A0A060WXK5_ONCMY Loading...

Guanine nucleotide binding protein (G protein), beta polypeptide 2

Guanine nucleotide-binding proteins (G proteins) are involved as a modulator or transducer in various transmembrane signaling systems. The beta and gamma chains are required for the GTPase activity, for replacement of GDP by GTP, and for G protein-effector interaction.

AlphaFold DB (A0A1S3LQE9), UniProt , Accession A0A060WXK5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110537401, Length 340 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	66.6	Low	93.1	Very high	151 Å²	151	109.5 Å²	109.5	74%	0.744	54%	0.539	S	S	*	.				0	124.4	0	-141.3	-174.1	-70.3	0	0	106.2	E5 Q6	M1-E5 WeakPolarHBondContact CA-OE2 3.36Å; M1-E5 HydrophobicContact CG-CB 3.76Å; M1-E5 VanDerWaalsContact CG-OE2 3.27Å; M1-E5 WeakPolarHBondContact CG-OE2 3.47Å; M1-E5 HydrophobicContact SD-CB 4.45Å; M1-Q6 HydrophobicContact CB-CG 4.32Å; M1-Q6 HydrophobicContact CG-CG 4.43Å; M1-Q6 HydrophobicContact SD-CG 3.99Å
2	S	91.7	Very high	93.4	Very high	67 Å²	67	107 Å²	107	47%	0.469	53%	0.525	S	S	.	.			trans	-64.6	150.3	176.6	177.4	0	0	0	0	109.8	L4 E5 Q6	S2-L4 PolarHBondContact O-N 3.04Å; S2-L4 PolarHBondContact OG-N 3.19Å; S2-E5 PolarHBondContact N-OE2 3.3Å; S2-E5 WeakPolarHBondContact O-CB 3.38Å; S2-E5 PolarHBondContact O-N 3.18Å; S2-Q6 PolarHBondContact O-N 3.05Å; S2-Q6 VanDerWaalsContact O-N 3.11Å
3	E	95.3	Very high	93.8	Very high	148 Å²	148	107.5 Å²	107.5	69%	0.692	53%	0.525	S	S	*	.	H	α-helix	trans	-51.8	-37.6	172.9	-176.5	179.4	177.5	0	0	111.3	E5 Q6 L7	E3-E5 PolarHBondContact O-N 3.36Å; E3-Q6 PolarHBondContact O-N 3.31Å; E3-L7 HydrophobicContact CG-CD1 4.45Å; E3-L7 WeakPolarHBondContact O-CG 3.37Å; E3-L7 PolarHBondContact O-N 2.89Å
4	L	95.4	Very high	94.1	Very high	94 Å²	94	105.8 Å²	105.8	49%	0.492	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-37.9	175.4	-179	63.6	0	0	0	113.2	S2 R8	S2-L4 PolarHBondContact O-N 3.04Å; S2-L4 PolarHBondContact OG-N 3.19Å; L4-R8 WeakPolarHBondContact O-CB 3.36Å; L4-R8 VanDerWaalsContact O-CG 3.27Å; L4-R8 WeakPolarHBondContact O-CG 2.91Å; L4-R8 PolarHBondContact O-N 3.31Å
5	E	95.6	Very high	94.2	Very high	104 Å²	104	109.1 Å²	109.1	49%	0.486	52%	0.524	S	S	.	.	H	α-helix	trans	-69.9	-38.2	178.3	-71.6	171.4	161.4	0	0	110.9	M1 S2 E3 R8 Q9	M1-E5 WeakPolarHBondContact CA-OE2 3.36Å; M1-E5 HydrophobicContact CG-CB 3.76Å; M1-E5 VanDerWaalsContact CG-OE2 3.27Å; M1-E5 WeakPolarHBondContact CG-OE2 3.47Å; M1-E5 HydrophobicContact SD-CB 4.45Å; S2-E5 PolarHBondContact N-OE2 3.3Å; S2-E5 WeakPolarHBondContact O-CB 3.38Å; S2-E5 PolarHBondContact O-N 3.18Å; E3-E5 PolarHBondContact O-N 3.36Å; E5-R8 PolarHBondContact O-N 3.48Å; E5-Q9 WeakPolarHBondContact O-CB 3.44Å; E5-Q9 PolarHBondContact O-N 2.93Å
6	Q	96.4	Very high	94.4	Very high	108 Å²	108	105.8 Å²	105.8	51%	0.505	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-49.3	175.7	-67.8	176.5	-15.5	0	0	111	M1 S2 E3 R8 Q9 E10	M1-Q6 HydrophobicContact CB-CG 4.32Å; M1-Q6 HydrophobicContact CG-CG 4.43Å; M1-Q6 HydrophobicContact SD-CG 3.99Å; S2-Q6 PolarHBondContact O-N 3.05Å; S2-Q6 VanDerWaalsContact O-N 3.11Å; E3-Q6 PolarHBondContact O-N 3.31Å; Q6-R8 VanDerWaalsContact C-N 3.33Å; Q6-R8 PolarHBondContact O-N 3.36Å; Q6-Q9 PolarHBondContact O-N 3.42Å; Q6-E10 WeakPolarHBondContact O-CB 3.4Å; Q6-E10 PolarHBondContact O-N 2.75Å
7	L	97.3	Very high	94.6	Very high	97 Å²	97	105.7 Å²	105.7	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-37.7	177.9	-70.2	172.5	0	0	0	112.5	E3 A11	E3-L7 HydrophobicContact CG-CD1 4.45Å; E3-L7 WeakPolarHBondContact O-CG 3.37Å; E3-L7 PolarHBondContact O-N 2.89Å; L7-A11 WeakPolarHBondContact O-CB 3.26Å; L7-A11 PolarHBondContact O-N 2.92Å
8	R	95.9	Very high	94.7	Very high	168 Å²	168	104.4 Å²	104.4	63%	0.634	50%	0.503	S	S	*	.	H	α-helix	trans	-64.5	-43.4	174.5	-78.9	176	178.9	-177.2	-0.3	112	L4 E5 Q6 A11 E12	L4-R8 WeakPolarHBondContact O-CB 3.36Å; L4-R8 VanDerWaalsContact O-CG 3.27Å; L4-R8 WeakPolarHBondContact O-CG 2.91Å; L4-R8 PolarHBondContact O-N 3.31Å; E5-R8 PolarHBondContact O-N 3.48Å; Q6-R8 VanDerWaalsContact C-N 3.33Å; Q6-R8 PolarHBondContact O-N 3.36Å; R8-A11 PolarHBondContact O-N 2.78Å; R8-E12 PolarHBondContact O-N 3.44Å; R8-E12 VanDerWaalsContact O-N 3.08Å
9	Q	96.4	Very high	94.8	Very high	118 Å²	118	106.7 Å²	106.7	55%	0.551	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-41.7	178.4	-172	175.2	5.7	0	0	111.2	E5 Q6 E12 Q13	E5-Q9 WeakPolarHBondContact O-CB 3.44Å; E5-Q9 PolarHBondContact O-N 2.93Å; Q6-Q9 PolarHBondContact O-N 3.42Å; Q9-E12 PolarHBondContact O-N 2.95Å; Q9-Q13 WeakPolarHBondContact O-CB 3.29Å; Q9-Q13 PolarHBondContact O-N 3.26Å
10	E	97.7	Very high	94.9	Very high	108 Å²	108	106.5 Å²	106.5	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-46.2	175.1	-175.6	177.7	-174.3	0	0	111.5	Q6 E12 Q13 L14	Q6-E10 WeakPolarHBondContact O-CB 3.4Å; Q6-E10 PolarHBondContact O-N 2.75Å; E10-E12 VanDerWaalsContact C-N 3.32Å; E10-E12 PolarHBondContact O-N 3.17Å; E10-Q13 WeakPolarHBondContact O-CB 3.49Å; E10-Q13 PolarHBondContact O-N 3.41Å; E10-L14 HydrophobicContact CG-CD1 4.23Å; E10-L14 WeakPolarHBondContact O-CG 3.28Å; E10-L14 PolarHBondContact O-N 2.64Å
11	A	96.1	Very high	95	Very high	41 Å²	41	104.1 Å²	104.1	34%	0.339	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-42.1	177.1	0	0	0	0	0	112.3	L7 R8 L14 R15	L7-A11 WeakPolarHBondContact O-CB 3.26Å; L7-A11 PolarHBondContact O-N 2.92Å; R8-A11 PolarHBondContact O-N 2.78Å; A11-L14 PolarHBondContact O-N 2.88Å; A11-R15 VanDerWaalsContact O-CG 3.31Å; A11-R15 WeakPolarHBondContact O-CG 3.43Å; A11-R15 PolarHBondContact O-N 3.19Å
12	E	96.5	Very high	96.5	Very high	80 Å²	80	98.9 Å²	98.9	37%	0.374	48%	0.479	S	S	.	.	H	α-helix	trans	-68.7	-37.4	177.4	-168.1	57.9	-157	0	0	111.9	R8 Q9 E10 R15 N16	R8-E12 PolarHBondContact O-N 3.44Å; R8-E12 VanDerWaalsContact O-N 3.08Å; Q9-E12 PolarHBondContact O-N 2.95Å; E10-E12 VanDerWaalsContact C-N 3.32Å; E10-E12 PolarHBondContact O-N 3.17Å; E12-R15 PolarHBondContact O-N 2.78Å; E12-R15 IonicContact OE2-NH1 3.39Å; E12-R15 PolarHBondContact OE2-NH1 3.26Å; E12-N16 PolarHBondContact O-N 3.14Å; E12-N16 PolarHBondContact O-ND2 3.32Å
13	Q	98	Very high	96.6	Very high	114 Å²	114	103.5 Å²	103.5	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-45.7	174.2	-174	176.4	1.6	0	0	111.6	Q9 E10 R15 N16 Q17	Q9-Q13 WeakPolarHBondContact O-CB 3.29Å; Q9-Q13 PolarHBondContact O-N 3.26Å; E10-Q13 WeakPolarHBondContact O-CB 3.49Å; E10-Q13 PolarHBondContact O-N 3.41Å; Q13-R15 PolarHBondContact O-N 3.47Å; Q13-N16 PolarHBondContact O-N 2.89Å; Q13-Q17 WeakPolarHBondContact O-CG 3.47Å; Q13-Q17 PolarHBondContact O-N 3.07Å
14	L	98.1	Very high	96.7	Very high	83 Å²	83	100.6 Å²	100.6	44%	0.435	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-40.8	176.5	-71.3	170.8	0	0	0	111.8	E10 A11 N16 Q17 I18	E10-L14 HydrophobicContact CG-CD1 4.23Å; E10-L14 WeakPolarHBondContact O-CG 3.28Å; E10-L14 PolarHBondContact O-N 2.64Å; A11-L14 PolarHBondContact O-N 2.88Å; L14-N16 VanDerWaalsContact C-N 3.34Å; L14-N16 PolarHBondContact O-N 3.36Å; L14-Q17 PolarHBondContact O-N 3.23Å; L14-I18 WeakPolarHBondContact O-CG1 3.49Å; L14-I18 PolarHBondContact O-N 2.87Å
15	R	95.9	Very high	96.7	Very high	156 Å²	156	100.3 Å²	100.3	59%	0.589	50%	0.496	S	S	*	.	H	α-helix	trans	-60.5	-42.5	174.2	-75.5	171.7	179.2	169.5	-2.7	112.4	A11 E12 Q13 I18 R19	A11-R15 VanDerWaalsContact O-CG 3.31Å; A11-R15 WeakPolarHBondContact O-CG 3.43Å; A11-R15 PolarHBondContact O-N 3.19Å; E12-R15 PolarHBondContact O-N 2.78Å; E12-R15 IonicContact OE2-NH1 3.39Å; E12-R15 PolarHBondContact OE2-NH1 3.26Å; Q13-R15 PolarHBondContact O-N 3.47Å; R15-I18 PolarHBondContact O-N 3.17Å; R15-R19 WeakPolarHBondContact O-CB 3.29Å; R15-R19 PolarHBondContact O-N 2.96Å
16	N	96.9	Very high	96.4	Very high	56 Å²	56	97.5 Å²	97.5	30%	0.299	50%	0.496	S	S	.	.	H	α-helix	trans	-65.8	-41.2	176.8	-71.9	-39.9	0	0	0	111.5	E12 Q13 L14 I18 R19 D20	E12-N16 PolarHBondContact O-N 3.14Å; E12-N16 PolarHBondContact O-ND2 3.32Å; Q13-N16 PolarHBondContact O-N 2.89Å; L14-N16 VanDerWaalsContact C-N 3.34Å; L14-N16 PolarHBondContact O-N 3.36Å; N16-I18 VanDerWaalsContact C-N 3.34Å; N16-I18 PolarHBondContact O-N 3.45Å; N16-R19 WeakPolarHBondContact O-CB 3.34Å; N16-R19 PolarHBondContact O-N 2.91Å; N16-R19 PolarHBondContact OD1-NH1 3.46Å; N16-D20 PolarHBondContact O-N 3.46Å
17	Q	98.1	Very high	96.3	Very high	104 Å²	104	99.4 Å²	99.4	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-59.2	-43.5	173.8	-71.2	173.9	8.2	0	0	112.2	Q13 L14 D20 A21	Q13-Q17 WeakPolarHBondContact O-CG 3.47Å; Q13-Q17 PolarHBondContact O-N 3.07Å; L14-Q17 PolarHBondContact O-N 3.23Å; Q17-D20 PolarHBondContact O-N 3.41Å; Q17-A21 WeakPolarHBondContact O-CB 3.49Å; Q17-A21 PolarHBondContact O-N 2.81Å
18	I	97.3	Very high	96.2	Very high	82 Å²	82	97.2 Å²	97.2	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-44.5	176	-67.9	165.3	0	0	0	110.5	L14 R15 N16 D20 A21 R22	L14-I18 WeakPolarHBondContact O-CG1 3.49Å; L14-I18 PolarHBondContact O-N 2.87Å; R15-I18 PolarHBondContact O-N 3.17Å; N16-I18 VanDerWaalsContact C-N 3.34Å; N16-I18 PolarHBondContact O-N 3.45Å; I18-D20 VanDerWaalsContact C-N 3.34Å; I18-D20 PolarHBondContact O-N 2.88Å; I18-A21 PolarHBondContact O-N 2.96Å; I18-R22 HydrophobicContact CG2-CG 4.45Å; I18-R22 WeakPolarHBondContact O-CG 3.23Å; I18-R22 PolarHBondContact O-N 2.96Å
19	R	95.8	Very high	96	Very high	148 Å²	148	92 Å²	92	56%	0.558	49%	0.489	S	S	*	.	H	α-helix	trans	-59.7	-44.9	177.6	-173.6	-174	-65.6	144.1	1.5	111.5	R15 N16 R22 K23	R15-R19 WeakPolarHBondContact O-CB 3.29Å; R15-R19 PolarHBondContact O-N 2.96Å; N16-R19 WeakPolarHBondContact O-CB 3.34Å; N16-R19 PolarHBondContact O-N 2.91Å; N16-R19 PolarHBondContact OD1-NH1 3.46Å; R19-R22 PolarHBondContact O-N 3.26Å; R19-K23 WeakPolarHBondContact O-CB 3.29Å; R19-K23 PolarHBondContact O-N 2.78Å
20	D	97.3	Very high	96	Very high	103 Å²	103	87.7 Å²	87.7	55%	0.551	47%	0.47	S	S	*	.	H	α-helix	trans	-67	-39.6	179	-69.4	-22.2	0	0	0	111.5	N16 Q17 I18 K23 A24	N16-D20 PolarHBondContact O-N 3.46Å; Q17-D20 PolarHBondContact O-N 3.41Å; I18-D20 VanDerWaalsContact C-N 3.34Å; I18-D20 PolarHBondContact O-N 2.88Å; D20-K23 PolarHBondContact O-N 3.31Å; D20-A24 WeakPolarHBondContact O-CB 3.41Å; D20-A24 PolarHBondContact O-N 3.31Å
21	A	97.8	Very high	95.6	Very high	57 Å²	57	85.8 Å²	85.8	47%	0.471	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-44.9	175	0	0	0	0	0	112.3	Q17 I18 A24 C25	Q17-A21 WeakPolarHBondContact O-CB 3.49Å; Q17-A21 PolarHBondContact O-N 2.81Å; I18-A21 PolarHBondContact O-N 2.96Å; A21-A24 PolarHBondContact O-N 2.82Å; A21-C25 PolarHBondContact O-N 3.18Å; A21-C25 PolarHBondContact O-SG 2.89Å
22	R	96.8	Very high	95.5	Very high	41 Å²	41	89.5 Å²	89.5	16%	0.155	48%	0.476	C	S	.	.	H	α-helix	trans	-60.7	-47	174.8	-73.8	174.1	180	175.1	-5.8	111.3	I18 R19 A24 C25 G26 T221 T223 D258 Q259	I18-R22 HydrophobicContact CG2-CG 4.45Å; I18-R22 WeakPolarHBondContact O-CG 3.23Å; I18-R22 PolarHBondContact O-N 2.96Å; R19-R22 PolarHBondContact O-N 3.26Å; R22-A24 VanDerWaalsContact C-N 3.3Å; R22-A24 PolarHBondContact O-N 3Å; R22-C25 PolarHBondContact O-N 3.45Å; R22-G26 PolarHBondContact O-N 2.85Å; R22-T221 PolarHBondContact NH2-O 2.9Å; R22-T223 PolarHBondContact NH1-OG1 2.82Å; R22-D258 WeakPolarHBondContact CD-O 3.43Å; R22-D258 VanDerWaalsContact CZ-O 3.27Å; R22-D258 IonicContact CZ-OD2 3.73Å; R22-D258 VanDerWaalsContact CZ-OD2 3.23Å; R22-D258 PolarHBondContact NE-O 3.42Å; R22-D258 IonicContact NE-OD2 2.69Å; R22-D258 PolarHBondContact NE-OD2 3.26Å; R22-D258 PolarHBondContact NH2-O 3.24Å; R22-D258 IonicContact NH2-OD1 3.51Å; R22-D258 IonicContact NH2-OD2 3.44Å; R22-D258 PolarHBondContact NH2-OD2 2.85Å; R22-Q259 PolarHBondContact O-NE2 2.85Å; R22-Q259 PolarHBondContact O-OE1 2.89Å
23	K	94.8	Very high	95.5	Very high	163 Å²	163	91.3 Å²	91.3	71%	0.709	49%	0.487	S	S	*	.	H	α-helix	trans	-61.1	-37.5	177.5	-171.3	177.9	-178.3	-179.2	0	112.4	R19 D20 C25 G26	R19-K23 WeakPolarHBondContact O-CB 3.29Å; R19-K23 PolarHBondContact O-N 2.78Å; D20-K23 PolarHBondContact O-N 3.31Å; K23-C25 PolarHBondContact O-N 3.44Å; K23-G26 PolarHBondContact O-N 2.75Å
24	A	96.4	Very high	95.4	Very high	87 Å²	87	86.2 Å²	86.2	72%	0.719	46%	0.464	S	S	*	.	H	α-helix	trans	-64.1	-27.9	176.1	0	0	0	0	0	112.9	D20 A21 R22	D20-A24 WeakPolarHBondContact O-CB 3.41Å; D20-A24 PolarHBondContact O-N 3.31Å; A21-A24 PolarHBondContact O-N 2.82Å; R22-A24 VanDerWaalsContact C-N 3.3Å; R22-A24 PolarHBondContact O-N 3Å
25	C	95.4	Very high	95.1	Very high	88 Å²	88	86.5 Å²	86.5	60%	0.595	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.4	176	-63.5	0	0	0	0	114	A21 R22 K23 D27	A21-C25 PolarHBondContact O-N 3.18Å; A21-C25 PolarHBondContact O-SG 2.89Å; R22-C25 PolarHBondContact O-N 3.45Å; K23-C25 PolarHBondContact O-N 3.44Å; C25-D27 VanDerWaalsContact C-N 3.3Å; C25-D27 PolarHBondContact O-N 2.93Å
26	G	90.2	Very high	95.1	Very high	46 Å²	46	82.5 Å²	82.5	47%	0.474	48%	0.48	S	S	.	.			trans	-81.6	66.9	-179.2	0	0	0	0	0	112.9	R22 K23	R22-G26 PolarHBondContact O-N 2.85Å; K23-G26 PolarHBondContact O-N 2.75Å
27	D	93.9	Very high	95	Very high	147 Å²	147	83.6 Å²	83.6	79%	0.786	49%	0.485	S	S	*	.			trans	-76.5	-27.5	-175.4	65.7	-10.7	0	0	0	114.3	C25	C25-D27 VanDerWaalsContact C-N 3.3Å; C25-D27 PolarHBondContact O-N 2.93Å
28	S	94.1	Very high	94.8	Very high	51 Å²	51	85.2 Å²	85.2	36%	0.357	50%	0.497	S	S	.	.			trans	-156.5	168.4	-173.9	59.8	0	0	0	0	111.5
29	T	93.7	Very high	94.7	Very high	60 Å²	60	85.8 Å²	85.8	37%	0.368	51%	0.506	S	S	.	.			trans	-109.1	154	172.9	69	0	0	0	0	111.3	T31 Q32 I33	T29-T31 PolarHBondContact O-N 2.97Å; T29-T31 PolarHBondContact OG1-OG1 3.2Å; T29-Q32 WeakPolarHBondContact O-CB 3.38Å; T29-Q32 PolarHBondContact O-N 2.96Å; T29-Q32 VanDerWaalsContact OG1-CG 3.29Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.44Å; T29-Q32 PolarHBondContact OG1-N 3.28Å; T29-I33 WeakPolarHBondContact O-CG1 3.49Å; T29-I33 PolarHBondContact O-N 3.49Å; T29-I33 VanDerWaalsContact O-N 3.14Å
30	L	94.5	Very high	94.6	Very high	27 Å²	27	81 Å²	81	14%	0.141	49%	0.493	C	S	.	.	H	α-helix	trans	-56	-40.6	176.6	-176.2	61.7	0	0	0	111.5	Q32 I33 T34 L252 S262 A299	L30-Q32 VanDerWaalsContact C-N 3.31Å; L30-Q32 PolarHBondContact O-N 3.37Å; L30-I33 PolarHBondContact O-N 3.26Å; L30-T34 HydrophobicContact CD1-CG2 3.82Å; L30-T34 HydrophobicContact CG-CG2 4.1Å; L30-T34 WeakPolarHBondContact O-CB 3.33Å; L30-T34 VanDerWaalsContact O-CG2 3.28Å; L30-T34 WeakPolarHBondContact O-CG2 3.38Å; L30-T34 PolarHBondContact O-N 3.45Å; L30-T34 PolarHBondContact O-OG1 2.9Å; L30-L252 HydrophobicContact CD2-CD2 4.02Å; L30-S262 VanDerWaalsContact CB-OG 3.29Å; L30-S262 WeakPolarHBondContact CB-OG 3.45Å; L30-S262 VanDerWaalsContact CD2-OG 3.29Å; L30-S262 WeakPolarHBondContact CD2-OG 3.38Å; L30-A299 WeakPolarHBondContact CD2-O 3.3Å
31	T	91.2	Very high	94.5	Very high	68 Å²	68	78.1 Å²	78.1	42%	0.417	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-33.4	178.5	50.7	0	0	0	0	113.7	T29 T34 S35	T29-T31 PolarHBondContact O-N 2.97Å; T29-T31 PolarHBondContact OG1-OG1 3.2Å; T31-T34 WeakPolarHBondContact CA-OG1 3.4Å; T31-T34 PolarHBondContact O-OG1 3.42Å; T31-S35 PolarHBondContact O-N 2.86Å
32	Q	93.4	Very high	94.5	Very high	119 Å²	119	85 Å²	85	56%	0.556	50%	0.502	S	S	*	.	H	α-helix	trans	-71.4	-45.1	174.1	-72.7	169.5	-10.7	0	0	111	T29 L30 T34 S35	T29-Q32 WeakPolarHBondContact O-CB 3.38Å; T29-Q32 PolarHBondContact O-N 2.96Å; T29-Q32 VanDerWaalsContact OG1-CG 3.29Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.44Å; T29-Q32 PolarHBondContact OG1-N 3.28Å; L30-Q32 VanDerWaalsContact C-N 3.31Å; L30-Q32 PolarHBondContact O-N 3.37Å; Q32-T34 VanDerWaalsContact C-N 3.29Å; Q32-T34 PolarHBondContact O-N 3.25Å; Q32-S35 VanDerWaalsContact O-CB 3.26Å; Q32-S35 WeakPolarHBondContact O-CB 3.27Å; Q32-S35 PolarHBondContact O-N 3.17Å; Q32-S35 PolarHBondContact O-OG 2.62Å
33	I	95.7	Very high	94.5	Very high	118 Å²	118	85.2 Å²	85.2	61%	0.605	51%	0.506	S	S	*	.	H	α-helix	trans	-62.7	-38.3	179.2	-61.7	170.3	0	0	0	110.9	T29 L30 S35	T29-I33 WeakPolarHBondContact O-CG1 3.49Å; T29-I33 PolarHBondContact O-N 3.49Å; T29-I33 VanDerWaalsContact O-N 3.14Å; L30-I33 PolarHBondContact O-N 3.26Å; I33-S35 VanDerWaalsContact C-N 3.33Å
34	T	95.6	Very high	94.6	Very high	7 Å²	7	83.5 Å²	83.5	4%	0.043	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	8.2	-177.6	63.2	0	0	0	0	113.2	L30 T31 Q32 G36 L37 M300 K301	L30-T34 HydrophobicContact CD1-CG2 3.82Å; L30-T34 HydrophobicContact CG-CG2 4.1Å; L30-T34 WeakPolarHBondContact O-CB 3.33Å; L30-T34 VanDerWaalsContact O-CG2 3.28Å; L30-T34 WeakPolarHBondContact O-CG2 3.38Å; L30-T34 PolarHBondContact O-N 3.45Å; L30-T34 PolarHBondContact O-OG1 2.9Å; T31-T34 WeakPolarHBondContact CA-OG1 3.4Å; T31-T34 PolarHBondContact O-OG1 3.42Å; Q32-T34 VanDerWaalsContact C-N 3.29Å; Q32-T34 PolarHBondContact O-N 3.25Å; T34-G36 PolarHBondContact O-N 2.77Å; T34-G36 VanDerWaalsContact O-N 3.17Å; T34-L37 HydrophobicContact CG2-CD1 3.91Å; T34-L37 WeakPolarHBondContact O-CB 3.42Å; T34-L37 PolarHBondContact O-N 3.35Å; T34-M300 WeakPolarHBondContact CB-O 3.4Å; T34-M300 HydrophobicContact CG2-CB 3.87Å; T34-M300 HydrophobicContact CG2-CG 4.47Å; T34-M300 HydrophobicContact CG2-SD 4.13Å; T34-M300 PolarHBondContact OG1-O 2.97Å; T34-K301 WeakPolarHBondContact O-CE 3.49Å; T34-K301 PolarHBondContact O-NZ 3.17Å
35	S	92.9	Very high	94.6	Very high	88 Å²	88	81.7 Å²	81.7	62%	0.615	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-37.6	-178	56.5	0	0	0	0	113	T31 Q32 I33 L37 K301	T31-S35 PolarHBondContact O-N 2.86Å; Q32-S35 VanDerWaalsContact O-CB 3.26Å; Q32-S35 WeakPolarHBondContact O-CB 3.27Å; Q32-S35 PolarHBondContact O-N 3.17Å; Q32-S35 PolarHBondContact O-OG 2.62Å; I33-S35 VanDerWaalsContact C-N 3.33Å; S35-L37 VanDerWaalsContact C-N 3.35Å; S35-L37 PolarHBondContact O-N 2.99Å; S35-K301 PolarHBondContact O-NZ 3.05Å
36	G	94.4	Very high	94.7	Very high	73 Å²	73	85.4 Å²	85.4	75%	0.753	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-5.1	177.3	0	0	0	0	0	116.3	T34	T34-G36 PolarHBondContact O-N 2.77Å; T34-G36 VanDerWaalsContact O-N 3.17Å
37	L	95.1	Very high	95.1	Very high	79 Å²	79	85.8 Å²	85.8	41%	0.414	47%	0.472	S	S	.	.	S	Bend	trans	-77.1	141.5	176.9	-69.7	177.9	0	0	0	111.5	T34 S35 M300 K301	T34-L37 HydrophobicContact CG2-CD1 3.91Å; T34-L37 WeakPolarHBondContact O-CB 3.42Å; T34-L37 PolarHBondContact O-N 3.35Å; S35-L37 VanDerWaalsContact C-N 3.35Å; S35-L37 PolarHBondContact O-N 2.99Å; L37-M300 HydrophobicContact CD1-CB 4.09Å; L37-M300 HydrophobicContact CD1-CG 4.22Å; L37-K301 WeakPolarHBondContact O-CE 3.45Å; L37-K301 PolarHBondContact O-NZ 3.4Å
38	D	94.9	Very high	95.3	Very high	138 Å²	138	84.4 Å²	84.4	74%	0.738	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-68.1	140.7	170.9	-66.9	-43.4	0	0	0	111	R283	D38-R283 PolarHBondContact O-NH2 3.02Å
39	P	94.4	Very high	95.5	Very high	93 Å²	93	87.2 Å²	87.2	60%	0.604	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-60.3	146.9	172.1	-20.4	32	0	0	0	111.3	G41	P39-G41 PolarHBondContact O-N 3.09Å; P39-G41 VanDerWaalsContact O-N 3.09Å
40	V	94.9	Very high	95.8	Very high	47 Å²	47	85.8 Å²	85.8	29%	0.285	45%	0.45	S	S	.	.			trans	-63.5	-13	174.2	-69.2	0	0	0	0	114.2	R283 L284 D298 A305	V40-R283 HydrophobicContact CG1-CG 3.56Å; V40-L284 HydrophobicContact CG1-CD2 4.27Å; V40-L284 HydrophobicContact CG2-CD2 4.25Å; V40-D298 HydrophobicContact CG2-CB 4.1Å; V40-A305 HydrophobicContact CG2-CB 3.51Å
41	G	94.9	Very high	95.9	Very high	43 Å²	43	84.6 Å²	84.6	44%	0.443	44%	0.443	S	S	.	.			trans	75.5	-178.9	-171.9	0	0	0	0	0	112.5	P39 I43	P39-G41 PolarHBondContact O-N 3.09Å; P39-G41 VanDerWaalsContact O-N 3.09Å; G41-I43 PolarHBondContact O-N 2.8Å
42	R	96.4	Very high	96.3	Very high	203 Å²	203	88.8 Å²	88.8	77%	0.766	45%	0.452	S	S	*	.			trans	-76.1	113.6	-178.3	-173.1	177	178.1	-178.8	3.6	110.5	Q44 A305	R42-Q44 HydrophobicContact CG-CG 4.2Å; R42-A305 CarbonylContact C-O 3.48Å; R42-A305 WeakPolarHBondContact CA-O 3.47Å
43	I	97.1	Very high	96.4	Very high	45 Å²	45	84.4 Å²	84.4	23%	0.231	44%	0.438	C	S	.	.	B	Isolated β-bridge	trans	-82.2	120.8	176.1	-56.7	-60.5	0	0	0	109.3	G41 M45 L284 I296 A305	G41-I43 PolarHBondContact O-N 2.8Å; I43-M45 HydrophobicContact CG2-CG 3.95Å; I43-L284 HydrophobicContact CG1-CD2 4.4Å; I43-I296 HydrophobicContact CB-CD1 4.32Å; I43-I296 HydrophobicContact CG2-CD1 3.73Å; I43-A305 HydrophobicContact CG1-CB 4Å; I43-A305 PolarHBondContact N-O 3.3Å
44	Q	96.6	Very high	96.5	Very high	126 Å²	126	79.1 Å²	79.1	59%	0.589	41%	0.411	S	S	*	.			trans	-123.2	80.8	177.5	-65.2	-175.1	-0.8	0	0	109.8	R42	R42-Q44 HydrophobicContact CG-CG 4.2Å
45	M	97.6	Very high	96.6	Very high	49 Å²	49	85.5 Å²	85.5	24%	0.241	44%	0.444	C	S	.	.			trans	-74.9	151.8	172	-58.4	178.5	135.7	0	0	110.2	I43 I296 L308 V327 W339	I43-M45 HydrophobicContact CG2-CG 3.95Å; M45-I296 HydrophobicContact CG-CD1 4.37Å; M45-I296 HydrophobicContact SD-CD1 3.95Å; M45-L308 HydrophobicContact CB-CD2 3.65Å; M45-L308 HydrophobicContact CG-CD2 4.16Å; M45-L308 HydrophobicContact SD-CD1 4.37Å; M45-L308 HydrophobicContact SD-CD2 4.02Å; M45-V327 HydrophobicContact CE-CG1 4.22Å; M45-V327 HydrophobicContact SD-CG1 3.81Å; M45-W339 HydrophobicContact CB-CB 4.07Å; M45-W339 HydrophobicContact SD-CB 4.31Å
46	R	97.9	Very high	96.8	Very high	167 Å²	167	82.8 Å²	82.8	63%	0.63	43%	0.427	S	S	*	.			trans	-118.8	145.1	175.7	-64.2	-175.9	-179.3	-175.1	0.3	110.1	R48 W339 N340	R46-R48 PolarHBondContact O-N 2.76Å; R46-R48 VanDerWaalsContact O-N 3.15Å; R46-W339 WeakPolarHBondContact O-CA 3.25Å; R46-N340 PolarHBondContact N-O 3.32Å; R46-N340 VanDerWaalsContact N-O 3.15Å; R46-N340 PolarHBondContact O-N 3.25Å
47	T	98.4	Very high	97	Very high	54 Å²	54	82.9 Å²	82.9	33%	0.331	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	118	169.8	-48.6	0	0	0	0	109.2	R49 K337 I338 W339	T47-R49 VanDerWaalsContact CG2-O 3.25Å; T47-R49 WeakPolarHBondContact CG2-O 3.42Å; T47-K337 HydrophobicContact CG2-CB 4.01Å; T47-K337 HydrophobicContact CG2-CD 4.3Å; T47-K337 HydrophobicContact CG2-CG 4.15Å; T47-I338 CarbonylContact C-O 3.59Å; T47-I338 WeakPolarHBondContact CA-O 3.34Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.3Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.49Å
48	R	98.3	Very high	97.2	Very high	118 Å²	118	79.1 Å²	79.1	45%	0.445	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-31.5	175.1	-58.1	-52.2	175.1	168.7	-0.2	112.6	R46 I338 N340	R46-R48 PolarHBondContact O-N 2.76Å; R46-R48 VanDerWaalsContact O-N 3.15Å; R48-I338 PolarHBondContact N-O 2.82Å; R48-N340 WeakPolarHBondContact CD-OD1 3.24Å; R48-N340 WeakPolarHBondContact CG-OD1 3.21Å; R48-N340 PolarHBondContact NE-O 2.85Å; R48-N340 PolarHBondContact NE-OD1 3.29Å; R48-N340 PolarHBondContact NH2-O 2.94Å
49	R	98.3	Very high	97.4	Very high	110 Å²	110	75.5 Å²	75.5	42%	0.415	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.7	-179.3	-57.4	-68	-174.4	-89.4	-0.7	110.2	T47 Y85 T87 K337 I338	T47-R49 VanDerWaalsContact CG2-O 3.25Å; T47-R49 WeakPolarHBondContact CG2-O 3.42Å; R49-Y85 PolarHBondContact NE-O 3.44Å; R49-T87 HydrophobicContact CB-CG2 4.08Å; R49-T87 HydrophobicContact CG-CG2 4.16Å; R49-K337 WeakPolarHBondContact O-CA 3.29Å; R49-I338 HydrophobicContact CB-CB 4.07Å; R49-I338 HydrophobicContact CB-CD1 4.1Å; R49-I338 HydrophobicContact CB-CG1 4.18Å; R49-I338 PolarHBondContact N-O 2.97Å; R49-I338 PolarHBondContact O-N 3.39Å
50	T	98.4	Very high	97.5	Very high	30 Å²	30	71.6 Å²	71.6	18%	0.184	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	112.1	170	-55.3	0	0	0	0	107.6	R52 F335 L336 K337	T50-R52 HydrophobicContact CG2-CG 4.2Å; T50-F335 HydrophobicContact CG2-CB 4.3Å; T50-F335 HydrophobicContact CG2-CD1 4.15Å; T50-F335 HydrophobicContact CG2-CG 4.36Å; T50-L336 CarbonylContact C-O 3.55Å; T50-L336 WeakPolarHBondContact CA-O 3.47Å; T50-K337 HydrophobicContact CG2-CG 4.43Å
51	L	98.4	Very high	97.7	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	119.4	179.8	-50.6	-178.3	0	0	0	108.4	L70 W82 T87 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.21Å; L51-L70 HydrophobicContact CD1-CD2 4.03Å; L51-W82 HydrophobicContact CB-CD2 4.12Å; L51-W82 HydrophobicContact CB-CE3 3.85Å; L51-W82 HydrophobicContact CB-CH2 4.25Å; L51-W82 HydrophobicContact CB-CZ3 3.92Å; L51-W82 HydrophobicContact CD1-CB 3.9Å; L51-W82 HydrophobicContact CD1-CD2 3.97Å; L51-W82 HydrophobicContact CD1-CE3 4.31Å; L51-W82 HydrophobicContact CD1-CG 3.79Å; L51-W82 HydrophobicContact CD2-CE3 4.36Å; L51-W82 HydrophobicContact CG-CE3 4.4Å; L51-T87 HydrophobicContact CD2-CG2 3.84Å; L51-L336 HydrophobicContact CB-CB 4.08Å; L51-L336 HydrophobicContact CB-CD1 4.45Å; L51-L336 HydrophobicContact CD1-CB 4.08Å; L51-L336 HydrophobicContact CG-CB 4.29Å; L51-L336 PolarHBondContact N-O 3.28Å; L51-L336 PolarHBondContact O-N 2.74Å; L51-I338 HydrophobicContact CD1-CD1 4.3Å; L51-I338 HydrophobicContact CD2-CD1 4.45Å; L51-I338 HydrophobicContact CG-CD1 4.49Å
52	R	97.9	Very high	97.9	Very high	156 Å²	156	70.2 Å²	70.2	59%	0.589	32%	0.318	S	S	*	.			trans	-116.5	130.3	-176.8	-58.8	-172.6	174	79.9	-2.6	110.1	T50 W82 K89 F335	T50-R52 HydrophobicContact CG2-CG 4.2Å; R52-W82 WeakPolarHBondContact O-CH2 3.45Å; R52-W82 WeakPolarHBondContact O-CZ3 3.44Å; R52-K89 VanDerWaalsContact O-CE 3.3Å; R52-K89 WeakPolarHBondContact O-CE 3.46Å; R52-K89 PolarHBondContact O-NZ 3.01Å; R52-F335 HydrophobicContact CB-CE1 4.39Å; R52-F335 HydrophobicContact CG-CD1 3.86Å; R52-F335 HydrophobicContact CG-CE1 3.77Å
