W266 PolarHBondContact OD2-NE1 3.05Å; D234-L273 HydrophobicContact CB-CD1 4.19Å; D234-L273 HydrophobicContact CB-CD2 4.24Å
235	R	93.9	Very high	94.5	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.008	30%	0.296	C	S	.	.	S	Bend	trans	-69.9	142.9	-179.1	66.2	173.2	-178.7	77.8	1.2	111.9	T213 G215 Q216 A217 T233 S256 Y264 W266	T213-R235 PolarHBondContact OG1-NH2 2.74Å; T213-R235 VanDerWaalsContact OG1-NH2 3.12Å; G215-R235 PolarHBondContact O-NH1 3.4Å; G215-R235 PolarHBondContact O-NH2 3.38Å; Q216-R235 VanDerWaalsContact O-CG 3.31Å; Q216-R235 WeakPolarHBondContact O-CG 3.33Å; Q216-R235 PolarHBondContact O-NE 2.84Å; Q216-R235 PolarHBondContact O-NH2 3.46Å; A217-R235 PolarHBondContact O-NH2 3.33Å; T233-R235 VanDerWaalsContact C-N 3.32Å; T233-R235 PolarHBondContact O-N 3.35Å; R235-S256 VanDerWaalsContact CD-OG 3.29Å; R235-S256 WeakPolarHBondContact CD-OG 3.21Å; R235-Y264 HydrophobicContact CB-CD1 4.48Å; R235-Y264 HydrophobicContact CB-CD2 3.7Å; R235-Y264 HydrophobicContact CB-CE2 4.07Å; R235-Y264 HydrophobicContact CB-CG 3.93Å; R235-W266 HydrophobicContact CB-CH2 3.99Å; R235-W266 HydrophobicContact CB-CZ2 4.24Å; R235-W266 HydrophobicContact CG-CH2 4.12Å; R235-W266 HydrophobicContact CG-CZ2 4.44Å
236	V	93.6	Very high	94.4	Very high	57 Å²	57	48.5 Å²	48.5	35%	0.345	28%	0.277	S	S	.	.			trans	-84.4	135	172.9	-171.1	0	0	0	0	110.6	S258 T259 D260	V236-S258 WeakPolarHBondContact CA-OG 3.4Å; V236-S258 WeakPolarHBondContact CB-OG 3.31Å; V236-S258 PolarHBondContact N-OG 3.08Å; V236-S258 WeakPolarHBondContact O-CA 3.44Å; V236-S258 PolarHBondContact O-OG 2.88Å; V236-T259 PolarHBondContact O-N 2.88Å; V236-T259 PolarHBondContact O-OG1 2.85Å; V236-D260 HydrophobicContact CB-CB 4.33Å; V236-D260 HydrophobicContact CG2-CB 4.43Å
237	N	93.8	Very high	94.3	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	28%	0.275	C	S	.	.			trans	-141.9	60	167.5	-167	2.3	0	0	0	111.3	N214 G215 R239 G240 I241 L243 T259	N214-N237 VanDerWaalsContact C-ND2 3.28Å; N214-N237 PolarHBondContact O-ND2 3.2Å; G215-N237 WeakPolarHBondContact O-CB 3.48Å; G215-N237 PolarHBondContact O-ND2 2.88Å; N237-R239 PolarHBondContact O-N 2.96Å; N237-G240 PolarHBondContact O-N 3.3Å; N237-G240 PolarHBondContact OD1-N 2.76Å; N237-I241 PolarHBondContact ND2-O 3.32Å; N237-I241 WeakPolarHBondContact OD1-CG1 3.35Å; N237-I241 PolarHBondContact OD1-N 3.45Å; N237-L243 HydrophobicContact CB-CD1 3.75Å; N237-L243 VanDerWaalsContact CG-CD1 3.47Å; N237-T259 WeakPolarHBondContact CA-OG1 3.41Å; N237-T259 VanDerWaalsContact OD1-CG2 3.32Å; N237-T259 WeakPolarHBondContact OD1-CG2 3.19Å
238	G	87.9	Confident	94	Very high	68 Å²	68	43 Å²	43	70%	0.701	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.5	-175.6	0	0	0	0	0	114.2	T259	G238-T259 PolarHBondContact N-OG1 2.86Å
239	R	88.8	Confident	93.7	Very high	187 Å²	187	43.1 Å²	43.1	71%	0.706	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.5	-179.5	-62.3	-160.8	-175.7	-160.1	1.3	114.3	N237 I241 T259	N237-R239 PolarHBondContact O-N 2.96Å; R239-I241 VanDerWaalsContact C-N 3.26Å; R239-I241 HydrophobicContact CB-CG1 4.26Å; R239-I241 HydrophobicContact CB-CG2 4.09Å; R239-I241 PolarHBondContact O-N 3.43Å; R239-T259 HydrophobicContact CB-CG2 4.18Å; R239-T259 HydrophobicContact CG-CG2 4.3Å
240	G	92.2	Very high	93.3	Very high	42 Å²	42	43.3 Å²	43.3	43%	0.433	25%	0.254	S	S	.	.			trans	63.2	31.8	179.4	0	0	0	0	0	113.5	N214 N237	N214-G240 CarbonylContact O-C 3.56Å; N214-G240 VanDerWaalsContact O-C 3.28Å; N214-G240 WeakPolarHBondContact O-CA 3.23Å; N237-G240 PolarHBondContact O-N 3.3Å; N237-G240 PolarHBondContact OD1-N 2.76Å
241	I	91.5	Very high	93.2	Very high	30 Å²	30	40.8 Å²	40.8	15%	0.154	25%	0.247	C	C	.	.			trans	-100	154.8	-176.3	54.2	166.6	0	0	0	110.9	N214 N237 R239 L243 T259 I284	N214-I241 VanDerWaalsContact CA-O 3.26Å; N214-I241 WeakPolarHBondContact CA-O 2.98Å; N237-I241 PolarHBondContact ND2-O 3.32Å; N237-I241 WeakPolarHBondContact OD1-CG1 3.35Å; N237-I241 PolarHBondContact OD1-N 3.45Å; R239-I241 VanDerWaalsContact C-N 3.26Å; R239-I241 HydrophobicContact CB-CG1 4.26Å; R239-I241 HydrophobicContact CB-CG2 4.09Å; R239-I241 PolarHBondContact O-N 3.43Å; I241-L243 HydrophobicContact CD1-CD2 3.75Å; I241-L243 HydrophobicContact CG1-CD2 3.87Å; I241-L243 HydrophobicContact CG1-CG 4.34Å; I241-L243 PolarHBondContact O-N 3.18Å; I241-L243 VanDerWaalsContact O-N 3.16Å; I241-T259 HydrophobicContact CD1-CG2 4.03Å; I241-T259 HydrophobicContact CG1-CG2 4.12Å; I241-I284 HydrophobicContact CD1-CD1 4.04Å; I241-I284 HydrophobicContact CD1-CG2 3.34Å
242	P	93.3	Very high	93.1	Very high	74 Å²	74	42 Å²	42	48%	0.481	25%	0.247	S	C	.	.			trans	-57	119.7	170.8	-24.6	34.7	0	0	0	111	T198	T198-P242 HydrophobicContact CG2-CB 3.75Å; T198-P242 HydrophobicContact CG2-CG 3.89Å
243	L	94.1	Very high	93	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	25%	0.249	C	C	.	.			trans	-119.5	130.9	171	-59.1	-175.6	0	0	0	108.3	S212 N237 I241 G257 T259 I284 V285 N286	S212-L243 WeakPolarHBondContact CB-O 3.33Å; N237-L243 HydrophobicContact CB-CD1 3.75Å; N237-L243 VanDerWaalsContact CG-CD1 3.47Å; I241-L243 HydrophobicContact CD1-CD2 3.75Å; I241-L243 HydrophobicContact CG1-CD2 3.87Å; I241-L243 HydrophobicContact CG1-CG 4.34Å; I241-L243 PolarHBondContact O-N 3.18Å; I241-L243 VanDerWaalsContact O-N 3.16Å; L243-G257 WeakPolarHBondContact CD1-O 3.27Å; L243-T259 HydrophobicContact CD1-CG2 4.39Å; L243-I284 HydrophobicContact CD2-CG2 4.12Å; L243-V285 WeakPolarHBondContact CD2-O 3.42Å; L243-N286 HydrophobicContact CD2-CB 4.15Å
244	E	93.8	Very high	93.1	Very high	35 Å²	35	38.9 Å²	38.9	16%	0.164	23%	0.226	C	C	.	.			trans	-78.7	151.9	-179.6	-65.3	-171.3	135.6	0	0	112.3	S256 G257 N286 C287 V288 R289	E244-S256 WeakPolarHBondContact O-CA 3.44Å; E244-S256 PolarHBondContact O-OG 2.87Å; E244-G257 PolarHBondContact O-N 2.79Å; E244-N286 WeakPolarHBondContact CG-O 3.33Å; E244-N286 PolarHBondContact N-O 2.79Å; E244-C287 VanDerWaalsContact OE2-CA 3.27Å; E244-C287 WeakPolarHBondContact OE2-CA 3.5Å; E244-C287 VanDerWaalsContact OE2-CB 3.32Å; E244-C287 WeakPolarHBondContact OE2-CB 3.38Å; E244-V288 HydrophobicContact CB-CG2 4.45Å; E244-V288 WeakPolarHBondContact O-CG2 3.38Å; E244-V288 PolarHBondContact OE2-N 3.47Å; E244-R289 VanDerWaalsContact CD-NH2 3.35Å; E244-R289 IonicContact OE1-CZ 3.7Å; E244-R289 IonicContact OE1-NH1 2.88Å; E244-R289 PolarHBondContact OE1-NH1 2.94Å; E244-R289 IonicContact OE1-NH2 3.69Å; E244-R289 PolarHBondContact OE1-NH2 2.73Å; E244-R289 IonicContact OE2-CZ 3.05Å; E244-R289 VanDerWaalsContact OE2-CZ 3.28Å; E244-R289 IonicContact OE2-NH1 2.84Å; E244-R289 PolarHBondContact OE2-NH1 2.99Å; E244-R289 IonicContact OE2-NH2 3.35Å; E244-R289 PolarHBondContact OE2-NH2 3.3Å
245	A	95.7	Very high	93	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	157.4	165.1	0	0	0	0	0	110.5	K201 L210 S212 V218 L255	K201-A245 PolarHBondContact NZ-O 2.82Å; L210-A245 HydrophobicContact CD2-CB 3.74Å; L210-A245 HydrophobicContact CG-CB 4.29Å; S212-A245 PolarHBondContact OG-N 2.99Å; V218-A245 HydrophobicContact CG1-CB 3.55Å; V218-A245 HydrophobicContact CG2-CB 4.09Å; A245-L255 CarbonylContact C-O 3.58Å; A245-L255 WeakPolarHBondContact CA-O 3.44Å; A245-L255 WeakPolarHBondContact CB-O 3.44Å
246	S	95	Very high	93.1	Very high	16 Å²	16	35.2 Å²	35.2	11%	0.112	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	165.3	177.7	-153.2	0	0	0	0	110.3	K201 I254 L255	K201-S246 PolarHBondContact NZ-OG 2.82Å; K201-S246 VanDerWaalsContact NZ-OG 3.09Å; S246-I254 CarbonylContact O-C 3.5Å; S246-I254 WeakPolarHBondContact O-CA 3.5Å; S246-L255 PolarHBondContact N-O 2.87Å; S246-L255 VanDerWaalsContact O-CD2 3.22Å; S246-L255 WeakPolarHBondContact O-CD2 3.12Å; S246-L255 PolarHBondContact O-N 3.42Å