53	G	96.2	Very high	98	Very high	27 Å²	27	61.1 Å²	61.1	28%	0.278	28%	0.284	S	S	.	.			trans	163.6	-17.9	175.2	0	0	0	0	0	116.5
54	H	98.2	Very high	98.1	Very high	8 Å²	8	59.1 Å²	59.1	4%	0.037	28%	0.275	C	S	.	.			trans	-73.6	151.6	166.5	-73.8	-61.5	0	0	0	110.6	I58 S72 S74 D76 I80 W82	H54-I58 HydrophobicContact CB-CG1 4.24Å; H54-S72 PolarHBondContact NE2-OG 3.39Å; H54-S74 WeakPolarHBondContact CE1-CB 3.31Å; H54-S74 WeakPolarHBondContact ND1-CB 3.43Å; H54-D76 VanDerWaalsContact CA-OD2 3.27Å; H54-D76 WeakPolarHBondContact CA-OD2 3.5Å; H54-D76 WeakPolarHBondContact CB-OD2 3.4Å; H54-D76 IonicContact CG-OD2 2.82Å; H54-D76 IonicContact ND1-OD1 3.55Å; H54-D76 IonicContact ND1-OD2 3.71Å; H54-D76 PolarHBondContact ND1-OD2 3.45Å; H54-D76 VanDerWaalsContact ND1-OD2 3.12Å; H54-I80 VanDerWaalsContact CE1-CD1 3.46Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.23Å; H54-W82 AromaticContact CD2-CZ2 3.99Å
55	L	97.1	Very high	98.1	Very high	141 Å²	141	56.7 Å²	56.7	74%	0.738	27%	0.268	S	S	*	.	S	Bend	trans	-112.1	-3.6	180	-58.5	178.6	0	0	0	112.2	D76	L55-D76 HydrophobicContact CB-CB 4.26Å; L55-D76 PolarHBondContact N-OD2 3.23Å
56	A	98	Very high	98.1	Very high	31 Å²	31	58.1 Å²	58.1	26%	0.256	28%	0.277	S	S	.	.	S	Bend	trans	-143.5	-174.2	-179.2	0	0	0	0	0	110.3	I58 S74 Q75 D76 S334	A56-I58 PolarHBondContact O-N 3.24Å; A56-S74 PolarHBondContact O-OG 3Å; A56-Q75 HydrophobicContact CB-CB 4.22Å; A56-D76 HydrophobicContact CB-CB 3.88Å; A56-S334 WeakPolarHBondContact O-CA 3.2Å; A56-S334 WeakPolarHBondContact O-CB 3.25Å
57	K	98.3	Very high	98	Very high	75 Å²	75	50.6 Å²	50.6	33%	0.326	25%	0.25	S	C	.	.			trans	-61	128.8	-177.6	-60.4	174.3	177.8	-176.4	0	111.1	Y59 S74 Q75 W332	K57-Y59 HydrophobicContact CB-CD2 4.34Å; K57-Y59 HydrophobicContact CB-CE2 4.07Å; K57-S74 WeakPolarHBondContact O-CA 3.4Å; K57-S74 PolarHBondContact O-OG 2.85Å; K57-Q75 PolarHBondContact O-N 3.48Å; K57-W332 HydrophobicContact CB-CB 4.19Å; K57-W332 HydrophobicContact CB-CD2 4.47Å; K57-W332 HydrophobicContact CB-CG 3.88Å; K57-W332 HydrophobicContact CD-CB 4.3Å; K57-W332 HydrophobicContact CD-CD2 3.67Å; K57-W332 HydrophobicContact CD-CE3 3.96Å; K57-W332 HydrophobicContact CD-CG 3.86Å; K57-W332 HydrophobicContact CG-CB 3.88Å; K57-W332 HydrophobicContact CG-CD2 4.18Å; K57-W332 HydrophobicContact CG-CG 3.82Å
58	I	98.7	Very high	98	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.1	169.6	-63.6	156.7	0	0	0	108	H54 A56 A73 S316 S331 S334 F335 L336	H54-I58 HydrophobicContact CB-CG1 4.24Å; A56-I58 PolarHBondContact O-N 3.24Å; I58-A73 WeakPolarHBondContact CA-O 3.32Å; I58-S316 VanDerWaalsContact O-CB 3.29Å; I58-S316 WeakPolarHBondContact O-CB 3.16Å; I58-S316 PolarHBondContact O-OG 2.8Å; I58-S331 WeakPolarHBondContact CB-O 3.42Å; I58-S331 PolarHBondContact N-O 3.2Å; I58-S334 VanDerWaalsContact CD1-C 3.4Å; I58-S334 WeakPolarHBondContact CD1-O 3.46Å; I58-F335 WeakPolarHBondContact CD1-O 3.42Å; I58-L336 HydrophobicContact CD1-CD1 3.42Å; I58-L336 VanDerWaalsContact CD1-CD1 3.42Å; I58-L336 HydrophobicContact CD1-CG 3.86Å; I58-L336 HydrophobicContact CG1-CD1 4.42Å
59	Y	98.5	Very high	98	Very high	61 Å²	61	49 Å²	49	24%	0.239	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-40.6	178.9	-95.7	-108.8	0	0	0	112.6	K57 A73 Q75 M101 W332	K57-Y59 HydrophobicContact CB-CD2 4.34Å; K57-Y59 HydrophobicContact CB-CE2 4.07Å; Y59-A73 PolarHBondContact N-O 2.77Å; Y59-Q75 HydrophobicContact CD2-CG 3.76Å; Y59-Q75 HydrophobicContact CE2-CG 3.65Å; Y59-Q75 PolarHBondContact OH-NE2 3.41Å; Y59-M101 HydrophobicContact CD1-CG 4.45Å; Y59-W332 HydrophobicContact CE2-CZ2 4.29Å; Y59-W332 AromaticContact CE2-NE1 3.64Å; Y59-W332 AromaticContact CZ-CZ2 3.88Å; Y59-W332 AromaticContact CZ-NE1 3.98Å; Y59-W332 WeakPolarHBondContact OH-CZ2 3.37Å
60	A	98.6	Very high	98	Very high	12 Å²	12	43.8 Å²	43.8	10%	0.099	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	152.8	-177.3	0	0	0	0	0	111.2	S72 A73 M101	A60-S72 WeakPolarHBondContact O-CA 3.49Å; A60-A73 PolarHBondContact O-N 3.45Å; A60-M101 WeakPolarHBondContact CB-O 3.48Å
61	M	98.7	Very high	98.1	Very high	10 Å²	10	42.4 Å²	42.4	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154	166.8	71	79.2	54.2	0	0	109.5	W63 L70 V71 C317 A328 L336	M61-W63 HydrophobicContact CE-CD2 4.35Å; M61-W63 HydrophobicContact CE-CG 4.3Å; M61-L70 HydrophobicContact CE-CB 4.1Å; M61-L70 HydrophobicContact CE-CD1 3.8Å; M61-L70 HydrophobicContact CE-CG 4.34Å; M61-V71 CarbonylContact C-O 3.54Å; M61-V71 WeakPolarHBondContact CA-O 3.07Å; M61-V71 WeakPolarHBondContact CB-O 3.18Å; M61-C317 HydrophobicContact CG-CB 4.14Å; M61-A328 HydrophobicContact CE-CB 3.49Å; M61-A328 VanDerWaalsContact CE-CB 3.49Å; M61-A328 HydrophobicContact SD-CB 4.27Å; M61-L336 HydrophobicContact CB-CD2 3.86Å; M61-L336 HydrophobicContact CG-CD2 4.27Å
62	H	98.8	Very high	98.1	Very high	50 Å²	50	42.3 Å²	42.3	23%	0.231	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	131.1	174.9	-166.1	-117.3	0	0	0	109.9	L70 V71 Y105	H62-L70 CarbonylContact O-C 3.55Å; H62-L70 WeakPolarHBondContact O-CA 3.18Å; H62-L70 WeakPolarHBondContact O-CB 3.37Å; H62-V71 HydrophobicContact CB-CG1 3.96Å; H62-V71 PolarHBondContact N-O 2.83Å; H62-V71 PolarHBondContact O-N 3Å; H62-Y105 WeakPolarHBondContact ND1-CB 3.4Å; H62-Y105 PolarHBondContact ND1-N 3.12Å
63	W	98.8	Very high	98.1	Very high	13 Å²	13	34.9 Å²	34.9	5%	0.049	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	147.4	171.3	-73.7	108.1	0	0	0	110.6	M61 L70 G319 T321 A328 I338	M61-W63 HydrophobicContact CE-CD2 4.35Å; M61-W63 HydrophobicContact CE-CG 4.3Å; W63-L70 HydrophobicContact CD2-CB 4.04Å; W63-L70 HydrophobicContact CD2-CD2 4.34Å; W63-L70 HydrophobicContact CE3-CB 3.68Å; W63-L70 HydrophobicContact CE3-CD2 3.83Å; W63-L70 HydrophobicContact CE3-CG 4.4Å; W63-L70 HydrophobicContact CH2-CD2 3.51Å; W63-L70 HydrophobicContact CZ2-CD2 4.04Å; W63-L70 HydrophobicContact CZ3-CB 4.11Å; W63-L70 HydrophobicContact CZ3-CD2 3.39Å; W63-L70 HydrophobicContact CZ3-CG 4.36Å; W63-G319 PolarHBondContact NE1-O 3.34Å; W63-T321 HydrophobicContact CD2-CG2 3.67Å; W63-T321 HydrophobicContact CE3-CG2 3.83Å; W63-T321 HydrophobicContact CG-CG2 4.23Å; W63-T321 HydrophobicContact CH2-CG2 3.89Å; W63-T321 HydrophobicContact CZ2-CG2 3.72Å; W63-T321 HydrophobicContact CZ3-CG2 3.94Å; W63-A328 HydrophobicContact CH2-CB 4.49Å; W63-A328 HydrophobicContact CZ2-CB 3.46Å; W63-A328 VanDerWaalsContact CZ2-CB 3.46Å; W63-I338 HydrophobicContact CH2-CD1 4.08Å
64	G	98	Very high	98.2	Very high	3 Å²	3	33.6 Å²	33.6	3%	0.031	17%	0.171	C	C	.	.			trans	-77.7	159.7	160.4	0	0	0	0	0	110.5	D66 S67 L69	G64-D66 PolarHBondContact O-N 2.74Å; G64-S67 PolarHBondContact O-N 3.23Å; G64-S67 VanDerWaalsContact O-N 3.12Å; G64-L69 PolarHBondContact N-O 2.84Å
65	T	96.9	Very high	98.1	Very high	74 Å²	74	34.9 Å²	34.9	45%	0.454	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.4	179.4	49.4	0	0	0	0	113.5	S67 P107 D322	T65-S67 PolarHBondContact O-N 2.98Å; T65-P107 HydrophobicContact CG2-CB 4.13Å; T65-P107 PolarHBondContact OG1-O 2.88Å; T65-D322 WeakPolarHBondContact CA-OD2 3.29Å
66	D	96.9	Very high	98.1	Very high	80 Å²	80	30.1 Å²	30.1	43%	0.428	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-1.5	174.7	73	-11.7	0	0	0	113.6	G64 R68 L69	G64-D66 PolarHBondContact O-N 2.74Å; D66-R68 PolarHBondContact O-N 2.89Å; D66-R68 PolarHBondContact OD1-N 2.81Å; D66-L69 PolarHBondContact OD1-N 2.96Å; D66-L69 VanDerWaalsContact OD2-CG 3.29Å; D66-L69 WeakPolarHBondContact OD2-CG 3.29Å; D66-L69 PolarHBondContact OD2-N 3.4Å
67	S	97.8	Very high	98	Very high	9 Å²	9	29.1 Å²	29.1	6%	0.063	14%	0.144	C	C	.	.	S	Bend	trans	55.8	21.6	-178.2	-62.2	0	0	0	0	113.9	G64 T65 D322 D323	G64-S67 PolarHBondContact O-N 3.23Å; G64-S67 VanDerWaalsContact O-N 3.12Å; T65-S67 PolarHBondContact O-N 2.98Å; S67-D322 PolarHBondContact OG-N 2.89Å; S67-D323 VanDerWaalsContact CB-CG 3.48Å; S67-D323 WeakPolarHBondContact CB-OD2 3.42Å; S67-D323 PolarHBondContact OG-N 2.82Å
68	R	97.7	Very high	97.9	Very high	100 Å²	100	29.2 Å²	29.2	38%	0.377	15%	0.145	S	C	.	.	S	Bend	trans	-132.1	-51.8	-176.4	177.8	179.8	175.8	-176.8	-3	111.8	D66 D83 S84 Y85	D66-R68 PolarHBondContact O-N 2.89Å; D66-R68 PolarHBondContact OD1-N 2.81Å; R68-D83 WeakPolarHBondContact CG-OD1 3.27Å; R68-D83 IonicContact CZ-OD1 2.68Å; R68-D83 IonicContact CZ-OD2 3.56Å; R68-D83 IonicContact NE-OD1 3.86Å; R68-D83 PolarHBondContact NE-OD1 2.93Å; R68-D83 IonicContact NE-OD2 2.7Å; R68-D83 PolarHBondContact NE-OD2 3.05Å; R68-D83 IonicContact NH2-OD1 3.18Å; R68-D83 IonicContact NH2-OD2 3.06Å; R68-D83 PolarHBondContact NH2-OD2 3.11Å; R68-S84 WeakPolarHBondContact CA-OG 3.5Å; R68-S84 VanDerWaalsContact O-CB 3.22Å; R68-S84 WeakPolarHBondContact O-CB 3.42Å; R68-S84 PolarHBondContact O-N 3.04Å; R68-S84 PolarHBondContact O-OG 3.46Å; R68-Y85 HydrophobicContact CB-CE1 4.48Å; R68-Y85 HydrophobicContact CG-CD1 4.16Å; R68-Y85 HydrophobicContact CG-CD2 4.42Å; R68-Y85 HydrophobicContact CG-CE1 4.32Å; R68-Y85 HydrophobicContact CG-CG 4.21Å
69	L	98.3	Very high	97.9	Very high	39 Å²	39	29.2 Å²	29.2	20%	0.204	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	144.9	176.8	-64.7	177.9	0	0	0	109.3	G64 D66 W82 D83 M90 Y105	G64-L69 PolarHBondContact N-O 2.84Å; D66-L69 PolarHBondContact OD1-N 2.96Å; D66-L69 VanDerWaalsContact OD2-CG 3.29Å; D66-L69 WeakPolarHBondContact OD2-CG 3.29Å; D66-L69 PolarHBondContact OD2-N 3.4Å; L69-W82 VanDerWaalsContact CA-O 3.32Å; L69-W82 WeakPolarHBondContact CA-O 3.14Å; L69-W82 WeakPolarHBondContact CD2-O 3.1Å; L69-D83 HydrophobicContact CD2-CB 4.18Å; L69-M90 HydrophobicContact CD2-CG 3.96Å; L69-Y105 HydrophobicContact CB-CE2 4.19Å
70	L	98.6	Very high	97.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	150.9	171.3	68.6	104.8	0	0	0	110	L51 M61 H62 W63 I81 W82 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.21Å; L51-L70 HydrophobicContact CD1-CD2 4.03Å; M61-L70 HydrophobicContact CE-CB 4.1Å; M61-L70 HydrophobicContact CE-CD1 3.8Å; M61-L70 HydrophobicContact CE-CG 4.34Å; H62-L70 CarbonylContact O-C 3.55Å; H62-L70 WeakPolarHBondContact O-CA 3.18Å; H62-L70 WeakPolarHBondContact O-CB 3.37Å; W63-L70 HydrophobicContact CD2-CB 4.04Å; W63-L70 HydrophobicContact CD2-CD2 4.34Å; W63-L70 HydrophobicContact CE3-CB 3.68Å; W63-L70 HydrophobicContact CE3-CD2 3.83Å; W63-L70 HydrophobicContact CE3-CG 4.4Å; W63-L70 HydrophobicContact CH2-CD2 3.51Å; W63-L70 HydrophobicContact CZ2-CD2 4.04Å; W63-L70 HydrophobicContact CZ3-CB 4.11Å; W63-L70 HydrophobicContact CZ3-CD2 3.39Å; W63-L70 HydrophobicContact CZ3-CG 4.36Å; L70-I81 CarbonylContact O-C 3.58Å; L70-I81 WeakPolarHBondContact O-CA 3.15Å; L70-W82 HydrophobicContact CD1-CB 4.46Å; L70-W82 HydrophobicContact CD1-CG 4.31Å; L70-W82 HydrophobicContact CG-CB 4.17Å; L70-W82 PolarHBondContact N-O 3.05Å; L70-W82 VanDerWaalsContact N-O 3.14Å; L70-W82 PolarHBondContact O-N 3.2Å; L70-L336 HydrophobicContact CD1-CD2 3.8Å; L70-I338 HydrophobicContact CD2-CD1 4.41Å
71	V	98.8	Very high	97.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.4	174.1	64.3	0	0	0	0	109.4	M61 H62 L79 I80 I81 C103 Y105 V112	M61-V71 CarbonylContact C-O 3.54Å; M61-V71 WeakPolarHBondContact CA-O 3.07Å; M61-V71 WeakPolarHBondContact CB-O 3.18Å; H62-V71 HydrophobicContact CB-CG1 3.96Å; H62-V71 PolarHBondContact N-O 2.83Å; H62-V71 PolarHBondContact O-N 3Å; V71-L79 HydrophobicContact CG2-CD1 3.54Å; V71-L79 HydrophobicContact CG2-CD2 4Å; V71-L79 HydrophobicContact CG2-CG 3.51Å; V71-I80 CarbonylContact C-O 3.53Å; V71-I80 WeakPolarHBondContact CA-O 3.32Å; V71-I81 HydrophobicContact CB-CG1 4.28Å; V71-I81 HydrophobicContact CG2-CG1 4.09Å; V71-C103 HydrophobicContact CG1-CB 4.32Å; V71-C103 HydrophobicContact CG2-CB 4.49Å; V71-Y105 HydrophobicContact CB-CD2 3.98Å; V71-Y105 HydrophobicContact CG1-CD2 3.95Å; V71-Y105 HydrophobicContact CG1-CG 4.48Å; V71-V112 HydrophobicContact CB-CG1 4.27Å; V71-V112 HydrophobicContact CG1-CG1 4.46Å; V71-V112 HydrophobicContact CG2-CB 4.49Å; V71-V112 HydrophobicContact CG2-CG1 4.24Å
72	S	98.8	Very high	97.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143.9	171.7	65.1	0	0	0	0	111.7	H54 A60 L79 I80 W82	H54-S72 PolarHBondContact NE2-OG 3.39Å; A60-S72 WeakPolarHBondContact O-CA 3.49Å; S72-L79 WeakPolarHBondContact O-CA 3.17Å; S72-I80 PolarHBondContact N-O 2.94Å; S72-I80 PolarHBondContact O-N 3.46Å; S72-W82 PolarHBondContact OG-NE1 2.94Å
73	A	98.5	Very high	97.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.2	-178	0	0	0	0	0	111	I58 Y59 A60 L79 V100 C103	I58-A73 WeakPolarHBondContact CA-O 3.32Å; Y59-A73 PolarHBondContact N-O 2.77Å; A60-A73 PolarHBondContact O-N 3.45Å; A73-L79 HydrophobicContact CB-CD1 3.69Å; A73-V100 HydrophobicContact CB-CB 4.36Å; A73-V100 HydrophobicContact CB-CG1 3.71Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; A73-C103 HydrophobicContact CB-CB 3.9Å
74	S	98.3	Very high	97.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.6	-175.2	170.2	0	0	0	0	112.2	H54 A56 K57 D76 G77 K78 V100	H54-S74 WeakPolarHBondContact CE1-CB 3.31Å; H54-S74 WeakPolarHBondContact ND1-CB 3.43Å; A56-S74 PolarHBondContact O-OG 3Å; K57-S74 WeakPolarHBondContact O-CA 3.4Å; K57-S74 PolarHBondContact O-OG 2.85Å; S74-D76 VanDerWaalsContact CB-OD1 3.28Å; S74-D76 WeakPolarHBondContact CB-OD1 3.36Å; S74-D76 PolarHBondContact O-N 3.33Å; S74-D76 VanDerWaalsContact O-N 3.08Å; S74-D76 PolarHBondContact OG-N 3Å; S74-D76 PolarHBondContact OG-OD1 3.19Å; S74-D76 PolarHBondContact OG-OD2 2.93Å; S74-D76 VanDerWaalsContact OG-OD2 3.12Å; S74-G77 PolarHBondContact O-N 2.97Å; S74-G77 VanDerWaalsContact O-N 3.13Å; S74-K78 PolarHBondContact N-O 3.08Å; S74-V100 WeakPolarHBondContact O-CG1 3.42Å
75	Q	96.9	Very high	97.7	Very high	35 Å²	35	29.3 Å²	29.3	16%	0.164	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-3.1	176.6	-74.5	-173	-22.8	0	0	114.8	A56 K57 Y59 G77 S98 W99	A56-Q75 HydrophobicContact CB-CB 4.22Å; K57-Q75 PolarHBondContact O-N 3.48Å; Y59-Q75 HydrophobicContact CD2-CG 3.76Å; Y59-Q75 HydrophobicContact CE2-CG 3.65Å; Y59-Q75 PolarHBondContact OH-NE2 3.41Å; Q75-G77 PolarHBondContact O-N 3.37Å; Q75-S98 CarbonylContact C-O 3.59Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.18Å; Q75-W99 VanDerWaalsContact NE2-CE3 3.28Å; Q75-W99 VanDerWaalsContact NE2-CZ3 3.27Å
76	D	95.6	Very high	97.7	Very high	40 Å²	40	28.6 Å²	28.6	21%	0.214	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	3.1	168.6	60.4	20.9	0	0	0	112.8	H54 L55 A56 S74 K78	H54-D76 VanDerWaalsContact CA-OD2 3.27Å; H54-D76 WeakPolarHBondContact CA-OD2 3.5Å; H54-D76 WeakPolarHBondContact CB-OD2 3.4Å; H54-D76 IonicContact CG-OD2 2.82Å; H54-D76 IonicContact ND1-OD1 3.55Å; H54-D76 IonicContact ND1-OD2 3.71Å; H54-D76 PolarHBondContact ND1-OD2 3.45Å; H54-D76 VanDerWaalsContact ND1-OD2 3.12Å; L55-D76 HydrophobicContact CB-CB 4.26Å; L55-D76 PolarHBondContact N-OD2 3.23Å; A56-D76 HydrophobicContact CB-CB 3.88Å; S74-D76 VanDerWaalsContact CB-OD1 3.28Å; S74-D76 WeakPolarHBondContact CB-OD1 3.36Å; S74-D76 PolarHBondContact O-N 3.33Å; S74-D76 VanDerWaalsContact O-N 3.08Å; S74-D76 PolarHBondContact OG-N 3Å; S74-D76 PolarHBondContact OG-OD1 3.19Å; S74-D76 PolarHBondContact OG-OD2 2.93Å; S74-D76 VanDerWaalsContact OG-OD2 3.12Å; D76-K78 WeakPolarHBondContact OD1-CB 3.4Å; D76-K78 PolarHBondContact OD1-N 3.38Å
77	G	95.9	Very high	97.7	Very high	10 Å²	10	27.4 Å²	27.4	10%	0.103	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	28.9	-177.8	0	0	0	0	0	112.7	S74 Q75 L95	S74-G77 PolarHBondContact O-N 2.97Å; S74-G77 VanDerWaalsContact O-N 3.13Å; Q75-G77 PolarHBondContact O-N 3.37Å; G77-L95 WeakPolarHBondContact O-CB 3.45Å; G77-L95 PolarHBondContact O-N 3.38Å
78	K	97.1	Very high	97.7	Very high	78 Å²	78	31.7 Å²	31.7	34%	0.339	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.9	176	-58.3	-176.8	179.8	176.9	0	112.3	S74 D76 I80 I93	S74-K78 PolarHBondContact N-O 3.08Å; D76-K78 WeakPolarHBondContact OD1-CB 3.4Å; D76-K78 PolarHBondContact OD1-N 3.38Å; K78-I80 HydrophobicContact CB-CG1 4.23Å; K78-I93 WeakPolarHBondContact CA-O 3.34Å
79	L	97.6	Very high	97.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	114.9	163.4	-166.3	73	0	0	0	107.8	V71 S72 A73 I93 L95 C103 V112 C114 Y124	V71-L79 HydrophobicContact CG2-CD1 3.54Å; V71-L79 HydrophobicContact CG2-CD2 4Å; V71-L79 HydrophobicContact CG2-CG 3.51Å; S72-L79 WeakPolarHBondContact O-CA 3.17Å; A73-L79 HydrophobicContact CB-CD1 3.69Å; L79-I93 HydrophobicContact CB-CB 4.22Å; L79-I93 HydrophobicContact CD2-CD1 4.22Å; L79-I93 PolarHBondContact N-O 3.21Å; L79-I93 PolarHBondContact O-N 3.03Å; L79-L95 HydrophobicContact CB-CD1 4.46Å; L79-L95 HydrophobicContact CB-CD2 3.99Å; L79-L95 HydrophobicContact CB-CG 4.38Å; L79-C103 HydrophobicContact CD1-CB 3.58Å; L79-V112 HydrophobicContact CD2-CB 4.19Å; L79-V112 HydrophobicContact CD2-CG2 3.64Å; L79-C114 HydrophobicContact CD1-CB 4.16Å; L79-C114 HydrophobicContact CD2-CB 4.27Å; L79-Y124 HydrophobicContact CD2-CD2 4.39Å
80	I	98.3	Very high	97.5	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	132.4	-177.5	-56.7	178	0	0	0	109.2	H54 V71 S72 K78 W82 K89 H91 A92	H54-I80 VanDerWaalsContact CE1-CD1 3.46Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.23Å; V71-I80 CarbonylContact C-O 3.53Å; V71-I80 WeakPolarHBondContact CA-O 3.32Å; S72-I80 PolarHBondContact N-O 2.94Å; S72-I80 PolarHBondContact O-N 3.46Å; K78-I80 HydrophobicContact CB-CG1 4.23Å; I80-W82 HydrophobicContact CB-CZ2 3.79Å; I80-W82 HydrophobicContact CD1-CH2 4.14Å; I80-W82 HydrophobicContact CD1-CZ2 3.74Å; I80-W82 HydrophobicContact CG1-CZ2 4.35Å; I80-W82 HydrophobicContact CG2-CD2 3.69Å; I80-W82 HydrophobicContact CG2-CE3 4.22Å; I80-W82 HydrophobicContact CG2-CG 4.2Å; I80-W82 HydrophobicContact CG2-CH2 4.05Å; I80-W82 HydrophobicContact CG2-CZ2 3.48Å; I80-W82 VanDerWaalsContact CG2-CZ2 3.48Å; I80-W82 HydrophobicContact CG2-CZ3 4.39Å; I80-W82 PolarHBondContact O-NE1 2.96Å; I80-K89 HydrophobicContact CG2-CB 4.18Å; I80-K89 HydrophobicContact CG2-CD 4.24Å; I80-K89 HydrophobicContact CG2-CG 3.95Å; I80-H91 WeakPolarHBondContact CA-O 3.3Å; I80-H91 WeakPolarHBondContact CG2-O 3.33Å; I80-A92 HydrophobicContact CG1-CB 4.42Å
81	I	98.1	Very high	97.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.8	171.1	-59.7	176	0	0	0	108.1	L70 V71 K89 M90 H91 Y105 V112 L126	L70-I81 CarbonylContact O-C 3.58Å; L70-I81 WeakPolarHBondContact O-CA 3.15Å; V71-I81 HydrophobicContact CB-CG1 4.28Å; V71-I81 HydrophobicContact CG2-CG1 4.09Å; I81-K89 CarbonylContact O-C 3.57Å; I81-M90 HydrophobicContact CB-CB 4.42Å; I81-M90 HydrophobicContact CG2-CB 4.14Å; I81-M90 PolarHBondContact O-N 3.01Å; I81-H91 HydrophobicContact CB-CB 4.21Å; I81-H91 HydrophobicContact CD1-CB 4.22Å; I81-H91 HydrophobicContact CG1-CB 4.39Å; I81-H91 PolarHBondContact N-O 3.46Å; I81-H91 PolarHBondContact O-N 2.87Å; I81-Y105 HydrophobicContact CG2-CE2 4.13Å; I81-V112 HydrophobicContact CD1-CG1 3.9Å; I81-V112 HydrophobicContact CD1-CG2 4.34Å; I81-L126 HydrophobicContact CD1-CD1 3.46Å; I81-L126 VanDerWaalsContact CD1-CD1 3.46Å; I81-L126 HydrophobicContact CD1-CD2 3.33Å; I81-L126 HydrophobicContact CD1-CG 4.03Å
82	W	98.5	Very high	97.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	147.4	-174.4	-48.1	82.5	0	0	0	110.7	L51 R52 H54 L69 L70 S72 I80 N88 K89 L336	L51-W82 HydrophobicContact CB-CD2 4.12Å; L51-W82 HydrophobicContact CB-CE3 3.85Å; L51-W82 HydrophobicContact CB-CH2 4.25Å; L51-W82 HydrophobicContact CB-CZ3 3.92Å; L51-W82 HydrophobicContact CD1-CB 3.9Å; L51-W82 HydrophobicContact CD1-CD2 3.97Å; L51-W82 HydrophobicContact CD1-CE3 4.31Å; L51-W82 HydrophobicContact CD1-CG 3.79Å; L51-W82 HydrophobicContact CD2-CE3 4.36Å; L51-W82 HydrophobicContact CG-CE3 4.4Å; R52-W82 WeakPolarHBondContact O-CH2 3.45Å; R52-W82 WeakPolarHBondContact O-CZ3 3.44Å; H54-W82 AromaticContact CD2-CZ2 3.99Å; L69-W82 VanDerWaalsContact CA-O 3.32Å; L69-W82 WeakPolarHBondContact CA-O 3.14Å; L69-W82 WeakPolarHBondContact CD2-O 3.1Å; L70-W82 HydrophobicContact CD1-CB 4.46Å; L70-W82 HydrophobicContact CD1-CG 4.31Å; L70-W82 HydrophobicContact CG-CB 4.17Å; L70-W82 PolarHBondContact N-O 3.05Å; L70-W82 VanDerWaalsContact N-O 3.14Å; L70-W82 PolarHBondContact O-N 3.2Å; S72-W82 PolarHBondContact OG-NE1 2.94Å; I80-W82 HydrophobicContact CB-CZ2 3.79Å; I80-W82 HydrophobicContact CD1-CH2 4.14Å; I80-W82 HydrophobicContact CD1-CZ2 3.74Å; I80-W82 HydrophobicContact CG1-CZ2 4.35Å; I80-W82 HydrophobicContact CG2-CD2 3.69Å; I80-W82 HydrophobicContact CG2-CE3 4.22Å; I80-W82 HydrophobicContact CG2-CG 4.2Å; I80-W82 HydrophobicContact CG2-CH2 4.05Å; I80-W82 HydrophobicContact CG2-CZ2 3.48Å; I80-W82 VanDerWaalsContact CG2-CZ2 3.48Å; I80-W82 HydrophobicContact CG2-CZ3 4.39Å; I80-W82 PolarHBondContact O-NE1 2.96Å; W82-N88 WeakPolarHBondContact CA-O 3.32Å; W82-K89 HydrophobicContact CE3-CG 3.8Å; W82-K89 HydrophobicContact CH2-CD 4.39Å; W82-K89 HydrophobicContact CH2-CG 4.21Å; W82-K89 HydrophobicContact CZ3-CD 4.17Å; W82-K89 HydrophobicContact CZ3-CG 3.59Å; W82-L336 HydrophobicContact CZ2-CD1 4.29Å
83	D	98.2	Very high	96.9	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.043	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	110.2	157.5	175.4	3.5	0	0	0	108.6	R68 L69 Y85 T86 T87 N88 M90	R68-D83 WeakPolarHBondContact CG-OD1 3.27Å; R68-D83 IonicContact CZ-OD1 2.68Å; R68-D83 IonicContact CZ-OD2 3.56Å; R68-D83 IonicContact NE-OD1 3.86Å; R68-D83 PolarHBondContact NE-OD1 2.93Å; R68-D83 IonicContact NE-OD2 2.7Å; R68-D83 PolarHBondContact NE-OD2 3.05Å; R68-D83 IonicContact NH2-OD1 3.18Å; R68-D83 IonicContact NH2-OD2 3.06Å; R68-D83 PolarHBondContact NH2-OD2 3.11Å; L69-D83 HydrophobicContact CD2-CB 4.18Å; D83-Y85 PolarHBondContact O-N 2.85Å; D83-Y85 PolarHBondContact OD1-N 2.79Å; D83-T86 WeakPolarHBondContact CB-OG1 3.36Å; D83-T86 PolarHBondContact O-N 3.04Å; D83-T86 VanDerWaalsContact OD2-CG2 3.31Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.36Å; D83-T86 PolarHBondContact OD2-OG1 2.62Å; D83-T87 VanDerWaalsContact O-CA 3.24Å; D83-T87 WeakPolarHBondContact O-CA 3.46Å; D83-T87 PolarHBondContact O-N 3.4Å; D83-N88 PolarHBondContact N-O 3.1Å; D83-M90 HydrophobicContact CB-CG 4.28Å; D83-M90 HydrophobicContact CB-SD 4.47Å
84	S	97.6	Very high	96.8	Very high	6 Å²	6	45.7 Å²	45.7	4%	0.042	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.6	-178.3	55.9	0	0	0	0	113.7	R68	R68-S84 WeakPolarHBondContact CA-OG 3.5Å; R68-S84 VanDerWaalsContact O-CB 3.22Å; R68-S84 WeakPolarHBondContact O-CB 3.42Å; R68-S84 PolarHBondContact O-N 3.04Å; R68-S84 PolarHBondContact O-OG 3.46Å
85	Y	97	Very high	96.6	Very high	133 Å²	133	46.9 Å²	46.9	52%	0.522	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-45.3	-174	-73.1	11.8	0	0	0	110.8	R49 R68 D83	R49-Y85 PolarHBondContact NE-O 3.44Å; R68-Y85 HydrophobicContact CB-CE1 4.48Å; R68-Y85 HydrophobicContact CG-CD1 4.16Å; R68-Y85 HydrophobicContact CG-CD2 4.42Å; R68-Y85 HydrophobicContact CG-CE1 4.32Å; R68-Y85 HydrophobicContact CG-CG 4.21Å; D83-Y85 PolarHBondContact O-N 2.85Å; D83-Y85 PolarHBondContact OD1-N 2.79Å
86	T	97.5	Very high	96.3	Very high	60 Å²	60	54.4 Å²	54.4	37%	0.368	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-13.3	-175.4	64	0	0	0	0	113.5	D83 N88	D83-T86 WeakPolarHBondContact CB-OG1 3.36Å; D83-T86 PolarHBondContact O-N 3.04Å; D83-T86 VanDerWaalsContact OD2-CG2 3.31Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.36Å; D83-T86 PolarHBondContact OD2-OG1 2.62Å; T86-N88 PolarHBondContact O-N 3.11Å; T86-N88 WeakPolarHBondContact OG1-CB 3.46Å; T86-N88 PolarHBondContact OG1-N 3.3Å; T86-N88 PolarHBondContact OG1-ND2 3.4Å
87	T	97.6	Very high	96.1	Very high	55 Å²	55	53.9 Å²	53.9	34%	0.337	28%	0.276	S	S	.	.			trans	64	9.6	-171.8	71.8	0	0	0	0	114.9	R49 L51 D83	R49-T87 HydrophobicContact CB-CG2 4.08Å; R49-T87 HydrophobicContact CG-CG2 4.16Å; L51-T87 HydrophobicContact CD2-CG2 3.84Å; D83-T87 VanDerWaalsContact O-CA 3.24Å; D83-T87 WeakPolarHBondContact O-CA 3.46Å; D83-T87 PolarHBondContact O-N 3.4Å
88	N	97.5	Very high	95.8	Very high	98 Å²	98	55.9 Å²	55.9	52%	0.524	29%	0.288	S	S	.	.			trans	-72.5	146.6	178.6	-70.8	-25	0	0	0	111.1	W82 D83 T86	W82-N88 WeakPolarHBondContact CA-O 3.32Å; D83-N88 PolarHBondContact N-O 3.1Å; T86-N88 PolarHBondContact O-N 3.11Å; T86-N88 WeakPolarHBondContact OG1-CB 3.46Å; T86-N88 PolarHBondContact OG1-N 3.3Å; T86-N88 PolarHBondContact OG1-ND2 3.4Å
89	K	96.4	Very high	95.7	Very high	105 Å²	105	58.5 Å²	58.5	46%	0.457	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	110.3	170.7	-58.5	177.4	-175.6	72.7	0	107.6	R52 I80 I81 W82	R52-K89 VanDerWaalsContact O-CE 3.3Å; R52-K89 WeakPolarHBondContact O-CE 3.46Å; R52-K89 PolarHBondContact O-NZ 3.01Å; I80-K89 HydrophobicContact CG2-CB 4.18Å; I80-K89 HydrophobicContact CG2-CD 4.24Å; I80-K89 HydrophobicContact CG2-CG 3.95Å; I81-K89 CarbonylContact O-C 3.57Å; W82-K89 HydrophobicContact CE3-CG 3.8Å; W82-K89 HydrophobicContact CH2-CD 4.39Å; W82-K89 HydrophobicContact CH2-CG 4.21Å; W82-K89 HydrophobicContact CZ3-CD 4.17Å; W82-K89 HydrophobicContact CZ3-CG 3.59Å
90	M	94.2	Very high	95.6	Very high	99 Å²	99	58.7 Å²	58.7	49%	0.488	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	-44.4	176	-67.1	-58.2	-61.1	0	0	110.6	L69 I81 D83	L69-M90 HydrophobicContact CD2-CG 3.96Å; I81-M90 HydrophobicContact CB-CB 4.42Å; I81-M90 HydrophobicContact CG2-CB 4.14Å; I81-M90 PolarHBondContact O-N 3.01Å; D83-M90 HydrophobicContact CB-CG 4.28Å; D83-M90 HydrophobicContact CB-SD 4.47Å