247	F	94	Very high	93	Very high	12 Å²	12	32.5 Å²	32.5	5%	0.053	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	156.8	162.8	-65.7	-84.3	0	0	0	110.6	S203 P204 F208 L210 M220 Y253 I254 Q268	S203-F247 VanDerWaalsContact CA-CE2 3.44Å; P204-F247 HydrophobicContact CG-CB 4.29Å; F208-F247 HydrophobicContact CB-CZ 4.29Å; L210-F247 HydrophobicContact CB-CD2 4.4Å; L210-F247 HydrophobicContact CB-CE2 3.48Å; L210-F247 VanDerWaalsContact CB-CE2 3.48Å; L210-F247 HydrophobicContact CB-CZ 3.81Å; L210-F247 HydrophobicContact CD1-CZ 4.32Å; L210-F247 HydrophobicContact CD2-CD2 4.2Å; L210-F247 HydrophobicContact CD2-CE2 4Å; L210-F247 HydrophobicContact CD2-CZ 4.37Å; L210-F247 HydrophobicContact CG-CE2 4.26Å; L210-F247 HydrophobicContact CG-CZ 4.42Å; M220-F247 HydrophobicContact SD-CE1 4.43Å; F247-Y253 CarbonylContact C-O 3.53Å; F247-Y253 WeakPolarHBondContact CA-O 3.36Å; F247-I254 HydrophobicContact CD1-CG1 3.71Å; F247-I254 HydrophobicContact CE1-CD1 3.95Å; F247-I254 HydrophobicContact CE1-CG1 3.51Å; F247-I254 HydrophobicContact CZ-CG1 4.34Å; F247-Q268 HydrophobicContact CD1-CG 4.42Å; F247-Q268 HydrophobicContact CE1-CG 3.97Å
248	T	92.4	Very high	93	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	19%	0.188	C	C	.	.			trans	-66.8	157.2	158	55.2	0	0	0	0	110.4	I3 D250 G251 K252 Y253 L255 F290	I3-T248 HydrophobicContact CD1-CG2 4Å; I3-T248 HydrophobicContact CG2-CG2 4.33Å; T248-D250 WeakPolarHBondContact CB-OD1 3.38Å; T248-D250 PolarHBondContact O-N 3.42Å; T248-D250 VanDerWaalsContact O-N 3.17Å; T248-D250 PolarHBondContact OG1-OD1 3.07Å; T248-G251 WeakPolarHBondContact O-CA 3.46Å; T248-G251 PolarHBondContact O-N 3.15Å; T248-K252 PolarHBondContact OG1-N 2.96Å; T248-Y253 PolarHBondContact N-O 3.18Å; T248-Y253 PolarHBondContact OG1-N 2.96Å; T248-Y253 VanDerWaalsContact OG1-N 3.13Å; T248-Y253 PolarHBondContact OG1-O 2.82Å; T248-L255 HydrophobicContact CG2-CD2 4.12Å; T248-F290 HydrophobicContact CG2-CD2 4.11Å; T248-F290 HydrophobicContact CG2-CE2 3.97Å; T248-F290 HydrophobicContact CG2-CG 4.46Å; T248-F290 HydrophobicContact CG2-CZ 4.21Å
249	P	89.1	Confident	93.2	Very high	54 Å²	54	30 Å²	30	35%	0.351	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.2	-176.6	-24.6	35.4	0	0	0	113.7	G251 F290 N291	P249-G251 VanDerWaalsContact C-N 3.3Å; P249-F290 HydrophobicContact CG-CB 4.02Å; P249-N291 WeakPolarHBondContact CG-O 3.44Å
250	D	90.4	Very high	93.3	Very high	55 Å²	55	23.4 Å²	23.4	29%	0.294	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	2.4	176.2	73.8	-15.4	0	0	0	114	T248 K252	T248-D250 WeakPolarHBondContact CB-OD1 3.38Å; T248-D250 PolarHBondContact O-N 3.42Å; T248-D250 VanDerWaalsContact O-N 3.17Å; T248-D250 PolarHBondContact OG1-OD1 3.07Å; D250-K252 PolarHBondContact O-N 3.09Å; D250-K252 VanDerWaalsContact O-N 3.16Å; D250-K252 PolarHBondContact OD1-N 3.3Å; D250-K252 WeakPolarHBondContact OD2-CD 3.08Å; D250-K252 IonicContact OD2-NZ 2.55Å; D250-K252 PolarHBondContact OD2-NZ 3.12Å
251	G	93.1	Very high	93	Very high	11 Å²	11	21.4 Å²	21.4	11%	0.113	12%	0.12	C	C	.	.	S	Bend	trans	72.4	-2.2	177.3	0	0	0	0	0	115.7	T248 P249 Q268	T248-G251 WeakPolarHBondContact O-CA 3.46Å; T248-G251 PolarHBondContact O-N 3.15Å; P249-G251 VanDerWaalsContact C-N 3.3Å; G251-Q268 WeakPolarHBondContact O-CB 3.24Å; G251-Q268 WeakPolarHBondContact O-CG 3.11Å
252	K	93.9	Very high	93	Very high	71 Å²	71	20 Å²	20	31%	0.309	11%	0.113	S	C	.	.	S	Bend	trans	-79.3	-21.3	-170.9	-64.6	-167.4	-163	103.5	0	114.7	T248 D250 Q268	T248-K252 PolarHBondContact OG1-N 2.96Å; D250-K252 PolarHBondContact O-N 3.09Å; D250-K252 VanDerWaalsContact O-N 3.16Å; D250-K252 PolarHBondContact OD1-N 3.3Å; D250-K252 WeakPolarHBondContact OD2-CD 3.08Å; D250-K252 IonicContact OD2-NZ 2.55Å; D250-K252 PolarHBondContact OD2-NZ 3.12Å; K252-Q268 VanDerWaalsContact O-CB 3.23Å; K252-Q268 WeakPolarHBondContact O-CB 3.27Å; K252-Q268 PolarHBondContact O-N 2.96Å
253	Y	95.3	Very high	92.9	Very high	18 Å²	18	16.5 Å²	16.5	7%	0.071	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146.6	-179.3	-62.2	-89.6	0	0	0	111.3	I3 D4 T5 L8 F247 T248 W266 N267 A274	I3-Y253 HydrophobicContact CB-CD2 4.33Å; I3-Y253 HydrophobicContact CB-CE2 4.34Å; I3-Y253 HydrophobicContact CG2-CD2 3.57Å; I3-Y253 HydrophobicContact CG2-CE2 3.77Å; D4-Y253 VanDerWaalsContact CA-OH 3.32Å; D4-Y253 WeakPolarHBondContact CA-OH 3.42Å; T5-Y253 PolarHBondContact N-OH 3.01Å; T5-Y253 PolarHBondContact OG1-OH 3.17Å; L8-Y253 HydrophobicContact CD1-CD1 3.59Å; L8-Y253 HydrophobicContact CD1-CD2 3.96Å; L8-Y253 HydrophobicContact CD1-CE1 3.74Å; L8-Y253 HydrophobicContact CD1-CE2 4.1Å; L8-Y253 HydrophobicContact CD1-CG 3.7Å; F247-Y253 CarbonylContact C-O 3.53Å; F247-Y253 WeakPolarHBondContact CA-O 3.36Å; T248-Y253 PolarHBondContact N-O 3.18Å; T248-Y253 PolarHBondContact OG1-N 2.96Å; T248-Y253 VanDerWaalsContact OG1-N 3.13Å; T248-Y253 PolarHBondContact OG1-O 2.82Å; Y253-W266 CarbonylContact C-O 3.54Å; Y253-W266 WeakPolarHBondContact CA-O 3.47Å; Y253-N267 HydrophobicContact CD1-CB 4.4Å; Y253-N267 HydrophobicContact CE1-CB 4.19Å; Y253-A274 HydrophobicContact CD1-CB 3.94Å; Y253-A274 HydrophobicContact CE1-CB 3.59Å
254	I	96.4	Very high	93	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	138.7	167.3	-65.3	161.7	0	0	0	107	L210 M220 L232 S246 F247 F265 W266 Q268	L210-I254 HydrophobicContact CD1-CD1 3.95Å; L210-I254 HydrophobicContact CD1-CG1 4.22Å; L210-I254 HydrophobicContact CD1-CG2 3.86Å; L210-I254 HydrophobicContact CD2-CG2 4.03Å; M220-I254 HydrophobicContact CB-CD1 4.28Å; M220-I254 HydrophobicContact CG-CD1 4.32Å; M220-I254 HydrophobicContact SD-CD1 3.66Å; L232-I254 HydrophobicContact CD1-CB 4.09Å; L232-I254 HydrophobicContact CD1-CD1 3.7Å; L232-I254 HydrophobicContact CD1-CG2 3.83Å; S246-I254 CarbonylContact O-C 3.5Å; S246-I254 WeakPolarHBondContact O-CA 3.5Å; F247-I254 HydrophobicContact CD1-CG1 3.71Å; F247-I254 HydrophobicContact CE1-CD1 3.95Å; F247-I254 HydrophobicContact CE1-CG1 3.51Å; F247-I254 HydrophobicContact CZ-CG1 4.34Å; I254-F265 CarbonylContact O-C 3.59Å; I254-F265 VanDerWaalsContact O-CA 3.25Å; I254-F265 WeakPolarHBondContact O-CA 3.36Å; I254-W266 HydrophobicContact CB-CE3 4.38Å; I254-W266 HydrophobicContact CG2-CE3 4.08Å; I254-W266 PolarHBondContact N-O 2.87Å; I254-W266 PolarHBondContact O-N 2.99Å; I254-Q268 HydrophobicContact CD1-CG 4.45Å
255	L	95	Very high	93.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.1	174.5	60.9	143	0	0	0	111.3	A245 S246 T248 V263 Y264 F265 V288 F290 M297	A245-L255 CarbonylContact C-O 3.58Å; A245-L255 WeakPolarHBondContact CA-O 3.44Å; A245-L255 WeakPolarHBondContact CB-O 3.44Å; S246-L255 PolarHBondContact N-O 2.87Å; S246-L255 VanDerWaalsContact O-CD2 3.22Å; S246-L255 WeakPolarHBondContact O-CD2 3.12Å; S246-L255 PolarHBondContact O-N 3.42Å; T248-L255 HydrophobicContact CG2-CD2 4.12Å; L255-V263 HydrophobicContact CB-CG1 4.21Å; L255-Y264 CarbonylContact C-O 3.36Å; L255-Y264 WeakPolarHBondContact CA-O 3.49Å; L255-F265 HydrophobicContact CB-CD1 3.88Å; L255-F265 HydrophobicContact CB-CE1 3.84Å; L255-F265 HydrophobicContact CB-CG 4.47Å; L255-F265 HydrophobicContact CB-CZ 4.38Å; L255-V288 HydrophobicContact CD1-CB 3.84Å; L255-V288 HydrophobicContact CD1-CG2 3.88Å; L255-V288 HydrophobicContact CG-CG2 4.36Å; L255-F290 HydrophobicContact CD1-CD2 3.55Å; L255-F290 HydrophobicContact CD1-CE2 3.7Å; L255-F290 HydrophobicContact CD2-CD2 3.41Å; L255-F290 VanDerWaalsContact CD2-CD2 3.41Å; L255-F290 HydrophobicContact CD2-CE2 3.73Å; L255-F290 HydrophobicContact CG-CD2 4.1Å; L255-F290 HydrophobicContact CG-CE2 4.21Å; L255-M297 HydrophobicContact CD1-CG 4.26Å; L255-M297 HydrophobicContact CD1-SD 3.62Å
256	S	95.1	Very high	93.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	143.6	173.5	-169.6	0	0	0	0	111.2	R235 E244 V263 Y264	R235-S256 VanDerWaalsContact CD-OG 3.29Å; R235-S256 WeakPolarHBondContact CD-OG 3.21Å; E244-S256 WeakPolarHBondContact O-CA 3.44Å; E244-S256 PolarHBondContact O-OG 2.87Å; S256-V263 WeakPolarHBondContact O-CA 3.33Å; S256-Y264 PolarHBondContact N-O 2.9Å; S256-Y264 PolarHBondContact O-N 2.8Å
257	G	91.8	Very high	93.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	164.4	171.6	0	0	0	0	0	112.4	L243 E244 V285	L243-G257 WeakPolarHBondContact CD1-O 3.27Å; E244-G257 PolarHBondContact O-N 2.79Å; G257-V285 CarbonylContact C-O 3.54Å; G257-V285 WeakPolarHBondContact CA-O 3.48Å
258	S	93.7	Very high	93.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.			trans	-136.4	155.6	179.8	-177	0	0	0	0	112.7	V236 D260 G261 S262 V285	V236-S258 WeakPolarHBondContact CA-OG 3.4Å; V236-S258 WeakPolarHBondContact CB-OG 3.31Å; V236-S258 PolarHBondContact N-OG 3.08Å; V236-S258 WeakPolarHBondContact O-CA 3.44Å; V236-S258 PolarHBondContact O-OG 2.88Å; S258-D260 WeakPolarHBondContact CB-OD1 3.38Å; S258-D260 PolarHBondContact O-N 2.78Å; S258-D260 PolarHBondContact OG-N 2.89Å; S258-D260 PolarHBondContact OG-OD1 2.95Å; S258-D260 VanDerWaalsContact OG-OD1 3.11Å; S258-G261 PolarHBondContact O-N 2.77Å; S258-S262 WeakPolarHBondContact CB-O 3.4Å; S258-S262 PolarHBondContact N-O 2.88Å; S258-V285 PolarHBondContact N-O 2.98Å; S258-V285 PolarHBondContact O-N 3.01Å
259	T	92	Very high	93.5	Very high	22 Å²	22	22 Å²	22	14%	0.135	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-11.1	172.1	53.4	0	0	0	0	113.9	V236 N237 G238 R239 I241 L243 G261 I284	V236-T259 PolarHBondContact O-N 2.88Å; V236-T259 PolarHBondContact O-OG1 2.85Å; N237-T259 WeakPolarHBondContact CA-OG1 3.41Å; N237-T259 VanDerWaalsContact OD1-CG2 3.32Å; N237-T259 WeakPolarHBondContact OD1-CG2 3.19Å; G238-T259 PolarHBondContact N-OG1 2.86Å; R239-T259 HydrophobicContact CB-CG2 4.18Å; R239-T259 HydrophobicContact CG-CG2 4.3Å; I241-T259 HydrophobicContact CD1-CG2 4.03Å; I241-T259 HydrophobicContact CG1-CG2 4.12Å; L243-T259 HydrophobicContact CD1-CG2 4.39Å; T259-G261 VanDerWaalsContact C-N 3.33Å; T259-I284 HydrophobicContact CG2-CG1 4.35Å; T259-I284 HydrophobicContact CG2-CG2 4.24Å
260	D	90.7	Very high	93.9	Very high	50 Å²	50	23 Å²	23	27%	0.267	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.1	176.5	72.2	4.5	0	0	0	113.8	V236 S258 S262 Y264	V236-D260 HydrophobicContact CB-CB 4.33Å; V236-D260 HydrophobicContact CG2-CB 4.43Å; S258-D260 WeakPolarHBondContact CB-OD1 3.38Å; S258-D260 PolarHBondContact O-N 2.78Å; S258-D260 PolarHBondContact OG-N 2.89Å; S258-D260 PolarHBondContact OG-OD1 2.95Å; S258-D260 VanDerWaalsContact OG-OD1 3.11Å; D260-S262 WeakPolarHBondContact OD1-CA 3.41Å; D260-S262 WeakPolarHBondContact OD1-CB 3.43Å; D260-S262 PolarHBondContact OD1-N 2.92Å; D260-S262 PolarHBondContact OD1-OG 2.84Å; D260-Y264 PolarHBondContact OD2-OH 2.88Å
261	G	87.2	Confident	94.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	S	Bend	trans	90.6	1.1	-178	0	0	0	0	0	115.1	S258 T259 H279 A283	S258-G261 PolarHBondContact O-N 2.77Å; T259-G261 VanDerWaalsContact C-N 3.33Å; G261-H279 PolarHBondContact O-N 3.22Å; G261-A283 VanDerWaalsContact CA-O 3.31Å; G261-A283 WeakPolarHBondContact CA-O 3.27Å
262	S	90.8	Very high	94.4	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.007	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	160.7	-179.5	-39.6	0	0	0	0	112.8	S258 D260 Q276 V277 H278	S258-S262 WeakPolarHBondContact CB-O 3.4Å; S258-S262 PolarHBondContact N-O 2.88Å; D260-S262 WeakPolarHBondContact OD1-CA 3.41Å; D260-S262 WeakPolarHBondContact OD1-CB 3.43Å; D260-S262 PolarHBondContact OD1-N 2.92Å; D260-S262 PolarHBondContact OD1-OG 2.84Å; S262-Q276 PolarHBondContact OG-NE2 3Å; S262-Q276 VanDerWaalsContact OG-NE2 3.11Å; S262-V277 CarbonylContact C-O 3.59Å; S262-V277 VanDerWaalsContact CA-O 3.27Å; S262-V277 WeakPolarHBondContact CA-O 3.35Å; S262-H278 PolarHBondContact OG-ND1 3.32Å
263	V	91.8	Very high	94.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.1	162.5	-178.7	0	0	0	0	108.6	L255 S256 F265 V277 H279 V285 V288 M297	L255-V263 HydrophobicContact CB-CG1 4.21Å; S256-V263 WeakPolarHBondContact O-CA 3.33Å; V263-F265 HydrophobicContact CB-CE2 4.07Å; V263-F265 HydrophobicContact CG1-CD2 4.25Å; V263-F265 HydrophobicContact CG1-CE2 3.59Å; V263-F265 HydrophobicContact CG1-CZ 3.88Å; V263-V277 PolarHBondContact N-O 2.91Å; V263-V277 PolarHBondContact O-N 3.05Å; V263-H279 WeakPolarHBondContact CG2-NE2 3.19Å; V263-V285 HydrophobicContact CG2-CG1 4.02Å; V263-V288 HydrophobicContact CG1-CG1 4.37Å; V263-V288 HydrophobicContact CG2-CG1 4.02Å; V263-M297 HydrophobicContact CB-CE 4.12Å; V263-M297 HydrophobicContact CG1-CE 4.05Å; V263-M297 HydrophobicContact CG1-SD 3.95Å; V263-M297 HydrophobicContact CG2-CE 3.92Å
264	Y	94.8	Very high	94.5	Very high	14 Å²	14	24.2 Å²	24.2	6%	0.055	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	142.3	179.8	-74.1	-103.1	0	0	0	110	D234 R235 L255 S256 D260 W266 L273 Q276	D234-Y264 HydrophobicContact CB-CD1 3.98Å; D234-Y264 HydrophobicContact CB-CE1 4.1Å; D234-Y264 VanDerWaalsContact O-CE1 3.32Å; D234-Y264 WeakPolarHBondContact O-CE1 3.46Å; R235-Y264 HydrophobicContact CB-CD1 4.48Å; R235-Y264 HydrophobicContact CB-CD2 3.7Å; R235-Y264 HydrophobicContact CB-CE2 4.07Å; R235-Y264 HydrophobicContact CB-CG 3.93Å; L255-Y264 CarbonylContact C-O 3.36Å; L255-Y264 WeakPolarHBondContact CA-O 3.49Å; S256-Y264 PolarHBondContact N-O 2.9Å; S256-Y264 PolarHBondContact O-N 2.8Å; D260-Y264 PolarHBondContact OD2-OH 2.88Å; Y264-W266 HydrophobicContact CD1-CZ2 4.39Å; Y264-W266 HydrophobicContact CG-CH2 4.25Å; Y264-W266 HydrophobicContact CG-CZ2 4.28Å; Y264-L273 HydrophobicContact CD1-CD1 3.69Å; Y264-Q276 HydrophobicContact CD1-CG 4.47Å; Y264-Q276 HydrophobicContact CE1-CG 4.2Å; Y264-Q276 HydrophobicContact CE2-CG 4.47Å; Y264-Q276 PolarHBondContact OH-NE2 2.83Å
265	F	95.9	Very high	94.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.9	179.2	-66.8	-100.3	0	0	0	110.7	L8 L11 I254 L255 V263 L273 A274 A275 V277 F290 M297	L8-F265 HydrophobicContact CD1-CB 4.03Å; L8-F265 HydrophobicContact CD1-CD1 3.81Å; L8-F265 HydrophobicContact CD1-CG 4.09Å; L8-F265 HydrophobicContact CD2-CD1 3.64Å; L8-F265 HydrophobicContact CD2-CE1 3.5Å; L8-F265 VanDerWaalsContact CD2-CE1 3.5Å; L8-F265 HydrophobicContact CD2-CG 4.36Å; L8-F265 HydrophobicContact CD2-CZ 4.16Å; L8-F265 HydrophobicContact CG-CD1 4.29Å; L11-F265 HydrophobicContact CD1-CE1 4.32Å; L11-F265 HydrophobicContact CD1-CE2 4.28Å; L11-F265 HydrophobicContact CD1-CZ 3.7Å; I254-F265 CarbonylContact O-C 3.59Å; I254-F265 VanDerWaalsContact O-CA 3.25Å; I254-F265 WeakPolarHBondContact O-CA 3.36Å; L255-F265 HydrophobicContact CB-CD1 3.88Å; L255-F265 HydrophobicContact CB-CE1 3.84Å; L255-F265 HydrophobicContact CB-CG 4.47Å; L255-F265 HydrophobicContact CB-CZ 4.38Å; V263-F265 HydrophobicContact CB-CE2 4.07Å; V263-F265 HydrophobicContact CG1-CD2 4.25Å; V263-F265 HydrophobicContact CG1-CE2 3.59Å; V263-F265 HydrophobicContact CG1-CZ 3.88Å; F265-L273 WeakPolarHBondContact O-CD1 3.37Å; F265-A274 PolarHBondContact O-N 2.84Å; F265-A275 HydrophobicContact CB-CB 4.13Å; F265-A275 HydrophobicContact CD2-CB 4.24Å; F265-A275 HydrophobicContact CG-CB 4.44Å; F265-A275 PolarHBondContact N-O 3.45Å; F265-A275 PolarHBondContact O-N 2.9Å; F265-V277 HydrophobicContact CD2-CG2 4.31Å; F265-V277 HydrophobicContact CE2-CB 4.28Å; F265-V277 HydrophobicContact CE2-CG2 3.73Å; F265-F290 AromaticContact CE1-CE2 3.6Å; F265-F290 HydrophobicContact CE1-CE2 3.6Å; F265-F290 AromaticContact CE1-CZ 3.86Å; F265-F290 HydrophobicContact CE1-CZ 3.86Å; F265-F290 HydrophobicContact CZ-CE2 4.13Å; F265-F290 HydrophobicContact CZ-CZ 4.31Å; F265-M297 HydrophobicContact CE1-SD 4.41Å; F265-M297 HydrophobicContact CZ-CE 4.2Å; F265-M297 HydrophobicContact CZ-SD 3.74Å