91	H	94.2	Very high	95.6	Very high	56 Å²	56	60.7 Å²	60.7	26%	0.259	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	149.1	176.3	-60.4	-73.9	0	0	0	110.5	I80 I81 I93 V133	I80-H91 WeakPolarHBondContact CA-O 3.3Å; I80-H91 WeakPolarHBondContact CG2-O 3.33Å; I81-H91 HydrophobicContact CB-CB 4.21Å; I81-H91 HydrophobicContact CD1-CB 4.22Å; I81-H91 HydrophobicContact CG1-CB 4.39Å; I81-H91 PolarHBondContact N-O 3.46Å; I81-H91 PolarHBondContact O-N 2.87Å; H91-I93 HydrophobicContact CB-CG1 4.4Å; H91-V133 HydrophobicContact CB-CG2 4.47Å; H91-V133 WeakPolarHBondContact ND1-CG2 3.49Å
92	A	95.2	Very high	95.6	Very high	62 Å²	62	60.9 Å²	60.9	51%	0.512	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	99.9	168.8	0	0	0	0	0	107.8	I80	I80-A92 HydrophobicContact CG1-CB 4.42Å
93	I	95.6	Very high	95.6	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.3	-172.9	-55.9	162.7	0	0	0	107.8	K78 L79 H91 V112 Y124 L126 V133	K78-I93 WeakPolarHBondContact CA-O 3.34Å; L79-I93 HydrophobicContact CB-CB 4.22Å; L79-I93 HydrophobicContact CD2-CD1 4.22Å; L79-I93 PolarHBondContact N-O 3.21Å; L79-I93 PolarHBondContact O-N 3.03Å; H91-I93 HydrophobicContact CB-CG1 4.4Å; I93-V112 HydrophobicContact CD1-CG2 3.94Å; I93-Y124 HydrophobicContact CD1-CG 4.4Å; I93-Y124 HydrophobicContact CG2-CD1 3.57Å; I93-Y124 HydrophobicContact CG2-CE1 3.44Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.44Å; I93-Y124 HydrophobicContact CG2-CG 4.29Å; I93-L126 HydrophobicContact CD1-CD2 4.25Å; I93-V133 HydrophobicContact CD1-CB 4.41Å; I93-V133 HydrophobicContact CD1-CG1 3.61Å; I93-V133 HydrophobicContact CG1-CB 4.11Å; I93-V133 HydrophobicContact CG1-CG1 3.77Å
94	P	95.3	Very high	95.7	Very high	106 Å²	106	60.5 Å²	60.5	69%	0.688	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.9	172.1	30.2	-32.4	0	0	0	109.9
95	L	94.7	Very high	95.7	Very high	25 Å²	25	61 Å²	61	13%	0.131	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-90	152.1	177.3	-57	-178.1	0	0	0	110.3	G77 L79 S97 V100 C114 Y124	G77-L95 WeakPolarHBondContact O-CB 3.45Å; G77-L95 PolarHBondContact O-N 3.38Å; L79-L95 HydrophobicContact CB-CD1 4.46Å; L79-L95 HydrophobicContact CB-CD2 3.99Å; L79-L95 HydrophobicContact CB-CG 4.38Å; L95-S97 WeakPolarHBondContact CB-O 3.31Å; L95-V100 HydrophobicContact CD1-CB 3.87Å; L95-V100 HydrophobicContact CD1-CG1 4.13Å; L95-V100 HydrophobicContact CD1-CG2 4.03Å; L95-C114 WeakPolarHBondContact CD2-SG 3.26Å; L95-Y124 HydrophobicContact CD2-CE2 4.16Å; L95-Y124 VanDerWaalsContact CD2-OH 3.25Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.37Å
96	R	89.8	Confident	95.7	Very high	194 Å²	194	54.7 Å²	54.7	73%	0.732	28%	0.282	S	S	*	.	S	Bend	trans	-72.6	-42.8	173.4	-70.8	179.1	175.3	178.5	-3.4	111.3	E138	R96-E138 IonicContact CZ-OE1 2.66Å; R96-E138 VanDerWaalsContact CZ-OE1 3.3Å; R96-E138 IonicContact NE-OE1 2.74Å; R96-E138 VanDerWaalsContact NH1-CD 3.25Å; R96-E138 IonicContact NH1-OE1 3.72Å; R96-E138 PolarHBondContact NH1-OE1 2.79Å; R96-E138 IonicContact NH1-OE2 3.3Å; R96-E138 PolarHBondContact NH1-OE2 3.31Å; R96-E138 VanDerWaalsContact NH1-OE2 3.07Å
97	S	91.3	Very high	95.7	Very high	29 Å²	29	54 Å²	54	20%	0.203	28%	0.279	C	S	.	.			trans	-98.1	132.7	173.6	-176	0	0	0	0	110.3	L95 W99 D118	L95-S97 WeakPolarHBondContact CB-O 3.31Å; S97-W99 VanDerWaalsContact C-N 3.31Å; S97-W99 PolarHBondContact OG-N 3.28Å; S97-D118 VanDerWaalsContact CB-OD2 3.26Å; S97-D118 WeakPolarHBondContact CB-OD2 3.19Å
98	S	91.2	Very high	95.6	Very high	51 Å²	51	53.8 Å²	53.8	36%	0.357	28%	0.28	S	S	.	.	S	Bend	trans	-74.1	-25.4	174	57.5	0	0	0	0	112.3	Q75 V100	Q75-S98 CarbonylContact C-O 3.59Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.18Å; S98-V100 VanDerWaalsContact C-N 3.33Å; S98-V100 PolarHBondContact O-N 3.24Å
99	W	93.9	Very high	95.5	Very high	134 Å²	134	50.3 Å²	50.3	51%	0.508	27%	0.267	S	S	.	.			trans	-89.6	68.9	-172.9	-66.5	94.9	0	0	0	111.6	Q75 S97 G116 L117	Q75-W99 VanDerWaalsContact NE2-CE3 3.28Å; Q75-W99 VanDerWaalsContact NE2-CZ3 3.27Å; S97-W99 VanDerWaalsContact C-N 3.31Å; S97-W99 PolarHBondContact OG-N 3.28Å; W99-G116 WeakPolarHBondContact O-CA 3.34Å; W99-L117 HydrophobicContact CB-CB 3.85Å; W99-L117 HydrophobicContact CB-CD1 3.67Å; W99-L117 HydrophobicContact CB-CG 3.78Å; W99-L117 HydrophobicContact CD2-CD1 3.89Å; W99-L117 HydrophobicContact CE3-CD1 3.98Å; W99-L117 HydrophobicContact CG-CD1 3.77Å; W99-L117 HydrophobicContact CG-CG 4.43Å; W99-L117 PolarHBondContact O-N 2.84Å
100	V	96.6	Very high	95.4	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	137	174.8	67.9	0	0	0	0	110.8	A73 S74 L95 S98 T102 C114 G115	A73-V100 HydrophobicContact CB-CB 4.36Å; A73-V100 HydrophobicContact CB-CG1 3.71Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; S74-V100 WeakPolarHBondContact O-CG1 3.42Å; L95-V100 HydrophobicContact CD1-CB 3.87Å; L95-V100 HydrophobicContact CD1-CG1 4.13Å; L95-V100 HydrophobicContact CD1-CG2 4.03Å; S98-V100 VanDerWaalsContact C-N 3.33Å; S98-V100 PolarHBondContact O-N 3.24Å; V100-T102 WeakPolarHBondContact CG2-O 3.28Å; V100-C114 HydrophobicContact CG2-CB 3.88Å; V100-G115 WeakPolarHBondContact CG2-O 3.48Å
101	M	97.9	Very high	95.5	Very high	45 Å²	45	44.7 Å²	44.7	22%	0.222	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	-31	179	-66.1	179.3	67.7	0	0	111.9	Y59 A60 G115 L117 Y145 L146	Y59-M101 HydrophobicContact CD1-CG 4.45Å; A60-M101 WeakPolarHBondContact CB-O 3.48Å; M101-G115 PolarHBondContact N-O 3.09Å; M101-L117 HydrophobicContact SD-CD2 3.97Å; M101-L117 HydrophobicContact SD-CG 4.49Å; M101-Y145 HydrophobicContact CE-CD2 3.58Å; M101-Y145 HydrophobicContact CE-CE2 3.64Å; M101-Y145 HydrophobicContact SD-CD2 3.53Å; M101-Y145 VanDerWaalsContact SD-CD2 3.53Å; M101-Y145 HydrophobicContact SD-CE2 4.23Å; M101-Y145 HydrophobicContact SD-CG 4.04Å; M101-L146 WeakPolarHBondContact CB-O 3.2Å
102	T	98.4	Very high	95.7	Very high	5 Å²	5	42 Å²	42	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.4	-178.6	-178.3	0	0	0	0	112.6	V100 C114 G115 L146 S147 C148 C149	V100-T102 WeakPolarHBondContact CG2-O 3.28Å; T102-C114 VanDerWaalsContact O-CA 3.24Å; T102-C114 WeakPolarHBondContact O-CA 3.22Å; T102-C114 WeakPolarHBondContact O-CB 3.47Å; T102-G115 PolarHBondContact N-O 2.87Å; T102-G115 PolarHBondContact O-N 2.92Å; T102-L146 HydrophobicContact CG2-CD2 3.72Å; T102-L146 HydrophobicContact CG2-CG 4.08Å; T102-S147 WeakPolarHBondContact CB-O 3.48Å; T102-C148 WeakPolarHBondContact OG1-CA 3.44Å; T102-C149 HydrophobicContact CG2-CB 4.37Å; T102-C149 PolarHBondContact OG1-N 3.36Å; T102-C149 VanDerWaalsContact OG1-N 3.13Å; T102-C149 PolarHBondContact OG1-SG 2.89Å
103	C	98.4	Very high	95.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.2	158.4	60.6	0	0	0	0	111.4	V71 A73 L79 A113 C114 R150	V71-C103 HydrophobicContact CG1-CB 4.32Å; V71-C103 HydrophobicContact CG2-CB 4.49Å; A73-C103 HydrophobicContact CB-CB 3.9Å; L79-C103 HydrophobicContact CD1-CB 3.58Å; C103-A113 CarbonylContact C-O 3.56Å; C103-A113 WeakPolarHBondContact CA-O 3.49Å; C103-A113 WeakPolarHBondContact CB-O 3.35Å; C103-C114 HydrophobicContact CB-CB 4.4Å; C103-R150 PolarHBondContact O-NH1 2.83Å
104	A	98.6	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	147.2	176.4	0	0	0	0	0	110.6	V112 A113 C149 F151	A104-V112 CarbonylContact O-C 3.55Å; A104-V112 VanDerWaalsContact O-CA 3.22Å; A104-V112 WeakPolarHBondContact O-CA 3.24Å; A104-A113 HydrophobicContact CB-CB 4.4Å; A104-A113 PolarHBondContact N-O 2.93Å; A104-A113 PolarHBondContact O-N 2.69Å; A104-C149 WeakPolarHBondContact CB-O 3.44Å; A104-F151 HydrophobicContact CB-CD2 3.83Å; A104-F151 HydrophobicContact CB-CE2 3.95Å
105	Y	98.3	Very high	96.1	Very high	15 Å²	15	34 Å²	34	6%	0.059	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.4	171.9	-147.4	-54.8	0	0	0	107.9	H62 L69 V71 I81 V112 L126	H62-Y105 WeakPolarHBondContact ND1-CB 3.4Å; H62-Y105 PolarHBondContact ND1-N 3.12Å; L69-Y105 HydrophobicContact CB-CE2 4.19Å; V71-Y105 HydrophobicContact CB-CD2 3.98Å; V71-Y105 HydrophobicContact CG1-CD2 3.95Å; V71-Y105 HydrophobicContact CG1-CG 4.48Å; I81-Y105 HydrophobicContact CG2-CE2 4.13Å; Y105-V112 HydrophobicContact CD1-CG1 4.31Å; Y105-V112 HydrophobicContact CD2-CG1 4.03Å; Y105-V112 HydrophobicContact CE1-CG1 4.4Å; Y105-V112 HydrophobicContact CE2-CG1 4.21Å; Y105-V112 HydrophobicContact CG-CG1 4.1Å; Y105-L126 HydrophobicContact CE1-CD1 4.15Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.41Å
106	A	97.9	Very high	96.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.008	17%	0.165	C	C	.	.			trans	-67.9	141.8	177	0	0	0	0	0	111.4	S108 G109 Y111 F151	A106-S108 PolarHBondContact O-N 3.04Å; A106-G109 PolarHBondContact O-N 2.87Å; A106-Y111 WeakPolarHBondContact CB-O 3.4Å; A106-Y111 PolarHBondContact N-O 2.82Å; A106-F151 HydrophobicContact CB-CB 4.32Å; A106-F151 HydrophobicContact CB-CD1 4.13Å; A106-F151 HydrophobicContact CB-CD2 3.86Å; A106-F151 HydrophobicContact CB-CE1 4.35Å; A106-F151 HydrophobicContact CB-CE2 4.11Å; A106-F151 HydrophobicContact CB-CG 3.85Å; A106-F151 HydrophobicContact CB-CZ 4.34Å
107	P	96.8	Very high	96.5	Very high	46 Å²	46	27.8 Å²	27.8	30%	0.299	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.9	-179	-28.2	34.3	0	0	0	114.7	T65 G109	T65-P107 HydrophobicContact CG2-CB 4.13Å; T65-P107 PolarHBondContact OG1-O 2.88Å; P107-G109 VanDerWaalsContact C-N 3.3Å; P107-G109 PolarHBondContact O-N 2.91Å
108	S	96.1	Very high	96.7	Very high	50 Å²	50	29 Å²	29	35%	0.35	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-17.4	179	67.5	0	0	0	0	114.7	A106 N110 D154	A106-S108 PolarHBondContact O-N 3.04Å; S108-N110 VanDerWaalsContact C-N 3.3Å; S108-N110 WeakPolarHBondContact CB-ND2 3.34Å; S108-N110 VanDerWaalsContact OG-CB 3.3Å; S108-N110 WeakPolarHBondContact OG-CB 3.27Å; S108-N110 PolarHBondContact OG-N 3.33Å; S108-N110 PolarHBondContact OG-ND2 2.91Å; S108-D154 WeakPolarHBondContact CB-OD1 3.29Å; S108-D154 VanDerWaalsContact CB-OD2 3.3Å; S108-D154 WeakPolarHBondContact CB-OD2 3.39Å; S108-D154 PolarHBondContact OG-OD1 3.03Å; S108-D154 PolarHBondContact OG-OD2 3.34Å
109	G	94.9	Very high	97	Very high	25 Å²	25	28.9 Å²	28.9	26%	0.258	15%	0.152	S	C	.	.	S	Bend	trans	83.9	-3.8	-168.9	0	0	0	0	0	114.9	A106 P107	A106-G109 PolarHBondContact O-N 2.87Å; P107-G109 VanDerWaalsContact C-N 3.3Å; P107-G109 PolarHBondContact O-N 2.91Å
110	N	93.9	Very high	97.1	Very high	32 Å²	32	24.7 Å²	24.7	17%	0.171	14%	0.139	C	C	.	.	S	Bend	trans	-87.9	-29.8	-168.3	-63.6	-31.7	0	0	0	114.1	S108 L126 K127 D154	S108-N110 VanDerWaalsContact C-N 3.3Å; S108-N110 WeakPolarHBondContact CB-ND2 3.34Å; S108-N110 VanDerWaalsContact OG-CB 3.3Å; S108-N110 WeakPolarHBondContact OG-CB 3.27Å; S108-N110 PolarHBondContact OG-N 3.33Å; S108-N110 PolarHBondContact OG-ND2 2.91Å; N110-L126 WeakPolarHBondContact O-CB 3.27Å; N110-L126 PolarHBondContact O-N 2.92Å; N110-K127 VanDerWaalsContact OD1-CD 3.24Å; N110-K127 WeakPolarHBondContact OD1-CD 3.21Å; N110-K127 WeakPolarHBondContact OD1-CE 3.18Å; N110-K127 PolarHBondContact OD1-NZ 3.22Å; N110-D154 PolarHBondContact ND2-OD2 2.84Å
111	Y	96.9	Very high	97.2	Very high	54 Å²	54	24.6 Å²	24.6	21%	0.212	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.9	-172.4	-58.5	-85.1	0	0	0	112.3	A106 I123 Y124 C125 D154	A106-Y111 WeakPolarHBondContact CB-O 3.4Å; A106-Y111 PolarHBondContact N-O 2.82Å; Y111-I123 HydrophobicContact CD1-CG2 3.87Å; Y111-I123 HydrophobicContact CG-CG2 4.32Å; Y111-Y124 VanDerWaalsContact CA-O 3.24Å; Y111-Y124 WeakPolarHBondContact CA-O 3.08Å; Y111-C125 HydrophobicContact CD1-CB 4.01Å; Y111-C125 HydrophobicContact CE1-CB 3.75Å; Y111-D154 HydrophobicContact CD2-CB 4.09Å; Y111-D154 HydrophobicContact CE2-CB 3.82Å
112	V	98	Very high	97.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.1	162.5	-66.9	0	0	0	0	109.3	V71 L79 I81 I93 A104 Y105 Y124 L126	V71-V112 HydrophobicContact CB-CG1 4.27Å; V71-V112 HydrophobicContact CG1-CG1 4.46Å; V71-V112 HydrophobicContact CG2-CB 4.49Å; V71-V112 HydrophobicContact CG2-CG1 4.24Å; L79-V112 HydrophobicContact CD2-CB 4.19Å; L79-V112 HydrophobicContact CD2-CG2 3.64Å; I81-V112 HydrophobicContact CD1-CG1 3.9Å; I81-V112 HydrophobicContact CD1-CG2 4.34Å; I93-V112 HydrophobicContact CD1-CG2 3.94Å; A104-V112 CarbonylContact O-C 3.55Å; A104-V112 VanDerWaalsContact O-CA 3.22Å; A104-V112 WeakPolarHBondContact O-CA 3.24Å; Y105-V112 HydrophobicContact CD1-CG1 4.31Å; Y105-V112 HydrophobicContact CD2-CG1 4.03Å; Y105-V112 HydrophobicContact CE1-CG1 4.4Å; Y105-V112 HydrophobicContact CE2-CG1 4.21Å; Y105-V112 HydrophobicContact CG-CG1 4.1Å; V112-Y124 HydrophobicContact CG2-CD2 4.37Å; V112-Y124 HydrophobicContact CG2-CG 4.45Å; V112-Y124 PolarHBondContact N-O 3.16Å; V112-Y124 PolarHBondContact O-N 2.88Å; V112-L126 HydrophobicContact CG1-CD1 4.04Å; V112-L126 HydrophobicContact CG2-CD2 3.97Å
113	A	98.3	Very high	97.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.7	174.2	0	0	0	0	0	110.5	C103 A104 S122 I123 F151 I157	C103-A113 CarbonylContact C-O 3.56Å; C103-A113 WeakPolarHBondContact CA-O 3.49Å; C103-A113 WeakPolarHBondContact CB-O 3.35Å; A104-A113 HydrophobicContact CB-CB 4.4Å; A104-A113 PolarHBondContact N-O 2.93Å; A104-A113 PolarHBondContact O-N 2.69Å; A113-S122 CarbonylContact C-O 3.53Å; A113-S122 VanDerWaalsContact CA-O 3.23Å; A113-S122 WeakPolarHBondContact CA-O 3.44Å; A113-I123 HydrophobicContact CB-CG1 4.26Å; A113-F151 HydrophobicContact CB-CE2 3.56Å; A113-F151 HydrophobicContact CB-CZ 3.55Å; A113-I157 HydrophobicContact CB-CD1 3.6Å
114	C	98.2	Very high	97	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.027	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	166.2	166.4	71.1	0	0	0	0	111.3	L79 L95 V100 T102 C103 S122	L79-C114 HydrophobicContact CD1-CB 4.16Å; L79-C114 HydrophobicContact CD2-CB 4.27Å; L95-C114 WeakPolarHBondContact CD2-SG 3.26Å; V100-C114 HydrophobicContact CG2-CB 3.88Å; T102-C114 VanDerWaalsContact O-CA 3.24Å; T102-C114 WeakPolarHBondContact O-CA 3.22Å; T102-C114 WeakPolarHBondContact O-CB 3.47Å; C103-C114 HydrophobicContact CB-CB 4.4Å; C114-S122 PolarHBondContact N-O 2.69Å; C114-S122 PolarHBondContact O-N 2.91Å
115	G	97.5	Very high	96.8	Very high	2 Å²	2	23.9 Å²	23.9	2%	0.021	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	173.3	169.7	0	0	0	0	0	111.3	V100 M101 T102 I120	V100-G115 WeakPolarHBondContact CG2-O 3.48Å; M101-G115 PolarHBondContact N-O 3.09Å; T102-G115 PolarHBondContact N-O 2.87Å; T102-G115 PolarHBondContact O-N 2.92Å; G115-I120 WeakPolarHBondContact CA-O 3.43Å
116	G	96.8	Very high	96.4	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	-124.4	176.2	0	0	0	0	0	112.1	W99 D118 N119 Y145 L146	W99-G116 WeakPolarHBondContact O-CA 3.34Å; G116-D118 PolarHBondContact N-OD1 2.89Å; G116-D118 VanDerWaalsContact N-OD1 3.1Å; G116-D118 PolarHBondContact O-N 3.47Å; G116-D118 VanDerWaalsContact O-N 3.12Å; G116-N119 PolarHBondContact O-N 3.06Å; G116-N119 VanDerWaalsContact O-N 3.16Å; G116-Y145 CarbonylContact O-C 3.56Å; G116-Y145 WeakPolarHBondContact O-CA 3.37Å; G116-L146 PolarHBondContact O-N 2.85Å
117	L	96.6	Very high	95.5	Very high	88 Å²	88	31 Å²	31	46%	0.461	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.6	-175.4	-62	-175.2	0	0	0	114.6	W99 M101 N119 Y145	W99-L117 HydrophobicContact CB-CB 3.85Å; W99-L117 HydrophobicContact CB-CD1 3.67Å; W99-L117 HydrophobicContact CB-CG 3.78Å; W99-L117 HydrophobicContact CD2-CD1 3.89Å; W99-L117 HydrophobicContact CE3-CD1 3.98Å; W99-L117 HydrophobicContact CG-CD1 3.77Å; W99-L117 HydrophobicContact CG-CG 4.43Å; W99-L117 PolarHBondContact O-N 2.84Å; M101-L117 HydrophobicContact SD-CD2 3.97Å; M101-L117 HydrophobicContact SD-CG 4.49Å; L117-N119 VanDerWaalsContact C-N 3.26Å; L117-N119 PolarHBondContact O-OD1 2.58Å; L117-Y145 HydrophobicContact CD2-CD1 4.45Å; L117-Y145 HydrophobicContact CD2-CG 4.14Å
118	D	95.7	Very high	94.1	Very high	54 Å²	54	31 Å²	31	29%	0.289	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.9	172.7	55.5	-2.8	0	0	0	113.2	S97 G116 I120	S97-D118 VanDerWaalsContact CB-OD2 3.26Å; S97-D118 WeakPolarHBondContact CB-OD2 3.19Å; G116-D118 PolarHBondContact N-OD1 2.89Å; G116-D118 VanDerWaalsContact N-OD1 3.1Å; G116-D118 PolarHBondContact O-N 3.47Å; G116-D118 VanDerWaalsContact O-N 3.12Å; D118-I120 WeakPolarHBondContact O-CG1 3.17Å; D118-I120 PolarHBondContact O-N 2.89Å; D118-I120 VanDerWaalsContact O-N 3.09Å
119	N	96.8	Very high	92.5	Very high	48 Å²	48	41.2 Å²	41.2	26%	0.257	20%	0.199	S	C	.	.			trans	60.2	14.7	179.8	-52.2	-6.2	0	0	0	113.8	G116 L117 T143 G144 Y145	G116-N119 PolarHBondContact O-N 3.06Å; G116-N119 VanDerWaalsContact O-N 3.16Å; L117-N119 VanDerWaalsContact C-N 3.26Å; L117-N119 PolarHBondContact O-OD1 2.58Å; N119-T143 PolarHBondContact ND2-O 2.93Å; N119-G144 VanDerWaalsContact CB-O 3.3Å; N119-G144 WeakPolarHBondContact CB-O 3.4Å; N119-G144 PolarHBondContact OD1-O 3.43Å; N119-G144 VanDerWaalsContact OD1-O 3.05Å; N119-Y145 VanDerWaalsContact OD1-CA 3.28Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.37Å; N119-Y145 PolarHBondContact OD1-N 3.18Å; N119-Y145 VanDerWaalsContact OD1-N 3.17Å
120	I	97	Very high	90.9	Very high	47 Å²	47	46.3 Å²	46.3	24%	0.241	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.2	-175.4	-66.8	164.6	0	0	0	108.9	G115 D118 E138 P140	G115-I120 WeakPolarHBondContact CA-O 3.43Å; D118-I120 WeakPolarHBondContact O-CG1 3.17Å; D118-I120 PolarHBondContact O-N 2.89Å; D118-I120 VanDerWaalsContact O-N 3.09Å; I120-E138 HydrophobicContact CG2-CB 3.86Å; I120-E138 HydrophobicContact CG2-CG 4.36Å; I120-P140 HydrophobicContact CG1-CB 4.42Å
121	C	97.8	Very high	89.7	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	110.8	165.1	-165.9	0	0	0	0	109.5	L139 L146 T159	C121-L139 HydrophobicContact CB-CB 4.1Å; C121-L139 HydrophobicContact CB-CD1 4.23Å; C121-L139 PolarHBondContact N-O 3.44Å; C121-L139 PolarHBondContact O-N 3.22Å; C121-L146 HydrophobicContact CB-CD2 3.63Å; C121-T159 HydrophobicContact CB-CG2 4.04Å
122	S	97.6	Very high	88.8	Confident	6 Å²	6	50.3 Å²	50.3	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.9	177.2	-64.2	0	0	0	0	110.3	A113 C114	A113-S122 CarbonylContact C-O 3.53Å; A113-S122 VanDerWaalsContact CA-O 3.23Å; A113-S122 WeakPolarHBondContact CA-O 3.44Å; C114-S122 PolarHBondContact N-O 2.69Å; C114-S122 PolarHBondContact O-N 2.91Å
123	I	97.4	Very high	88.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.7	179.7	-61.1	171.1	0	0	0	109.2	Y111 A113 S136 R137 L139 F151 I157 I171	Y111-I123 HydrophobicContact CD1-CG2 3.87Å; Y111-I123 HydrophobicContact CG-CG2 4.32Å; A113-I123 HydrophobicContact CB-CG1 4.26Å; I123-S136 WeakPolarHBondContact O-CA 3.3Å; I123-S136 WeakPolarHBondContact O-CB 3.15Å; I123-S136 PolarHBondContact O-N 2.97Å; I123-R137 HydrophobicContact CB-CB 4.36Å; I123-R137 PolarHBondContact N-O 3.2Å; I123-R137 PolarHBondContact O-N 2.78Å; I123-L139 HydrophobicContact CD1-CD1 3.73Å; I123-L139 HydrophobicContact CD1-CG 4.2Å; I123-F151 HydrophobicContact CG2-CE1 4.45Å; I123-F151 HydrophobicContact CG2-CZ 4.31Å; I123-I157 HydrophobicContact CD1-CG2 4.33Å; I123-I171 HydrophobicContact CD1-CB 4.12Å; I123-I171 HydrophobicContact CD1-CD1 3.8Å; I123-I171 HydrophobicContact CD1-CG1 3.55Å; I123-I171 HydrophobicContact CD1-CG2 3.6Å
124	Y	96.1	Very high	87.4	Confident	5 Å²	5	58.8 Å²	58.8	2%	0.02	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.4	-177.6	-59.6	-96	0	0	0	110.2	L79 I93 L95 Y111 V112 V133 V135	L79-Y124 HydrophobicContact CD2-CD2 4.39Å; I93-Y124 HydrophobicContact CD1-CG 4.4Å; I93-Y124 HydrophobicContact CG2-CD1 3.57Å; I93-Y124 HydrophobicContact CG2-CE1 3.44Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.44Å; I93-Y124 HydrophobicContact CG2-CG 4.29Å; L95-Y124 HydrophobicContact CD2-CE2 4.16Å; L95-Y124 VanDerWaalsContact CD2-OH 3.25Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.37Å; Y111-Y124 VanDerWaalsContact CA-O 3.24Å; Y111-Y124 WeakPolarHBondContact CA-O 3.08Å; V112-Y124 HydrophobicContact CG2-CD2 4.37Å; V112-Y124 HydrophobicContact CG2-CG 4.45Å; V112-Y124 PolarHBondContact N-O 3.16Å; V112-Y124 PolarHBondContact O-N 2.88Å; Y124-V133 HydrophobicContact CD1-CG1 4.34Å; Y124-V135 HydrophobicContact CD1-CG2 4Å; Y124-V135 HydrophobicContact CE1-CB 4.34Å; Y124-V135 HydrophobicContact CE1-CG2 3.38Å
125	C	93.6	Very high	86.9	Confident	23 Å²	23	61.1 Å²	61.1	16%	0.155	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.8	173.3	-176.7	0	0	0	0	109.9	Y111 T128 R134	Y111-C125 HydrophobicContact CD1-CB 4.01Å; Y111-C125 HydrophobicContact CE1-CB 3.75Å; C125-T128 HydrophobicContact CB-CG2 4.47Å; C125-R134 PolarHBondContact N-O 2.81Å
126	L	90.1	Very high	86.5	Confident	18 Å²	18	63 Å²	63	9%	0.094	32%	0.316	C	S	.	.	S	Bend	trans	-82.9	-28.5	179.2	-57.1	-176.1	0	0	0	112.6	I81 I93 Y105 N110 V112 T128 V133	I81-L126 HydrophobicContact CD1-CD1 3.46Å; I81-L126 VanDerWaalsContact CD1-CD1 3.46Å; I81-L126 HydrophobicContact CD1-CD2 3.33Å; I81-L126 HydrophobicContact CD1-CG 4.03Å; I93-L126 HydrophobicContact CD1-CD2 4.25Å; Y105-L126 HydrophobicContact CE1-CD1 4.15Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.41Å; N110-L126 WeakPolarHBondContact O-CB 3.27Å; N110-L126 PolarHBondContact O-N 2.92Å; V112-L126 HydrophobicContact CG1-CD1 4.04Å; V112-L126 HydrophobicContact CG2-CD2 3.97Å; L126-T128 PolarHBondContact O-N 3.44Å; L126-V133 HydrophobicContact CD2-CG1 4.17Å; L126-V133 HydrophobicContact CD2-CG2 4.28Å
127	K	80.4	Confident	86.4	Confident	149 Å²	149	68 Å²	68	65%	0.648	34%	0.336	S	S	*	.			trans	-90.6	77.4	177.6	-69.1	-174.2	-178.8	161.9	0	110.5	N110	N110-K127 VanDerWaalsContact OD1-CD 3.24Å; N110-K127 WeakPolarHBondContact OD1-CD 3.21Å; N110-K127 WeakPolarHBondContact OD1-CE 3.18Å; N110-K127 PolarHBondContact OD1-NZ 3.22Å
128	T	67.4	Low	86.3	Confident	45 Å²	45	66.8 Å²	66.8	28%	0.276	33%	0.328	S	S	.	.			trans	-102.7	135	170.5	58.2	0	0	0	0	111.1	C125 L126 E130 G131 N132	C125-T128 HydrophobicContact CB-CG2 4.47Å; L126-T128 PolarHBondContact O-N 3.44Å; T128-E130 PolarHBondContact O-N 3.06Å; T128-E130 VanDerWaalsContact O-N 3.16Å; T128-G131 PolarHBondContact O-N 2.58Å; T128-N132 PolarHBondContact OG1-O 3.49Å
129	R	62	Low	86.4	Confident	264 Å²	264	64.3 Å²	64.3	100%	0.996	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.4	175.4	-68.3	-176.6	179	-177.4	0	112.9
130	E	61.6	Low	86.2	Confident	133 Å²	133	65.9 Å²	65.9	62%	0.621	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	2.8	-174.4	-62.3	178.5	-172.6	0	0	113.4	T128 N132 R134	T128-E130 PolarHBondContact O-N 3.06Å; T128-E130 VanDerWaalsContact O-N 3.16Å; E130-N132 PolarHBondContact O-N 2.97Å; E130-R134 IonicContact OE2-CZ 3.27Å; E130-R134 VanDerWaalsContact OE2-CZ 3.27Å; E130-R134 IonicContact OE2-NH1 3.28Å; E130-R134 PolarHBondContact OE2-NH1 3.38Å; E130-R134 IonicContact OE2-NH2 3.55Å; E130-R134 PolarHBondContact OE2-NH2 2.93Å
131	G	67.4	Low	85.9	Confident	57 Å²	57	65.9 Å²	65.9	59%	0.588	34%	0.338	S	S	*	.	S	Bend	trans	73.4	-20.1	177.1	0	0	0	0	0	116	T128	T128-G131 PolarHBondContact O-N 2.58Å
132	N	77.9	Confident	85.8	Confident	113 Å²	113	66.5 Å²	66.5	60%	0.604	34%	0.341	S	S	*	.			trans	-90.1	124.4	174.7	-75.7	-12.4	0	0	0	111	T128 E130 R134	T128-N132 PolarHBondContact OG1-O 3.49Å; E130-N132 PolarHBondContact O-N 2.97Å; N132-R134 PolarHBondContact O-N 2.82Å
133	V	84.6	Confident	85.8	Confident	32 Å²	32	72 Å²	72	19%	0.194	38%	0.375	C	S	.	.			trans	-71	124.4	172.2	179.7	0	0	0	0	108.7	H91 I93 Y124 L126	H91-V133 HydrophobicContact CB-CG2 4.47Å; H91-V133 WeakPolarHBondContact ND1-CG2 3.49Å; I93-V133 HydrophobicContact CD1-CB 4.41Å; I93-V133 HydrophobicContact CD1-CG1 3.61Å; I93-V133 HydrophobicContact CG1-CB 4.11Å; I93-V133 HydrophobicContact CG1-CG1 3.77Å; Y124-V133 HydrophobicContact CD1-CG1 4.34Å; L126-V133 HydrophobicContact CD2-CG1 4.17Å; L126-V133 HydrophobicContact CD2-CG2 4.28Å
134	R	83.1	Confident	85.8	Confident	146 Å²	146	72.7 Å²	72.7	55%	0.551	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	156.9	177.8	-64.6	-171.7	-175.6	151.3	13.8	110.4	C125 E130 N132 S136	C125-R134 PolarHBondContact N-O 2.81Å; E130-R134 IonicContact OE2-CZ 3.27Å; E130-R134 VanDerWaalsContact OE2-CZ 3.27Å; E130-R134 IonicContact OE2-NH1 3.28Å; E130-R134 PolarHBondContact OE2-NH1 3.38Å; E130-R134 IonicContact OE2-NH2 3.55Å; E130-R134 PolarHBondContact OE2-NH2 2.93Å; N132-R134 PolarHBondContact O-N 2.82Å; R134-S136 PolarHBondContact O-N 2.96Å
135	V	87.6	Confident	85.8	Confident	52 Å²	52	74.8 Å²	74.8	32%	0.315	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	119.1	167.5	-177	0	0	0	0	107.6	Y124 R137 E138	Y124-V135 HydrophobicContact CD1-CG2 4Å; Y124-V135 HydrophobicContact CE1-CB 4.34Å; Y124-V135 HydrophobicContact CE1-CG2 3.38Å; V135-R137 WeakPolarHBondContact CG1-O 3.46Å; V135-E138 HydrophobicContact CG1-CG 3.66Å
136	S	88.9	Confident	86	Confident	41 Å²	41	73.7 Å²	73.7	29%	0.287	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-47.4	174.9	-173.4	0	0	0	0	110.1	I123 R134	I123-S136 WeakPolarHBondContact O-CA 3.3Å; I123-S136 WeakPolarHBondContact O-CB 3.15Å; I123-S136 PolarHBondContact O-N 2.97Å; R134-S136 PolarHBondContact O-N 2.96Å
137	R	94.1	Very high	86.4	Confident	107 Å²	107	73.4 Å²	73.4	40%	0.404	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	150.6	-175.7	-64.3	-64.3	-173.3	-109.5	7.4	110.9	I123 V135 I171 S174	I123-R137 HydrophobicContact CB-CB 4.36Å; I123-R137 PolarHBondContact N-O 3.2Å; I123-R137 PolarHBondContact O-N 2.78Å; V135-R137 WeakPolarHBondContact CG1-O 3.46Å; R137-I171 HydrophobicContact CG-CG2 4.12Å; R137-I171 WeakPolarHBondContact CG-O 3.45Å; R137-S174 WeakPolarHBondContact CD-OG 3.32Å
138	E	95.9	Very high	87.3	Confident	62 Å²	62	66.8 Å²	66.8	29%	0.29	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.9	168.2	-66.1	-176.8	156.2	0	0	106.5	R96 I120 V135 P140	R96-E138 IonicContact CZ-OE1 2.66Å; R96-E138 VanDerWaalsContact CZ-OE1 3.3Å; R96-E138 IonicContact NE-OE1 2.74Å; R96-E138 VanDerWaalsContact NH1-CD 3.25Å; R96-E138 IonicContact NH1-OE1 3.72Å; R96-E138 PolarHBondContact NH1-OE1 2.79Å; R96-E138 IonicContact NH1-OE2 3.3Å; R96-E138 PolarHBondContact NH1-OE2 3.31Å; R96-E138 VanDerWaalsContact NH1-OE2 3.07Å; I120-E138 HydrophobicContact CG2-CB 3.86Å; I120-E138 HydrophobicContact CG2-CG 4.36Å; V135-E138 HydrophobicContact CG1-CG 3.66Å; E138-P140 VanDerWaalsContact C-CD 3.44Å; E138-P140 WeakPolarHBondContact O-CD 3.47Å
139	L	96.7	Very high	88.8	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	87.6	-178.2	-54.7	178.8	0	0	0	109	C121 I123 I157 W169	C121-L139 HydrophobicContact CB-CB 4.1Å; C121-L139 HydrophobicContact CB-CD1 4.23Å; C121-L139 PolarHBondContact N-O 3.44Å; C121-L139 PolarHBondContact O-N 3.22Å; I123-L139 HydrophobicContact CD1-CD1 3.73Å; I123-L139 HydrophobicContact CD1-CG 4.2Å; L139-I157 HydrophobicContact CD1-CG2 3.59Å; L139-W169 HydrophobicContact CB-CD2 4.11Å; L139-W169 HydrophobicContact CB-CE3 3.87Å; L139-W169 HydrophobicContact CB-CH2 4.48Å; L139-W169 HydrophobicContact CB-CZ3 4.06Å; L139-W169 HydrophobicContact CD1-CB 3.8Å; L139-W169 HydrophobicContact CD1-CD2 4.05Å; L139-W169 HydrophobicContact CD1-CE3 4.35Å; L139-W169 HydrophobicContact CD1-CG 3.79Å; L139-W169 HydrophobicContact CD2-CE3 4.21Å; L139-W169 HydrophobicContact CG-CE3 4.37Å
140	P	93.8	Very high	90.5	Very high	82 Å²	82	54.9 Å²	54.9	53%	0.532	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.5	173.3	33.5	-33.6	0	0	0	110.2	I120 E138	I120-P140 HydrophobicContact CG1-CB 4.42Å; E138-P140 VanDerWaalsContact C-CD 3.44Å; E138-P140 WeakPolarHBondContact O-CD 3.47Å
141	G	89.1	Confident	92.3	Very high	46 Å²	46	48.9 Å²	48.9	47%	0.474	28%	0.276	S	S	.	.			trans	168.6	-18	167.9	0	0	0	0	0	114.9
142	H	96.5	Very high	93.7	Very high	14 Å²	14	47.3 Å²	47.3	7%	0.065	25%	0.254	C	S	.	.			trans	-68.8	143.6	166.4	-78.7	-61.3	0	0	0	111.4	T159 S161 D163 T165	H142-T159 PolarHBondContact NE2-OG1 2.88Å; H142-S161 VanDerWaalsContact CG-CB 3.48Å; H142-S161 WeakPolarHBondContact ND1-CB 3.29Å; H142-D163 VanDerWaalsContact CA-OD2 3.31Å; H142-D163 WeakPolarHBondContact CA-OD2 3.48Å; H142-D163 WeakPolarHBondContact CB-OD2 3.34Å; H142-D163 IonicContact CG-OD2 2.76Å; H142-D163 IonicContact ND1-OD1 3.95Å; H142-D163 PolarHBondContact ND1-OD1 2.96Å; H142-D163 IonicContact ND1-OD2 3.67Å; H142-D163 PolarHBondContact ND1-OD2 3.05Å; H142-T165 PolarHBondContact CE1-OG1 3.04Å
143	T	97	Very high	94.6	Very high	122 Å²	122	45.1 Å²	45.1	75%	0.748	24%	0.242	S	C	*	.	S	Bend	trans	-96.9	-5.8	176	60.1	0	0	0	0	112.7	N119 D163	N119-T143 PolarHBondContact ND2-O 2.93Å; T143-D163 PolarHBondContact N-OD2 3.08Å; T143-D163 WeakPolarHBondContact OG1-CB 3.11Å
144	G	96.9	Very high	95.2	Very high	14 Å²	14	45.3 Å²	45.3	14%	0.144	24%	0.242	C	C	.	.	S	Bend	trans	-126.2	176.2	175.4	0	0	0	0	0	112.1	N119 S161	N119-G144 VanDerWaalsContact CB-O 3.3Å; N119-G144 WeakPolarHBondContact CB-O 3.4Å; N119-G144 PolarHBondContact OD1-O 3.43Å; N119-G144 VanDerWaalsContact OD1-O 3.05Å; G144-S161 VanDerWaalsContact C-OG 3.26Å; G144-S161 PolarHBondContact O-OG 2.85Å; G144-S161 VanDerWaalsContact O-OG 3.04Å
145	Y	97.6	Very high	95.8	Very high	49 Å²	49	42.5 Å²	42.5	19%	0.192	24%	0.238	C	C	.	.			trans	-61.9	149.9	-177.7	60.6	-94.1	0	0	0	111.6	M101 G116 L117 N119 S161 G162 D186	M101-Y145 HydrophobicContact CE-CD2 3.58Å; M101-Y145 HydrophobicContact CE-CE2 3.64Å; M101-Y145 HydrophobicContact SD-CD2 3.53Å; M101-Y145 VanDerWaalsContact SD-CD2 3.53Å; M101-Y145 HydrophobicContact SD-CE2 4.23Å; M101-Y145 HydrophobicContact SD-CG 4.04Å; G116-Y145 CarbonylContact O-C 3.56Å; G116-Y145 WeakPolarHBondContact O-CA 3.37Å; L117-Y145 HydrophobicContact CD2-CD1 4.45Å; L117-Y145 HydrophobicContact CD2-CG 4.14Å; N119-Y145 VanDerWaalsContact OD1-CA 3.28Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.37Å; N119-Y145 PolarHBondContact OD1-N 3.18Å; N119-Y145 VanDerWaalsContact OD1-N 3.17Å; Y145-S161 CarbonylContact O-C 3.55Å; Y145-S161 WeakPolarHBondContact O-CA 3.44Å; Y145-S161 WeakPolarHBondContact O-CB 3.44Å; Y145-S161 PolarHBondContact O-OG 3.16Å; Y145-G162 PolarHBondContact O-N 2.76Å; Y145-D186 WeakPolarHBondContact CE1-OD2 3.46Å; Y145-D186 VanDerWaalsContact OH-CB 3.3Å; Y145-D186 WeakPolarHBondContact OH-CB 3.17Å; Y145-D186 PolarHBondContact OH-OD2 3.01Å
146	L	98.3	Very high	96.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.7	174.8	-156.9	75.2	0	0	0	109.7	M101 T102 G116 C121 T159	M101-L146 WeakPolarHBondContact CB-O 3.2Å; T102-L146 HydrophobicContact CG2-CD2 3.72Å; T102-L146 HydrophobicContact CG2-CG 4.08Å; G116-L146 PolarHBondContact O-N 2.85Å; C121-L146 HydrophobicContact CB-CD2 3.63Å; L146-T159 HydrophobicContact CD1-CG2 3.89Å; L146-T159 HydrophobicContact CD2-CG2 4.41Å
147	S	98	Very high	96.8	Very high	12 Å²	12	41.4 Å²	41.4	8%	0.084	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-40.6	-175.8	60.1	0	0	0	0	113.1	T102 S160 V187 M188	T102-S147 WeakPolarHBondContact CB-O 3.48Å; S147-S160 PolarHBondContact N-O 3.06Å; S147-S160 VanDerWaalsContact OG-C 3.32Å; S147-S160 WeakPolarHBondContact OG-CB 3.29Å; S147-S160 PolarHBondContact OG-O 3.47Å; S147-S160 VanDerWaalsContact OG-O 3.09Å; S147-S160 PolarHBondContact OG-OG 2.81Å; S147-V187 WeakPolarHBondContact CB-O 3.33Å; S147-V187 PolarHBondContact OG-O 3.18Å; S147-M188 WeakPolarHBondContact CB-O 3.29Å
148	C	98.5	Very high	97	Very high	11 Å²	11	36.3 Å²	36.3	7%	0.074	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.9	178.2	-167	0	0	0	0	110.9	T102 T159 S160 L190	T102-C148 WeakPolarHBondContact OG1-CA 3.44Å; C148-T159 WeakPolarHBondContact O-CA 3.5Å; C148-S160 VanDerWaalsContact CB-OG 3.27Å; C148-S160 WeakPolarHBondContact CB-OG 3.36Å; C148-S160 PolarHBondContact N-OG 2.9Å; C148-S160 PolarHBondContact O-N 3.44Å; C148-S160 PolarHBondContact O-OG 3.38Å; C148-L190 HydrophobicContact CB-CD2 4.49Å; C148-L190 HydrophobicContact CB-CG 4.19Å
149	C	98.4	Very high	97.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	147.5	170.2	63.2	0	0	0	0	111.3	T102 A104 I157 I158 T159	T102-C149 HydrophobicContact CG2-CB 4.37Å; T102-C149 PolarHBondContact OG1-N 3.36Å; T102-C149 VanDerWaalsContact OG1-N 3.13Å; T102-C149 PolarHBondContact OG1-SG 2.89Å; A104-C149 WeakPolarHBondContact CB-O 3.44Å; C149-I157 HydrophobicContact CB-CD1 4.04Å; C149-I157 HydrophobicContact CB-CG1 4.41Å; C149-I158 CarbonylContact C-O 3.56Å; C149-I158 WeakPolarHBondContact CA-O 3.47Å; C149-T159 HydrophobicContact CB-CG2 3.98Å
150	R	98.6	Very high	97.2	Very high	59 Å²	59	33.3 Å²	33.3	22%	0.223	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	133.1	174.7	-68.6	-65.7	178.9	-98.8	4.5	110.8	C103 I157 I158 L190 L192	C103-R150 PolarHBondContact O-NH1 2.83Å; R150-I157 WeakPolarHBondContact O-CG1 3.5Å; R150-I158 PolarHBondContact N-O 3.05Å; R150-I158 PolarHBondContact O-N 3.49Å; R150-L190 HydrophobicContact CB-CD1 3.81Å; R150-L190 HydrophobicContact CG-CD1 3.59Å; R150-L192 HydrophobicContact CB-CD1 3.56Å; R150-L192 HydrophobicContact CB-CG 3.89Å
151	F	98.5	Very high	97.4	Very high	7 Å²	7	29.4 Å²	29.4	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137.3	173.3	-71.2	-85.1	0	0	0	110.3	A104 A106 A113 I123 D153 I157 I171 L192	A104-F151 HydrophobicContact CB-CD2 3.83Å; A104-F151 HydrophobicContact CB-CE2 3.95Å; A106-F151 HydrophobicContact CB-CB 4.32Å; A106-F151 HydrophobicContact CB-CD1 4.13Å; A106-F151 HydrophobicContact CB-CD2 3.86Å; A106-F151 HydrophobicContact CB-CE1 4.35Å; A106-F151 HydrophobicContact CB-CE2 4.11Å; A106-F151 HydrophobicContact CB-CG 3.85Å; A106-F151 HydrophobicContact CB-CZ 4.34Å; A113-F151 HydrophobicContact CB-CE2 3.56Å; A113-F151 HydrophobicContact CB-CZ 3.55Å; I123-F151 HydrophobicContact CG2-CE1 4.45Å; I123-F151 HydrophobicContact CG2-CZ 4.31Å; F151-D153 WeakPolarHBondContact CD1-O 3.42Å; F151-I157 HydrophobicContact CD1-CB 4.1Å; F151-I157 HydrophobicContact CD1-CD1 4.13Å; F151-I157 HydrophobicContact CD1-CG1 4.24Å; F151-I157 HydrophobicContact CD2-CD1 4.3Å; F151-I157 HydrophobicContact CE1-CB 4.41Å; F151-I157 HydrophobicContact CE1-CD1 3.95Å; F151-I157 HydrophobicContact CE2-CD1 4.13Å; F151-I157 HydrophobicContact CG-CD1 4.31Å; F151-I157 HydrophobicContact CG-CG1 4.38Å; F151-I157 HydrophobicContact CZ-CD1 3.96Å; F151-I171 HydrophobicContact CD1-CD1 3.88Å; F151-I171 HydrophobicContact CE1-CD1 3.66Å; F151-L192 WeakPolarHBondContact O-CD1 3.36Å
152	I	97.8	Very high	97.9	Very high	23 Å²	23	27.8 Å²	27.8	12%	0.118	15%	0.15	C	C	.	.	S	Bend	trans	-83.8	-49	163.8	-61.7	179.6	0	0	0	108.1	Q156 I158 L168 L192 F196 I213	I152-Q156 HydrophobicContact CB-CB 4.03Å; I152-Q156 HydrophobicContact CD1-CB 4.24Å; I152-Q156 HydrophobicContact CG1-CB 4.49Å; I152-Q156 PolarHBondContact N-O 3.04Å; I152-I158 HydrophobicContact CD1-CD1 4.02Å; I152-I158 HydrophobicContact CD1-CG1 3.96Å; I152-I158 HydrophobicContact CG1-CD1 4.4Å; I152-I158 HydrophobicContact CG1-CG1 4.19Å; I152-L168 HydrophobicContact CD1-CD1 3.56Å; I152-L192 HydrophobicContact CG1-CD1 4.36Å; I152-L192 HydrophobicContact CG1-CD2 4.38Å; I152-F196 HydrophobicContact CG2-CB 4.2Å; I152-F196 HydrophobicContact CG2-CD1 4.32Å; I152-I213 HydrophobicContact CD1-CD1 4.06Å; I152-I213 HydrophobicContact CD1-CG2 4.12Å
153	D	96.8	Very high	97.9	Very high	67 Å²	67	28.6 Å²	28.6	36%	0.358	16%	0.155	S	C	.	.	S	Bend	trans	-150.4	-163.5	175.4	60.7	31.9	0	0	0	109.5	F151 N155 Q156	F151-D153 WeakPolarHBondContact CD1-O 3.42Å; D153-N155 PolarHBondContact O-N 2.76Å; D153-N155 WeakPolarHBondContact OD1-CA 3.32Å; D153-N155 WeakPolarHBondContact OD1-CB 3.38Å; D153-N155 PolarHBondContact OD1-N 3.4Å; D153-Q156 PolarHBondContact N-O 2.76Å; D153-Q156 PolarHBondContact OD1-N 3.41Å
154	D	96.4	Very high	98	Very high	36 Å²	36	25 Å²	25	19%	0.193	13%	0.133	C	C	.	.	S	Bend	trans	-73.5	-13.4	179.7	-79.2	-1.4	0	0	0	114	S108 N110 Y111 I171	S108-D154 WeakPolarHBondContact CB-OD1 3.29Å; S108-D154 VanDerWaalsContact CB-OD2 3.3Å; S108-D154 WeakPolarHBondContact CB-OD2 3.39Å; S108-D154 PolarHBondContact OG-OD1 3.03Å; S108-D154 PolarHBondContact OG-OD2 3.34Å; N110-D154 PolarHBondContact ND2-OD2 2.84Å; Y111-D154 HydrophobicContact CD2-CB 4.09Å; Y111-D154 HydrophobicContact CE2-CB 3.82Å; D154-I171 WeakPolarHBondContact O-CD1 3.29Å
155	N	96.8	Very high	98	Very high	88 Å²	88	25.4 Å²	25.4	47%	0.471	13%	0.133	S	C	.	.	S	Bend	trans	-110.7	-19.3	-176.2	-65.4	-11.2	0	0	0	112.7	D153 I171	D153-N155 PolarHBondContact O-N 2.76Å; D153-N155 WeakPolarHBondContact OD1-CA 3.32Å; D153-N155 WeakPolarHBondContact OD1-CB 3.38Å; D153-N155 PolarHBondContact OD1-N 3.4Å; N155-I171 WeakPolarHBondContact O-CB 3.3Å; N155-I171 VanDerWaalsContact O-CG1 3.32Å; N155-I171 WeakPolarHBondContact O-CG1 3.4Å; N155-I171 PolarHBondContact O-N 2.95Å
156	Q	97.8	Very high	98.1	Very high	70 Å²	70	23.1 Å²	23.1	33%	0.327	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.2	-176.3	-67.3	-172	-13.7	0	0	112.7	I152 D153 L168 W169	I152-Q156 HydrophobicContact CB-CB 4.03Å; I152-Q156 HydrophobicContact CD1-CB 4.24Å; I152-Q156 HydrophobicContact CG1-CB 4.49Å; I152-Q156 PolarHBondContact N-O 3.04Å; D153-Q156 PolarHBondContact N-O 2.76Å; D153-Q156 PolarHBondContact OD1-N 3.41Å; Q156-L168 HydrophobicContact CB-CD1 4.29Å; Q156-W169 WeakPolarHBondContact CA-O 3.45Å
157	I	98.5	Very high	98.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.3	175.3	-169.5	171	0	0	0	110.1	A113 I123 L139 C149 R150 F151 W169 I171	A113-I157 HydrophobicContact CB-CD1 3.6Å; I123-I157 HydrophobicContact CD1-CG2 4.33Å; L139-I157 HydrophobicContact CD1-CG2 3.59Å; C149-I157 HydrophobicContact CB-CD1 4.04Å; C149-I157 HydrophobicContact CB-CG1 4.41Å; R150-I157 WeakPolarHBondContact O-CG1 3.5Å; F151-I157 HydrophobicContact CD1-CB 4.1Å; F151-I157 HydrophobicContact CD1-CD1 4.13Å; F151-I157 HydrophobicContact CD1-CG1 4.24Å; F151-I157 HydrophobicContact CD2-CD1 4.3Å; F151-I157 HydrophobicContact CE1-CB 4.41Å; F151-I157 HydrophobicContact CE1-CD1 3.95Å; F151-I157 HydrophobicContact CE2-CD1 4.13Å; F151-I157 HydrophobicContact CG-CD1 4.31Å; F151-I157 HydrophobicContact CG-CG1 4.38Å; F151-I157 HydrophobicContact CZ-CD1 3.96Å; I157-W169 HydrophobicContact CG2-CB 3.79Å; I157-W169 HydrophobicContact CG2-CG 4.26Å; I157-W169 PolarHBondContact N-O 3.21Å; I157-W169 PolarHBondContact O-N 2.82Å; I157-I171 HydrophobicContact CB-CD1 4.17Å; I157-I171 HydrophobicContact CB-CG1 4.46Å; I157-I171 HydrophobicContact CG2-CD1 4.18Å; I157-I171 HydrophobicContact CG2-CG1 3.95Å
158	I	98.5	Very high	98.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.7	170.1	-56.3	-170.8	0	0	0	109.1	C149 R150 I152 A167 L168 L190 L192 F199 I213	C149-I158 CarbonylContact C-O 3.56Å; C149-I158 WeakPolarHBondContact CA-O 3.47Å; R150-I158 PolarHBondContact N-O 3.05Å; R150-I158 PolarHBondContact O-N 3.49Å; I152-I158 HydrophobicContact CD1-CD1 4.02Å; I152-I158 HydrophobicContact CD1-CG1 3.96Å; I152-I158 HydrophobicContact CG1-CD1 4.4Å; I152-I158 HydrophobicContact CG1-CG1 4.19Å; I158-A167 CarbonylContact C-O 3.59Å; I158-A167 VanDerWaalsContact CA-O 3.26Å; I158-A167 WeakPolarHBondContact CA-O 3.31Å; I158-L168 HydrophobicContact CD1-CD1 4.42Å; I158-L168 HydrophobicContact CG1-CD1 3.74Å; I158-L190 HydrophobicContact CB-CD2 4.5Å; I158-L190 HydrophobicContact CG2-CD1 4.5Å; I158-L190 HydrophobicContact CG2-CD2 3.8Å; I158-L192 HydrophobicContact CD1-CD2 3.65Å; I158-L192 HydrophobicContact CG1-CD2 4.36Å; I158-F199 HydrophobicContact CD1-CB 4.49Å; I158-F199 HydrophobicContact CD1-CD1 3.57Å; I158-F199 HydrophobicContact CD1-CE1 3.91Å; I158-F199 HydrophobicContact CD1-CG 4.09Å; I158-F199 HydrophobicContact CG2-CE1 4.41Å; I158-F199 HydrophobicContact CG2-CE2 4.31Å; I158-F199 HydrophobicContact CG2-CZ 4.25Å; I158-I213 HydrophobicContact CD1-CD1 3.72Å; I158-I213 HydrophobicContact CD1-CG1 3.91Å
159	T	98.7	Very high	98.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	151.8	173.7	57.6	0	0	0	0	111.5	C121 H142 L146 C148 C149 C166 A167 W169	C121-T159 HydrophobicContact CB-CG2 4.04Å; H142-T159 PolarHBondContact NE2-OG1 2.88Å; L146-T159 HydrophobicContact CD1-CG2 3.89Å; L146-T159 HydrophobicContact CD2-CG2 4.41Å; C148-T159 WeakPolarHBondContact O-CA 3.5Å; C149-T159 HydrophobicContact CB-CG2 3.98Å; T159-C166 CarbonylContact O-C 3.56Å; T159-C166 WeakPolarHBondContact O-CA 3.36Å; T159-C166 VanDerWaalsContact O-CB 3.28Å; T159-C166 WeakPolarHBondContact O-CB 3.36Å; T159-A167 PolarHBondContact N-O 2.79Å; T159-A167 PolarHBondContact O-N 2.91Å; T159-W169 PolarHBondContact OG1-NE1 3.02Å
160	S	98.5	Very high	98.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	148.8	165.4	56.1	0	0	0	0	110.1	S147 C148	S147-S160 PolarHBondContact N-O 3.06Å; S147-S160 VanDerWaalsContact OG-C 3.32Å; S147-S160 WeakPolarHBondContact OG-CB 3.29Å; S147-S160 PolarHBondContact OG-O 3.47Å; S147-S160 VanDerWaalsContact OG-O 3.09Å; S147-S160 PolarHBondContact OG-OG 2.81Å; C148-S160 VanDerWaalsContact CB-OG 3.27Å; C148-S160 WeakPolarHBondContact CB-OG 3.36Å; C148-S160 PolarHBondContact N-OG 2.9Å; C148-S160 PolarHBondContact O-N 3.44Å; C148-S160 PolarHBondContact O-OG 3.38Å
161	S	98.6	Very high	98	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	157	-176.2	179.3	0	0	0	0	113.4	H142 G144 Y145 D163 T164 T165 V187	H142-S161 VanDerWaalsContact CG-CB 3.48Å; H142-S161 WeakPolarHBondContact ND1-CB 3.29Å; G144-S161 VanDerWaalsContact C-OG 3.26Å; G144-S161 PolarHBondContact O-OG 2.85Å; G144-S161 VanDerWaalsContact O-OG 3.04Å; Y145-S161 CarbonylContact O-C 3.55Å; Y145-S161 WeakPolarHBondContact O-CA 3.44Å; Y145-S161 WeakPolarHBondContact O-CB 3.44Å; Y145-S161 PolarHBondContact O-OG 3.16Å; S161-D163 WeakPolarHBondContact CB-OD1 3.27Å; S161-D163 PolarHBondContact O-N 2.81Å; S161-D163 PolarHBondContact OG-N 2.86Å; S161-D163 VanDerWaalsContact OG-N 3.17Å; S161-T164 PolarHBondContact O-N 3.01Å; S161-T165 PolarHBondContact N-O 3.47Å; S161-V187 PolarHBondContact O-N 3.34Å; S161-V187 VanDerWaalsContact O-N 3.16Å
162	G	98.3	Very high	97.8	Very high	12 Å²	12	28.4 Å²	28.4	12%	0.124	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-5.2	166.4	0	0	0	0	0	114.2	Y145 T164	Y145-G162 PolarHBondContact O-N 2.76Å; G162-T164 PolarHBondContact O-N 2.78Å
163	D	98	Very high	97.7	Very high	30 Å²	30	30.8 Å²	30.8	16%	0.16	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	13.2	169.6	67.8	18.8	0	0	0	114.3	H142 T143 S161 T165	H142-D163 VanDerWaalsContact CA-OD2 3.31Å; H142-D163 WeakPolarHBondContact CA-OD2 3.48Å; H142-D163 WeakPolarHBondContact CB-OD2 3.34Å; H142-D163 IonicContact CG-OD2 2.76Å; H142-D163 IonicContact ND1-OD1 3.95Å; H142-D163 PolarHBondContact ND1-OD1 2.96Å; H142-D163 IonicContact ND1-OD2 3.67Å; H142-D163 PolarHBondContact ND1-OD2 3.05Å; T143-D163 PolarHBondContact N-OD2 3.08Å; T143-D163 WeakPolarHBondContact OG1-CB 3.11Å; S161-D163 WeakPolarHBondContact CB-OD1 3.27Å; S161-D163 PolarHBondContact O-N 2.81Å; S161-D163 PolarHBondContact OG-N 2.86Å; S161-D163 VanDerWaalsContact OG-N 3.17Å; D163-T165 VanDerWaalsContact C-N 3.25Å; D163-T165 PolarHBondContact O-N 3.39Å; D163-T165 WeakPolarHBondContact OD1-CB 3.07Å; D163-T165 PolarHBondContact OD1-N 2.59Å; D163-T165 PolarHBondContact OD1-OG1 3.12Å
164	T	98.3	Very high	97.6	Very high	47 Å²	47	28.9 Å²	28.9	29%	0.288	16%	0.158	S	C	.	.	S	Bend	trans	71.5	8	-178.9	77.1	0	0	0	0	115.3	S161 G162	S161-T164 PolarHBondContact O-N 3.01Å; G162-T164 PolarHBondContact O-N 2.78Å
165	T	98.3	Very high	97.6	Very high	23 Å²	23	33.1 Å²	33.1	14%	0.141	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	156.2	-179	74.7	0	0	0	0	113.2	H142 S161 D163 V179	H142-T165 PolarHBondContact CE1-OG1 3.04Å; S161-T165 PolarHBondContact N-O 3.47Å; D163-T165 VanDerWaalsContact C-N 3.25Å; D163-T165 PolarHBondContact O-N 3.39Å; D163-T165 WeakPolarHBondContact OD1-CB 3.07Å; D163-T165 PolarHBondContact OD1-N 2.59Å; D163-T165 PolarHBondContact OD1-OG1 3.12Å; T165-V179 HydrophobicContact CG2-CG1 4.25Å
166	C	98.6	Very high	97.5	Very high	1 Å²	1	32 Å²	32	1%	0.007	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	158.4	157.8	-59.5	0	0	0	0	109.6	T159 F180 F199	T159-C166 CarbonylContact O-C 3.56Å; T159-C166 WeakPolarHBondContact O-CA 3.36Å; T159-C166 VanDerWaalsContact O-CB 3.28Å; T159-C166 WeakPolarHBondContact O-CB 3.36Å; C166-F180 HydrophobicContact CB-CB 4.03Å; C166-F180 HydrophobicContact CB-CD2 4.13Å; C166-F180 PolarHBondContact N-O 3.05Å; C166-F180 PolarHBondContact O-N 3.37Å; C166-F199 HydrophobicContact CB-CE2 3.99Å; C166-F199 HydrophobicContact CB-CZ 3.97Å
167	A	98.3	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.6	-177.8	0	0	0	0	0	111.3	I158 T159 W169 Q176 T178	I158-A167 CarbonylContact C-O 3.59Å; I158-A167 VanDerWaalsContact CA-O 3.26Å; I158-A167 WeakPolarHBondContact CA-O 3.31Å; T159-A167 PolarHBondContact N-O 2.79Å; T159-A167 PolarHBondContact O-N 2.91Å; A167-W169 HydrophobicContact CB-CZ2 4.05Å; A167-W169 VanDerWaalsContact CB-NE1 3.34Å; A167-Q176 HydrophobicContact CB-CG 4.06Å; A167-T178 WeakPolarHBondContact CA-O 3.28Å
168	L	98.4	Very high	97.4	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.052	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135.7	164.2	-178.5	67.6	0	0	0	108.2	I152 Q156 I158 T177 T178 F180 I213	I152-L168 HydrophobicContact CD1-CD1 3.56Å; Q156-L168 HydrophobicContact CB-CD1 4.29Å; I158-L168 HydrophobicContact CD1-CD1 4.42Å; I158-L168 HydrophobicContact CG1-CD1 3.74Å; L168-T177 WeakPolarHBondContact CB-OG1 3.48Å; L168-T177 WeakPolarHBondContact CD2-OG1 3.23Å; L168-T177 WeakPolarHBondContact CG-OG1 3.2Å; L168-T177 PolarHBondContact O-N 2.84Å; L168-T177 PolarHBondContact O-OG1 3.32Å; L168-T178 PolarHBondContact N-O 2.87Å; L168-T178 PolarHBondContact O-N 3.42Å; L168-F180 HydrophobicContact CB-CE2 3.94Å; L168-F180 HydrophobicContact CB-CZ 4.43Å; L168-I213 HydrophobicContact CD2-CG2 3.99Å
169	W	98.4	Very high	97.3	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.011	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.3	-178.8	-58.4	83.5	0	0	0	110.9	L139 Q156 I157 T159 A167 Q176	L139-W169 HydrophobicContact CB-CD2 4.11Å; L139-W169 HydrophobicContact CB-CE3 3.87Å; L139-W169 HydrophobicContact CB-CH2 4.48Å; L139-W169 HydrophobicContact CB-CZ3 4.06Å; L139-W169 HydrophobicContact CD1-CB 3.8Å; L139-W169 HydrophobicContact CD1-CD2 4.05Å; L139-W169 HydrophobicContact CD1-CE3 4.35Å; L139-W169 HydrophobicContact CD1-CG 3.79Å; L139-W169 HydrophobicContact CD2-CE3 4.21Å; L139-W169 HydrophobicContact CG-CE3 4.37Å; Q156-W169 WeakPolarHBondContact CA-O 3.45Å; I157-W169 HydrophobicContact CG2-CB 3.79Å; I157-W169 HydrophobicContact CG2-CG 4.26Å; I157-W169 PolarHBondContact N-O 3.21Å; I157-W169 PolarHBondContact O-N 2.82Å; T159-W169 PolarHBondContact OG1-NE1 3.02Å; A167-W169 HydrophobicContact CB-CZ2 4.05Å; A167-W169 VanDerWaalsContact CB-NE1 3.34Å; W169-Q176 HydrophobicContact CD2-CB 4.39Å; W169-Q176 HydrophobicContact CE3-CB 3.99Å; W169-Q176 HydrophobicContact CH2-CB 4.11Å; W169-Q176 HydrophobicContact CZ2-CB 4.49Å; W169-Q176 HydrophobicContact CZ3-CB 3.85Å
170	D	97.7	Very high	97.3	Very high	39 Å²	39	36.7 Å²	36.7	21%	0.209	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.3	159.5	172.4	0.1	0	0	0	108.2	E172 T173 S174 Q175 T177	D170-E172 VanDerWaalsContact C-N 3.33Å; D170-E172 WeakPolarHBondContact OD1-CB 3.26Å; D170-E172 PolarHBondContact OD1-N 2.98Å; D170-T173 WeakPolarHBondContact CB-OG1 3.46Å; D170-T173 PolarHBondContact OD1-N 2.85Å; D170-T173 VanDerWaalsContact OD2-CG2 3.3Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.34Å; D170-T173 PolarHBondContact OD2-OG1 2.85Å; D170-S174 VanDerWaalsContact O-CA 3.29Å; D170-S174 WeakPolarHBondContact O-CA 3.21Å; D170-S174 PolarHBondContact O-N 3.35Å; D170-Q175 PolarHBondContact N-O 3.2Å; D170-Q175 PolarHBondContact O-N 3.3Å; D170-T177 HydrophobicContact CB-CG2 3.6Å
171	I	96.5	Very high	97.2	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.041	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-35.6	-176.6	-61.8	172.3	0	0	0	110.6	I123 R137 F151 D154 N155 I157	I123-I171 HydrophobicContact CD1-CB 4.12Å; I123-I171 HydrophobicContact CD1-CD1 3.8Å; I123-I171 HydrophobicContact CD1-CG1 3.55Å; I123-I171 HydrophobicContact CD1-CG2 3.6Å; R137-I171 HydrophobicContact CG-CG2 4.12Å; R137-I171 WeakPolarHBondContact CG-O 3.45Å; F151-I171 HydrophobicContact CD1-CD1 3.88Å; F151-I171 HydrophobicContact CE1-CD1 3.66Å; D154-I171 WeakPolarHBondContact O-CD1 3.29Å; N155-I171 WeakPolarHBondContact O-CB 3.3Å; N155-I171 VanDerWaalsContact O-CG1 3.32Å; N155-I171 WeakPolarHBondContact O-CG1 3.4Å; N155-I171 PolarHBondContact O-N 2.95Å; I157-I171 HydrophobicContact CB-CD1 4.17Å; I157-I171 HydrophobicContact CB-CG1 4.46Å; I157-I171 HydrophobicContact CG2-CD1 4.18Å; I157-I171 HydrophobicContact CG2-CG1 3.95Å
172	E	94.8	Very high	97.1	Very high	139 Å²	139	43 Å²	43	65%	0.65	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-48.3	-176.7	-174.3	174.6	-177.7	0	0	110.5	D170	D170-E172 VanDerWaalsContact C-N 3.33Å; D170-E172 WeakPolarHBondContact OD1-CB 3.26Å; D170-E172 PolarHBondContact OD1-N 2.98Å
173	T	95.5	Very high	97.1	Very high	73 Å²	73	43 Å²	43	45%	0.448	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-13.9	-178.9	60.9	0	0	0	0	113.6	D170 Q175	D170-T173 WeakPolarHBondContact CB-OG1 3.46Å; D170-T173 PolarHBondContact OD1-N 2.85Å; D170-T173 VanDerWaalsContact OD2-CG2 3.3Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.34Å; D170-T173 PolarHBondContact OD2-OG1 2.85Å; T173-Q175 PolarHBondContact O-N 3.1Å
174	S	95.2	Very high	97.1	Very high	28 Å²	28	46.6 Å²	46.6	20%	0.196	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	27.9	-173.4	-48.9	0	0	0	0	113.5	R137 D170	R137-S174 WeakPolarHBondContact CD-OG 3.32Å; D170-S174 VanDerWaalsContact O-CA 3.29Å; D170-S174 WeakPolarHBondContact O-CA 3.21Å; D170-S174 PolarHBondContact O-N 3.35Å
175	Q	95.6	Very high	97.1	Very high	125 Å²	125	44.9 Å²	44.9	58%	0.584	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	146.8	-179.9	-64.6	-59.7	-46.8	0	0	110.5	D170 T173 T177	D170-Q175 PolarHBondContact N-O 3.2Å; D170-Q175 PolarHBondContact O-N 3.3Å; T173-Q175 PolarHBondContact O-N 3.1Å; Q175-T177 PolarHBondContact O-N 3.03Å
176	Q	95.9	Very high	97.1	Very high	64 Å²	64	46.5 Å²	46.5	30%	0.299	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	117.4	169.2	-173.8	171.4	5.3	0	0	108.9	A167 W169 T178 V179	A167-Q176 HydrophobicContact CB-CG 4.06Å; W169-Q176 HydrophobicContact CD2-CB 4.39Å; W169-Q176 HydrophobicContact CE3-CB 3.99Å; W169-Q176 HydrophobicContact CH2-CB 4.11Å; W169-Q176 HydrophobicContact CZ2-CB 4.49Å; W169-Q176 HydrophobicContact CZ3-CB 3.85Å; Q176-T178 WeakPolarHBondContact CG-O 3.34Å; Q176-T178 PolarHBondContact NE2-O 3.45Å; Q176-V179 HydrophobicContact CG-CG2 4.36Å
177	T	95.8	Very high	97.1	Very high	69 Å²	69	46.5 Å²	46.5	42%	0.423	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-31.1	179.1	53.8	0	0	0	0	111.9	L168 D170 Q175	L168-T177 WeakPolarHBondContact CB-OG1 3.48Å; L168-T177 WeakPolarHBondContact CD2-OG1 3.23Å; L168-T177 WeakPolarHBondContact CG-OG1 3.2Å; L168-T177 PolarHBondContact O-N 2.84Å; L168-T177 PolarHBondContact O-OG1 3.32Å; D170-T177 HydrophobicContact CB-CG2 3.6Å; Q175-T177 PolarHBondContact O-N 3.03Å