266	W	97.5	Very high	94.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.5	174.7	-58.7	-93.7	0	0	0	110.2	L232 D234 R235 Y253 I254 Y264 Q268 V272	L232-W266 HydrophobicContact CB-CD2 3.89Å; L232-W266 HydrophobicContact CB-CE3 4.42Å; L232-W266 HydrophobicContact CB-CG 4.15Å; L232-W266 HydrophobicContact CB-CZ2 4.1Å; L232-W266 HydrophobicContact CD1-CB 3.93Å; L232-W266 HydrophobicContact CD1-CD2 3.8Å; L232-W266 HydrophobicContact CD1-CE3 3.89Å; L232-W266 HydrophobicContact CD1-CG 3.82Å; L232-W266 HydrophobicContact CD2-CB 4.01Å; L232-W266 HydrophobicContact CD2-CD2 4.43Å; L232-W266 HydrophobicContact CD2-CG 3.81Å; L232-W266 HydrophobicContact CG-CD2 4.25Å; L232-W266 HydrophobicContact CG-CG 4.13Å; D234-W266 HydrophobicContact CB-CZ2 4.13Å; D234-W266 PolarHBondContact OD2-NE1 3.05Å; R235-W266 HydrophobicContact CB-CH2 3.99Å; R235-W266 HydrophobicContact CB-CZ2 4.24Å; R235-W266 HydrophobicContact CG-CH2 4.12Å; R235-W266 HydrophobicContact CG-CZ2 4.44Å; Y253-W266 CarbonylContact C-O 3.54Å; Y253-W266 WeakPolarHBondContact CA-O 3.47Å; I254-W266 HydrophobicContact CB-CE3 4.38Å; I254-W266 HydrophobicContact CG2-CE3 4.08Å; I254-W266 PolarHBondContact N-O 2.87Å; I254-W266 PolarHBondContact O-N 2.99Å; Y264-W266 HydrophobicContact CD1-CZ2 4.39Å; Y264-W266 HydrophobicContact CG-CH2 4.25Å; Y264-W266 HydrophobicContact CG-CZ2 4.28Å; W266-Q268 PolarHBondContact O-N 2.93Å; W266-V272 CarbonylContact C-O 3.49Å; W266-V272 VanDerWaalsContact CA-O 3.3Å; W266-V272 WeakPolarHBondContact CA-O 3.17Å
267	N	96.9	Very high	93.9	Very high	35 Å²	35	29.5 Å²	29.5	19%	0.187	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	124.2	168.3	173.2	0.6	0	0	0	108.5	Y253 N269 D270 G271 V272	Y253-N267 HydrophobicContact CD1-CB 4.4Å; Y253-N267 HydrophobicContact CE1-CB 4.19Å; N267-N269 PolarHBondContact O-N 3.24Å; N267-N269 WeakPolarHBondContact OD1-CB 3.19Å; N267-N269 PolarHBondContact OD1-N 3.31Å; N267-D270 WeakPolarHBondContact CB-OD1 3.46Å; N267-D270 VanDerWaalsContact CG-OD1 3.31Å; N267-D270 VanDerWaalsContact ND2-CG 3.35Å; N267-D270 PolarHBondContact ND2-OD1 2.71Å; N267-D270 PolarHBondContact ND2-OD2 2.78Å; N267-G271 VanDerWaalsContact O-CA 3.3Å; N267-G271 WeakPolarHBondContact O-CA 3.47Å; N267-G271 PolarHBondContact O-N 3.37Å; N267-V272 PolarHBondContact N-O 3.31Å
268	Q	96.5	Very high	93.5	Very high	15 Å²	15	34.5 Å²	34.5	7%	0.07	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.7	-175.8	-177.2	-77	-36.1	0	0	111.8	F208 M220 Y230 F247 G251 K252 I254 W266	F208-Q268 VanDerWaalsContact CD2-NE2 3.26Å; M220-Q268 HydrophobicContact SD-CG 3.87Å; M220-Q268 PolarHBondContact SD-NE2 3.38Å; Y230-Q268 WeakPolarHBondContact CE2-O 3.39Å; F247-Q268 HydrophobicContact CD1-CG 4.42Å; F247-Q268 HydrophobicContact CE1-CG 3.97Å; G251-Q268 WeakPolarHBondContact O-CB 3.24Å; G251-Q268 WeakPolarHBondContact O-CG 3.11Å; K252-Q268 VanDerWaalsContact O-CB 3.23Å; K252-Q268 WeakPolarHBondContact O-CB 3.27Å; K252-Q268 PolarHBondContact O-N 2.96Å; I254-Q268 HydrophobicContact CD1-CG 4.45Å; W266-Q268 PolarHBondContact O-N 2.93Å
269	N	96.1	Very high	92.4	Very high	115 Å²	115	34.8 Å²	34.8	62%	0.615	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-29.6	-174	-70.1	-56.2	0	0	0	114.6	Y230 N267	Y230-N269 PolarHBondContact OH-O 2.96Å; N267-N269 PolarHBondContact O-N 3.24Å; N267-N269 WeakPolarHBondContact OD1-CB 3.19Å; N267-N269 PolarHBondContact OD1-N 3.31Å
270	D	96.5	Very high	91	Very high	76 Å²	76	39.5 Å²	39.5	41%	0.406	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-9	-174.3	60.4	20.8	0	0	0	113.5	Y230 N267 V272	Y230-D270 WeakPolarHBondContact CE1-O 3.39Å; Y230-D270 VanDerWaalsContact OH-CA 3.27Å; Y230-D270 WeakPolarHBondContact OH-CA 3.44Å; N267-D270 WeakPolarHBondContact CB-OD1 3.46Å; N267-D270 VanDerWaalsContact CG-OD1 3.31Å; N267-D270 VanDerWaalsContact ND2-CG 3.35Å; N267-D270 PolarHBondContact ND2-OD1 2.71Å; N267-D270 PolarHBondContact ND2-OD2 2.78Å; D270-V272 HydrophobicContact CB-CG2 4.18Å; D270-V272 PolarHBondContact O-N 3.08Å; D270-V272 WeakPolarHBondContact OD1-CB 3.42Å; D270-V272 PolarHBondContact OD1-N 2.86Å
271	G	96.2	Very high	89.7	Confident	14 Å²	14	38.5 Å²	38.5	14%	0.144	21%	0.21	C	C	.	.			trans	73	7.9	-179.5	0	0	0	0	0	114.1	L232 N267	L232-G271 WeakPolarHBondContact CD2-O 3.33Å; N267-G271 VanDerWaalsContact O-CA 3.3Å; N267-G271 WeakPolarHBondContact O-CA 3.47Å; N267-G271 PolarHBondContact O-N 3.37Å
272	V	97.2	Very high	88.5	Confident	86 Å²	86	43.7 Å²	43.7	52%	0.521	25%	0.246	S	C	.	.			trans	-81.2	140.2	-176.6	179.8	0	0	0	0	110.2	W266 N267 D270 A274	W266-V272 CarbonylContact C-O 3.49Å; W266-V272 VanDerWaalsContact CA-O 3.3Å; W266-V272 WeakPolarHBondContact CA-O 3.17Å; N267-V272 PolarHBondContact N-O 3.31Å; D270-V272 HydrophobicContact CB-CG2 4.18Å; D270-V272 PolarHBondContact O-N 3.08Å; D270-V272 WeakPolarHBondContact OD1-CB 3.42Å; D270-V272 PolarHBondContact OD1-N 2.86Å; V272-A274 PolarHBondContact O-N 2.73Å; V272-A274 VanDerWaalsContact O-N 3.15Å
273	L	97	Very high	87.9	Confident	61 Å²	61	45 Å²	45	32%	0.319	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	116.3	172.3	-175.5	70.6	0	0	0	110	D234 Y264 F265	D234-L273 HydrophobicContact CB-CD1 4.19Å; D234-L273 HydrophobicContact CB-CD2 4.24Å; Y264-L273 HydrophobicContact CD1-CD1 3.69Å; F265-L273 WeakPolarHBondContact O-CD1 3.37Å
274	A	95.3	Very high	87.4	Confident	19 Å²	19	46.4 Å²	46.4	16%	0.157	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-42.6	-179.4	0	0	0	0	0	112	T5 Y253 F265 V272	T5-A274 HydrophobicContact CG2-CB 4.16Å; T5-A274 WeakPolarHBondContact CG2-O 3.18Å; Y253-A274 HydrophobicContact CD1-CB 3.94Å; Y253-A274 HydrophobicContact CE1-CB 3.59Å; F265-A274 PolarHBondContact O-N 2.84Å; V272-A274 PolarHBondContact O-N 2.73Å; V272-A274 VanDerWaalsContact O-N 3.15Å
275	A	93.3	Very high	87	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.033	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	155.5	-178.3	0	0	0	0	0	111.7	L8 N9 F265	L8-A275 HydrophobicContact CB-CB 3.84Å; N9-A275 WeakPolarHBondContact OD1-CB 3.15Å; F265-A275 HydrophobicContact CB-CB 4.13Å; F265-A275 HydrophobicContact CD2-CB 4.24Å; F265-A275 HydrophobicContact CG-CB 4.44Å; F265-A275 PolarHBondContact N-O 3.45Å; F265-A275 PolarHBondContact O-N 2.9Å
276	Q	92.3	Very high	86.6	Confident	92 Å²	92	46.3 Å²	46.3	43%	0.43	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	116.5	168.9	178.6	-177.8	-0.6	0	0	107.8	S262 Y264	S262-Q276 PolarHBondContact OG-NE2 3Å; S262-Q276 VanDerWaalsContact OG-NE2 3.11Å; Y264-Q276 HydrophobicContact CD1-CG 4.47Å; Y264-Q276 HydrophobicContact CE1-CG 4.2Å; Y264-Q276 HydrophobicContact CE2-CG 4.47Å; Y264-Q276 PolarHBondContact OH-NE2 2.83Å