178	T	96.9	Very high	97.1	Very high	24 Å²	24	48.7 Å²	48.7	15%	0.147	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	143.5	179.2	-63.7	0	0	0	0	110.8	A167 L168 Q176 F180 S216	A167-T178 WeakPolarHBondContact CA-O 3.28Å; L168-T178 PolarHBondContact N-O 2.87Å; L168-T178 PolarHBondContact O-N 3.42Å; Q176-T178 WeakPolarHBondContact CG-O 3.34Å; Q176-T178 PolarHBondContact NE2-O 3.45Å; T178-F180 HydrophobicContact CG2-CD1 4.22Å; T178-F180 HydrophobicContact CG2-CD2 4.31Å; T178-F180 HydrophobicContact CG2-CE1 3.85Å; T178-F180 HydrophobicContact CG2-CE2 3.93Å; T178-F180 HydrophobicContact CG2-CG 4.44Å; T178-F180 HydrophobicContact CG2-CZ 3.67Å; T178-S216 VanDerWaalsContact CG2-CB 3.47Å; T178-S216 VanDerWaalsContact CG2-OG 3.32Å; T178-S216 WeakPolarHBondContact CG2-OG 3.42Å; T178-S216 PolarHBondContact OG1-OG 2.73Å
179	V	97.3	Very high	97.1	Very high	74 Å²	74	48.8 Å²	48.8	45%	0.448	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.7	169.2	-172.7	0	0	0	0	107.6	T165 Q176	T165-V179 HydrophobicContact CG2-CG1 4.25Å; Q176-V179 HydrophobicContact CG-CG2 4.36Å
180	F	98.2	Very high	97.1	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.009	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	97.4	171.9	-55.9	-84.6	0	0	0	108.2	C166 L168 T178 F199 W211	C166-F180 HydrophobicContact CB-CB 4.03Å; C166-F180 HydrophobicContact CB-CD2 4.13Å; C166-F180 PolarHBondContact N-O 3.05Å; C166-F180 PolarHBondContact O-N 3.37Å; L168-F180 HydrophobicContact CB-CE2 3.94Å; L168-F180 HydrophobicContact CB-CZ 4.43Å; T178-F180 HydrophobicContact CG2-CD1 4.22Å; T178-F180 HydrophobicContact CG2-CD2 4.31Å; T178-F180 HydrophobicContact CG2-CE1 3.85Å; T178-F180 HydrophobicContact CG2-CE2 3.93Å; T178-F180 HydrophobicContact CG2-CG 4.44Å; T178-F180 HydrophobicContact CG2-CZ 3.67Å; F180-F199 HydrophobicContact CB-CZ 4.27Å; F180-F199 HydrophobicContact CD1-CE1 4.07Å; F180-F199 HydrophobicContact CD1-CZ 4.12Å; F180-F199 AromaticContact CD2-CE1 3.89Å; F180-F199 HydrophobicContact CD2-CE1 3.89Å; F180-F199 AromaticContact CD2-CZ 3.65Å; F180-F199 HydrophobicContact CD2-CZ 3.65Å; F180-F199 AromaticContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CZ 4.36Å; F180-F199 AromaticContact CE2-CE1 3.68Å; F180-F199 HydrophobicContact CE2-CE1 3.68Å; F180-F199 AromaticContact CE2-CZ 3.93Å; F180-F199 HydrophobicContact CE2-CZ 3.93Å; F180-F199 HydrophobicContact CG-CE1 4.09Å; F180-F199 AromaticContact CG-CZ 3.76Å; F180-F199 HydrophobicContact CG-CZ 3.76Å; F180-F199 AromaticContact CZ-CE1 3.68Å; F180-F199 HydrophobicContact CZ-CE1 3.68Å; F180-F199 HydrophobicContact CZ-CZ 4.29Å; F180-W211 HydrophobicContact CB-CD2 4Å; F180-W211 HydrophobicContact CB-CE3 3.75Å; F180-W211 HydrophobicContact CB-CH2 4.24Å; F180-W211 HydrophobicContact CB-CZ2 4.46Å; F180-W211 HydrophobicContact CB-CZ3 3.86Å; F180-W211 HydrophobicContact CD1-CB 4.12Å; F180-W211 HydrophobicContact CD1-CD2 4.16Å; F180-W211 AromaticContact CD1-CE3 3.77Å; F180-W211 HydrophobicContact CD1-CE3 3.77Å; F180-W211 HydrophobicContact CD1-CG 4.34Å; F180-W211 HydrophobicContact CE1-CB 4.35Å; F180-W211 HydrophobicContact CG-CD2 4.39Å; F180-W211 HydrophobicContact CG-CE3 4.19Å
181	S	96.8	Very high	97.1	Very high	87 Å²	87	47.9 Å²	47.9	61%	0.608	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.7	178.4	56.7	0	0	0	0	110.6	W211	S181-W211 WeakPolarHBondContact O-CH2 3.27Å
182	G	96.3	Very high	97.2	Very high	44 Å²	44	48.6 Å²	48.6	45%	0.454	29%	0.289	S	S	.	.			trans	158.4	-14.6	178	0	0	0	0	0	115.3	K209	G182-K209 WeakPolarHBondContact O-CE 3.12Å; G182-K209 PolarHBondContact O-NZ 3.28Å
183	H	98.2	Very high	97.3	Very high	13 Å²	13	42.2 Å²	42.2	6%	0.06	26%	0.26	C	S	.	.			trans	-72.8	153.9	165	-79.6	-68.6	0	0	0	110.8	V187 S201 A203 D205 S207	H183-V187 HydrophobicContact CB-CG2 4.05Å; H183-S201 PolarHBondContact NE2-OG 2.88Å; H183-A203 HydrophobicContact CB-CB 4.33Å; H183-A203 VanDerWaalsContact ND1-CB 3.34Å; H183-A203 WeakPolarHBondContact ND1-CB 3.39Å; H183-D205 WeakPolarHBondContact CA-OD2 3.15Å; H183-D205 WeakPolarHBondContact CB-OD2 3.47Å; H183-D205 IonicContact CG-OD2 3.42Å; H183-D205 IonicContact ND1-OD1 2.89Å; H183-D205 PolarHBondContact ND1-OD1 3.03Å; H183-D205 IonicContact ND1-OD2 2.81Å; H183-D205 PolarHBondContact ND1-OD2 3.38Å; H183-S207 PolarHBondContact CE1-O 2.81Å; H183-S207 PolarHBondContact ND1-OG 2.79Å
184	S	97.6	Very high	97.3	Very high	105 Å²	105	42 Å²	42	73%	0.734	26%	0.26	S	S	*	.	S	Bend	trans	-112.3	4.8	176.7	56	0	0	0	0	113.5	D205	S184-D205 PolarHBondContact N-OD2 2.72Å; S184-D205 VanDerWaalsContact OG-CB 3.29Å; S184-D205 WeakPolarHBondContact OG-CB 3.47Å
185	G	97.9	Very high	97.3	Very high	12 Å²	12	45 Å²	45	12%	0.124	27%	0.274	C	S	.	.	S	Bend	trans	-144.5	173.5	175.7	0	0	0	0	0	110.7	V187	G185-V187 PolarHBondContact O-N 3.12Å
186	D	98.6	Very high	97.4	Very high	57 Å²	57	43.3 Å²	43.3	31%	0.305	27%	0.265	S	S	.	.			trans	-54.1	127.5	-178.2	-61.9	17.2	0	0	0	110.6	Y145 M188 A203 C204	Y145-D186 WeakPolarHBondContact CE1-OD2 3.46Å; Y145-D186 VanDerWaalsContact OH-CB 3.3Å; Y145-D186 WeakPolarHBondContact OH-CB 3.17Å; Y145-D186 PolarHBondContact OH-OD2 3.01Å; D186-M188 HydrophobicContact CB-SD 4.48Å; D186-M188 PolarHBondContact O-N 3.35Å; D186-A203 CarbonylContact O-C 3.55Å; D186-A203 WeakPolarHBondContact O-CA 3.38Å; D186-A203 VanDerWaalsContact O-CB 3.28Å; D186-A203 WeakPolarHBondContact O-CB 3.29Å; D186-C204 HydrophobicContact CB-CB 4.41Å; D186-C204 PolarHBondContact O-N 3.05Å
187	V	98.8	Very high	97.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	120.2	176.1	-172.4	0	0	0	0	107.4	S147 S161 H183 G185 A203	S147-V187 WeakPolarHBondContact CB-O 3.33Å; S147-V187 PolarHBondContact OG-O 3.18Å; S161-V187 PolarHBondContact O-N 3.34Å; S161-V187 VanDerWaalsContact O-N 3.16Å; H183-V187 HydrophobicContact CB-CG2 4.05Å; G185-V187 PolarHBondContact O-N 3.12Å; V187-A203 HydrophobicContact CG2-CB 4.38Å
188	M	98.6	Very high	97.5	Very high	47 Å²	47	46.8 Å²	46.8	23%	0.232	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-34.3	-171.2	-67.3	-60.3	-72.7	0	0	112.9	S147 D186 G202 I229	S147-M188 WeakPolarHBondContact CB-O 3.29Å; D186-M188 HydrophobicContact CB-SD 4.48Å; D186-M188 PolarHBondContact O-N 3.35Å; M188-G202 PolarHBondContact N-O 2.95Å; M188-I229 WeakPolarHBondContact CB-O 3.13Å
189	S	98.1	Very high	97.6	Very high	12 Å²	12	45.6 Å²	45.6	8%	0.084	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158.9	-180	62.9	0	0	0	0	112.5	S201 G202 N230 A231 V232	S189-S201 VanDerWaalsContact O-CA 3.32Å; S189-S201 WeakPolarHBondContact O-CA 3.47Å; S189-G202 PolarHBondContact N-O 2.6Å; S189-G202 PolarHBondContact O-N 2.89Å; S189-N230 VanDerWaalsContact CB-O 3.29Å; S189-N230 WeakPolarHBondContact CB-O 3.29Å; S189-N230 PolarHBondContact OG-O 2.88Å; S189-N230 VanDerWaalsContact OG-O 3.13Å; S189-A231 WeakPolarHBondContact OG-CA 3.19Å; S189-V232 PolarHBondContact OG-N 2.88Å; S189-V232 VanDerWaalsContact OG-N 3.1Å
190	L	98.6	Very high	97.6	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.3	172.2	70.2	87.4	0	0	0	110.8	C148 R150 I158 F199 V200	C148-L190 HydrophobicContact CB-CD2 4.49Å; C148-L190 HydrophobicContact CB-CG 4.19Å; R150-L190 HydrophobicContact CB-CD1 3.81Å; R150-L190 HydrophobicContact CG-CD1 3.59Å; I158-L190 HydrophobicContact CB-CD2 4.5Å; I158-L190 HydrophobicContact CG2-CD1 4.5Å; I158-L190 HydrophobicContact CG2-CD2 3.8Å; L190-F199 HydrophobicContact CB-CD2 4.31Å; L190-V200 CarbonylContact C-O 3.53Å; L190-V200 WeakPolarHBondContact CA-O 3.24Å
191	S	98.6	Very high	97.7	Very high	19 Å²	19	42 Å²	42	13%	0.133	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.9	173.5	-169	0	0	0	0	109.5	F199 V200 F234	S191-F199 VanDerWaalsContact O-CA 3.3Å; S191-F199 WeakPolarHBondContact O-CA 3.12Å; S191-F199 WeakPolarHBondContact O-CB 3.39Å; S191-V200 PolarHBondContact N-O 2.97Å; S191-V200 PolarHBondContact O-N 3.13Å; S191-F234 WeakPolarHBondContact O-CD2 3.31Å; S191-F234 WeakPolarHBondContact O-CE2 3.22Å; S191-F234 PolarHBondContact OG-N 3.19Å
192	L	98.4	Very high	97.7	Very high	23 Å²	23	37.9 Å²	37.9	12%	0.12	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	141.7	174.3	-69.2	172.8	0	0	0	109.9	R150 F151 I152 I158 F196 F199 I213 F234	R150-L192 HydrophobicContact CB-CD1 3.56Å; R150-L192 HydrophobicContact CB-CG 3.89Å; F151-L192 WeakPolarHBondContact O-CD1 3.36Å; I152-L192 HydrophobicContact CG1-CD1 4.36Å; I152-L192 HydrophobicContact CG1-CD2 4.38Å; I158-L192 HydrophobicContact CD1-CD2 3.65Å; I158-L192 HydrophobicContact CG1-CD2 4.36Å; L192-F196 HydrophobicContact CB-CD1 4.42Å; L192-F196 HydrophobicContact CD1-CD1 3.87Å; L192-F196 HydrophobicContact CD1-CE1 3.89Å; L192-F199 HydrophobicContact CD2-CB 3.89Å; L192-I213 HydrophobicContact CD2-CD1 4.22Å; L192-F234 WeakPolarHBondContact O-CD2 3.4Å
193	S	97.5	Very high	97.9	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.028	19%	0.191	C	C	.	.			trans	-65.9	152.7	169.5	53.3	0	0	0	0	110.8	D195 F196 R197 T198 F234	S193-D195 PolarHBondContact O-N 3.25Å; S193-D195 VanDerWaalsContact O-N 3.1Å; S193-D195 PolarHBondContact OG-OD1 3.09Å; S193-F196 PolarHBondContact O-N 2.94Å; S193-R197 PolarHBondContact OG-N 3.49Å; S193-T198 WeakPolarHBondContact CB-O 3.26Å; S193-T198 WeakPolarHBondContact CB-OG1 3.28Å; S193-T198 PolarHBondContact N-O 3.41Å; S193-T198 PolarHBondContact OG-N 3.09Å; S193-T198 PolarHBondContact OG-O 3.3Å; S193-T198 PolarHBondContact OG-OG1 2.99Å; S193-T198 VanDerWaalsContact OG-OG1 3.11Å; S193-F234 VanDerWaalsContact N-CE2 3.26Å
194	P	95.5	Very high	97.9	Very high	70 Å²	70	36.8 Å²	36.8	46%	0.455	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.1	179.5	-25.5	34.8	0	0	0	114.9
195	D	95.3	Very high	97.9	Very high	91 Å²	91	33.6 Å²	33.6	49%	0.487	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	0.3	177.5	73.4	-2.3	0	0	0	113.7	S193 R197	S193-D195 PolarHBondContact O-N 3.25Å; S193-D195 VanDerWaalsContact O-N 3.1Å; S193-D195 PolarHBondContact OG-OD1 3.09Å; D195-R197 HydrophobicContact CB-CG 4.37Å; D195-R197 PolarHBondContact O-N 2.94Å; D195-R197 WeakPolarHBondContact OD1-CB 3.45Å; D195-R197 PolarHBondContact OD1-N 2.87Å; D195-R197 WeakPolarHBondContact OD2-CD 3.36Å; D195-R197 IonicContact OD2-NE 3.91Å
196	F	96	Very high	97.9	Very high	88 Å²	88	34 Å²	34	39%	0.386	18%	0.177	S	C	.	.	S	Bend	trans	57.5	21.1	-178.7	-62.3	-87.2	0	0	0	115	I152 L192 S193 I213	I152-F196 HydrophobicContact CG2-CB 4.2Å; I152-F196 HydrophobicContact CG2-CD1 4.32Å; L192-F196 HydrophobicContact CB-CD1 4.42Å; L192-F196 HydrophobicContact CD1-CD1 3.87Å; L192-F196 HydrophobicContact CD1-CE1 3.89Å; S193-F196 PolarHBondContact O-N 2.94Å; F196-I213 WeakPolarHBondContact O-CD1 3.35Å
197	R	96	Very high	97.9	Very high	179 Å²	179	31.9 Å²	31.9	68%	0.675	17%	0.166	S	C	*	.	S	Bend	trans	-95.3	-30.4	179.4	-61.7	-176.1	-179.1	-159.4	-1.1	113.2	S193 D195 I213	S193-R197 PolarHBondContact OG-N 3.49Å; D195-R197 HydrophobicContact CB-CG 4.37Å; D195-R197 PolarHBondContact O-N 2.94Å; D195-R197 WeakPolarHBondContact OD1-CB 3.45Å; D195-R197 PolarHBondContact OD1-N 2.87Å; D195-R197 WeakPolarHBondContact OD2-CD 3.36Å; D195-R197 IonicContact OD2-NE 3.91Å; R197-I213 WeakPolarHBondContact O-CB 3.22Å; R197-I213 WeakPolarHBondContact O-CG1 3.24Å; R197-I213 PolarHBondContact O-N 3.39Å
198	T	98.1	Very high	97.9	Very high	27 Å²	27	31.9 Å²	31.9	17%	0.166	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	162.3	-179.4	62.9	0	0	0	0	111.1	S193 W211	S193-T198 WeakPolarHBondContact CB-O 3.26Å; S193-T198 WeakPolarHBondContact CB-OG1 3.28Å; S193-T198 PolarHBondContact N-O 3.41Å; S193-T198 PolarHBondContact OG-N 3.09Å; S193-T198 PolarHBondContact OG-O 3.3Å; S193-T198 PolarHBondContact OG-OG1 2.99Å; S193-T198 VanDerWaalsContact OG-OG1 3.11Å; T198-W211 CarbonylContact C-O 3.5Å; T198-W211 WeakPolarHBondContact CA-O 3.44Å; T198-W211 VanDerWaalsContact CB-O 3.23Å; T198-W211 WeakPolarHBondContact CB-O 3.19Å
199	F	98.7	Very high	97.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.9	168.5	74.2	-85.9	0	0	0	110.5	I158 C166 F180 L190 S191 L192 W211 I213	I158-F199 HydrophobicContact CD1-CB 4.49Å; I158-F199 HydrophobicContact CD1-CD1 3.57Å; I158-F199 HydrophobicContact CD1-CE1 3.91Å; I158-F199 HydrophobicContact CD1-CG 4.09Å; I158-F199 HydrophobicContact CG2-CE1 4.41Å; I158-F199 HydrophobicContact CG2-CE2 4.31Å; I158-F199 HydrophobicContact CG2-CZ 4.25Å; C166-F199 HydrophobicContact CB-CE2 3.99Å; C166-F199 HydrophobicContact CB-CZ 3.97Å; F180-F199 HydrophobicContact CB-CZ 4.27Å; F180-F199 HydrophobicContact CD1-CE1 4.07Å; F180-F199 HydrophobicContact CD1-CZ 4.12Å; F180-F199 AromaticContact CD2-CE1 3.89Å; F180-F199 HydrophobicContact CD2-CE1 3.89Å; F180-F199 AromaticContact CD2-CZ 3.65Å; F180-F199 HydrophobicContact CD2-CZ 3.65Å; F180-F199 AromaticContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CZ 4.36Å; F180-F199 AromaticContact CE2-CE1 3.68Å; F180-F199 HydrophobicContact CE2-CE1 3.68Å; F180-F199 AromaticContact CE2-CZ 3.93Å; F180-F199 HydrophobicContact CE2-CZ 3.93Å; F180-F199 HydrophobicContact CG-CE1 4.09Å; F180-F199 AromaticContact CG-CZ 3.76Å; F180-F199 HydrophobicContact CG-CZ 3.76Å; F180-F199 AromaticContact CZ-CE1 3.68Å; F180-F199 HydrophobicContact CZ-CE1 3.68Å; F180-F199 HydrophobicContact CZ-CZ 4.29Å; L190-F199 HydrophobicContact CB-CD2 4.31Å; S191-F199 VanDerWaalsContact O-CA 3.3Å; S191-F199 WeakPolarHBondContact O-CA 3.12Å; S191-F199 WeakPolarHBondContact O-CB 3.39Å; L192-F199 HydrophobicContact CD2-CB 3.89Å; F199-W211 HydrophobicContact CD1-CB 3.74Å; F199-W211 HydrophobicContact CD1-CG 4.43Å; F199-W211 HydrophobicContact CD2-CB 4.47Å; F199-W211 AromaticContact CD2-CD1 3.74Å; F199-W211 HydrophobicContact CD2-CG 4.4Å; F199-W211 HydrophobicContact CE1-CB 3.32Å; F199-W211 AromaticContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE2-CB 4.12Å; F199-W211 AromaticContact CE2-CD1 3.23Å; F199-W211 AromaticContact CE2-CG 3.78Å; F199-W211 HydrophobicContact CE2-CG 3.78Å; F199-W211 AromaticContact CE2-NE1 3.86Å; F199-W211 HydrophobicContact CG-CB 4.29Å; F199-W211 HydrophobicContact CZ-CB 3.53Å; F199-W211 AromaticContact CZ-CD1 3.42Å; F199-W211 VanDerWaalsContact CZ-CD1 3.42Å; F199-W211 HydrophobicContact CZ-CD2 4.27Å; F199-W211 AromaticContact CZ-CG 3.46Å; F199-W211 HydrophobicContact CZ-CG 3.46Å; F199-W211 VanDerWaalsContact CZ-CG 3.46Å; F199-W211 PolarHBondContact N-O 2.92Å; F199-W211 PolarHBondContact O-N 3.27Å; F199-I213 HydrophobicContact CD1-CD1 4.24Å; F199-I213 HydrophobicContact CD1-CG1 3.72Å; F199-I213 HydrophobicContact CE1-CG1 4.26Å
200	V	98.8	Very high	97.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.6	172.1	-68.8	0	0	0	0	109.7	L190 S191 I208 K209 L210 V232 F234 F241	L190-V200 CarbonylContact C-O 3.53Å; L190-V200 WeakPolarHBondContact CA-O 3.24Å; S191-V200 PolarHBondContact N-O 2.97Å; S191-V200 PolarHBondContact O-N 3.13Å; V200-I208 HydrophobicContact CB-CG2 4.15Å; V200-K209 CarbonylContact C-O 3.57Å; V200-K209 VanDerWaalsContact CA-O 3.24Å; V200-K209 WeakPolarHBondContact CA-O 3.09Å; V200-L210 HydrophobicContact CG1-CB 4.37Å; V200-L210 HydrophobicContact CG1-CD1 3.65Å; V200-V232 HydrophobicContact CB-CG1 4.15Å; V200-V232 HydrophobicContact CG2-CB 4.37Å; V200-V232 HydrophobicContact CG2-CG1 3.32Å; V200-F234 HydrophobicContact CB-CE2 4.2Å; V200-F234 HydrophobicContact CB-CZ 4.44Å; V200-F234 HydrophobicContact CG1-CE1 4.39Å; V200-F234 HydrophobicContact CG1-CE2 3.94Å; V200-F234 HydrophobicContact CG1-CZ 3.68Å; V200-F234 HydrophobicContact CG2-CD2 3.85Å; V200-F234 HydrophobicContact CG2-CE2 3.59Å; V200-F234 HydrophobicContact CG2-CZ 4.16Å; V200-F241 HydrophobicContact CG1-CD1 3.94Å; V200-F241 HydrophobicContact CG1-CE1 4.11Å; V200-F241 HydrophobicContact CG1-CG 4.3Å; V200-F241 HydrophobicContact CG2-CB 4.41Å; V200-F241 HydrophobicContact CG2-CG 4.39Å
201	S	98.8	Very high	97.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.3	173.9	59.4	0	0	0	0	111.2	H183 S189 I208 K209 W211	H183-S201 PolarHBondContact NE2-OG 2.88Å; S189-S201 VanDerWaalsContact O-CA 3.32Å; S189-S201 WeakPolarHBondContact O-CA 3.47Å; S201-I208 CarbonylContact O-C 3.59Å; S201-I208 VanDerWaalsContact O-CA 3.27Å; S201-I208 WeakPolarHBondContact O-CA 3.3Å; S201-I208 VanDerWaalsContact O-CG2 3.29Å; S201-I208 WeakPolarHBondContact O-CG2 3.16Å; S201-K209 PolarHBondContact N-O 3Å; S201-K209 PolarHBondContact O-N 2.85Å; S201-W211 PolarHBondContact OG-NE1 2.9Å
202	G	98.6	Very high	97.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.6	173.6	0	0	0	0	0	110.8	M188 S189	M188-G202 PolarHBondContact N-O 2.95Å; S189-G202 PolarHBondContact N-O 2.6Å; S189-G202 PolarHBondContact O-N 2.89Å
203	A	98.7	Very high	97.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	171.1	-172.9	0	0	0	0	0	113.2	H183 D186 V187 D205 A206 S207 I229	H183-A203 HydrophobicContact CB-CB 4.33Å; H183-A203 VanDerWaalsContact ND1-CB 3.34Å; H183-A203 WeakPolarHBondContact ND1-CB 3.39Å; D186-A203 CarbonylContact O-C 3.55Å; D186-A203 WeakPolarHBondContact O-CA 3.38Å; D186-A203 VanDerWaalsContact O-CB 3.28Å; D186-A203 WeakPolarHBondContact O-CB 3.29Å; V187-A203 HydrophobicContact CG2-CB 4.38Å; A203-D205 PolarHBondContact O-N 3.46Å; A203-A206 PolarHBondContact O-N 2.49Å; A203-S207 PolarHBondContact N-O 2.92Å; A203-I229 PolarHBondContact O-N 2.87Å; A203-I229 VanDerWaalsContact O-N 3.11Å
204	C	98.6	Very high	97.6	Very high	35 Å²	35	41.3 Å²	41.3	24%	0.236	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-0.7	173.1	-63.3	0	0	0	0	113.8	D186 A206 D228	D186-C204 HydrophobicContact CB-CB 4.41Å; D186-C204 PolarHBondContact O-N 3.05Å; C204-A206 PolarHBondContact O-N 3.27Å; C204-D228 HydrophobicContact CB-CB 4.33Å; C204-D228 VanDerWaalsContact SG-CG 3.55Å; C204-D228 PolarHBondContact SG-OD2 3.18Å
205	D	97.9	Very high	97.5	Very high	37 Å²	37	41.8 Å²	41.8	20%	0.198	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	11.6	170.5	63.8	19.7	0	0	0	113.2	H183 S184 A203 S207	H183-D205 WeakPolarHBondContact CA-OD2 3.15Å; H183-D205 WeakPolarHBondContact CB-OD2 3.47Å; H183-D205 IonicContact CG-OD2 3.42Å; H183-D205 IonicContact ND1-OD1 2.89Å; H183-D205 PolarHBondContact ND1-OD1 3.03Å; H183-D205 IonicContact ND1-OD2 2.81Å; H183-D205 PolarHBondContact ND1-OD2 3.38Å; S184-D205 PolarHBondContact N-OD2 2.72Å; S184-D205 VanDerWaalsContact OG-CB 3.29Å; S184-D205 WeakPolarHBondContact OG-CB 3.47Å; A203-D205 PolarHBondContact O-N 3.46Å; D205-S207 VanDerWaalsContact CG-OG 3.22Å; D205-S207 PolarHBondContact O-N 2.99Å; D205-S207 VanDerWaalsContact O-N 3.09Å; D205-S207 WeakPolarHBondContact OD1-CA 3.04Å; D205-S207 VanDerWaalsContact OD1-CB 3.26Å; D205-S207 WeakPolarHBondContact OD1-CB 3.41Å; D205-S207 PolarHBondContact OD1-N 3.34Å; D205-S207 PolarHBondContact OD1-OG 2.87Å; D205-S207 PolarHBondContact OD2-OG 3.37Å
206	A	98.1	Very high	97.4	Very high	22 Å²	22	39.5 Å²	39.5	18%	0.182	19%	0.186	C	C	.	.	S	Bend	trans	56.1	18.6	-175.2	0	0	0	0	0	114.3	A203 C204 H225 S227	A203-A206 PolarHBondContact O-N 2.49Å; C204-A206 PolarHBondContact O-N 3.27Å; A206-H225 HydrophobicContact CB-CB 4.44Å; A206-S227 WeakPolarHBondContact CB-O 3.4Å
207	S	98	Very high	97.3	Very high	11 Å²	11	41.3 Å²	41.3	8%	0.077	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.5	177.5	83.3	0	0	0	0	112.3	H183 A203 D205 F222	H183-S207 PolarHBondContact CE1-O 2.81Å; H183-S207 PolarHBondContact ND1-OG 2.79Å; A203-S207 PolarHBondContact N-O 2.92Å; D205-S207 VanDerWaalsContact CG-OG 3.22Å; D205-S207 PolarHBondContact O-N 2.99Å; D205-S207 VanDerWaalsContact O-N 3.09Å; D205-S207 WeakPolarHBondContact OD1-CA 3.04Å; D205-S207 VanDerWaalsContact OD1-CB 3.26Å; D205-S207 WeakPolarHBondContact OD1-CB 3.41Å; D205-S207 PolarHBondContact OD1-N 3.34Å; D205-S207 PolarHBondContact OD1-OG 2.87Å; D205-S207 PolarHBondContact OD2-OG 3.37Å; S207-F222 WeakPolarHBondContact CA-O 3.3Å
208	I	98.6	Very high	97.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.3	169.2	-49.2	93.5	0	0	0	108.2	V200 S201 T221 F222 I229 F241 T243 F253	V200-I208 HydrophobicContact CB-CG2 4.15Å; S201-I208 CarbonylContact O-C 3.59Å; S201-I208 VanDerWaalsContact O-CA 3.27Å; S201-I208 WeakPolarHBondContact O-CA 3.3Å; S201-I208 VanDerWaalsContact O-CG2 3.29Å; S201-I208 WeakPolarHBondContact O-CG2 3.16Å; I208-T221 CarbonylContact O-C 3.55Å; I208-T221 WeakPolarHBondContact O-CA 3.44Å; I208-F222 HydrophobicContact CB-CB 4.2Å; I208-F222 HydrophobicContact CB-CD2 4.49Å; I208-F222 HydrophobicContact CD1-CB 4.14Å; I208-F222 PolarHBondContact N-O 3.35Å; I208-F222 PolarHBondContact O-N 3.1Å; I208-I229 HydrophobicContact CD1-CD1 3.4Å; I208-I229 VanDerWaalsContact CD1-CD1 3.4Å; I208-I229 HydrophobicContact CG1-CD1 3.51Å; I208-F241 HydrophobicContact CB-CE2 4.09Å; I208-F241 HydrophobicContact CB-CZ 4.24Å; I208-F241 HydrophobicContact CD1-CE2 4.49Å; I208-F241 HydrophobicContact CG1-CE2 4.14Å; I208-F241 HydrophobicContact CG2-CD2 4.42Å; I208-F241 HydrophobicContact CG2-CE2 3.63Å; I208-F241 HydrophobicContact CG2-CZ 3.84Å; I208-T243 HydrophobicContact CD1-CG2 3.91Å; I208-T243 HydrophobicContact CG1-CG2 3.69Å; I208-F253 HydrophobicContact CD1-CD2 4.42Å; I208-F253 HydrophobicContact CD1-CE2 3.8Å; I208-F253 HydrophobicContact CD1-CZ 3.99Å
209	K	98.7	Very high	97.4	Very high	25 Å²	25	40 Å²	40	11%	0.109	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.6	176.2	-68.8	177.6	-171.9	-79.8	0	111	G182 V200 S201 W211 Q220 T221	G182-K209 WeakPolarHBondContact O-CE 3.12Å; G182-K209 PolarHBondContact O-NZ 3.28Å; V200-K209 CarbonylContact C-O 3.57Å; V200-K209 VanDerWaalsContact CA-O 3.24Å; V200-K209 WeakPolarHBondContact CA-O 3.09Å; S201-K209 PolarHBondContact N-O 3Å; S201-K209 PolarHBondContact O-N 2.85Å; K209-W211 HydrophobicContact CB-CD2 4.49Å; K209-W211 HydrophobicContact CB-CZ2 3.67Å; K209-W211 HydrophobicContact CD-CH2 3.99Å; K209-W211 HydrophobicContact CD-CZ2 3.52Å; K209-W211 HydrophobicContact CG-CZ2 4.21Å; K209-Q220 WeakPolarHBondContact CA-O 3.47Å; K209-T221 HydrophobicContact CG-CG2 4.19Å; K209-T221 PolarHBondContact NZ-OG1 3.21Å
210	L	98.8	Very high	97.3	Very high	12 Å²	12	42.2 Å²	42.2	6%	0.063	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127.1	169.1	178.8	73.9	0	0	0	108.7	V200 C218 R219 Q220 F222 F234 L255	V200-L210 HydrophobicContact CG1-CB 4.37Å; V200-L210 HydrophobicContact CG1-CD1 3.65Å; L210-C218 CarbonylContact O-C 3.49Å; L210-C218 WeakPolarHBondContact O-CA 3.4Å; L210-R219 HydrophobicContact CD2-CB 4.07Å; L210-R219 HydrophobicContact CG-CB 4.41Å; L210-R219 PolarHBondContact O-N 3.28Å; L210-Q220 HydrophobicContact CB-CB 4.2Å; L210-Q220 PolarHBondContact N-O 2.88Å; L210-F222 HydrophobicContact CB-CE2 4.19Å; L210-F234 HydrophobicContact CD1-CZ 4.15Å; L210-L255 HydrophobicContact CD1-CD1 4.39Å; L210-L255 HydrophobicContact CD1-CD2 4.26Å; L210-L255 HydrophobicContact CD2-CD1 4.3Å; L210-L255 HydrophobicContact CD2-CD2 4.08Å
211	W	98.6	Very high	97.3	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137.8	-178.2	-53.5	92.7	0	0	0	110.8	F180 S181 T198 F199 S201 K209 C218	F180-W211 HydrophobicContact CB-CD2 4Å; F180-W211 HydrophobicContact CB-CE3 3.75Å; F180-W211 HydrophobicContact CB-CH2 4.24Å; F180-W211 HydrophobicContact CB-CZ2 4.46Å; F180-W211 HydrophobicContact CB-CZ3 3.86Å; F180-W211 HydrophobicContact CD1-CB 4.12Å; F180-W211 HydrophobicContact CD1-CD2 4.16Å; F180-W211 AromaticContact CD1-CE3 3.77Å; F180-W211 HydrophobicContact CD1-CE3 3.77Å; F180-W211 HydrophobicContact CD1-CG 4.34Å; F180-W211 HydrophobicContact CE1-CB 4.35Å; F180-W211 HydrophobicContact CG-CD2 4.39Å; F180-W211 HydrophobicContact CG-CE3 4.19Å; S181-W211 WeakPolarHBondContact O-CH2 3.27Å; T198-W211 CarbonylContact C-O 3.5Å; T198-W211 WeakPolarHBondContact CA-O 3.44Å; T198-W211 VanDerWaalsContact CB-O 3.23Å; T198-W211 WeakPolarHBondContact CB-O 3.19Å; F199-W211 HydrophobicContact CD1-CB 3.74Å; F199-W211 HydrophobicContact CD1-CG 4.43Å; F199-W211 HydrophobicContact CD2-CB 4.47Å; F199-W211 AromaticContact CD2-CD1 3.74Å; F199-W211 HydrophobicContact CD2-CG 4.4Å; F199-W211 HydrophobicContact CE1-CB 3.32Å; F199-W211 AromaticContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE2-CB 4.12Å; F199-W211 AromaticContact CE2-CD1 3.23Å; F199-W211 AromaticContact CE2-CG 3.78Å; F199-W211 HydrophobicContact CE2-CG 3.78Å; F199-W211 AromaticContact CE2-NE1 3.86Å; F199-W211 HydrophobicContact CG-CB 4.29Å; F199-W211 HydrophobicContact CZ-CB 3.53Å; F199-W211 AromaticContact CZ-CD1 3.42Å; F199-W211 VanDerWaalsContact CZ-CD1 3.42Å; F199-W211 HydrophobicContact CZ-CD2 4.27Å; F199-W211 AromaticContact CZ-CG 3.46Å; F199-W211 HydrophobicContact CZ-CG 3.46Å; F199-W211 VanDerWaalsContact CZ-CG 3.46Å; F199-W211 PolarHBondContact N-O 2.92Å; F199-W211 PolarHBondContact O-N 3.27Å; S201-W211 PolarHBondContact OG-NE1 2.9Å; K209-W211 HydrophobicContact CB-CD2 4.49Å; K209-W211 HydrophobicContact CB-CZ2 3.67Å; K209-W211 HydrophobicContact CD-CH2 3.99Å; K209-W211 HydrophobicContact CD-CZ2 3.52Å; K209-W211 HydrophobicContact CG-CZ2 4.21Å; W211-C218 HydrophobicContact CD2-CB 4.38Å; W211-C218 HydrophobicContact CE3-CB 3.69Å; W211-C218 HydrophobicContact CH2-CB 4.03Å; W211-C218 HydrophobicContact CZ3-CB 3.51Å
212	D	97.5	Very high	97.3	Very high	27 Å²	27	44.4 Å²	44.4	14%	0.144	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.6	167.6	-168.6	-50.4	0	0	0	109.1	R214 D215 S216 M217 R219	D212-R214 VanDerWaalsContact C-N 3.33Å; D212-R214 PolarHBondContact OD1-N 3.17Å; D212-D215 HydrophobicContact CB-CB 4.11Å; D212-D215 PolarHBondContact OD1-N 2.85Å; D212-S216 WeakPolarHBondContact O-CA 3.27Å; D212-S216 PolarHBondContact O-N 2.88Å; D212-M217 PolarHBondContact N-O 3.01Å; D212-R219 HydrophobicContact CB-CG 4.05Å; D212-R219 IonicContact OD2-CZ 3.56Å; D212-R219 IonicContact OD2-NE 2.75Å; D212-R219 PolarHBondContact OD2-NE 3.15Å; D212-R219 IonicContact OD2-NH2 3.23Å; D212-R219 PolarHBondContact OD2-NH2 3.31Å
213	I	96.3	Very high	97.2	Very high	17 Å²	17	48.4 Å²	48.4	9%	0.087	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-35.8	-174.8	-64.7	167.6	0	0	0	110.7	I152 I158 L168 L192 F196 R197 F199	I152-I213 HydrophobicContact CD1-CD1 4.06Å; I152-I213 HydrophobicContact CD1-CG2 4.12Å; I158-I213 HydrophobicContact CD1-CD1 3.72Å; I158-I213 HydrophobicContact CD1-CG1 3.91Å; L168-I213 HydrophobicContact CD2-CG2 3.99Å; L192-I213 HydrophobicContact CD2-CD1 4.22Å; F196-I213 WeakPolarHBondContact O-CD1 3.35Å; R197-I213 WeakPolarHBondContact O-CB 3.22Å; R197-I213 WeakPolarHBondContact O-CG1 3.24Å; R197-I213 PolarHBondContact O-N 3.39Å; F199-I213 HydrophobicContact CD1-CD1 4.24Å; F199-I213 HydrophobicContact CD1-CG1 3.72Å; F199-I213 HydrophobicContact CE1-CG1 4.26Å
214	R	94.4	Very high	97.1	Very high	222 Å²	222	49.8 Å²	49.8	84%	0.838	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-42.5	-176.2	-179	-179.8	178.8	179.1	-0.2	111.7	D212 S216	D212-R214 VanDerWaalsContact C-N 3.33Å; D212-R214 PolarHBondContact OD1-N 3.17Å; R214-S216 VanDerWaalsContact C-N 3.29Å
215	D	93.4	Very high	97.1	Very high	81 Å²	81	48.7 Å²	48.7	43%	0.433	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-7	-177.7	-72.6	4.2	0	0	0	112.3	D212 M217 R219	D212-D215 HydrophobicContact CB-CB 4.11Å; D212-D215 PolarHBondContact OD1-N 2.85Å; D215-M217 VanDerWaalsContact O-CG 3.27Å; D215-M217 WeakPolarHBondContact O-CG 3.37Å; D215-M217 PolarHBondContact O-N 3.02Å; D215-R219 IonicContact OD2-CZ 3.94Å; D215-R219 IonicContact OD2-NH1 2.82Å; D215-R219 IonicContact OD2-NH2 2.85Å; D215-R219 PolarHBondContact OD2-NH2 2.77Å
216	S	93.3	Very high	97.1	Very high	43 Å²	43	55 Å²	55	30%	0.301	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	29.3	176.3	-53.1	0	0	0	0	113.9	T178 D212 R214	T178-S216 VanDerWaalsContact CG2-CB 3.47Å; T178-S216 VanDerWaalsContact CG2-OG 3.32Å; T178-S216 WeakPolarHBondContact CG2-OG 3.42Å; T178-S216 PolarHBondContact OG1-OG 2.73Å; D212-S216 WeakPolarHBondContact O-CA 3.27Å; D212-S216 PolarHBondContact O-N 2.88Å; R214-S216 VanDerWaalsContact C-N 3.29Å
217	M	93.4	Very high	97.1	Very high	125 Å²	125	56 Å²	56	62%	0.616	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.2	-171	-71.4	-72.8	171.2	0	0	112.5	D212 D215 R219	D212-M217 PolarHBondContact N-O 3.01Å; D215-M217 VanDerWaalsContact O-CG 3.27Å; D215-M217 WeakPolarHBondContact O-CG 3.37Å; D215-M217 PolarHBondContact O-N 3.02Å; M217-R219 PolarHBondContact O-N 3.15Å
218	C	97.7	Very high	97.1	Very high	47 Å²	47	58 Å²	58	32%	0.318	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	121.7	168.7	-177.7	0	0	0	0	109.3	L210 W211 Q220	L210-C218 CarbonylContact O-C 3.49Å; L210-C218 WeakPolarHBondContact O-CA 3.4Å; W211-C218 HydrophobicContact CD2-CB 4.38Å; W211-C218 HydrophobicContact CE3-CB 3.69Å; W211-C218 HydrophobicContact CH2-CB 4.03Å; W211-C218 HydrophobicContact CZ3-CB 3.51Å; C218-Q220 PolarHBondContact SG-O 2.92Å; C218-Q220 VanDerWaalsContact SG-O 3.33Å
219	R	97.9	Very high	97.1	Very high	131 Å²	131	58 Å²	58	49%	0.494	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-42.7	177.2	-65.3	-63.5	-163.7	-179.5	1.8	112.3	L210 D212 D215 M217	L210-R219 HydrophobicContact CD2-CB 4.07Å; L210-R219 HydrophobicContact CG-CB 4.41Å; L210-R219 PolarHBondContact O-N 3.28Å; D212-R219 HydrophobicContact CB-CG 4.05Å; D212-R219 IonicContact OD2-CZ 3.56Å; D212-R219 IonicContact OD2-NE 2.75Å; D212-R219 PolarHBondContact OD2-NE 3.15Å; D212-R219 IonicContact OD2-NH2 3.23Å; D212-R219 PolarHBondContact OD2-NH2 3.31Å; D215-R219 IonicContact OD2-CZ 3.94Å; D215-R219 IonicContact OD2-NH1 2.82Å; D215-R219 IonicContact OD2-NH2 2.85Å; D215-R219 PolarHBondContact OD2-NH2 2.77Å; M217-R219 PolarHBondContact O-N 3.15Å
220	Q	98.2	Very high	97.1	Very high	47 Å²	47	58 Å²	58	22%	0.22	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	149.1	-174.4	-71.4	173.9	-43.7	0	0	110.6	K209 L210 C218 F222 L255 D258	K209-Q220 WeakPolarHBondContact CA-O 3.47Å; L210-Q220 HydrophobicContact CB-CB 4.2Å; L210-Q220 PolarHBondContact N-O 2.88Å; C218-Q220 PolarHBondContact SG-O 2.92Å; C218-Q220 VanDerWaalsContact SG-O 3.33Å; Q220-F222 HydrophobicContact CB-CD2 4.45Å; Q220-F222 HydrophobicContact CB-CE2 3.7Å; Q220-F222 HydrophobicContact CB-CZ 3.95Å; Q220-L255 PolarHBondContact NE2-O 2.89Å; Q220-L255 PolarHBondContact OE1-O 3.04Å; Q220-D258 WeakPolarHBondContact CG-OD1 3.41Å; Q220-D258 PolarHBondContact NE2-OD1 2.91Å
221	T	98.4	Very high	97.1	Very high	46 Å²	46	57.8 Å²	57.8	28%	0.282	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	117.6	169.9	-61.8	0	0	0	0	108.7	R22 I208 K209	R22-T221 PolarHBondContact NH2-O 2.9Å; I208-T221 CarbonylContact O-C 3.55Å; I208-T221 WeakPolarHBondContact O-CA 3.44Å; K209-T221 HydrophobicContact CG-CG2 4.19Å; K209-T221 PolarHBondContact NZ-OG1 3.21Å
222	F	98.5	Very high	97.1	Very high	1 Å²	1	58.2 Å²	58.2	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136.8	177.1	-54.2	-97.4	0	0	0	109.2	S207 I208 L210 Q220 F241 F253 L255	S207-F222 WeakPolarHBondContact CA-O 3.3Å; I208-F222 HydrophobicContact CB-CB 4.2Å; I208-F222 HydrophobicContact CB-CD2 4.49Å; I208-F222 HydrophobicContact CD1-CB 4.14Å; I208-F222 PolarHBondContact N-O 3.35Å; I208-F222 PolarHBondContact O-N 3.1Å; L210-F222 HydrophobicContact CB-CE2 4.19Å; Q220-F222 HydrophobicContact CB-CD2 4.45Å; Q220-F222 HydrophobicContact CB-CE2 3.7Å; Q220-F222 HydrophobicContact CB-CZ 3.95Å; F222-F241 HydrophobicContact CB-CZ 4.28Å; F222-F241 HydrophobicContact CD1-CE1 4.44Å; F222-F241 HydrophobicContact CD1-CZ 4.14Å; F222-F241 AromaticContact CD2-CE1 3.89Å; F222-F241 HydrophobicContact CD2-CE1 3.89Å; F222-F241 AromaticContact CD2-CZ 3.52Å; F222-F241 HydrophobicContact CD2-CZ 3.52Å; F222-F241 HydrophobicContact CE1-CE1 4.2Å; F222-F241 HydrophobicContact CE1-CZ 4.35Å; F222-F241 AromaticContact CE2-CE1 3.65Å; F222-F241 HydrophobicContact CE2-CE1 3.65Å; F222-F241 AromaticContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CG-CE1 4.3Å; F222-F241 AromaticContact CG-CZ 3.72Å; F222-F241 HydrophobicContact CG-CZ 3.72Å; F222-F241 AromaticContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CZ 4.22Å; F222-F253 HydrophobicContact CB-CD1 3.93Å; F222-F253 HydrophobicContact CB-CE1 4.02Å; F222-F253 HydrophobicContact CB-CG 4.46Å; F222-F253 HydrophobicContact CD1-CB 4.14Å; F222-F253 AromaticContact CD1-CD1 3.79Å; F222-F253 HydrophobicContact CD1-CD1 3.79Å; F222-F253 HydrophobicContact CD1-CG 4.24Å; F222-F253 HydrophobicContact CE1-CB 4.42Å; F222-F253 HydrophobicContact CG-CD1 4.2Å; F222-L255 HydrophobicContact CE2-CD2 4.09Å; F222-L255 HydrophobicContact CZ-CD2 3.63Å
223	T	97.1	Very high	97.1	Very high	83 Å²	83	58.1 Å²	58.1	51%	0.509	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.1	-179.8	54	0	0	0	0	107.9	R22	R22-T223 PolarHBondContact NH1-OG1 2.82Å
224	G	95.9	Very high	97.3	Very high	29 Å²	29	57.9 Å²	57.9	30%	0.299	30%	0.297	S	S	.	.			trans	170.8	-39.5	175.1	0	0	0	0	0	112	R251	G224-R251 VanDerWaalsContact CA-NH1 3.33Å; G224-R251 PolarHBondContact O-NH1 3.32Å; G224-R251 PolarHBondContact O-NH2 3.16Å
225	H	98.2	Very high	97.4	Very high	13 Å²	13	48.7 Å²	48.7	6%	0.06	26%	0.263	C	S	.	.			trans	-60.5	151.7	175.6	-78.6	-66.7	0	0	0	112.6	A206 I229 T243 S245 D247 T249	A206-H225 HydrophobicContact CB-CB 4.44Å; H225-I229 HydrophobicContact CB-CD1 4.24Å; H225-I229 HydrophobicContact CB-CG1 4.16Å; H225-T243 WeakPolarHBondContact NE2-CB 3.44Å; H225-T243 PolarHBondContact NE2-OG1 3.04Å; H225-S245 VanDerWaalsContact CE1-CB 3.48Å; H225-S245 WeakPolarHBondContact CE1-CB 3.22Å; H225-S245 WeakPolarHBondContact ND1-CB 3.47Å; H225-D247 WeakPolarHBondContact CA-OD2 3.19Å; H225-D247 IonicContact CE1-OD1 3.63Å; H225-D247 IonicContact CE1-OD2 3.49Å; H225-D247 IonicContact CG-OD2 3.45Å; H225-D247 IonicContact ND1-OD1 3.58Å; H225-D247 PolarHBondContact ND1-OD1 2.78Å; H225-D247 IonicContact ND1-OD2 2.72Å; H225-D247 PolarHBondContact ND1-OD2 2.92Å; H225-T249 PolarHBondContact CE1-O 3.13Å; H225-T249 PolarHBondContact CE1-OG1 3.48Å
226	E	97.7	Very high	97.6	Very high	170 Å²	170	47 Å²	47	79%	0.794	26%	0.256	S	S	*	.	S	Bend	trans	-98.4	-10.8	179.9	-60.7	-174.9	177.7	0	0	112.7	D247	E226-D247 HydrophobicContact CB-CB 4.11Å; E226-D247 PolarHBondContact N-OD2 2.86Å
227	S	98.2	Very high	97.8	Very high	42 Å²	42	49.7 Å²	49.7	29%	0.294	27%	0.268	S	S	.	.	S	Bend	trans	-148.4	-169.1	-177.4	-162.5	0	0	0	0	111.5	A206 S245	A206-S227 WeakPolarHBondContact CB-O 3.4Å; S227-S245 PolarHBondContact O-OG 2.81Å
228	D	98.4	Very high	98	Very high	52 Å²	52	44.6 Å²	44.6	28%	0.278	25%	0.247	S	C	.	.			trans	-60.9	140.6	-171.7	-64.4	3.1	0	0	0	111.4	C204 S245 D246	C204-D228 HydrophobicContact CB-CB 4.33Å; C204-D228 VanDerWaalsContact SG-CG 3.55Å; C204-D228 PolarHBondContact SG-OD2 3.18Å; D228-S245 CarbonylContact O-C 3.52Å; D228-S245 WeakPolarHBondContact O-CA 3.3Å; D228-S245 VanDerWaalsContact O-CB 3.23Å; D228-S245 WeakPolarHBondContact O-CB 3.23Å; D228-S245 PolarHBondContact O-OG 2.64Å; D228-D246 PolarHBondContact O-N 3.04Å
229	I	98.8	Very high	98	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	97.7	179.8	-56.7	178	0	0	0	108.7	M188 A203 I208 H225 V232 T243	M188-I229 WeakPolarHBondContact CB-O 3.13Å; A203-I229 PolarHBondContact O-N 2.87Å; A203-I229 VanDerWaalsContact O-N 3.11Å; I208-I229 HydrophobicContact CD1-CD1 3.4Å; I208-I229 VanDerWaalsContact CD1-CD1 3.4Å; I208-I229 HydrophobicContact CG1-CD1 3.51Å; H225-I229 HydrophobicContact CB-CD1 4.24Å; H225-I229 HydrophobicContact CB-CG1 4.16Å; I229-V232 HydrophobicContact CG2-CG2 3.89Å; I229-T243 HydrophobicContact CG2-CG2 4.39Å
230	N	98.6	Very high	98	Very high	26 Å²	26	38.3 Å²	38.3	14%	0.139	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-32.8	-176	-64.2	-44.1	0	0	0	113.2	S189 G244 D246 I273	S189-N230 VanDerWaalsContact CB-O 3.29Å; S189-N230 WeakPolarHBondContact CB-O 3.29Å; S189-N230 PolarHBondContact OG-O 2.88Å; S189-N230 VanDerWaalsContact OG-O 3.13Å; N230-G244 PolarHBondContact N-O 2.72Å; N230-D246 VanDerWaalsContact ND2-CG 3.33Å; N230-D246 PolarHBondContact ND2-OD1 3.49Å; N230-I273 VanDerWaalsContact CB-O 3.28Å; N230-I273 WeakPolarHBondContact CB-O 3.3Å; N230-I273 PolarHBondContact ND2-O 3.44Å
231	A	98.5	Very high	98	Very high	7 Å²	7	36 Å²	36	6%	0.058	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	139.8	-171.1	0	0	0	0	0	112.6	S189 T243 G244 S275 V276	S189-A231 WeakPolarHBondContact OG-CA 3.19Å; A231-T243 CarbonylContact O-C 3.44Å; A231-T243 VanDerWaalsContact O-CA 3.26Å; A231-T243 WeakPolarHBondContact O-CA 3.11Å; A231-G244 PolarHBondContact N-O 3.45Å; A231-G244 PolarHBondContact O-N 3.23Å; A231-S275 VanDerWaalsContact CB-CA 3.5Å; A231-V276 HydrophobicContact CB-CG1 4.42Å; A231-V276 HydrophobicContact CB-CG2 3.9Å
232	V	98.6	Very high	98	Very high	13 Å²	13	33.9 Å²	33.9	8%	0.079	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141	173.4	-169.2	0	0	0	0	109.8	S189 V200 I229 F241 A242 T243	S189-V232 PolarHBondContact OG-N 2.88Å; S189-V232 VanDerWaalsContact OG-N 3.1Å; V200-V232 HydrophobicContact CB-CG1 4.15Å; V200-V232 HydrophobicContact CG2-CB 4.37Å; V200-V232 HydrophobicContact CG2-CG1 3.32Å; I229-V232 HydrophobicContact CG2-CG2 3.89Å; V232-F241 HydrophobicContact CG1-CD2 3.88Å; V232-A242 CarbonylContact C-O 3.51Å; V232-A242 WeakPolarHBondContact CA-O 3.47Å; V232-T243 HydrophobicContact CG1-CG2 4.26Å; V232-T243 HydrophobicContact CG2-CG2 4.23Å
233	C	98.6	Very high	98	Very high	25 Å²	25	33.8 Å²	33.8	17%	0.169	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	126.4	177	-178.8	0	0	0	0	111	F241 A242 V276	C233-F241 CarbonylContact O-C 3.56Å; C233-F241 VanDerWaalsContact O-CA 3.29Å; C233-F241 WeakPolarHBondContact O-CA 3.43Å; C233-F241 WeakPolarHBondContact O-CB 3.27Å; C233-A242 PolarHBondContact N-O 3.11Å; C233-A242 PolarHBondContact O-N 2.91Å; C233-V276 HydrophobicContact CB-CG2 3.88Å; C233-V276 WeakPolarHBondContact CB-O 3.28Å
234	F	98.6	Very high	98.1	Very high	13 Å²	13	29.9 Å²	29.9	6%	0.057	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	141.8	170.9	-94.5	-78.7	0	0	0	112.2	S191 L192 S193 V200 L210 A240 F241 L255	S191-F234 WeakPolarHBondContact O-CD2 3.31Å; S191-F234 WeakPolarHBondContact O-CE2 3.22Å; S191-F234 PolarHBondContact OG-N 3.19Å; L192-F234 WeakPolarHBondContact O-CD2 3.4Å; S193-F234 VanDerWaalsContact N-CE2 3.26Å; V200-F234 HydrophobicContact CB-CE2 4.2Å; V200-F234 HydrophobicContact CB-CZ 4.44Å; V200-F234 HydrophobicContact CG1-CE1 4.39Å; V200-F234 HydrophobicContact CG1-CE2 3.94Å; V200-F234 HydrophobicContact CG1-CZ 3.68Å; V200-F234 HydrophobicContact CG2-CD2 3.85Å; V200-F234 HydrophobicContact CG2-CE2 3.59Å; V200-F234 HydrophobicContact CG2-CZ 4.16Å; L210-F234 HydrophobicContact CD1-CZ 4.15Å; F234-A240 WeakPolarHBondContact CD1-O 3.13Å; F234-F241 HydrophobicContact CD1-CB 4.38Å; F234-L255 HydrophobicContact CE1-CD1 4.35Å
235	F	98.4	Very high	98.2	Very high	28 Å²	28	28.5 Å²	28.5	12%	0.123	16%	0.162	C	C	.	.			trans	-68.8	147.4	165.8	-169.6	-91.7	0	0	0	109.6	N237 G238 A240 F278 G282	F235-N237 HydrophobicContact CD1-CB 4.13Å; F235-N237 VanDerWaalsContact CD1-CG 3.47Å; F235-N237 VanDerWaalsContact CD1-OD1 3.23Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.37Å; F235-N237 HydrophobicContact CE1-CB 4.34Å; F235-N237 PolarHBondContact O-N 3.23Å; F235-G238 PolarHBondContact O-N 3.38Å; F235-A240 HydrophobicContact CB-CB 3.86Å; F235-A240 WeakPolarHBondContact CB-O 3.49Å; F235-A240 HydrophobicContact CG-CB 4.36Å; F235-A240 PolarHBondContact N-O 3.06Å; F235-F278 HydrophobicContact CB-CD2 4.39Å; F235-F278 HydrophobicContact CB-CE2 4.13Å; F235-F278 AromaticContact CD2-CD1 3.92Å; F235-F278 HydrophobicContact CD2-CD1 3.92Å; F235-F278 HydrophobicContact CD2-CD2 4.18Å; F235-F278 AromaticContact CD2-CE1 3.68Å; F235-F278 HydrophobicContact CD2-CE1 3.68Å; F235-F278 AromaticContact CD2-CE2 3.94Å; F235-F278 HydrophobicContact CD2-CE2 3.94Å; F235-F278 HydrophobicContact CD2-CG 4.15Å; F235-F278 AromaticContact CD2-CZ 3.68Å; F235-F278 HydrophobicContact CD2-CZ 3.68Å; F235-F278 HydrophobicContact CE2-CD1 4.18Å; F235-F278 HydrophobicContact CE2-CE1 4.04Å; F235-F278 HydrophobicContact CE2-CZ 4.47Å; F235-G282 VanDerWaalsContact CE2-CA 3.47Å; F235-G282 WeakPolarHBondContact CE2-O 3.29Å
236	P	97.1	Very high	98.3	Very high	45 Å²	45	30.9 Å²	30.9	29%	0.292	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-23.2	-172.3	-30.2	36.1	0	0	0	116.7	F278	P236-F278 HydrophobicContact CG-CB 4.25Å
237	N	96.7	Very high	98.3	Very high	100 Å²	100	24.3 Å²	24.3	54%	0.535	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-4.7	177.6	75	2.9	0	0	0	114.2	F235 S239	F235-N237 HydrophobicContact CD1-CB 4.13Å; F235-N237 VanDerWaalsContact CD1-CG 3.47Å; F235-N237 VanDerWaalsContact CD1-OD1 3.23Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.37Å; F235-N237 HydrophobicContact CE1-CB 4.34Å; F235-N237 PolarHBondContact O-N 3.23Å; N237-S239 PolarHBondContact O-N 3.26Å; N237-S239 VanDerWaalsContact OD1-CB 3.29Å; N237-S239 WeakPolarHBondContact OD1-CB 3.39Å; N237-S239 PolarHBondContact OD1-N 2.99Å; N237-S239 PolarHBondContact OD1-OG 2.69Å
238	G	97.1	Very high	98.3	Very high	18 Å²	18	22.7 Å²	22.7	19%	0.186	14%	0.135	C	C	.	.	S	Bend	trans	73.4	1.5	-178.9	0	0	0	0	0	116.1	F235 L255	F235-G238 PolarHBondContact O-N 3.38Å; G238-L255 WeakPolarHBondContact O-CD1 3.46Å
239	S	97.6	Very high	98.2	Very high	38 Å²	38	21.1 Å²	21.1	27%	0.266	13%	0.127	S	C	.	.	S	Bend	trans	-93.1	-12.5	-176.8	-46.3	0	0	0	0	113.6	N237 L255	N237-S239 PolarHBondContact O-N 3.26Å; N237-S239 VanDerWaalsContact OD1-CB 3.29Å; N237-S239 WeakPolarHBondContact OD1-CB 3.39Å; N237-S239 PolarHBondContact OD1-N 2.99Å; N237-S239 PolarHBondContact OD1-OG 2.69Å; S239-L255 WeakPolarHBondContact O-CG 3.4Å; S239-L255 PolarHBondContact O-N 2.95Å
240	A	98.4	Very high	98.2	Very high	8 Å²	8	21.1 Å²	21.1	7%	0.066	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	167.6	-176	0	0	0	0	0	109.9	F234 F235 L252 F253	F234-A240 WeakPolarHBondContact CD1-O 3.13Å; F235-A240 HydrophobicContact CB-CB 3.86Å; F235-A240 WeakPolarHBondContact CB-O 3.49Å; F235-A240 HydrophobicContact CG-CB 4.36Å; F235-A240 PolarHBondContact N-O 3.06Å; A240-L252 HydrophobicContact CB-CD1 3.96Å; A240-F253 CarbonylContact C-O 3.57Å; A240-F253 WeakPolarHBondContact CA-O 3.32Å; A240-F253 WeakPolarHBondContact CB-O 3.32Å
241	F	98.8	Very high	98.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153.1	174.2	61.9	-91.4	0	0	0	110.9	V200 I208 F222 V232 C233 F234 T243 L252 F253 L255	V200-F241 HydrophobicContact CG1-CD1 3.94Å; V200-F241 HydrophobicContact CG1-CE1 4.11Å; V200-F241 HydrophobicContact CG1-CG 4.3Å; V200-F241 HydrophobicContact CG2-CB 4.41Å; V200-F241 HydrophobicContact CG2-CG 4.39Å; I208-F241 HydrophobicContact CB-CE2 4.09Å; I208-F241 HydrophobicContact CB-CZ 4.24Å; I208-F241 HydrophobicContact CD1-CE2 4.49Å; I208-F241 HydrophobicContact CG1-CE2 4.14Å; I208-F241 HydrophobicContact CG2-CD2 4.42Å; I208-F241 HydrophobicContact CG2-CE2 3.63Å; I208-F241 HydrophobicContact CG2-CZ 3.84Å; F222-F241 HydrophobicContact CB-CZ 4.28Å; F222-F241 HydrophobicContact CD1-CE1 4.44Å; F222-F241 HydrophobicContact CD1-CZ 4.14Å; F222-F241 AromaticContact CD2-CE1 3.89Å; F222-F241 HydrophobicContact CD2-CE1 3.89Å; F222-F241 AromaticContact CD2-CZ 3.52Å; F222-F241 HydrophobicContact CD2-CZ 3.52Å; F222-F241 HydrophobicContact CE1-CE1 4.2Å; F222-F241 HydrophobicContact CE1-CZ 4.35Å; F222-F241 AromaticContact CE2-CE1 3.65Å; F222-F241 HydrophobicContact CE2-CE1 3.65Å; F222-F241 AromaticContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CG-CE1 4.3Å; F222-F241 AromaticContact CG-CZ 3.72Å; F222-F241 HydrophobicContact CG-CZ 3.72Å; F222-F241 AromaticContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CZ 4.22Å; V232-F241 HydrophobicContact CG1-CD2 3.88Å; C233-F241 CarbonylContact O-C 3.56Å; C233-F241 VanDerWaalsContact O-CA 3.29Å; C233-F241 WeakPolarHBondContact O-CA 3.43Å; C233-F241 WeakPolarHBondContact O-CB 3.27Å; F234-F241 HydrophobicContact CD1-CB 4.38Å; F241-T243 HydrophobicContact CD2-CG2 3.87Å; F241-T243 HydrophobicContact CE2-CG2 3.76Å; F241-L252 WeakPolarHBondContact O-CD1 3.38Å; F241-F253 HydrophobicContact CD1-CB 4.26Å; F241-F253 HydrophobicContact CD2-CB 4.23Å; F241-F253 HydrophobicContact CD2-CD2 4.22Å; F241-F253 HydrophobicContact CE1-CB 3.72Å; F241-F253 HydrophobicContact CE2-CB 3.67Å; F241-F253 AromaticContact CE2-CD2 3.51Å; F241-F253 HydrophobicContact CE2-CD2 3.51Å; F241-F253 HydrophobicContact CE2-CE2 4.4Å; F241-F253 AromaticContact CE2-CG 3.81Å; F241-F253 HydrophobicContact CE2-CG 3.81Å; F241-F253 HydrophobicContact CG-CB 4.49Å; F241-F253 HydrophobicContact CZ-CB 3.39Å; F241-F253 AromaticContact CZ-CD2 3.98Å; F241-F253 HydrophobicContact CZ-CD2 3.98Å; F241-F253 AromaticContact CZ-CG 3.79Å; F241-F253 HydrophobicContact CZ-CG 3.79Å; F241-F253 PolarHBondContact N-O 3.49Å; F241-F253 PolarHBondContact O-N 2.9Å; F241-L255 HydrophobicContact CD1-CD2 3.8Å; F241-L255 HydrophobicContact CE1-CD2 3.63Å
242	A	98.8	Very high	98.2	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	152.1	172.5	0	0	0	0	0	111.5	V232 C233 R251 F278 L285	V232-A242 CarbonylContact C-O 3.51Å; V232-A242 WeakPolarHBondContact CA-O 3.47Å; C233-A242 PolarHBondContact N-O 3.11Å; C233-A242 PolarHBondContact O-N 2.91Å; A242-R251 CarbonylContact C-O 3.5Å; A242-R251 WeakPolarHBondContact CA-O 3.08Å; A242-F278 HydrophobicContact CB-CD2 4.45Å; A242-F278 HydrophobicContact CB-CE2 3.4Å; A242-F278 VanDerWaalsContact CB-CE2 3.4Å; A242-F278 HydrophobicContact CB-CZ 3.5Å; A242-F278 VanDerWaalsContact CB-CZ 3.5Å; A242-L285 HydrophobicContact CB-CD1 3.7Å; A242-L285 HydrophobicContact CB-CD2 4.2Å
243	T	98.8	Very high	98.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.6	178.5	55.2	0	0	0	0	110	I208 H225 I229 A231 V232 F241 C250 R251 F253	I208-T243 HydrophobicContact CD1-CG2 3.91Å; I208-T243 HydrophobicContact CG1-CG2 3.69Å; H225-T243 WeakPolarHBondContact NE2-CB 3.44Å; H225-T243 PolarHBondContact NE2-OG1 3.04Å; I229-T243 HydrophobicContact CG2-CG2 4.39Å; A231-T243 CarbonylContact O-C 3.44Å; A231-T243 VanDerWaalsContact O-CA 3.26Å; A231-T243 WeakPolarHBondContact O-CA 3.11Å; V232-T243 HydrophobicContact CG1-CG2 4.26Å; V232-T243 HydrophobicContact CG2-CG2 4.23Å; F241-T243 HydrophobicContact CD2-CG2 3.87Å; F241-T243 HydrophobicContact CE2-CG2 3.76Å; T243-C250 WeakPolarHBondContact O-CA 3.31Å; T243-C250 VanDerWaalsContact O-CB 3.27Å; T243-C250 WeakPolarHBondContact O-CB 3.4Å; T243-R251 PolarHBondContact N-O 3.09Å; T243-R251 PolarHBondContact O-N 3.5Å; T243-R251 VanDerWaalsContact O-N 3.16Å; T243-R251 PolarHBondContact OG1-O 2.96Å; T243-F253 HydrophobicContact CG2-CD2 4.04Å; T243-F253 HydrophobicContact CG2-CE2 3.96Å
244	G	98.6	Very high	98.2	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	133	169.7	0	0	0	0	0	110	N230 A231	N230-G244 PolarHBondContact N-O 2.72Å; A231-G244 PolarHBondContact N-O 3.45Å; A231-G244 PolarHBondContact O-N 3.23Å
245	S	98.7	Very high	98.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	163.8	-171.7	176.2	0	0	0	0	112.8	H225 S227 D228 D247 A248 T249 I273	H225-S245 VanDerWaalsContact CE1-CB 3.48Å; H225-S245 WeakPolarHBondContact CE1-CB 3.22Å; H225-S245 WeakPolarHBondContact ND1-CB 3.47Å; S227-S245 PolarHBondContact O-OG 2.81Å; D228-S245 CarbonylContact O-C 3.52Å; D228-S245 WeakPolarHBondContact O-CA 3.3Å; D228-S245 VanDerWaalsContact O-CB 3.23Å; D228-S245 WeakPolarHBondContact O-CB 3.23Å; D228-S245 PolarHBondContact O-OG 2.64Å; S245-D247 WeakPolarHBondContact CB-OD1 3.42Å; S245-D247 PolarHBondContact O-N 2.71Å; S245-D247 PolarHBondContact OG-N 2.86Å; S245-A248 PolarHBondContact O-N 2.9Å; S245-T249 PolarHBondContact N-O 3.18Å; S245-I273 PolarHBondContact O-N 2.97Å
246	D	98.4	Very high	98.2	Very high	64 Å²	64	29 Å²	29	34%	0.342	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.3	168.4	-80.3	-16.2	0	0	0	113.6	D228 N230 A248	D228-D246 PolarHBondContact O-N 3.04Å; N230-D246 VanDerWaalsContact ND2-CG 3.33Å; N230-D246 PolarHBondContact ND2-OD1 3.49Å; D246-A248 PolarHBondContact O-N 3.14Å; D246-A248 VanDerWaalsContact O-N 3.1Å
247	D	97.8	Very high	98.2	Very high	31 Å²	31	28.4 Å²	28.4	17%	0.166	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	8.9	169.2	72.8	12.8	0	0	0	114	H225 E226 S245 T249 R251	H225-D247 WeakPolarHBondContact CA-OD2 3.19Å; H225-D247 IonicContact CE1-OD1 3.63Å; H225-D247 IonicContact CE1-OD2 3.49Å; H225-D247 IonicContact CG-OD2 3.45Å; H225-D247 IonicContact ND1-OD1 3.58Å; H225-D247 PolarHBondContact ND1-OD1 2.78Å; H225-D247 IonicContact ND1-OD2 2.72Å; H225-D247 PolarHBondContact ND1-OD2 2.92Å; E226-D247 HydrophobicContact CB-CB 4.11Å; E226-D247 PolarHBondContact N-OD2 2.86Å; S245-D247 WeakPolarHBondContact CB-OD1 3.42Å; S245-D247 PolarHBondContact O-N 2.71Å; S245-D247 PolarHBondContact OG-N 2.86Å; D247-T249 VanDerWaalsContact CG-OG1 3.3Å; D247-T249 WeakPolarHBondContact O-CG2 3.48Å; D247-T249 PolarHBondContact O-N 2.92Å; D247-T249 WeakPolarHBondContact OD1-CA 3.32Å; D247-T249 VanDerWaalsContact OD1-CB 3.31Å; D247-T249 WeakPolarHBondContact OD1-CB 3.46Å; D247-T249 PolarHBondContact OD1-N 3.42Å; D247-T249 PolarHBondContact OD1-OG1 2.51Å; D247-T249 PolarHBondContact OD2-OG1 2.74Å; D247-R251 IonicContact OD2-NH2 3.43Å
248	A	97.9	Very high	98.2	Very high	9 Å²	9	25.4 Å²	25.4	7%	0.074	13%	0.133	C	C	.	.	S	Bend	trans	63.5	12.7	-178	0	0	0	0	0	115.1	S245 D246 I269 C271	S245-A248 PolarHBondContact O-N 2.9Å; D246-A248 PolarHBondContact O-N 3.14Å; D246-A248 VanDerWaalsContact O-N 3.1Å; A248-I269 HydrophobicContact CB-CG2 4.48Å; A248-I269 WeakPolarHBondContact CB-O 3.27Å; A248-C271 WeakPolarHBondContact CA-O 3.36Å; A248-C271 VanDerWaalsContact CB-O 3.24Å; A248-C271 WeakPolarHBondContact CB-O 3.18Å
249	T	98.2	Very high	98.2	Very high	18 Å²	18	26.6 Å²	26.6	11%	0.11	13%	0.134	C	C	.	.			trans	-112.1	142.8	178.9	77.2	0	0	0	0	112.7	H225 S245 D247 L263 I273	H225-T249 PolarHBondContact CE1-O 3.13Å; H225-T249 PolarHBondContact CE1-OG1 3.48Å; S245-T249 PolarHBondContact N-O 3.18Å; D247-T249 VanDerWaalsContact CG-OG1 3.3Å; D247-T249 WeakPolarHBondContact O-CG2 3.48Å; D247-T249 PolarHBondContact O-N 2.92Å; D247-T249 WeakPolarHBondContact OD1-CA 3.32Å; D247-T249 VanDerWaalsContact OD1-CB 3.31Å; D247-T249 WeakPolarHBondContact OD1-CB 3.46Å; D247-T249 PolarHBondContact OD1-N 3.42Å; D247-T249 PolarHBondContact OD1-OG1 2.51Å; D247-T249 PolarHBondContact OD2-OG1 2.74Å; T249-L263 HydrophobicContact CG2-CD1 3.96Å; T249-I273 WeakPolarHBondContact O-CD1 3.24Å