277	V	87.6	Confident	86.2	Confident	15 Å²	15	46.4 Å²	46.4	9%	0.091	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	113.7	179.2	-179.4	0	0	0	0	108	L11 S262 V263 F265	L11-V277 HydrophobicContact CB-CG1 4.45Å; L11-V277 HydrophobicContact CB-CG2 4.19Å; L11-V277 HydrophobicContact CD1-CG2 4.29Å; S262-V277 CarbonylContact C-O 3.59Å; S262-V277 VanDerWaalsContact CA-O 3.27Å; S262-V277 WeakPolarHBondContact CA-O 3.35Å; V263-V277 PolarHBondContact N-O 2.91Å; V263-V277 PolarHBondContact O-N 3.05Å; F265-V277 HydrophobicContact CD2-CG2 4.31Å; F265-V277 HydrophobicContact CE2-CB 4.28Å; F265-V277 HydrophobicContact CE2-CG2 3.73Å
278	H	83.7	Confident	85.9	Confident	105 Å²	105	44.8 Å²	44.8	49%	0.486	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.3	175.1	-165.9	67.3	0	0	0	109.9	S262	S262-H278 PolarHBondContact OG-ND1 3.32Å
279	H	71.3	Confident	85.6	Confident	6 Å²	6	46 Å²	46	3%	0.028	26%	0.261	C	S	.	.			trans	-93.2	137	166.6	-61.3	-44.3	0	0	0	108.8	G261 V263 S281 S299 T307	G261-H279 PolarHBondContact O-N 3.22Å; V263-H279 WeakPolarHBondContact CG2-NE2 3.19Å; H279-S281 CarbonylContact O-C 3.59Å; H279-S281 PolarHBondContact O-N 3.09Å; H279-S281 VanDerWaalsContact O-O 3.1Å; H279-S299 PolarHBondContact CD2-OG 3.42Å; H279-S299 PolarHBondContact NE2-OG 3.11Å; H279-T307 VanDerWaalsContact CE1-CG2 3.44Å; H279-T307 WeakPolarHBondContact CE1-CG2 3.23Å
280	D	62.7	Low	85.2	Confident	121 Å²	121	41.3 Å²	41.3	65%	0.647	24%	0.235	S	C	*	.	S	Bend	trans	-57.7	-17.5	-180	-63.1	-33.1	0	0	0	113.2	S282	D280-S282 PolarHBondContact O-N 2.95Å
281	S	62.2	Low	84.8	Confident	30 Å²	30	37.7 Å²	37.7	21%	0.21	22%	0.216	C	C	.	.	S	Bend	trans	-78.2	115.8	165.6	78.3	0	0	0	0	110.2	H279 A283	H279-S281 CarbonylContact O-C 3.59Å; H279-S281 PolarHBondContact O-N 3.09Å; H279-S281 VanDerWaalsContact O-O 3.1Å; S281-A283 PolarHBondContact O-N 2.82Å
282	S	62.8	Low	84.3	Confident	108 Å²	108	40 Å²	40	76%	0.755	23%	0.228	S	C	*	.			trans	-65.6	24.3	164.9	-44.6	0	0	0	0	113.4	D280	D280-S282 PolarHBondContact O-N 2.95Å
283	A	77.9	Confident	83.5	Confident	30 Å²	30	41.5 Å²	41.5	25%	0.248	23%	0.229	C	C	.	.	S	Bend	trans	-92.1	139.6	-178.9	0	0	0	0	0	109.9	G261 S281 V285 C301	G261-A283 VanDerWaalsContact CA-O 3.31Å; G261-A283 WeakPolarHBondContact CA-O 3.27Å; S281-A283 PolarHBondContact O-N 2.82Å; A283-V285 PolarHBondContact O-N 3.04Å; A283-C301 HydrophobicContact CB-CB 3.82Å; A283-C301 VanDerWaalsContact CB-SG 3.56Å
284	I	81.1	Confident	82.5	Confident	29 Å²	29	40.7 Å²	40.7	15%	0.149	22%	0.222	C	C	.	.			trans	-52.9	124.1	179.7	-63.7	167.7	0	0	0	111.2	I241 L243 T259 N286 C301	I241-I284 HydrophobicContact CD1-CD1 4.04Å; I241-I284 HydrophobicContact CD1-CG2 3.34Å; L243-I284 HydrophobicContact CD2-CG2 4.12Å; T259-I284 HydrophobicContact CG2-CG1 4.35Å; T259-I284 HydrophobicContact CG2-CG2 4.24Å; I284-N286 HydrophobicContact CG2-CB 4.38Å; I284-N286 PolarHBondContact O-N 2.98Å; I284-C301 VanDerWaalsContact O-CA 3.28Å; I284-C301 WeakPolarHBondContact O-CA 3.47Å; I284-C301 WeakPolarHBondContact O-CB 3.32Å
285	V	86	Confident	81.6	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.018	22%	0.222	C	C	.	.			trans	-88.2	100.6	172.1	-176.5	0	0	0	0	109.3	L243 G257 S258 V263 A283 V288 A300	L243-V285 WeakPolarHBondContact CD2-O 3.42Å; G257-V285 CarbonylContact C-O 3.54Å; G257-V285 WeakPolarHBondContact CA-O 3.48Å; S258-V285 PolarHBondContact N-O 2.98Å; S258-V285 PolarHBondContact O-N 3.01Å; V263-V285 HydrophobicContact CG2-CG1 4.02Å; A283-V285 PolarHBondContact O-N 3.04Å; V285-V288 HydrophobicContact CG1-CG1 3.55Å; V285-A300 CarbonylContact C-O 3.56Å
286	N	88.6	Confident	81.2	Confident	9 Å²	9	41.4 Å²	41.4	5%	0.048	22%	0.22	C	C	.	.			trans	-96.9	-30.2	-177.8	61.3	-93	0	0	0	115	R23 I24 L243 E244 I284 A300	R23-N286 PolarHBondContact NE-OD1 2.75Å; R23-N286 VanDerWaalsContact NE-OD1 3.16Å; R23-N286 VanDerWaalsContact NH2-CG 3.35Å; I24-N286 PolarHBondContact O-ND2 2.81Å; L243-N286 HydrophobicContact CD2-CB 4.15Å; E244-N286 WeakPolarHBondContact CG-O 3.33Å; E244-N286 PolarHBondContact N-O 2.79Å; I284-N286 HydrophobicContact CG2-CB 4.38Å; I284-N286 PolarHBondContact O-N 2.98Å; N286-A300 PolarHBondContact N-O 2.96Å; N286-A300 PolarHBondContact OD1-O 2.89Å
287	C	88.9	Confident	80.9	Confident	2 Å²	2	37 Å²	37	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	141.3	173.6	-55.2	0	0	0	0	109.9	N25 V27 E244 S299 A300	N25-C287 PolarHBondContact O-SG 2.73Å; V27-C287 HydrophobicContact CG1-CB 4.4Å; V27-C287 HydrophobicContact CG2-CB 3.84Å; E244-C287 VanDerWaalsContact OE2-CA 3.27Å; E244-C287 WeakPolarHBondContact OE2-CA 3.5Å; E244-C287 VanDerWaalsContact OE2-CB 3.32Å; E244-C287 WeakPolarHBondContact OE2-CB 3.38Å; C287-S299 CarbonylContact O-C 3.48Å; C287-S299 VanDerWaalsContact O-CA 3.27Å; C287-S299 WeakPolarHBondContact O-CA 3.18Å; C287-A300 HydrophobicContact CB-CB 3.89Å; C287-A300 PolarHBondContact N-O 3.43Å; C287-A300 PolarHBondContact O-N 3.02Å
288	V	90.6	Very high	80.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	134.8	171.2	-64.3	0	0	0	0	110.9	E244 L255 V263 V285 A298	E244-V288 HydrophobicContact CB-CG2 4.45Å; E244-V288 WeakPolarHBondContact O-CG2 3.38Å; E244-V288 PolarHBondContact OE2-N 3.47Å; L255-V288 HydrophobicContact CD1-CB 3.84Å; L255-V288 HydrophobicContact CD1-CG2 3.88Å; L255-V288 HydrophobicContact CG-CG2 4.36Å; V263-V288 HydrophobicContact CG1-CG1 4.37Å; V263-V288 HydrophobicContact CG2-CG1 4.02Å; V285-V288 HydrophobicContact CG1-CG1 3.55Å; V288-A298 CarbonylContact C-O 3.5Å; V288-A298 VanDerWaalsContact CA-O 3.31Å; V288-A298 WeakPolarHBondContact CA-O 3.42Å
289	R	89.8	Confident	81	Confident	42 Å²	42	31.3 Å²	31.3	16%	0.158	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	145	173.8	-69.2	-66.9	-178.6	-79.2	-10.9	109.8	V27 F29 E244 M297 A298	V27-R289 HydrophobicContact CG2-CB 4.4Å; V27-R289 HydrophobicContact CG2-CG 3.82Å; F29-R289 HydrophobicContact CD2-CB 3.76Å; F29-R289 HydrophobicContact CE2-CB 3.69Å; F29-R289 WeakPolarHBondContact CE2-O 3.3Å; E244-R289 VanDerWaalsContact CD-NH2 3.35Å; E244-R289 IonicContact OE1-CZ 3.7Å; E244-R289 IonicContact OE1-NH1 2.88Å; E244-R289 PolarHBondContact OE1-NH1 2.94Å; E244-R289 IonicContact OE1-NH2 3.69Å; E244-R289 PolarHBondContact OE1-NH2 2.73Å; E244-R289 IonicContact OE2-CZ 3.05Å; E244-R289 VanDerWaalsContact OE2-CZ 3.28Å; E244-R289 IonicContact OE2-NH1 2.84Å; E244-R289 PolarHBondContact OE2-NH1 2.99Å; E244-R289 IonicContact OE2-NH2 3.35Å; E244-R289 PolarHBondContact OE2-NH2 3.3Å; R289-M297 WeakPolarHBondContact O-CA 3.4Å; R289-M297 VanDerWaalsContact O-CG 3.27Å; R289-M297 WeakPolarHBondContact O-CG 3.42Å; R289-A298 PolarHBondContact N-O 2.85Å; R289-A298 PolarHBondContact O-N 2.94Å
290	F	88	Confident	81.6	Confident	16 Å²	16	31.1 Å²	31.1	7%	0.07	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	144.4	161.9	-99	-93.7	0	0	0	110.3	L8 L11 F29 T248 P249 L255 F265 Y295 M297	L8-F290 HydrophobicContact CD2-CZ 4.48Å; L11-F290 HydrophobicContact CD1-CZ 4.46Å; F29-F290 WeakPolarHBondContact CD2-O 3.16Å; T248-F290 HydrophobicContact CG2-CD2 4.11Å; T248-F290 HydrophobicContact CG2-CE2 3.97Å; T248-F290 HydrophobicContact CG2-CG 4.46Å; T248-F290 HydrophobicContact CG2-CZ 4.21Å; P249-F290 HydrophobicContact CG-CB 4.02Å; L255-F290 HydrophobicContact CD1-CD2 3.55Å; L255-F290 HydrophobicContact CD1-CE2 3.7Å; L255-F290 HydrophobicContact CD2-CD2 3.41Å; L255-F290 VanDerWaalsContact CD2-CD2 3.41Å; L255-F290 HydrophobicContact CD2-CE2 3.73Å; L255-F290 HydrophobicContact CG-CD2 4.1Å; L255-F290 HydrophobicContact CG-CE2 4.21Å; F265-F290 AromaticContact CE1-CE2 3.6Å; F265-F290 HydrophobicContact CE1-CE2 3.6Å; F265-F290 AromaticContact CE1-CZ 3.86Å; F265-F290 HydrophobicContact CE1-CZ 3.86Å; F265-F290 HydrophobicContact CZ-CE2 4.13Å; F265-F290 HydrophobicContact CZ-CZ 4.31Å; F290-Y295 HydrophobicContact CE1-CD1 4.38Å; F290-Y295 HydrophobicContact CE1-CE1 4.27Å; F290-M297 HydrophobicContact CD1-CB 4.45Å; F290-M297 HydrophobicContact CD2-CB 4.31Å; F290-M297 HydrophobicContact CD2-CG 4.03Å; F290-M297 HydrophobicContact CD2-SD 4.24Å; F290-M297 HydrophobicContact CE1-CB 4.2Å; F290-M297 HydrophobicContact CE2-CB 4.04Å; F290-M297 HydrophobicContact CE2-CG 3.86Å; F290-M297 HydrophobicContact CE2-SD 3.62Å; F290-M297 HydrophobicContact CZ-CB 4Å; F290-M297 HydrophobicContact CZ-CG 4.31Å; F290-M297 HydrophobicContact CZ-SD 4.18Å
291	N	89.3	Confident	82.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.			trans	-67.8	136.1	170.3	-172.6	-70.3	0	0	0	109.7	F29 G33 P249 Q293 Y294 L296	F29-N291 HydrophobicContact CD1-CB 4.1Å; F29-N291 WeakPolarHBondContact CD1-ND2 3.28Å; F29-N291 HydrophobicContact CD2-CB 4.35Å; F29-N291 HydrophobicContact CE1-CB 3.93Å; F29-N291 WeakPolarHBondContact CE1-ND2 3.38Å; F29-N291 HydrophobicContact CE2-CB 4.2Å; F29-N291 HydrophobicContact CG-CB 4.3Å; F29-N291 HydrophobicContact CZ-CB 3.98Å; G33-N291 WeakPolarHBondContact CA-ND2 3.34Å; G33-N291 WeakPolarHBondContact CA-OD1 3.22Å; G33-N291 PolarHBondContact O-ND2 2.78Å; P249-N291 WeakPolarHBondContact CG-O 3.44Å; N291-Q293 VanDerWaalsContact C-N 3.29Å; N291-Q293 PolarHBondContact O-N 3.06Å; N291-Q293 PolarHBondContact OD1-N 2.86Å; N291-Y294 WeakPolarHBondContact OD1-CD2 3.33Å; N291-Y294 PolarHBondContact OD1-N 3.07Å; N291-L296 HydrophobicContact CB-CB 3.78Å; N291-L296 HydrophobicContact CB-CD2 4.44Å; N291-L296 HydrophobicContact CB-CG 4.46Å; N291-L296 VanDerWaalsContact CB-O 3.25Å; N291-L296 WeakPolarHBondContact CB-O 3.42Å; N291-L296 PolarHBondContact N-O 2.79Å
292	P	84.4	Confident	82.5	Confident	62 Å²	62	29.7 Å²	29.7	40%	0.403	16%	0.162	S	C	.	.	S	Bend	trans	-71.1	-20.8	-175.2	27.2	-35	0	0	0	114.2	S30	S30-P292 WeakPolarHBondContact O-CG 3.44Å
293	Q	80.1	Confident	82.5	Confident	117 Å²	117	24.8 Å²	24.8	55%	0.547	13%	0.129	S	C	.	.	S	Bend	trans	-116	-38.1	-175.2	-62.7	-160.3	-5.3	0	0	113.5	D32 N291	D32-Q293 VanDerWaalsContact C-CD 3.42Å; D32-Q293 PolarHBondContact O-OE1 3.13Å; N291-Q293 VanDerWaalsContact C-N 3.29Å; N291-Q293 PolarHBondContact O-N 3.06Å; N291-Q293 PolarHBondContact OD1-N 2.86Å
294	Y	76.3	Confident	81.8	Confident	44 Å²	44	23.3 Å²	23.3	17%	0.173	12%	0.117	C	C	.	.	S	Bend	trans	-103.1	154.2	-174.4	-51.1	-59.5	0	0	0	110.8	G33 N291 L296 F316	G33-Y294 WeakPolarHBondContact O-CD2 3.3Å; G33-Y294 WeakPolarHBondContact O-CE2 3.28Å; N291-Y294 WeakPolarHBondContact OD1-CD2 3.33Å; N291-Y294 PolarHBondContact OD1-N 3.07Å; Y294-L296 PolarHBondContact O-N 3.3Å; Y294-F316 HydrophobicContact CD1-CD2 4.49Å; Y294-F316 AromaticContact CD1-CE2 3.32Å; Y294-F316 HydrophobicContact CD1-CE2 3.32Å; Y294-F316 AromaticContact CD1-CZ 3.51Å; Y294-F316 HydrophobicContact CD1-CZ 3.51Å; Y294-F316 HydrophobicContact CD2-CZ 4.44Å; Y294-F316 AromaticContact CE1-CE2 3.74Å; Y294-F316 HydrophobicContact CE1-CE2 3.74Å; Y294-F316 HydrophobicContact CE1-CZ 4.12Å; Y294-F316 HydrophobicContact CG-CE2 4.02Å; Y294-F316 AromaticContact CG-CZ 3.69Å; Y294-F316 HydrophobicContact CG-CZ 3.69Å
295	Y	77.6	Confident	81	Confident	37 Å²	37	22.1 Å²	22.1	15%	0.145	11%	0.111	C	C	.	.	S	Bend	trans	-77.5	67.6	171	-153.6	-61.6	0	0	0	109.6	I3 S7 L11 F290 C308 L309	I3-Y295 HydrophobicContact CB-CE2 4.04Å; I3-Y295 HydrophobicContact CD1-CE2 4.22Å; I3-Y295 HydrophobicContact CG1-CD2 4.06Å; I3-Y295 HydrophobicContact CG1-CE2 3.48Å; I3-Y295 VanDerWaalsContact CG1-CE2 3.48Å; I3-Y295 HydrophobicContact CG2-CE2 4.22Å; I3-Y295 WeakPolarHBondContact CG2-OH 3.4Å; S7-Y295 PolarHBondContact OG-OH 3.23Å; L11-Y295 HydrophobicContact CD2-CD1 4.22Å; L11-Y295 HydrophobicContact CD2-CE1 3.88Å; L11-Y295 HydrophobicContact CG-CE1 4.31Å; F290-Y295 HydrophobicContact CE1-CD1 4.38Å; F290-Y295 HydrophobicContact CE1-CE1 4.27Å; Y295-C308 PolarHBondContact O-SG 3.29Å; Y295-L309 HydrophobicContact CD1-CB 4.08Å; Y295-L309 HydrophobicContact CD1-CD1 3.4Å; Y295-L309 VanDerWaalsContact CD1-CD1 3.4Å; Y295-L309 HydrophobicContact CD1-CG 3.8Å; Y295-L309 HydrophobicContact CD2-CD1 4.09Å; Y295-L309 HydrophobicContact CE1-CB 4.49Å; Y295-L309 HydrophobicContact CE1-CD1 3.1Å; Y295-L309 HydrophobicContact CE1-CG 3.71Å; Y295-L309 HydrophobicContact CE2-CD1 3.76Å; Y295-L309 HydrophobicContact CG-CD1 3.9Å
296	L	83.1	Confident	79.8	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.9	-174.9	-178.6	74	0	0	0	108.1	L14 F29 C50 N291 Y294 I306 C308	L14-L296 HydrophobicContact CD2-CD1 4.13Å; F29-L296 HydrophobicContact CE1-CD2 4Å; F29-L296 HydrophobicContact CZ-CD2 4.4Å; C50-L296 HydrophobicContact CB-CD2 3.6Å; N291-L296 HydrophobicContact CB-CB 3.78Å; N291-L296 HydrophobicContact CB-CD2 4.44Å; N291-L296 HydrophobicContact CB-CG 4.46Å; N291-L296 VanDerWaalsContact CB-O 3.25Å; N291-L296 WeakPolarHBondContact CB-O 3.42Å; N291-L296 PolarHBondContact N-O 2.79Å; Y294-L296 PolarHBondContact O-N 3.3Å; L296-I306 HydrophobicContact CD1-CG2 3.52Å; L296-I306 HydrophobicContact CD2-CG2 4.43Å; L296-I306 HydrophobicContact CG-CG2 4.17Å; L296-C308 HydrophobicContact CD1-CB 3.54Å
297	M	86.5	Confident	78.3	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.4	174.7	-174	-178.5	68.5	0	0	109.4	L255 V263 F265 R289 F290 T307	L255-M297 HydrophobicContact CD1-CG 4.26Å; L255-M297 HydrophobicContact CD1-SD 3.62Å; V263-M297 HydrophobicContact CB-CE 4.12Å; V263-M297 HydrophobicContact CG1-CE 4.05Å; V263-M297 HydrophobicContact CG1-SD 3.95Å; V263-M297 HydrophobicContact CG2-CE 3.92Å; F265-M297 HydrophobicContact CE1-SD 4.41Å; F265-M297 HydrophobicContact CZ-CE 4.2Å; F265-M297 HydrophobicContact CZ-SD 3.74Å; R289-M297 WeakPolarHBondContact O-CA 3.4Å; R289-M297 VanDerWaalsContact O-CG 3.27Å; R289-M297 WeakPolarHBondContact O-CG 3.42Å; F290-M297 HydrophobicContact CD1-CB 4.45Å; F290-M297 HydrophobicContact CD2-CB 4.31Å; F290-M297 HydrophobicContact CD2-CG 4.03Å; F290-M297 HydrophobicContact CD2-SD 4.24Å; F290-M297 HydrophobicContact CE1-CB 4.2Å; F290-M297 HydrophobicContact CE2-CB 4.04Å; F290-M297 HydrophobicContact CE2-CG 3.86Å; F290-M297 HydrophobicContact CE2-SD 3.62Å; F290-M297 HydrophobicContact CZ-CB 4Å; F290-M297 HydrophobicContact CZ-CG 4.31Å; F290-M297 HydrophobicContact CZ-SD 4.18Å; M297-T307 WeakPolarHBondContact CE-OG1 3.29Å; M297-T307 PolarHBondContact N-O 2.66Å; M297-T307 PolarHBondContact O-N 3.42Å
298	A	87.2	Confident	76.8	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.3	167.5	0	0	0	0	0	109	F29 L36 V288 R289 L304	F29-A298 HydrophobicContact CE2-CB 3.89Å; F29-A298 HydrophobicContact CZ-CB 3.64Å; L36-A298 HydrophobicContact CD1-CB 4.07Å; L36-A298 HydrophobicContact CD2-CB 3.51Å; L36-A298 HydrophobicContact CG-CB 4.47Å; V288-A298 CarbonylContact C-O 3.5Å; V288-A298 VanDerWaalsContact CA-O 3.31Å; V288-A298 WeakPolarHBondContact CA-O 3.42Å; R289-A298 PolarHBondContact N-O 2.85Å; R289-A298 PolarHBondContact O-N 2.94Å; A298-L304 HydrophobicContact CB-CD1 4.37Å