250	C	98.6	Very high	98.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.3	158.9	-56.1	0	0	0	0	109.1	T243 Y264 I273 L285 A287	T243-C250 WeakPolarHBondContact O-CA 3.31Å; T243-C250 VanDerWaalsContact O-CB 3.27Å; T243-C250 WeakPolarHBondContact O-CB 3.4Å; C250-Y264 HydrophobicContact CB-CD2 3.91Å; C250-Y264 HydrophobicContact CB-CG 4.42Å; C250-Y264 PolarHBondContact N-O 2.95Å; C250-Y264 WeakPolarHBondContact O-CD2 3.25Å; C250-Y264 PolarHBondContact O-N 3.11Å; C250-I273 HydrophobicContact CB-CD1 4.49Å; C250-I273 WeakPolarHBondContact SG-CD1 3.49Å; C250-L285 HydrophobicContact CB-CD2 4.03Å; C250-A287 VanDerWaalsContact SG-CB 3.56Å
251	R	98.6	Very high	98.1	Very high	21 Å²	21	31.1 Å²	31.1	8%	0.079	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	149.3	173.1	-66.1	174.7	-171.9	-138.9	12	110.6	G224 A242 T243 D247 F253 E260 S262 L263	G224-R251 VanDerWaalsContact CA-NH1 3.33Å; G224-R251 PolarHBondContact O-NH1 3.32Å; G224-R251 PolarHBondContact O-NH2 3.16Å; A242-R251 CarbonylContact C-O 3.5Å; A242-R251 WeakPolarHBondContact CA-O 3.08Å; T243-R251 PolarHBondContact N-O 3.09Å; T243-R251 PolarHBondContact O-N 3.5Å; T243-R251 VanDerWaalsContact O-N 3.16Å; T243-R251 PolarHBondContact OG1-O 2.96Å; D247-R251 IonicContact OD2-NH2 3.43Å; R251-F253 HydrophobicContact CB-CD2 4.2Å; R251-F253 HydrophobicContact CB-CE2 3.53Å; R251-F253 HydrophobicContact CB-CZ 4.01Å; R251-E260 VanDerWaalsContact CD-OE2 3.31Å; R251-E260 WeakPolarHBondContact CD-OE2 3.47Å; R251-E260 IonicContact CZ-OE2 3.35Å; R251-E260 IonicContact NE-OE2 3.58Å; R251-E260 IonicContact NH1-OE1 3.88Å; R251-E260 IonicContact NH1-OE2 2.94Å; R251-E260 PolarHBondContact NH1-OE2 2.93Å; R251-S262 WeakPolarHBondContact CA-O 3.25Å; R251-L263 HydrophobicContact CG-CD1 3.63Å
252	L	98.6	Very high	98	Very high	10 Å²	10	31.7 Å²	31.7	5%	0.052	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.3	170.7	174.2	60.1	0	0	0	108.3	L30 A240 F241 E260 L261 S262 Y264 F278	L30-L252 HydrophobicContact CD2-CD2 4.02Å; A240-L252 HydrophobicContact CB-CD1 3.96Å; F241-L252 WeakPolarHBondContact O-CD1 3.38Å; L252-E260 CarbonylContact O-C 3.54Å; L252-E260 WeakPolarHBondContact O-CA 3.35Å; L252-L261 HydrophobicContact CD2-CB 4.49Å; L252-L261 HydrophobicContact CG-CB 4.35Å; L252-L261 PolarHBondContact O-N 3.26Å; L252-S262 PolarHBondContact N-O 3.13Å; L252-S262 PolarHBondContact O-N 3.4Å; L252-Y264 HydrophobicContact CB-CE2 3.92Å; L252-F278 HydrophobicContact CD1-CZ 4.01Å
253	F	98.6	Very high	97.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.1	177	-66.7	-89.4	0	0	0	110.5	I208 F222 A240 F241 T243 R251 E260	I208-F253 HydrophobicContact CD1-CD2 4.42Å; I208-F253 HydrophobicContact CD1-CE2 3.8Å; I208-F253 HydrophobicContact CD1-CZ 3.99Å; F222-F253 HydrophobicContact CB-CD1 3.93Å; F222-F253 HydrophobicContact CB-CE1 4.02Å; F222-F253 HydrophobicContact CB-CG 4.46Å; F222-F253 HydrophobicContact CD1-CB 4.14Å; F222-F253 AromaticContact CD1-CD1 3.79Å; F222-F253 HydrophobicContact CD1-CD1 3.79Å; F222-F253 HydrophobicContact CD1-CG 4.24Å; F222-F253 HydrophobicContact CE1-CB 4.42Å; F222-F253 HydrophobicContact CG-CD1 4.2Å; A240-F253 CarbonylContact C-O 3.57Å; A240-F253 WeakPolarHBondContact CA-O 3.32Å; A240-F253 WeakPolarHBondContact CB-O 3.32Å; F241-F253 HydrophobicContact CD1-CB 4.26Å; F241-F253 HydrophobicContact CD2-CB 4.23Å; F241-F253 HydrophobicContact CD2-CD2 4.22Å; F241-F253 HydrophobicContact CE1-CB 3.72Å; F241-F253 HydrophobicContact CE2-CB 3.67Å; F241-F253 AromaticContact CE2-CD2 3.51Å; F241-F253 HydrophobicContact CE2-CD2 3.51Å; F241-F253 HydrophobicContact CE2-CE2 4.4Å; F241-F253 AromaticContact CE2-CG 3.81Å; F241-F253 HydrophobicContact CE2-CG 3.81Å; F241-F253 HydrophobicContact CG-CB 4.49Å; F241-F253 HydrophobicContact CZ-CB 3.39Å; F241-F253 AromaticContact CZ-CD2 3.98Å; F241-F253 HydrophobicContact CZ-CD2 3.98Å; F241-F253 AromaticContact CZ-CG 3.79Å; F241-F253 HydrophobicContact CZ-CG 3.79Å; F241-F253 PolarHBondContact N-O 3.49Å; F241-F253 PolarHBondContact O-N 2.9Å; T243-F253 HydrophobicContact CG2-CD2 4.04Å; T243-F253 HydrophobicContact CG2-CE2 3.96Å; R251-F253 HydrophobicContact CB-CD2 4.2Å; R251-F253 HydrophobicContact CB-CE2 3.53Å; R251-F253 HydrophobicContact CB-CZ 4.01Å; F253-E260 HydrophobicContact CD1-CB 3.92Å; F253-E260 HydrophobicContact CE1-CB 3.7Å; F253-E260 HydrophobicContact CZ-CB 4.26Å
254	D	98.4	Very high	97.8	Very high	18 Å²	18	35.5 Å²	35.5	10%	0.096	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.5	172.4	178.1	-73.8	0	0	0	110.7	R256 A257 D258 Q259 L261	D254-R256 VanDerWaalsContact C-N 3.33Å; D254-R256 PolarHBondContact O-N 3.17Å; D254-R256 WeakPolarHBondContact OD1-CA 3.13Å; D254-R256 WeakPolarHBondContact OD1-CB 3.41Å; D254-R256 PolarHBondContact OD1-N 3.27Å; D254-R256 IonicContact OD1-NE 3.96Å; D254-R256 IonicContact OD2-NH2 3.78Å; D254-A257 HydrophobicContact CB-CB 4Å; D254-A257 PolarHBondContact OD1-N 3.36Å; D254-D258 PolarHBondContact O-N 3.05Å; D254-Q259 PolarHBondContact N-O 2.8Å; D254-L261 HydrophobicContact CB-CD1 3.56Å; D254-L261 HydrophobicContact CB-CD2 4.1Å; D254-L261 HydrophobicContact CB-CG 3.75Å
255	L	98	Very high	97.7	Very high	26 Å²	26	38.2 Å²	38.2	14%	0.136	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.3	-174.5	-60.4	-174.4	0	0	0	112.8	L210 Q220 F222 F234 G238 S239 F241	L210-L255 HydrophobicContact CD1-CD1 4.39Å; L210-L255 HydrophobicContact CD1-CD2 4.26Å; L210-L255 HydrophobicContact CD2-CD1 4.3Å; L210-L255 HydrophobicContact CD2-CD2 4.08Å; Q220-L255 PolarHBondContact NE2-O 2.89Å; Q220-L255 PolarHBondContact OE1-O 3.04Å; F222-L255 HydrophobicContact CE2-CD2 4.09Å; F222-L255 HydrophobicContact CZ-CD2 3.63Å; F234-L255 HydrophobicContact CE1-CD1 4.35Å; G238-L255 WeakPolarHBondContact O-CD1 3.46Å; S239-L255 WeakPolarHBondContact O-CG 3.4Å; S239-L255 PolarHBondContact O-N 2.95Å; F241-L255 HydrophobicContact CD1-CD2 3.8Å; F241-L255 HydrophobicContact CE1-CD2 3.63Å
256	R	97.8	Very high	97.4	Very high	204 Å²	204	41.6 Å²	41.6	77%	0.77	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-33.8	-178.7	-59.4	173.9	-64.4	167.7	2.9	111.2	D254 D258	D254-R256 VanDerWaalsContact C-N 3.33Å; D254-R256 PolarHBondContact O-N 3.17Å; D254-R256 WeakPolarHBondContact OD1-CA 3.13Å; D254-R256 WeakPolarHBondContact OD1-CB 3.41Å; D254-R256 PolarHBondContact OD1-N 3.27Å; D254-R256 IonicContact OD1-NE 3.96Å; D254-R256 IonicContact OD2-NH2 3.78Å; R256-D258 VanDerWaalsContact C-N 3.27Å
257	A	96.9	Very high	96.9	Very high	31 Å²	31	45.9 Å²	45.9	26%	0.256	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-23.1	173.4	0	0	0	0	0	112.3	D254 Q259 L261	D254-A257 HydrophobicContact CB-CB 4Å; D254-A257 PolarHBondContact OD1-N 3.36Å; A257-Q259 HydrophobicContact CB-CG 4.05Å; A257-Q259 WeakPolarHBondContact O-CG 3.12Å; A257-Q259 PolarHBondContact O-N 3.44Å; A257-L261 HydrophobicContact CB-CD2 4.28Å
258	D	98	Very high	96.5	Very high	37 Å²	37	50.9 Å²	50.9	20%	0.198	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	25.5	-175.6	-167.5	59.4	0	0	0	113.1	R22 Q220 D254 R256	R22-D258 WeakPolarHBondContact CD-O 3.43Å; R22-D258 VanDerWaalsContact CZ-O 3.27Å; R22-D258 IonicContact CZ-OD2 3.73Å; R22-D258 VanDerWaalsContact CZ-OD2 3.23Å; R22-D258 PolarHBondContact NE-O 3.42Å; R22-D258 IonicContact NE-OD2 2.69Å; R22-D258 PolarHBondContact NE-OD2 3.26Å; R22-D258 PolarHBondContact NH2-O 3.24Å; R22-D258 IonicContact NH2-OD1 3.51Å; R22-D258 IonicContact NH2-OD2 3.44Å; R22-D258 PolarHBondContact NH2-OD2 2.85Å; Q220-D258 WeakPolarHBondContact CG-OD1 3.41Å; Q220-D258 PolarHBondContact NE2-OD1 2.91Å; D254-D258 PolarHBondContact O-N 3.05Å; R256-D258 VanDerWaalsContact C-N 3.27Å
259	Q	96.3	Very high	96.2	Very high	43 Å²	43	51.2 Å²	51.2	20%	0.201	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	173.4	-176.8	66.4	-172.3	-20	0	0	111.9	R22 D254 A257	R22-Q259 PolarHBondContact O-NE2 2.85Å; R22-Q259 PolarHBondContact O-OE1 2.89Å; D254-Q259 PolarHBondContact N-O 2.8Å; A257-Q259 HydrophobicContact CB-CG 4.05Å; A257-Q259 WeakPolarHBondContact O-CG 3.12Å; A257-Q259 PolarHBondContact O-N 3.44Å
260	E	97	Very high	96	Very high	82 Å²	82	57.8 Å²	57.8	38%	0.383	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	139.7	175.2	67.6	-177.6	-175.7	0	0	111.5	R251 L252 F253	R251-E260 VanDerWaalsContact CD-OE2 3.31Å; R251-E260 WeakPolarHBondContact CD-OE2 3.47Å; R251-E260 IonicContact CZ-OE2 3.35Å; R251-E260 IonicContact NE-OE2 3.58Å; R251-E260 IonicContact NH1-OE1 3.88Å; R251-E260 IonicContact NH1-OE2 2.94Å; R251-E260 PolarHBondContact NH1-OE2 2.93Å; L252-E260 CarbonylContact O-C 3.54Å; L252-E260 WeakPolarHBondContact O-CA 3.35Å; F253-E260 HydrophobicContact CD1-CB 3.92Å; F253-E260 HydrophobicContact CE1-CB 3.7Å; F253-E260 HydrophobicContact CZ-CB 4.26Å
261	L	96.9	Very high	95.9	Very high	60 Å²	60	59.1 Å²	59.1	31%	0.314	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-32.2	173.4	-65.5	-171.2	0	0	0	112.6	L252 D254 A257	L252-L261 HydrophobicContact CD2-CB 4.49Å; L252-L261 HydrophobicContact CG-CB 4.35Å; L252-L261 PolarHBondContact O-N 3.26Å; D254-L261 HydrophobicContact CB-CD1 3.56Å; D254-L261 HydrophobicContact CB-CD2 4.1Å; D254-L261 HydrophobicContact CB-CG 3.75Å; A257-L261 HydrophobicContact CB-CD2 4.28Å
262	S	96.6	Very high	95.8	Very high	11 Å²	11	58.5 Å²	58.5	8%	0.077	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	146.5	-175.6	-71.1	0	0	0	0	112.5	L30 R251 L252	L30-S262 VanDerWaalsContact CB-OG 3.29Å; L30-S262 WeakPolarHBondContact CB-OG 3.45Å; L30-S262 VanDerWaalsContact CD2-OG 3.29Å; L30-S262 WeakPolarHBondContact CD2-OG 3.38Å; R251-S262 WeakPolarHBondContact CA-O 3.25Å; L252-S262 PolarHBondContact N-O 3.13Å; L252-S262 PolarHBondContact O-N 3.4Å
263	L	97.1	Very high	95.8	Very high	81 Å²	81	58 Å²	58	42%	0.424	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.9	173.7	-178.6	70.9	0	0	0	108.5	T249 R251	T249-L263 HydrophobicContact CG2-CD1 3.96Å; R251-L263 HydrophobicContact CG-CD1 3.63Å
264	Y	97.4	Very high	95.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	107.7	174.2	-46.4	-90.5	0	0	0	108.4	C250 L252 L285 W297 A299	C250-Y264 HydrophobicContact CB-CD2 3.91Å; C250-Y264 HydrophobicContact CB-CG 4.42Å; C250-Y264 PolarHBondContact N-O 2.95Å; C250-Y264 WeakPolarHBondContact O-CD2 3.25Å; C250-Y264 PolarHBondContact O-N 3.11Å; L252-Y264 HydrophobicContact CB-CE2 3.92Å; Y264-L285 HydrophobicContact CD2-CD2 3.66Å; Y264-L285 HydrophobicContact CE2-CD2 3.64Å; Y264-L285 HydrophobicContact CG-CD2 4.19Å; Y264-W297 HydrophobicContact CD1-CB 3.95Å; Y264-W297 HydrophobicContact CD1-CD2 4.48Å; Y264-W297 HydrophobicContact CD1-CE3 4.4Å; Y264-W297 HydrophobicContact CD1-CG 4.33Å; Y264-W297 HydrophobicContact CE1-CB 4.5Å; Y264-W297 HydrophobicContact CG-CB 4.49Å; Y264-W297 HydrophobicContact CG-CG 4.48Å; Y264-A299 WeakPolarHBondContact OH-CA 3.35Å; Y264-A299 PolarHBondContact OH-O 2.96Å
265	S	95.3	Very high	95.8	Very high	56 Å²	56	58.5 Å²	58.5	39%	0.392	30%	0.303	S	S	.	.			trans	-147.2	164.3	-179.4	63.7	0	0	0	0	110.1
266	H	92.5	Very high	95.8	Very high	71 Å²	71	57.9 Å²	57.9	33%	0.329	30%	0.301	S	S	.	.			trans	-151	138.5	173.7	-171.1	66.9	0	0	0	109.2	N268 I269 W297	H266-N268 PolarHBondContact NE2-ND2 3.28Å; H266-N268 PolarHBondContact O-N 3.05Å; H266-I269 HydrophobicContact CB-CD1 3.82Å; H266-I269 HydrophobicContact CB-CG1 4.02Å; H266-I269 PolarHBondContact O-N 3.42Å; H266-W297 HydrophobicContact CB-CH2 4.06Å
267	D	87.8	Confident	95.9	Very high	154 Å²	154	48.6 Å²	48.6	82%	0.824	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-26	-171.2	-57.6	-24.5	0	0	0	114.4
268	N	89.8	Confident	95.9	Very high	136 Å²	136	47.8 Å²	47.8	73%	0.727	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-7.3	178.2	-60.7	-50.8	0	0	0	113.7	H266	H266-N268 PolarHBondContact NE2-ND2 3.28Å; H266-N268 PolarHBondContact O-N 3.05Å
269	I	91.8	Very high	96	Very high	16 Å²	16	46.8 Å²	46.8	8%	0.082	25%	0.254	C	S	.	.			trans	-101.8	105.2	-179.2	-56.8	176.7	0	0	0	107.6	A248 H266 Y289 W297	A248-I269 HydrophobicContact CB-CG2 4.48Å; A248-I269 WeakPolarHBondContact CB-O 3.27Å; H266-I269 HydrophobicContact CB-CD1 3.82Å; H266-I269 HydrophobicContact CB-CG1 4.02Å; H266-I269 PolarHBondContact O-N 3.42Å; I269-Y289 HydrophobicContact CG2-CD1 3.69Å; I269-Y289 HydrophobicContact CG2-CE1 3.49Å; I269-Y289 VanDerWaalsContact CG2-CE1 3.49Å; I269-W297 HydrophobicContact CD1-CH2 4.22Å; I269-W297 HydrophobicContact CD1-CZ2 3.97Å
270	I	93.9	Very high	96	Very high	156 Å²	156	52 Å²	52	80%	0.8	27%	0.272	S	S	*	.			trans	-116.9	6.6	180	59.7	168.6	0	0	0	112.6
271	C	95.9	Very high	96	Very high	28 Å²	28	52.3 Å²	52.3	19%	0.189	28%	0.283	C	S	.	.	S	Bend	trans	-102.7	151.4	-175.9	68	0	0	0	0	110.9	A248 D290 D291	A248-C271 WeakPolarHBondContact CA-O 3.36Å; A248-C271 VanDerWaalsContact CB-O 3.24Å; A248-C271 WeakPolarHBondContact CB-O 3.18Å; C271-D290 HydrophobicContact CB-CB 4.05Å; C271-D291 VanDerWaalsContact SG-CB 3.59Å
272	G	96.9	Very high	96.1	Very high	8 Å²	8	49.5 Å²	49.5	8%	0.082	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-65.2	152.8	-178	0	0	0	0	0	113.2	D290	G272-D290 PolarHBondContact O-N 3.21Å
273	I	98.6	Very high	96.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.7	174.3	-64.7	144.1	0	0	0	108.7	N230 S245 T249 C250 V276 A287 G288 Y289	N230-I273 VanDerWaalsContact CB-O 3.28Å; N230-I273 WeakPolarHBondContact CB-O 3.3Å; N230-I273 PolarHBondContact ND2-O 3.44Å; S245-I273 PolarHBondContact O-N 2.97Å; T249-I273 WeakPolarHBondContact O-CD1 3.24Å; C250-I273 HydrophobicContact CB-CD1 4.49Å; C250-I273 WeakPolarHBondContact SG-CD1 3.49Å; I273-V276 HydrophobicContact CG2-CG1 3.81Å; I273-A287 HydrophobicContact CG2-CB 4.23Å; I273-G288 WeakPolarHBondContact CA-O 3.46Å; I273-Y289 HydrophobicContact CD1-CE1 3.87Å; I273-Y289 HydrophobicContact CG1-CD1 3.65Å; I273-Y289 HydrophobicContact CG1-CE1 3.22Å; I273-Y289 HydrophobicContact CG1-CE2 4.4Å; I273-Y289 HydrophobicContact CG1-CG 4.4Å
274	T	98.6	Very high	96.2	Very high	19 Å²	19	49.2 Å²	49.2	12%	0.117	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-28.1	-177	62.4	0	0	0	0	113.4	G288 D290 R314 V315	T274-G288 PolarHBondContact N-O 2.84Å; T274-G288 PolarHBondContact OG1-O 3.3Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.37Å; T274-R314 VanDerWaalsContact CG2-NH2 3.35Å; T274-V315 VanDerWaalsContact CB-O 3.3Å; T274-V315 WeakPolarHBondContact CB-O 3.43Å; T274-V315 VanDerWaalsContact CG2-O 3.27Å; T274-V315 WeakPolarHBondContact CG2-O 3.34Å; T274-V315 PolarHBondContact OG1-O 3.19Å
275	S	98.4	Very high	96.2	Very high	10 Å²	10	49.2 Å²	49.2	7%	0.07	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	144.7	-169.5	51.6	0	0	0	0	110.9	A231 A287 G288 L318	A231-S275 VanDerWaalsContact CB-CA 3.5Å; S275-A287 CarbonylContact O-C 3.6Å; S275-A287 VanDerWaalsContact O-CA 3.3Å; S275-A287 WeakPolarHBondContact O-CA 3.39Å; S275-G288 PolarHBondContact O-N 2.88Å; S275-L318 WeakPolarHBondContact OG-CD2 3.35Å; S275-L318 PolarHBondContact OG-N 3.47Å
276	V	98.7	Very high	96.4	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.079	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	144.5	178.5	-63.3	0	0	0	0	110.5	A231 C233 I273 L285 L286 A287	A231-V276 HydrophobicContact CB-CG1 4.42Å; A231-V276 HydrophobicContact CB-CG2 3.9Å; C233-V276 HydrophobicContact CB-CG2 3.88Å; C233-V276 WeakPolarHBondContact CB-O 3.28Å; I273-V276 HydrophobicContact CG2-CG1 3.81Å; V276-L285 HydrophobicContact CB-CD1 4.3Å; V276-L286 CarbonylContact C-O 3.57Å; V276-L286 VanDerWaalsContact CA-O 3.29Å; V276-L286 WeakPolarHBondContact CA-O 3.16Å; V276-A287 HydrophobicContact CG1-CB 4.13Å
277	A	98.6	Very high	96.7	Very high	9 Å²	9	43.4 Å²	43.4	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	147.5	170.9	0	0	0	0	0	111.9	L286 L318 V320	A277-L286 PolarHBondContact N-O 3.18Å; A277-L286 PolarHBondContact O-N 2.72Å; A277-L318 HydrophobicContact CB-CD1 3.29Å; A277-V320 HydrophobicContact CB-CG2 4.08Å
278	F	98.7	Very high	97.2	Very high	13 Å²	13	36 Å²	36	6%	0.057	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	146.1	171.2	-77	-74.5	0	0	0	112.1	F235 P236 A242 L252 L285 A299 V320	F235-F278 HydrophobicContact CB-CD2 4.39Å; F235-F278 HydrophobicContact CB-CE2 4.13Å; F235-F278 AromaticContact CD2-CD1 3.92Å; F235-F278 HydrophobicContact CD2-CD1 3.92Å; F235-F278 HydrophobicContact CD2-CD2 4.18Å; F235-F278 AromaticContact CD2-CE1 3.68Å; F235-F278 HydrophobicContact CD2-CE1 3.68Å; F235-F278 AromaticContact CD2-CE2 3.94Å; F235-F278 HydrophobicContact CD2-CE2 3.94Å; F235-F278 HydrophobicContact CD2-CG 4.15Å; F235-F278 AromaticContact CD2-CZ 3.68Å; F235-F278 HydrophobicContact CD2-CZ 3.68Å; F235-F278 HydrophobicContact CE2-CD1 4.18Å; F235-F278 HydrophobicContact CE2-CE1 4.04Å; F235-F278 HydrophobicContact CE2-CZ 4.47Å; P236-F278 HydrophobicContact CG-CB 4.25Å; A242-F278 HydrophobicContact CB-CD2 4.45Å; A242-F278 HydrophobicContact CB-CE2 3.4Å; A242-F278 VanDerWaalsContact CB-CE2 3.4Å; A242-F278 HydrophobicContact CB-CZ 3.5Å; A242-F278 VanDerWaalsContact CB-CZ 3.5Å; L252-F278 HydrophobicContact CD1-CZ 4.01Å; F278-L285 HydrophobicContact CD1-CB 4.28Å; F278-L285 HydrophobicContact CD1-CD1 4.32Å; F278-L285 HydrophobicContact CE1-CB 4Å; F278-L285 HydrophobicContact CE1-CD1 4.06Å; F278-L285 HydrophobicContact CE2-CD1 4.39Å; F278-L285 HydrophobicContact CZ-CD1 4.1Å; F278-A299 HydrophobicContact CE1-CB 4.22Å; F278-V320 WeakPolarHBondContact O-CG2 3.04Å
279	S	98.4	Very high	97.6	Very high	17 Å²	17	29.6 Å²	29.6	12%	0.119	16%	0.155	C	C	.	.			trans	-62.2	161.6	157.5	57.6	0	0	0	0	111.5	S281 G282 R283 L284	S279-S281 PolarHBondContact O-N 2.9Å; S279-S281 VanDerWaalsContact O-N 3.12Å; S279-G282 WeakPolarHBondContact O-CA 3.5Å; S279-G282 PolarHBondContact O-N 2.77Å; S279-R283 PolarHBondContact OG-N 3.37Å; S279-L284 PolarHBondContact N-O 2.77Å; S279-L284 WeakPolarHBondContact OG-CA 3.42Å; S279-L284 WeakPolarHBondContact OG-CB 3.48Å; S279-L284 PolarHBondContact OG-N 3.18Å; S279-L284 PolarHBondContact OG-O 3.38Å
280	R	97.5	Very high	97.9	Very high	153 Å²	153	31 Å²	31	58%	0.577	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-36.4	-176.8	-173.5	63.2	176.1	97.1	-5.6	114.8	D322	R280-D322 WeakPolarHBondContact CD-O 3.22Å; R280-D322 PolarHBondContact NE-O 2.82Å
281	S	97.6	Very high	98.1	Very high	88 Å²	88	26.4 Å²	26.4	62%	0.615	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-13.7	177.7	63.7	0	0	0	0	113.4	S279 R283	S279-S281 PolarHBondContact O-N 2.9Å; S279-S281 VanDerWaalsContact O-N 3.12Å; S281-R283 PolarHBondContact O-N 3.36Å; S281-R283 WeakPolarHBondContact OG-CB 3.24Å; S281-R283 PolarHBondContact OG-N 2.54Å
282	G	97.3	Very high	98.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	76.5	0	-170.6	0	0	0	0	0	114.5	F235 S279 A299	F235-G282 VanDerWaalsContact CE2-CA 3.47Å; F235-G282 WeakPolarHBondContact CE2-O 3.29Å; S279-G282 WeakPolarHBondContact O-CA 3.5Å; S279-G282 PolarHBondContact O-N 2.77Å; G282-A299 VanDerWaalsContact O-CB 3.25Å; G282-A299 WeakPolarHBondContact O-CB 3.28Å
283	R	97.6	Very high	98.2	Very high	60 Å²	60	31 Å²	31	23%	0.226	16%	0.157	C	C	.	.	S	Bend	trans	-69.6	-34	-179.1	-177.1	59.6	-175.2	-89.2	-0.2	112.9	D38 V40 S279 S281 D298 A299	D38-R283 PolarHBondContact O-NH2 3.02Å; V40-R283 HydrophobicContact CG1-CG 3.56Å; S279-R283 PolarHBondContact OG-N 3.37Å; S281-R283 PolarHBondContact O-N 3.36Å; S281-R283 WeakPolarHBondContact OG-CB 3.24Å; S281-R283 PolarHBondContact OG-N 2.54Å; R283-D298 IonicContact CZ-OD1 2.62Å; R283-D298 IonicContact CZ-OD2 3.98Å; R283-D298 IonicContact NE-OD1 3.8Å; R283-D298 PolarHBondContact NE-OD1 2.7Å; R283-D298 IonicContact NE-OD2 3.51Å; R283-D298 PolarHBondContact NE-OD2 2.68Å; R283-D298 IonicContact NH2-OD1 3.35Å; R283-D298 IonicContact NH2-OD2 2.77Å; R283-D298 PolarHBondContact NH2-OD2 3.06Å; R283-A299 WeakPolarHBondContact O-CB 3.36Å; R283-A299 PolarHBondContact O-N 2.63Å
284	L	98.4	Very high	98.2	Very high	27 Å²	27	31.1 Å²	31.1	14%	0.141	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.2	175.3	-50.4	177.2	0	0	0	110.4	V40 I43 S279 L286 I296 W297	V40-L284 HydrophobicContact CG1-CD2 4.27Å; V40-L284 HydrophobicContact CG2-CD2 4.25Å; I43-L284 HydrophobicContact CG1-CD2 4.4Å; S279-L284 PolarHBondContact N-O 2.77Å; S279-L284 WeakPolarHBondContact OG-CA 3.42Å; S279-L284 WeakPolarHBondContact OG-CB 3.48Å; S279-L284 PolarHBondContact OG-N 3.18Å; S279-L284 PolarHBondContact OG-O 3.38Å; L284-L286 HydrophobicContact CB-CD1 4.39Å; L284-I296 HydrophobicContact CB-CG2 4.01Å; L284-I296 HydrophobicContact CD1-CG2 4.08Å; L284-I296 HydrophobicContact CD2-CG2 4Å; L284-I296 HydrophobicContact CG-CG2 4.26Å; L284-W297 WeakPolarHBondContact CA-O 3.45Å
285	L	98.7	Very high	98.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.8	165.7	171.5	64.5	0	0	0	108.1	A242 C250 Y264 V276 F278 W297	A242-L285 HydrophobicContact CB-CD1 3.7Å; A242-L285 HydrophobicContact CB-CD2 4.2Å; C250-L285 HydrophobicContact CB-CD2 4.03Å; Y264-L285 HydrophobicContact CD2-CD2 3.66Å; Y264-L285 HydrophobicContact CE2-CD2 3.64Å; Y264-L285 HydrophobicContact CG-CD2 4.19Å; V276-L285 HydrophobicContact CB-CD1 4.3Å; F278-L285 HydrophobicContact CD1-CB 4.28Å; F278-L285 HydrophobicContact CD1-CD1 4.32Å; F278-L285 HydrophobicContact CE1-CB 4Å; F278-L285 HydrophobicContact CE1-CD1 4.06Å; F278-L285 HydrophobicContact CE2-CD1 4.39Å; F278-L285 HydrophobicContact CZ-CD1 4.1Å; L285-W297 HydrophobicContact CB-CB 4.25Å; L285-W297 PolarHBondContact N-O 2.92Å; L285-W297 PolarHBondContact O-N 3.39Å
286	L	98.8	Very high	98.1	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132	175.9	-61.9	96.2	0	0	0	108.9	V276 A277 L284 N295 I296 L308 L318 V320 V327	V276-L286 CarbonylContact C-O 3.57Å; V276-L286 VanDerWaalsContact CA-O 3.29Å; V276-L286 WeakPolarHBondContact CA-O 3.16Å; A277-L286 PolarHBondContact N-O 3.18Å; A277-L286 PolarHBondContact O-N 2.72Å; L284-L286 HydrophobicContact CB-CD1 4.39Å; L286-N295 WeakPolarHBondContact CA-O 3.39Å; L286-I296 HydrophobicContact CD2-CD1 4.4Å; L286-I296 HydrophobicContact CD2-CG1 4.04Å; L286-I296 HydrophobicContact CG-CG1 4.28Å; L286-L308 HydrophobicContact CD2-CD1 4.2Å; L286-L318 HydrophobicContact CB-CD1 4.25Å; L286-V320 HydrophobicContact CD1-CG2 3.89Å; L286-V327 HydrophobicContact CD2-CB 4.24Å; L286-V327 HydrophobicContact CD2-CG1 4.06Å; L286-V327 HydrophobicContact CD2-CG2 3.92Å
287	A	98.8	Very high	98.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	130.5	179.5	0	0	0	0	0	110.6	C250 I273 S275 V276 Y289 C294 N295	C250-A287 VanDerWaalsContact SG-CB 3.56Å; I273-A287 HydrophobicContact CG2-CB 4.23Å; S275-A287 CarbonylContact O-C 3.6Å; S275-A287 VanDerWaalsContact O-CA 3.3Å; S275-A287 WeakPolarHBondContact O-CA 3.39Å; V276-A287 HydrophobicContact CG1-CB 4.13Å; A287-Y289 HydrophobicContact CB-CD2 4.39Å; A287-Y289 HydrophobicContact CB-CE2 3.54Å; A287-Y289 VanDerWaalsContact O-CD2 3.22Å; A287-Y289 WeakPolarHBondContact O-CD2 3.44Å; A287-Y289 VanDerWaalsContact O-CE2 3.27Å; A287-Y289 WeakPolarHBondContact O-CE2 3.37Å; A287-C294 CarbonylContact O-C 3.55Å; A287-C294 WeakPolarHBondContact O-CA 3.42Å; A287-C294 PolarHBondContact O-SG 2.76Å; A287-N295 PolarHBondContact N-O 2.78Å; A287-N295 PolarHBondContact O-N 2.88Å
288	G	98.5	Very high	98.1	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	136.4	176.7	0	0	0	0	0	110.3	I273 T274 S275	I273-G288 WeakPolarHBondContact CA-O 3.46Å; T274-G288 PolarHBondContact N-O 2.84Å; T274-G288 PolarHBondContact OG1-O 3.3Å; S275-G288 PolarHBondContact O-N 2.88Å
289	Y	98.5	Very high	98	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	160.8	-171	-71.1	-98.7	0	0	0	112	I269 I273 A287 D291 F292 N293 N295 W297 V315	I269-Y289 HydrophobicContact CG2-CD1 3.69Å; I269-Y289 HydrophobicContact CG2-CE1 3.49Å; I269-Y289 VanDerWaalsContact CG2-CE1 3.49Å; I273-Y289 HydrophobicContact CD1-CE1 3.87Å; I273-Y289 HydrophobicContact CG1-CD1 3.65Å; I273-Y289 HydrophobicContact CG1-CE1 3.22Å; I273-Y289 HydrophobicContact CG1-CE2 4.4Å; I273-Y289 HydrophobicContact CG1-CG 4.4Å; A287-Y289 HydrophobicContact CB-CD2 4.39Å; A287-Y289 HydrophobicContact CB-CE2 3.54Å; A287-Y289 VanDerWaalsContact O-CD2 3.22Å; A287-Y289 WeakPolarHBondContact O-CD2 3.44Å; A287-Y289 VanDerWaalsContact O-CE2 3.27Å; A287-Y289 WeakPolarHBondContact O-CE2 3.37Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.39Å; Y289-D291 PolarHBondContact O-N 3.34Å; Y289-F292 PolarHBondContact O-N 3.41Å; Y289-N293 PolarHBondContact N-O 2.93Å; Y289-N295 HydrophobicContact CD2-CB 4.36Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.27Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.46Å; Y289-N295 HydrophobicContact CE2-CB 3.72Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.43Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.32Å; Y289-W297 PolarHBondContact OH-NE1 2.88Å; Y289-W297 VanDerWaalsContact OH-NE1 3.08Å; Y289-V315 PolarHBondContact O-N 3.22Å
290	D	97.7	Very high	97.8	Very high	47 Å²	47	30.1 Å²	30.1	25%	0.251	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.6	175.8	-79.1	-9.8	0	0	0	114.3	C271 G272 T274 F292 R314	C271-D290 HydrophobicContact CB-CB 4.05Å; G272-D290 PolarHBondContact O-N 3.21Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.37Å; D290-F292 WeakPolarHBondContact O-CD1 3.35Å; D290-F292 WeakPolarHBondContact O-CE1 3.24Å; D290-F292 PolarHBondContact O-N 3.26Å; D290-R314 VanDerWaalsContact CG-NH2 3.32Å; D290-R314 IonicContact OD1-CZ 2.8Å; D290-R314 IonicContact OD1-NE 3.49Å; D290-R314 PolarHBondContact OD1-NE 2.89Å; D290-R314 IonicContact OD1-NH2 3.97Å; D290-R314 PolarHBondContact OD1-NH2 2.59Å; D290-R314 IonicContact OD2-CZ 3.69Å; D290-R314 IonicContact OD2-NH2 3.34Å; D290-R314 PolarHBondContact OD2-NH2 3.17Å