299	S	86.1	Confident	74.9	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.007	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.9	170.3	56	0	0	0	0	109	H279 C287 V305	H279-S299 PolarHBondContact CD2-OG 3.42Å; H279-S299 PolarHBondContact NE2-OG 3.11Å; C287-S299 CarbonylContact O-C 3.48Å; C287-S299 VanDerWaalsContact O-CA 3.27Å; C287-S299 WeakPolarHBondContact O-CA 3.18Å; S299-V305 PolarHBondContact N-O 2.94Å; S299-V305 CarbonylContact O-C 3.57Å; S299-V305 WeakPolarHBondContact O-CA 3.34Å; S299-V305 PolarHBondContact O-N 3.48Å; S299-V305 WeakPolarHBondContact OG-CB 3.24Å; S299-V305 PolarHBondContact OG-O 3.19Å
300	A	83.6	Confident	72.8	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.008	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.2	-173.9	0	0	0	0	0	112.9	I24 V27 V285 N286 C287 L304	I24-A300 HydrophobicContact CB-CB 3.83Å; I24-A300 HydrophobicContact CD1-CB 4Å; I24-A300 HydrophobicContact CG1-CB 4.49Å; I24-A300 HydrophobicContact CG2-CB 3.64Å; V27-A300 HydrophobicContact CG1-CB 4.01Å; V285-A300 CarbonylContact C-O 3.56Å; N286-A300 PolarHBondContact N-O 2.96Å; N286-A300 PolarHBondContact OD1-O 2.89Å; C287-A300 HydrophobicContact CB-CB 3.89Å; C287-A300 PolarHBondContact N-O 3.43Å; C287-A300 PolarHBondContact O-N 3.02Å; A300-L304 HydrophobicContact CB-CD1 3.89Å
301	C	79.8	Confident	70.5	Confident	10 Å²	10	25.5 Å²	25.5	7%	0.068	13%	0.129	C	C	.	.	S	Bend	trans	-132.9	-127.7	177.2	67.6	0	0	0	0	110.1	I24 A283 I284 G303	I24-C301 PolarHBondContact N-O 3.26Å; A283-C301 HydrophobicContact CB-CB 3.82Å; A283-C301 VanDerWaalsContact CB-SG 3.56Å; I284-C301 VanDerWaalsContact O-CA 3.28Å; I284-C301 WeakPolarHBondContact O-CA 3.47Å; I284-C301 WeakPolarHBondContact O-CB 3.32Å; C301-G303 PolarHBondContact N-O 2.94Å; C301-G303 PolarHBondContact SG-N 3.48Å; C301-G303 PolarHBondContact SG-O 3.04Å; C301-G303 VanDerWaalsContact SG-O 3.4Å
302	N	65.5	Low	68.1	Low	111 Å²	111	33.7 Å²	33.7	59%	0.594	17%	0.165	S	C	*	.	S	Bend	trans	-73.1	-15	161.9	-69.8	-4.8	0	0	0	113.4
303	G	61.3	Low	65.6	Low	5 Å²	5	38.3 Å²	38.3	5%	0.052	18%	0.181	C	C	.	.	S	Bend	trans	-130	171.2	167.8	0	0	0	0	0	109.6	I24 C301	I24-G303 VanDerWaalsContact CD1-C 3.5Å; C301-G303 PolarHBondContact N-O 2.94Å; C301-G303 PolarHBondContact SG-N 3.48Å; C301-G303 PolarHBondContact SG-O 3.04Å; C301-G303 VanDerWaalsContact SG-O 3.4Å
304	L	63.5	Low	63.4	Low	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.2	171.6	-177.3	72.2	0	0	0	108.2	T17 I24 V27 L36 Y48 A298 A300 I306	T17-L304 PolarHBondContact N-O 2.79Å; T17-L304 PolarHBondContact O-N 2.97Å; T17-L304 WeakPolarHBondContact OG1-CB 3.33Å; T17-L304 PolarHBondContact OG1-O 2.89Å; I24-L304 HydrophobicContact CD1-CB 3.49Å; I24-L304 VanDerWaalsContact CD1-CB 3.49Å; I24-L304 HydrophobicContact CD1-CD1 4.19Å; I24-L304 HydrophobicContact CD1-CG 4.43Å; V27-L304 HydrophobicContact CG1-CD1 4.02Å; L36-L304 HydrophobicContact CD2-CD1 4.2Å; L36-L304 HydrophobicContact CD2-CD2 3.58Å; L36-L304 HydrophobicContact CD2-CG 4.39Å; Y48-L304 HydrophobicContact CD1-CD2 4.27Å; Y48-L304 HydrophobicContact CD2-CD2 3.49Å; Y48-L304 VanDerWaalsContact CD2-CD2 3.49Å; Y48-L304 HydrophobicContact CE1-CD2 4.08Å; Y48-L304 HydrophobicContact CE2-CD2 3.26Å; Y48-L304 HydrophobicContact CG-CD2 3.99Å; A298-L304 HydrophobicContact CB-CD1 4.37Å; A300-L304 HydrophobicContact CB-CD1 3.89Å; L304-I306 HydrophobicContact CD2-CD1 3.91Å; L304-I306 HydrophobicContact CD2-CG1 3.88Å; L304-I306 HydrophobicContact CG-CG1 4.01Å
305	V	65.2	Low	61.7	Low	4 Å²	4	44.1 Å²	44.1	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.5	172.2	179.6	0	0	0	0	106.8	L13 I16 S299 T307	L13-V305 HydrophobicContact CD1-CG1 3.48Å; L13-V305 VanDerWaalsContact CD1-CG1 3.48Å; I16-V305 HydrophobicContact CG1-CG1 4.39Å; I16-V305 HydrophobicContact CG1-CG2 4.23Å; I16-V305 HydrophobicContact CG2-CG2 4.29Å; S299-V305 PolarHBondContact N-O 2.94Å; S299-V305 CarbonylContact O-C 3.57Å; S299-V305 WeakPolarHBondContact O-CA 3.34Å; S299-V305 PolarHBondContact O-N 3.48Å; S299-V305 WeakPolarHBondContact OG-CB 3.24Å; S299-V305 PolarHBondContact OG-O 3.19Å; V305-T307 HydrophobicContact CG1-CG2 4.03Å
306	I	59.6	Low	60	Low	3 Å²	3	46 Å²	46	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.5	174.4	-58.2	178.2	0	0	0	106.7	L14 K15 L36 L296 L304	L14-I306 WeakPolarHBondContact CB-O 3.31Å; L14-I306 HydrophobicContact CD2-CG2 4.07Å; L14-I306 PolarHBondContact N-O 2.8Å; L14-I306 VanDerWaalsContact N-O 3.13Å; K15-I306 PolarHBondContact N-O 2.96Å; K15-I306 PolarHBondContact O-N 3.08Å; L36-I306 HydrophobicContact CD2-CD1 4.23Å; L36-I306 HydrophobicContact CD2-CG1 4.36Å; L296-I306 HydrophobicContact CD1-CG2 3.52Å; L296-I306 HydrophobicContact CD2-CG2 4.43Å; L296-I306 HydrophobicContact CG-CG2 4.17Å; L304-I306 HydrophobicContact CD2-CD1 3.91Å; L304-I306 HydrophobicContact CD2-CG1 3.88Å; L304-I306 HydrophobicContact CG-CG1 4.01Å
307	T	57.7	Low	58.2	Low	1 Å²	1	54.4 Å²	54.4	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.7	179.2	40.3	0	0	0	0	109.8	T12 L13 H279 M297 V305	T12-T307 WeakPolarHBondContact O-CA 3.35Å; T12-T307 WeakPolarHBondContact O-CB 3.35Å; L13-T307 HydrophobicContact CB-CG2 4.41Å; L13-T307 HydrophobicContact CD1-CG2 3.93Å; H279-T307 VanDerWaalsContact CE1-CG2 3.44Å; H279-T307 WeakPolarHBondContact CE1-CG2 3.23Å; M297-T307 WeakPolarHBondContact CE-OG1 3.29Å; M297-T307 PolarHBondContact N-O 2.66Å; M297-T307 PolarHBondContact O-N 3.42Å; V305-T307 HydrophobicContact CG1-CG2 4.03Å
308	C	58.1	Low	56.2	Low	3 Å²	3	54.9 Å²	54.9	2%	0.02	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158.8	-176.2	-167.5	0	0	0	0	108.8	T12 L14 Y295 L296 L310	T12-C308 CarbonylContact C-O 3.59Å; T12-C308 PolarHBondContact N-O 3.12Å; T12-C308 PolarHBondContact O-N 3.41Å; T12-C308 PolarHBondContact OG1-O 3.13Å; T12-C308 VanDerWaalsContact OG1-O 3.1Å; L14-C308 HydrophobicContact CB-CB 3.94Å; L14-C308 HydrophobicContact CD2-CB 4.04Å; L14-C308 HydrophobicContact CG-CB 4.42Å; Y295-C308 PolarHBondContact O-SG 3.29Å; L296-C308 HydrophobicContact CD1-CB 3.54Å; C308-L310 PolarHBondContact O-N 3.04Å
309	L	51	Low	54	Low	11 Å²	11	57.6 Å²	57.6	6%	0.058	28%	0.28	C	S	.	.			trans	-79.6	106.8	157.6	-83.3	171.9	0	0	0	108.6	M1 S7 E10 L11 Y295 F311	M1-L309 HydrophobicContact SD-CD1 4.5Å; S7-L309 VanDerWaalsContact O-CD1 3.31Å; S7-L309 WeakPolarHBondContact O-CD1 3.48Å; S7-L309 WeakPolarHBondContact O-CD2 3.36Å; E10-L309 HydrophobicContact CB-CD2 3.64Å; E10-L309 VanDerWaalsContact O-CD2 3.25Å; E10-L309 WeakPolarHBondContact O-CD2 3.35Å; L11-L309 HydrophobicContact CD2-CG 3.96Å; L11-L309 HydrophobicContact CG-CG 4.32Å; Y295-L309 HydrophobicContact CD1-CB 4.08Å; Y295-L309 HydrophobicContact CD1-CD1 3.4Å; Y295-L309 VanDerWaalsContact CD1-CD1 3.4Å; Y295-L309 HydrophobicContact CD1-CG 3.8Å; Y295-L309 HydrophobicContact CD2-CD1 4.09Å; Y295-L309 HydrophobicContact CE1-CB 4.49Å; Y295-L309 HydrophobicContact CE1-CD1 3.1Å; Y295-L309 HydrophobicContact CE1-CG 3.71Å; Y295-L309 HydrophobicContact CE2-CD1 3.76Å; Y295-L309 HydrophobicContact CG-CD1 3.9Å; L309-F311 HydrophobicContact CB-CD2 3.86Å; L309-F311 HydrophobicContact CB-CE2 3.59Å; L309-F311 HydrophobicContact CD1-CE2 3.65Å; L309-F311 HydrophobicContact CD1-CZ 4.27Å; L309-F311 HydrophobicContact CD2-CE2 4.07Å; L309-F311 HydrophobicContact CD2-CZ 4.36Å; L309-F311 HydrophobicContact CG-CE2 3.98Å; L309-F311 PolarHBondContact O-N 3.23Å; L309-F311 VanDerWaalsContact O-N 3.17Å
310	L	45.6	Very low	52.2	Low	50 Å²	50	62.4 Å²	62.4	26%	0.262	31%	0.314	S	S	.	.			trans	-73.2	99.1	163.7	-71.8	170.4	0	0	0	108.5	T12 L14 C308 I323	T12-L310 PolarHBondContact OG1-N 3.2Å; L14-L310 HydrophobicContact CD1-CD2 3.79Å; L14-L310 HydrophobicContact CD1-CG 4.39Å; C308-L310 PolarHBondContact O-N 3.04Å; L310-I323 HydrophobicContact CD1-CD1 3.52Å; L310-I323 HydrophobicContact CD1-CG1 3.96Å; L310-I323 HydrophobicContact CD2-CD1 3.86Å; L310-I323 HydrophobicContact CD2-CG1 4.2Å; L310-I323 HydrophobicContact CG-CD1 4.36Å
311	F	39.9	Very low	50.5	Low	74 Å²	74	66.7 Å²	66.7	33%	0.325	34%	0.344	S	S	.	.			trans	-92.3	115.9	162	-77.7	-79.6	0	0	0	109.6	M1 L309 E313	M1-F311 HydrophobicContact CE-CD1 4.14Å; M1-F311 HydrophobicContact CE-CD2 3.71Å; M1-F311 HydrophobicContact CE-CE1 3.84Å; M1-F311 HydrophobicContact CE-CE2 3.36Å; M1-F311 HydrophobicContact CE-CG 4.09Å; M1-F311 HydrophobicContact CE-CZ 3.44Å; M1-F311 VanDerWaalsContact CE-CZ 3.44Å; M1-F311 HydrophobicContact SD-CD2 3.93Å; M1-F311 HydrophobicContact SD-CE2 3.18Å; M1-F311 WeakPolarHBondContact SD-CE2 3.31Å; M1-F311 HydrophobicContact SD-CZ 3.56Å; M1-F311 VanDerWaalsContact SD-CZ 3.56Å; L309-F311 HydrophobicContact CB-CD2 3.86Å; L309-F311 HydrophobicContact CB-CE2 3.59Å; L309-F311 HydrophobicContact CD1-CE2 3.65Å; L309-F311 HydrophobicContact CD1-CZ 4.27Å; L309-F311 HydrophobicContact CD2-CE2 4.07Å; L309-F311 HydrophobicContact CD2-CZ 4.36Å; L309-F311 HydrophobicContact CG-CE2 3.98Å; L309-F311 PolarHBondContact O-N 3.23Å; L309-F311 VanDerWaalsContact O-N 3.17Å; F311-E313 PolarHBondContact O-N 3.02Å
312	F	37.2	Very low	48.8	Very low	172 Å²	172	66.3 Å²	66.3	75%	0.754	34%	0.341	S	S	*	.			trans	-74.8	50	161.9	-74.6	-87.3	0	0	0	110.7
313	E	32.6	Very low	48.2	Very low	160 Å²	160	63.5 Å²	63.5	75%	0.748	33%	0.326	S	S	*	.	S	Bend	trans	-141.7	94.4	169.3	-74.2	-165.2	164.2	0	0	110.7	F311 N315	F311-E313 PolarHBondContact O-N 3.02Å; E313-N315 VanDerWaalsContact C-N 3.28Å; E313-N315 PolarHBondContact O-N 2.6Å
314	D	34.9	Very low	47.6	Very low	132 Å²	132	67.5 Å²	67.5	71%	0.706	35%	0.346	S	S	*	.	S	Bend	trans	45.8	-3.8	156.7	-71.8	-21	0	0	0	123
315	N	39.3	Very low	46.6	Very low	151 Å²	151	72.7 Å²	72.7	81%	0.807	38%	0.382	S	S	*	.	S	Bend	trans	-134.2	6.5	-175.3	-73.1	-57.3	0	0	0	117.1	E313	E313-N315 VanDerWaalsContact C-N 3.28Å; E313-N315 PolarHBondContact O-N 2.6Å
316	F	42.8	Very low	45.4	Very low	77 Å²	77	76.5 Å²	76.5	34%	0.338	41%	0.414	S	S	.	.			trans	-149.6	104.1	167	-150.3	-104.5	0	0	0	110.7	Y294 L318	Y294-F316 HydrophobicContact CD1-CD2 4.49Å; Y294-F316 AromaticContact CD1-CE2 3.32Å; Y294-F316 HydrophobicContact CD1-CE2 3.32Å; Y294-F316 AromaticContact CD1-CZ 3.51Å; Y294-F316 HydrophobicContact CD1-CZ 3.51Å; Y294-F316 HydrophobicContact CD2-CZ 4.44Å; Y294-F316 AromaticContact CE1-CE2 3.74Å; Y294-F316 HydrophobicContact CE1-CE2 3.74Å; Y294-F316 HydrophobicContact CE1-CZ 4.12Å; Y294-F316 HydrophobicContact CG-CE2 4.02Å; Y294-F316 AromaticContact CG-CZ 3.69Å; Y294-F316 HydrophobicContact CG-CZ 3.69Å; F316-L318 HydrophobicContact CE1-CD1 4.26Å
317	W	45.7	Very low	44.1	Very low	177 Å²	177	79.7 Å²	79.7	67%	0.67	45%	0.447	S	S	*	.			trans	-102	102.5	176	-68.6	92.5	0	0	0	109.1
318	L	43.6	Very low	42.5	Very low	10 Å²	10	88.3 Å²	88.3	5%	0.052	49%	0.487	C	S	.	.			trans	-78.9	120.4	138.5	-86.3	141.1	0	0	0	105.5	L14 R51 F316 C322	L14-L318 HydrophobicContact CD1-CB 4.04Å; L14-L318 HydrophobicContact CD1-CD1 3.71Å; L14-L318 HydrophobicContact CD1-CD2 4.45Å; L14-L318 HydrophobicContact CD1-CG 4.28Å; L14-L318 HydrophobicContact CD2-CD1 3.29Å; L14-L318 HydrophobicContact CD2-CD2 3.97Å; L14-L318 HydrophobicContact CD2-CG 4.2Å; L14-L318 HydrophobicContact CG-CD1 4.12Å; R51-L318 WeakPolarHBondContact O-CD2 3.25Å; R51-L318 WeakPolarHBondContact O-CG 3.14Å; F316-L318 HydrophobicContact CE1-CD1 4.26Å; L318-C322 HydrophobicContact CB-CB 4.18Å; L318-C322 HydrophobicContact CD2-CB 3.83Å
319	P	40.7	Very low	41.2	Very low	56 Å²	56	94 Å²	94	36%	0.364	53%	0.525	S	S	.	.			trans	-52	148.2	177	-4.6	1.3	0	0	0	110.3	S321 C322	P319-S321 PolarHBondContact O-N 2.95Å; P319-C322 WeakPolarHBondContact CD-SG 3.31Å; P319-C322 WeakPolarHBondContact O-CB 3.2Å; P319-C322 PolarHBondContact O-N 3.35Å; P319-C322 PolarHBondContact O-SG 3.37Å; P319-C322 VanDerWaalsContact O-SG 3.36Å
320	S	48.3	Very low	40.1	Very low	102 Å²	102	106.2 Å²	106.2	71%	0.713	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-56.2	-23.8	178.6	52.6	0	0	0	0	113.2	C322 I323	S320-C322 PolarHBondContact O-N 3.09Å; S320-I323 PolarHBondContact O-N 3.48Å; S320-I323 VanDerWaalsContact O-N 3.14Å
321	S	47.6	Very low	39.8	Very low	92 Å²	92	109.1 Å²	109.1	64%	0.643	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-65.6	-11.9	171.8	59.4	0	0	0	0	114.8	P319	P319-S321 PolarHBondContact O-N 2.95Å
322	C	45.9	Very low	39.8	Very low	2 Å²	2	110.9 Å²	110.9	1%	0.014	61%	0.612	C	S	.	*	G	3₁₀ helix	trans	-86.9	-14.6	175.4	-55.9	0	0	0	0	112.4	T52 L318 P319 S320	T52-C322 PolarHBondContact O-SG 2.74Å; L318-C322 HydrophobicContact CB-CB 4.18Å; L318-C322 HydrophobicContact CD2-CB 3.83Å; P319-C322 WeakPolarHBondContact CD-SG 3.31Å; P319-C322 WeakPolarHBondContact O-CB 3.2Å; P319-C322 PolarHBondContact O-N 3.35Å; P319-C322 PolarHBondContact O-SG 3.37Å; P319-C322 VanDerWaalsContact O-SG 3.36Å; S320-C322 PolarHBondContact O-N 3.09Å
323	I	50.9	Low	40	Very low	52 Å²	52	107.5 Å²	107.5	27%	0.267	60%	0.604	S	S	.	*	S	Bend	trans	-91.8	112.4	179.1	-54.3	167.6	0	0	0	107.4	L14 L310 S320 S325	L14-I323 HydrophobicContact CD1-CG1 4.14Å; L14-I323 WeakPolarHBondContact O-CA 3.39Å; L310-I323 HydrophobicContact CD1-CD1 3.52Å; L310-I323 HydrophobicContact CD1-CG1 3.96Å; L310-I323 HydrophobicContact CD2-CD1 3.86Å; L310-I323 HydrophobicContact CD2-CG1 4.2Å; L310-I323 HydrophobicContact CG-CD1 4.36Å; S320-I323 PolarHBondContact O-N 3.48Å; S320-I323 VanDerWaalsContact O-N 3.14Å; I323-S325 PolarHBondContact O-N 3.16Å; I323-S325 VanDerWaalsContact O-N 3.12Å
324	D	49.1	Very low	40.4	Very low	89 Å²	89	104.4 Å²	104.4	48%	0.476	60%	0.595	S	S	.	*			trans	-67.1	111	166.9	-71.4	-37.3	0	0	0	106.9	K15 A326	K15-D324 WeakPolarHBondContact CG-OD2 3.28Å; D324-A326 PolarHBondContact O-N 3.26Å
325	S	43.2	Very low	40.8	Very low	108 Å²	108	102.7 Å²	102.7	76%	0.755	59%	0.588	S	S	*	*			trans	-57.1	114.9	169.1	54.1	0	0	0	0	107.1	I323 G327	I323-S325 PolarHBondContact O-N 3.16Å; I323-S325 VanDerWaalsContact O-N 3.12Å; S325-G327 PolarHBondContact O-N 2.92Å
326	A	40.6	Very low	40.9	Very low	85 Å²	85	99.5 Å²	99.5	70%	0.702	57%	0.574	S	S	*	*			trans	-48.2	110	172.1	0	0	0	0	0	107.5	D324 E328	D324-A326 PolarHBondContact O-N 3.26Å; A326-E328 PolarHBondContact O-N 3.48Å; A326-E328 VanDerWaalsContact O-N 3.13Å
327	G	31.9	Very low	40.7	Very low	69 Å²	69	101.1 Å²	101.1	71%	0.711	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-61.8	117.8	179.5	0	0	0	0	0	107.8	S325	S325-G327 PolarHBondContact O-N 2.92Å
328	E	23.1	Very low	40.3	Very low	182 Å²	182	95.2 Å²	95.2	85%	0.85	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-53.8	128.2	161.7	-72	-176.7	155.8	0	0	107.4	A326 E330	A326-E328 PolarHBondContact O-N 3.48Å; A326-E328 VanDerWaalsContact O-N 3.13Å; E328-E330 PolarHBondContact O-N 3.21Å
329	P	31.2	Very low	40.1	Very low	123 Å²	123	102.3 Å²	102.3	80%	0.799	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-66.7	125.7	168.6	27.4	-29.1	0	0	0	108
330	E	28.3	Very low	40	Very low	268 Å²	268	106.5 Å²	106.5	100%	1.252	65%	0.653	S	S	*	*			trans	-61.9	0	153.3	-77.9	-170.5	159.6	0	0	110.4	E328	E328-E330 PolarHBondContact O-N 3.21Å

Retrieved 330 of 330 residues in 126.1 ms (Link to these results)

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