291	D	97	Very high	97.6	Very high	59 Å²	59	24.6 Å²	24.6	32%	0.316	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	12.4	172	77.1	-17.2	0	0	0	114.1	C271 Y289 N293	C271-D291 VanDerWaalsContact SG-CB 3.59Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.39Å; Y289-D291 PolarHBondContact O-N 3.34Å; D291-N293 PolarHBondContact O-N 2.81Å; D291-N293 PolarHBondContact O-ND2 3.38Å; D291-N293 WeakPolarHBondContact OD1-CB 3.49Å; D291-N293 PolarHBondContact OD1-N 3.5Å; D291-N293 PolarHBondContact OD2-ND2 2.77Å; D291-N293 VanDerWaalsContact OD2-ND2 3.13Å
292	F	97.8	Very high	97.4	Very high	90 Å²	90	21.2 Å²	21.2	40%	0.395	11%	0.106	S	C	.	.	S	Bend	trans	77.4	-2.3	176.7	-38.3	-23.2	0	0	0	114.1	Y289 D290 N313 R314 V315	Y289-F292 PolarHBondContact O-N 3.41Å; D290-F292 WeakPolarHBondContact O-CD1 3.35Å; D290-F292 WeakPolarHBondContact O-CE1 3.24Å; D290-F292 PolarHBondContact O-N 3.26Å; F292-N313 WeakPolarHBondContact CB-O 3.42Å; F292-R314 HydrophobicContact CD1-CB 4.35Å; F292-V315 WeakPolarHBondContact O-CG2 3.35Å
293	N	97.5	Very high	97.2	Very high	43 Å²	43	26 Å²	26	23%	0.23	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	161.8	-179.9	-60.1	-54.7	0	0	0	111.7	Y289 D291 V307 A309	Y289-N293 PolarHBondContact N-O 2.93Å; D291-N293 PolarHBondContact O-N 2.81Å; D291-N293 PolarHBondContact O-ND2 3.38Å; D291-N293 WeakPolarHBondContact OD1-CB 3.49Å; D291-N293 PolarHBondContact OD1-N 3.5Å; D291-N293 PolarHBondContact OD2-ND2 2.77Å; D291-N293 VanDerWaalsContact OD2-ND2 3.13Å; N293-V307 HydrophobicContact CB-CG1 4.1Å; N293-A309 WeakPolarHBondContact OD1-CB 2.98Å
294	C	98.3	Very high	97.2	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.2	162.1	167.7	0	0	0	0	109.1	A287 V307 L308 T329	A287-C294 CarbonylContact O-C 3.55Å; A287-C294 WeakPolarHBondContact O-CA 3.42Å; A287-C294 PolarHBondContact O-SG 2.76Å; C294-V307 CarbonylContact O-C 3.56Å; C294-V307 WeakPolarHBondContact O-CA 3.45Å; C294-L308 HydrophobicContact CB-CB 4.05Å; C294-L308 HydrophobicContact CB-CD1 4.41Å; C294-L308 PolarHBondContact N-O 3.16Å; C294-L308 VanDerWaalsContact N-O 3.11Å; C294-L308 PolarHBondContact O-N 3.32Å; C294-T329 HydrophobicContact CB-CG2 4.48Å
295	N	98.3	Very high	97.1	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	142.5	176.7	-64.8	-67.7	0	0	0	109.9	L286 A287 Y289 W297 R304	L286-N295 WeakPolarHBondContact CA-O 3.39Å; A287-N295 PolarHBondContact N-O 2.78Å; A287-N295 PolarHBondContact O-N 2.88Å; Y289-N295 HydrophobicContact CD2-CB 4.36Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.27Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.46Å; Y289-N295 HydrophobicContact CE2-CB 3.72Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.43Å; N295-W297 HydrophobicContact CB-CZ2 4.34Å; N295-R304 HydrophobicContact CB-CG 4.49Å; N295-R304 WeakPolarHBondContact OD1-CD 3.4Å; N295-R304 PolarHBondContact OD1-NH1 2.85Å; N295-R304 VanDerWaalsContact OD1-NH1 3.17Å
296	I	98.4	Very high	97	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.9	173.6	-53.8	175.7	0	0	0	107.2	I43 M45 L284 L286 R304 A305 G306 L308	I43-I296 HydrophobicContact CB-CD1 4.32Å; I43-I296 HydrophobicContact CG2-CD1 3.73Å; M45-I296 HydrophobicContact CG-CD1 4.37Å; M45-I296 HydrophobicContact SD-CD1 3.95Å; L284-I296 HydrophobicContact CB-CG2 4.01Å; L284-I296 HydrophobicContact CD1-CG2 4.08Å; L284-I296 HydrophobicContact CD2-CG2 4Å; L284-I296 HydrophobicContact CG-CG2 4.26Å; L286-I296 HydrophobicContact CD2-CD1 4.4Å; L286-I296 HydrophobicContact CD2-CG1 4.04Å; L286-I296 HydrophobicContact CG-CG1 4.28Å; I296-R304 CarbonylContact O-C 3.58Å; I296-A305 HydrophobicContact CG2-CB 4.46Å; I296-A305 PolarHBondContact O-N 2.84Å; I296-G306 PolarHBondContact N-O 3.32Å; I296-G306 PolarHBondContact O-N 3.09Å; I296-G306 VanDerWaalsContact O-N 3.16Å; I296-L308 HydrophobicContact CD1-CD1 4.48Å; I296-L308 HydrophobicContact CD1-CD2 3.9Å; I296-L308 HydrophobicContact CD1-CG 4.04Å; I296-L308 HydrophobicContact CG1-CG 4.28Å
297	W	98.4	Very high	97	Very high	3 Å²	3	30.7 Å²	30.7	1%	0.011	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	140.7	-180	-58.8	97	0	0	0	110.6	Y264 H266 I269 L284 L285 Y289 N295 A299 R304	Y264-W297 HydrophobicContact CD1-CB 3.95Å; Y264-W297 HydrophobicContact CD1-CD2 4.48Å; Y264-W297 HydrophobicContact CD1-CE3 4.4Å; Y264-W297 HydrophobicContact CD1-CG 4.33Å; Y264-W297 HydrophobicContact CE1-CB 4.5Å; Y264-W297 HydrophobicContact CG-CB 4.49Å; Y264-W297 HydrophobicContact CG-CG 4.48Å; H266-W297 HydrophobicContact CB-CH2 4.06Å; I269-W297 HydrophobicContact CD1-CH2 4.22Å; I269-W297 HydrophobicContact CD1-CZ2 3.97Å; L284-W297 WeakPolarHBondContact CA-O 3.45Å; L285-W297 HydrophobicContact CB-CB 4.25Å; L285-W297 PolarHBondContact N-O 2.92Å; L285-W297 PolarHBondContact O-N 3.39Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.32Å; Y289-W297 PolarHBondContact OH-NE1 2.88Å; Y289-W297 VanDerWaalsContact OH-NE1 3.08Å; N295-W297 HydrophobicContact CB-CZ2 4.34Å; W297-A299 PolarHBondContact O-N 2.83Å; W297-R304 HydrophobicContact CE3-CB 4Å; W297-R304 HydrophobicContact CH2-CB 4.43Å; W297-R304 HydrophobicContact CZ3-CB 3.93Å
298	D	97.8	Very high	97	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	108.1	164.4	-174.5	-25.7	0	0	0	108.2	V40 R283 M300 K301 G302 D303	V40-D298 HydrophobicContact CG2-CB 4.1Å; R283-D298 IonicContact CZ-OD1 2.62Å; R283-D298 IonicContact CZ-OD2 3.98Å; R283-D298 IonicContact NE-OD1 3.8Å; R283-D298 PolarHBondContact NE-OD1 2.7Å; R283-D298 IonicContact NE-OD2 3.51Å; R283-D298 PolarHBondContact NE-OD2 2.68Å; R283-D298 IonicContact NH2-OD1 3.35Å; R283-D298 IonicContact NH2-OD2 2.77Å; R283-D298 PolarHBondContact NH2-OD2 3.06Å; D298-M300 PolarHBondContact O-N 2.92Å; D298-M300 VanDerWaalsContact O-N 3.09Å; D298-M300 PolarHBondContact OD1-N 3.07Å; D298-K301 HydrophobicContact CB-CB 4.14Å; D298-K301 PolarHBondContact O-N 3.1Å; D298-K301 PolarHBondContact OD1-N 2.87Å; D298-G302 PolarHBondContact O-N 3.29Å; D298-D303 PolarHBondContact N-O 3.12Å
299	A	96.9	Very high	96.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.008	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.7	-175.7	0	0	0	0	0	113.4	L30 Y264 F278 G282 R283 W297	L30-A299 WeakPolarHBondContact CD2-O 3.3Å; Y264-A299 WeakPolarHBondContact OH-CA 3.35Å; Y264-A299 PolarHBondContact OH-O 2.96Å; F278-A299 HydrophobicContact CE1-CB 4.22Å; G282-A299 VanDerWaalsContact O-CB 3.25Å; G282-A299 WeakPolarHBondContact O-CB 3.28Å; R283-A299 WeakPolarHBondContact O-CB 3.36Å; R283-A299 PolarHBondContact O-N 2.63Å; W297-A299 PolarHBondContact O-N 2.83Å
300	M	95.2	Very high	96.8	Very high	52 Å²	52	35.3 Å²	35.3	26%	0.256	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-33.5	-178.9	-61.7	-61.2	170.2	0	0	112	T34 L37 D298	T34-M300 WeakPolarHBondContact CB-O 3.4Å; T34-M300 HydrophobicContact CG2-CB 3.87Å; T34-M300 HydrophobicContact CG2-CG 4.47Å; T34-M300 HydrophobicContact CG2-SD 4.13Å; T34-M300 PolarHBondContact OG1-O 2.97Å; L37-M300 HydrophobicContact CD1-CB 4.09Å; L37-M300 HydrophobicContact CD1-CG 4.22Å; D298-M300 PolarHBondContact O-N 2.92Å; D298-M300 VanDerWaalsContact O-N 3.09Å; D298-M300 PolarHBondContact OD1-N 3.07Å
301	K	93.4	Very high	96.9	Very high	37 Å²	37	33.7 Å²	33.7	16%	0.161	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-24	-174.3	-67.8	-68.5	-167.6	179.8	0	113.8	T34 S35 L37 D298 D303	T34-K301 WeakPolarHBondContact O-CE 3.49Å; T34-K301 PolarHBondContact O-NZ 3.17Å; S35-K301 PolarHBondContact O-NZ 3.05Å; L37-K301 WeakPolarHBondContact O-CE 3.45Å; L37-K301 PolarHBondContact O-NZ 3.4Å; D298-K301 HydrophobicContact CB-CB 4.14Å; D298-K301 PolarHBondContact O-N 3.1Å; D298-K301 PolarHBondContact OD1-N 2.87Å; K301-D303 HydrophobicContact CB-CB 4.39Å; K301-D303 PolarHBondContact O-N 2.86Å
302	G	92.3	Very high	96.9	Very high	17 Å²	17	37.1 Å²	37.1	18%	0.175	21%	0.208	C	C	.	.			trans	81.8	-5.7	-171.5	0	0	0	0	0	113.9	D298	D298-G302 PolarHBondContact O-N 3.29Å
303	D	94.1	Very high	96.9	Very high	100 Å²	100	35.3 Å²	35.3	54%	0.535	20%	0.203	S	C	.	.			trans	-81.3	147.4	-176.6	-66.1	-39.8	0	0	0	112.4	D298 K301 A305	D298-D303 PolarHBondContact N-O 3.12Å; K301-D303 HydrophobicContact CB-CB 4.39Å; K301-D303 PolarHBondContact O-N 2.86Å; D303-A305 PolarHBondContact O-N 3.16Å
304	R	96.1	Very high	97	Very high	109 Å²	109	36.1 Å²	36.1	41%	0.411	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	109.5	170.8	-174.7	171.8	61.9	175.9	-5.2	110.5	N295 I296 W297	N295-R304 HydrophobicContact CB-CG 4.49Å; N295-R304 WeakPolarHBondContact OD1-CD 3.4Å; N295-R304 PolarHBondContact OD1-NH1 2.85Å; N295-R304 VanDerWaalsContact OD1-NH1 3.17Å; I296-R304 CarbonylContact O-C 3.58Å; W297-R304 HydrophobicContact CE3-CB 4Å; W297-R304 HydrophobicContact CH2-CB 4.43Å; W297-R304 HydrophobicContact CZ3-CB 3.93Å
305	A	96.9	Very high	97	Very high	12 Å²	12	36.1 Å²	36.1	10%	0.099	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-28.1	179.8	0	0	0	0	0	113.6	V40 R42 I43 I296 D303	V40-A305 HydrophobicContact CG2-CB 3.51Å; R42-A305 CarbonylContact C-O 3.48Å; R42-A305 WeakPolarHBondContact CA-O 3.47Å; I43-A305 HydrophobicContact CG1-CB 4Å; I43-A305 PolarHBondContact N-O 3.3Å; I296-A305 HydrophobicContact CG2-CB 4.46Å; I296-A305 PolarHBondContact O-N 2.84Å; D303-A305 PolarHBondContact O-N 3.16Å
306	G	97.2	Very high	97	Very high	7 Å²	7	36.8 Å²	36.8	7%	0.072	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	172.2	-177.1	0	0	0	0	0	114	I296	I296-G306 PolarHBondContact N-O 3.32Å; I296-G306 PolarHBondContact O-N 3.09Å; I296-G306 VanDerWaalsContact O-N 3.16Å
307	V	97.8	Very high	97	Very high	63 Å²	63	37.3 Å²	37.3	38%	0.382	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.2	177.2	-175.7	0	0	0	0	109.1	N293 C294 A309	N293-V307 HydrophobicContact CB-CG1 4.1Å; C294-V307 CarbonylContact O-C 3.56Å; C294-V307 WeakPolarHBondContact O-CA 3.45Å; V307-A309 HydrophobicContact CG1-CB 4.32Å
308	L	98.2	Very high	97	Very high	3 Å²	3	38 Å²	38	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	90.7	169.8	-53	-176.7	0	0	0	108.2	M45 L286 C294 I296 V327 W339	M45-L308 HydrophobicContact CB-CD2 3.65Å; M45-L308 HydrophobicContact CG-CD2 4.16Å; M45-L308 HydrophobicContact SD-CD1 4.37Å; M45-L308 HydrophobicContact SD-CD2 4.02Å; L286-L308 HydrophobicContact CD2-CD1 4.2Å; C294-L308 HydrophobicContact CB-CB 4.05Å; C294-L308 HydrophobicContact CB-CD1 4.41Å; C294-L308 PolarHBondContact N-O 3.16Å; C294-L308 VanDerWaalsContact N-O 3.11Å; C294-L308 PolarHBondContact O-N 3.32Å; I296-L308 HydrophobicContact CD1-CD1 4.48Å; I296-L308 HydrophobicContact CD1-CD2 3.9Å; I296-L308 HydrophobicContact CD1-CG 4.04Å; I296-L308 HydrophobicContact CG1-CG 4.28Å; L308-V327 HydrophobicContact CD1-CG1 4.1Å; L308-W339 HydrophobicContact CB-CD2 4.36Å; L308-W339 HydrophobicContact CB-CE3 4.34Å; L308-W339 HydrophobicContact CB-CH2 4.2Å; L308-W339 HydrophobicContact CB-CZ2 4.23Å; L308-W339 HydrophobicContact CB-CZ3 4.25Å; L308-W339 HydrophobicContact CD1-CD2 4.19Å; L308-W339 HydrophobicContact CD1-CG 4.09Å; L308-W339 HydrophobicContact CD2-CD2 4.2Å; L308-W339 HydrophobicContact CD2-CE3 3.92Å; L308-W339 HydrophobicContact CD2-CZ3 4.41Å; L308-W339 HydrophobicContact CG-CD2 4.49Å
309	A	97.5	Very high	97	Very high	68 Å²	68	38.4 Å²	38.4	56%	0.562	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	114.5	175.7	0	0	0	0	0	109	N293 V307	N293-A309 WeakPolarHBondContact OD1-CB 2.98Å; V307-A309 HydrophobicContact CG1-CB 4.32Å
310	G	96.8	Very high	97.1	Very high	26 Å²	26	39.6 Å²	39.6	27%	0.268	23%	0.226	S	C	.	.			trans	-175.3	5.4	176.3	0	0	0	0	0	115.6	K337	G310-K337 WeakPolarHBondContact O-CE 3.4Å; G310-K337 PolarHBondContact O-NZ 2.77Å
311	H	98.4	Very high	97.3	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.056	22%	0.216	C	C	.	.			trans	-100.6	150.7	170.9	-75.2	-71.9	0	0	0	110.2	V315 T329 S331 D333 F335	H311-V315 HydrophobicContact CB-CG2 4.49Å; H311-T329 PolarHBondContact NE2-OG1 2.93Å; H311-S331 VanDerWaalsContact CG-CB 3.47Å; H311-S331 WeakPolarHBondContact ND1-CB 3.33Å; H311-D333 WeakPolarHBondContact CA-OD2 3.04Å; H311-D333 WeakPolarHBondContact CB-OD2 3.28Å; H311-D333 IonicContact CE1-OD1 3.65Å; H311-D333 IonicContact CE1-OD2 3.12Å; H311-D333 IonicContact CG-OD2 3.07Å; H311-D333 IonicContact ND1-OD1 3.25Å; H311-D333 PolarHBondContact ND1-OD1 3.44Å; H311-D333 IonicContact ND1-OD2 3.57Å; H311-D333 PolarHBondContact ND1-OD2 2.94Å; H311-F335 PolarHBondContact CE1-O 3.21Å
312	D	98	Very high	97.4	Very high	131 Å²	131	39.7 Å²	39.7	70%	0.701	23%	0.23	S	C	*	.	S	Bend	trans	-97.9	5.5	179.9	-60.5	-43.6	0	0	0	112.1	D333	D312-D333 HydrophobicContact CB-CB 4.36Å; D312-D333 PolarHBondContact N-OD2 3.05Å
313	N	98.4	Very high	97.7	Very high	53 Å²	53	42 Å²	42	28%	0.283	24%	0.238	S	C	.	.	S	Bend	trans	-156	173.1	179.2	-150.5	-39.6	0	0	0	109.9	F292 V315 S331 W332 D333	F292-N313 WeakPolarHBondContact CB-O 3.42Å; N313-V315 PolarHBondContact O-N 3.37Å; N313-S331 PolarHBondContact O-OG 3.08Å; N313-W332 HydrophobicContact CB-CB 3.92Å; N313-D333 HydrophobicContact CB-CB 4.07Å
314	R	97.9	Very high	97.9	Very high	59 Å²	59	38.8 Å²	38.8	22%	0.223	23%	0.229	C	C	.	.			trans	-51	134.2	-174.7	71	-174.8	-65.5	-157.4	12.5	111.9	T274 D290 F292 S316 S331 W332	T274-R314 VanDerWaalsContact CG2-NH2 3.35Å; D290-R314 VanDerWaalsContact CG-NH2 3.32Å; D290-R314 IonicContact OD1-CZ 2.8Å; D290-R314 IonicContact OD1-NE 3.49Å; D290-R314 PolarHBondContact OD1-NE 2.89Å; D290-R314 IonicContact OD1-NH2 3.97Å; D290-R314 PolarHBondContact OD1-NH2 2.59Å; D290-R314 IonicContact OD2-CZ 3.69Å; D290-R314 IonicContact OD2-NH2 3.34Å; D290-R314 PolarHBondContact OD2-NH2 3.17Å; F292-R314 HydrophobicContact CD1-CB 4.35Å; R314-S316 PolarHBondContact O-N 2.74Å; R314-S331 VanDerWaalsContact O-CA 3.29Å; R314-S331 WeakPolarHBondContact O-CA 3.16Å; R314-S331 WeakPolarHBondContact O-CB 3.46Å; R314-S331 PolarHBondContact O-OG 3.06Å; R314-W332 VanDerWaalsContact CD-CE2 3.47Å; R314-W332 HydrophobicContact CG-CB 4.04Å; R314-W332 HydrophobicContact CG-CD2 3.4Å; R314-W332 VanDerWaalsContact CG-CD2 3.4Å; R314-W332 HydrophobicContact CG-CE3 3.61Å; R314-W332 HydrophobicContact CG-CG 3.57Å; R314-W332 HydrophobicContact CG-CZ3 4.23Å; R314-W332 PolarHBondContact O-N 2.65Å; R314-W332 VanDerWaalsContact O-N 3.11Å
315	V	98.7	Very high	98	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	116.1	169.9	179.7	0	0	0	0	105.4	T274 Y289 F292 H311 N313 T329	T274-V315 VanDerWaalsContact CB-O 3.3Å; T274-V315 WeakPolarHBondContact CB-O 3.43Å; T274-V315 VanDerWaalsContact CG2-O 3.27Å; T274-V315 WeakPolarHBondContact CG2-O 3.34Å; T274-V315 PolarHBondContact OG1-O 3.19Å; Y289-V315 PolarHBondContact O-N 3.22Å; F292-V315 WeakPolarHBondContact O-CG2 3.35Å; H311-V315 HydrophobicContact CB-CG2 4.49Å; N313-V315 PolarHBondContact O-N 3.37Å; V315-T329 HydrophobicContact CG1-CG2 4.45Å
316	S	98.6	Very high	98	Very high	16 Å²	16	39.9 Å²	39.9	11%	0.112	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-26.5	-175.6	53.8	0	0	0	0	112.6	I58 R314 G330	I58-S316 VanDerWaalsContact O-CB 3.29Å; I58-S316 WeakPolarHBondContact O-CB 3.16Å; I58-S316 PolarHBondContact O-OG 2.8Å; R314-S316 PolarHBondContact O-N 2.74Å; S316-G330 PolarHBondContact N-O 2.99Å; S316-G330 PolarHBondContact OG-O 3.28Å
317	C	98.4	Very high	98.1	Very high	10 Å²	10	39.6 Å²	39.6	7%	0.068	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	152.3	-178.4	54.7	0	0	0	0	110.7	M61 T329 G330	M61-C317 HydrophobicContact CG-CB 4.14Å; C317-T329 WeakPolarHBondContact O-CA 3.32Å; C317-G330 PolarHBondContact N-O 3.03Å; C317-G330 PolarHBondContact O-N 3.43Å
318	L	98.5	Very high	98.1	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.089	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.9	171.9	70.1	87.5	0	0	0	110.3	S275 A277 L286 A328 T329	S275-L318 WeakPolarHBondContact OG-CD2 3.35Å; S275-L318 PolarHBondContact OG-N 3.47Å; A277-L318 HydrophobicContact CB-CD1 3.29Å; L286-L318 HydrophobicContact CB-CD1 4.25Å; L318-A328 CarbonylContact C-O 3.52Å; L318-A328 WeakPolarHBondContact CA-O 3.48Å; L318-T329 HydrophobicContact CB-CG2 4.12Å
319	G	98.4	Very high	98.2	Very high	12 Å²	12	36.5 Å²	36.5	12%	0.124	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	140.4	175.6	0	0	0	0	0	111.6	W63 V327 A328	W63-G319 PolarHBondContact NE1-O 3.34Å; G319-V327 CarbonylContact O-C 3.49Å; G319-V327 WeakPolarHBondContact O-CA 3.48Å; G319-V327 WeakPolarHBondContact O-CG2 3.49Å; G319-A328 PolarHBondContact N-O 3.22Å; G319-A328 PolarHBondContact O-N 2.92Å
320	V	98.7	Very high	98.2	Very high	26 Å²	26	33.3 Å²	33.3	16%	0.158	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	144.1	172.1	-177.1	0	0	0	0	108.5	A277 F278 L286 V327	A277-V320 HydrophobicContact CB-CG2 4.08Å; F278-V320 WeakPolarHBondContact O-CG2 3.04Å; L286-V320 HydrophobicContact CD1-CG2 3.89Å; V320-V327 HydrophobicContact CG2-CB 4.26Å; V320-V327 HydrophobicContact CG2-CG2 4.11Å
321	T	98.6	Very high	98.3	Very high	5 Å²	5	32 Å²	32	3%	0.031	18%	0.18	C	C	.	.			trans	-68.2	153.1	175.2	54.7	0	0	0	0	112	W63 D323 G324 M325 A326	W63-T321 HydrophobicContact CD2-CG2 3.67Å; W63-T321 HydrophobicContact CE3-CG2 3.83Å; W63-T321 HydrophobicContact CG-CG2 4.23Å; W63-T321 HydrophobicContact CH2-CG2 3.89Å; W63-T321 HydrophobicContact CZ2-CG2 3.72Å; W63-T321 HydrophobicContact CZ3-CG2 3.94Å; T321-D323 WeakPolarHBondContact CB-OD1 3.29Å; T321-D323 PolarHBondContact O-N 3.16Å; T321-D323 PolarHBondContact OG1-OD1 3.43Å; T321-G324 WeakPolarHBondContact O-CA 3.42Å; T321-G324 PolarHBondContact O-N 3.11Å; T321-G324 PolarHBondContact OG1-N 3.29Å; T321-M325 PolarHBondContact OG1-N 2.82Å; T321-A326 HydrophobicContact CG2-CB 4.16Å; T321-A326 PolarHBondContact N-O 3.41Å; T321-A326 PolarHBondContact OG1-N 2.89Å; T321-A326 VanDerWaalsContact OG1-N 3.12Å; T321-A326 PolarHBondContact OG1-O 3.21Å
322	D	96.9	Very high	98.3	Very high	86 Å²	86	34 Å²	34	46%	0.46	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.7	-179.5	-73.8	-7.3	0	0	0	113.3	T65 S67 R280	T65-D322 WeakPolarHBondContact CA-OD2 3.29Å; S67-D322 PolarHBondContact OG-N 2.89Å; R280-D322 WeakPolarHBondContact CD-O 3.22Å; R280-D322 PolarHBondContact NE-O 2.82Å
323	D	97.6	Very high	98.3	Very high	66 Å²	66	28.7 Å²	28.7	35%	0.353	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-9.4	172.4	67.5	2.7	0	0	0	113.8	S67 T321 M325	S67-D323 VanDerWaalsContact CB-CG 3.48Å; S67-D323 WeakPolarHBondContact CB-OD2 3.42Å; S67-D323 PolarHBondContact OG-N 2.82Å; T321-D323 WeakPolarHBondContact CB-OD1 3.29Å; T321-D323 PolarHBondContact O-N 3.16Å; T321-D323 PolarHBondContact OG1-OD1 3.43Å; D323-M325 VanDerWaalsContact C-N 3.29Å; D323-M325 HydrophobicContact CB-CG 4.19Å; D323-M325 PolarHBondContact O-N 3.39Å; D323-M325 VanDerWaalsContact OD1-CB 3.28Å; D323-M325 WeakPolarHBondContact OD1-CB 3.4Å; D323-M325 WeakPolarHBondContact OD1-CG 3.43Å; D323-M325 PolarHBondContact OD1-N 3.27Å; D323-M325 WeakPolarHBondContact OD2-CG 3.48Å
324	G	97.6	Very high	98.3	Very high	33 Å²	33	27.3 Å²	27.3	34%	0.34	15%	0.153	S	C	.	.	S	Bend	trans	74.1	8.9	-176.9	0	0	0	0	0	115.8	T321	T321-G324 WeakPolarHBondContact O-CA 3.42Å; T321-G324 PolarHBondContact O-N 3.11Å; T321-G324 PolarHBondContact OG1-N 3.29Å
325	M	97.8	Very high	98.4	Very high	129 Å²	129	27.3 Å²	27.3	64%	0.635	15%	0.154	S	C	*	.	S	Bend	trans	-74.8	-25	-174.9	-69.3	-67.1	164.9	0	0	114.3	T321 D323 N340	T321-M325 PolarHBondContact OG1-N 2.82Å; D323-M325 VanDerWaalsContact C-N 3.29Å; D323-M325 HydrophobicContact CB-CG 4.19Å; D323-M325 PolarHBondContact O-N 3.39Å; D323-M325 VanDerWaalsContact OD1-CB 3.28Å; D323-M325 WeakPolarHBondContact OD1-CB 3.4Å; D323-M325 WeakPolarHBondContact OD1-CG 3.43Å; D323-M325 PolarHBondContact OD1-N 3.27Å; D323-M325 WeakPolarHBondContact OD2-CG 3.48Å; M325-N340 VanDerWaalsContact O-CB 3.29Å; M325-N340 WeakPolarHBondContact O-CB 3.27Å
326	A	98.3	Very high	98.4	Very high	14 Å²	14	27.3 Å²	27.3	12%	0.116	15%	0.154	C	C	.	.			trans	-148.6	158	-178.3	0	0	0	0	0	112.6	T321 I338 W339	T321-A326 HydrophobicContact CG2-CB 4.16Å; T321-A326 PolarHBondContact N-O 3.41Å; T321-A326 PolarHBondContact OG1-N 2.89Å; T321-A326 VanDerWaalsContact OG1-N 3.12Å; T321-A326 PolarHBondContact OG1-O 3.21Å; A326-I338 HydrophobicContact CB-CG2 3.78Å; A326-W339 WeakPolarHBondContact CA-O 3.47Å
327	V	98.6	Very high	98.4	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.6	164.7	58.7	0	0	0	0	109.1	M45 L286 L308 G319 V320 I338 W339	M45-V327 HydrophobicContact CE-CG1 4.22Å; M45-V327 HydrophobicContact SD-CG1 3.81Å; L286-V327 HydrophobicContact CD2-CB 4.24Å; L286-V327 HydrophobicContact CD2-CG1 4.06Å; L286-V327 HydrophobicContact CD2-CG2 3.92Å; L308-V327 HydrophobicContact CD1-CG1 4.1Å; G319-V327 CarbonylContact O-C 3.49Å; G319-V327 WeakPolarHBondContact O-CA 3.48Å; G319-V327 WeakPolarHBondContact O-CG2 3.49Å; V320-V327 HydrophobicContact CG2-CB 4.26Å; V320-V327 HydrophobicContact CG2-CG2 4.11Å; V327-I338 CarbonylContact O-C 3.52Å; V327-I338 WeakPolarHBondContact O-CA 3.4Å; V327-W339 HydrophobicContact CG1-CB 3.67Å; V327-W339 HydrophobicContact CG1-CG 4.12Å; V327-W339 PolarHBondContact N-O 3.31Å; V327-W339 PolarHBondContact O-N 3.31Å
328	A	98.8	Very high	98.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.6	168.1	0	0	0	0	0	110.1	M61 W63 L318 G319 K337	M61-A328 HydrophobicContact CE-CB 3.49Å; M61-A328 VanDerWaalsContact CE-CB 3.49Å; M61-A328 HydrophobicContact SD-CB 4.27Å; W63-A328 HydrophobicContact CH2-CB 4.49Å; W63-A328 HydrophobicContact CZ2-CB 3.46Å; W63-A328 VanDerWaalsContact CZ2-CB 3.46Å; L318-A328 CarbonylContact C-O 3.52Å; L318-A328 WeakPolarHBondContact CA-O 3.48Å; G319-A328 PolarHBondContact N-O 3.22Å; G319-A328 PolarHBondContact O-N 2.92Å; A328-K337 CarbonylContact C-O 3.59Å; A328-K337 VanDerWaalsContact CA-O 3.25Å; A328-K337 WeakPolarHBondContact CA-O 3.1Å
329	T	98.8	Very high	98.4	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.1	169.9	57.1	0	0	0	0	108.9	C294 H311 V315 C317 L318 L336 K337 W339	C294-T329 HydrophobicContact CB-CG2 4.48Å; H311-T329 PolarHBondContact NE2-OG1 2.93Å; V315-T329 HydrophobicContact CG1-CG2 4.45Å; C317-T329 WeakPolarHBondContact O-CA 3.32Å; L318-T329 HydrophobicContact CB-CG2 4.12Å; T329-L336 CarbonylContact O-C 3.56Å; T329-L336 VanDerWaalsContact O-CA 3.22Å; T329-L336 WeakPolarHBondContact O-CA 3.25Å; T329-K337 PolarHBondContact N-O 2.81Å; T329-K337 PolarHBondContact O-N 3.3Å; T329-W339 PolarHBondContact OG1-NE1 3.12Å
330	G	98.8	Very high	98.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.4	171.5	0	0	0	0	0	110.3	S316 C317	S316-G330 PolarHBondContact N-O 2.99Å; S316-G330 PolarHBondContact OG-O 3.28Å; C317-G330 PolarHBondContact N-O 3.03Å; C317-G330 PolarHBondContact O-N 3.43Å
331	S	98.8	Very high	98.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	163.5	-174.6	167.9	0	0	0	0	112.3	I58 H311 N313 R314 D333 S334 F335	I58-S331 WeakPolarHBondContact CB-O 3.42Å; I58-S331 PolarHBondContact N-O 3.2Å; H311-S331 VanDerWaalsContact CG-CB 3.47Å; H311-S331 WeakPolarHBondContact ND1-CB 3.33Å; N313-S331 PolarHBondContact O-OG 3.08Å; R314-S331 VanDerWaalsContact O-CA 3.29Å; R314-S331 WeakPolarHBondContact O-CA 3.16Å; R314-S331 WeakPolarHBondContact O-CB 3.46Å; R314-S331 PolarHBondContact O-OG 3.06Å; S331-D333 VanDerWaalsContact CB-OD1 3.29Å; S331-D333 WeakPolarHBondContact CB-OD1 3.47Å; S331-D333 PolarHBondContact O-N 3.12Å; S331-D333 PolarHBondContact OG-N 2.81Å; S331-D333 VanDerWaalsContact OG-N 3.16Å; S331-D333 PolarHBondContact OG-OD1 2.79Å; S331-S334 PolarHBondContact O-N 3.13Å; S331-F335 PolarHBondContact N-O 2.66Å
332	W	98.6	Very high	98.1	Very high	53 Å²	53	33.5 Å²	33.5	20%	0.201	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-8.6	169.7	-77.4	14.7	0	0	0	114.1	K57 Y59 N313 R314 S334	K57-W332 HydrophobicContact CB-CB 4.19Å; K57-W332 HydrophobicContact CB-CD2 4.47Å; K57-W332 HydrophobicContact CB-CG 3.88Å; K57-W332 HydrophobicContact CD-CB 4.3Å; K57-W332 HydrophobicContact CD-CD2 3.67Å; K57-W332 HydrophobicContact CD-CE3 3.96Å; K57-W332 HydrophobicContact CD-CG 3.86Å; K57-W332 HydrophobicContact CG-CB 3.88Å; K57-W332 HydrophobicContact CG-CD2 4.18Å; K57-W332 HydrophobicContact CG-CG 3.82Å; Y59-W332 HydrophobicContact CE2-CZ2 4.29Å; Y59-W332 AromaticContact CE2-NE1 3.64Å; Y59-W332 AromaticContact CZ-CZ2 3.88Å; Y59-W332 AromaticContact CZ-NE1 3.98Å; Y59-W332 WeakPolarHBondContact OH-CZ2 3.37Å; N313-W332 HydrophobicContact CB-CB 3.92Å; R314-W332 VanDerWaalsContact CD-CE2 3.47Å; R314-W332 HydrophobicContact CG-CB 4.04Å; R314-W332 HydrophobicContact CG-CD2 3.4Å; R314-W332 VanDerWaalsContact CG-CD2 3.4Å; R314-W332 HydrophobicContact CG-CE3 3.61Å; R314-W332 HydrophobicContact CG-CG 3.57Å; R314-W332 HydrophobicContact CG-CZ3 4.23Å; R314-W332 PolarHBondContact O-N 2.65Å; R314-W332 VanDerWaalsContact O-N 3.11Å; W332-S334 PolarHBondContact O-N 3.39Å
333	D	98.3	Very high	98.2	Very high	20 Å²	20	30.6 Å²	30.6	11%	0.107	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	3.6	169.9	71.5	7.1	0	0	0	114	H311 D312 N313 S331 F335	H311-D333 WeakPolarHBondContact CA-OD2 3.04Å; H311-D333 WeakPolarHBondContact CB-OD2 3.28Å; H311-D333 IonicContact CE1-OD1 3.65Å; H311-D333 IonicContact CE1-OD2 3.12Å; H311-D333 IonicContact CG-OD2 3.07Å; H311-D333 IonicContact ND1-OD1 3.25Å; H311-D333 PolarHBondContact ND1-OD1 3.44Å; H311-D333 IonicContact ND1-OD2 3.57Å; H311-D333 PolarHBondContact ND1-OD2 2.94Å; D312-D333 HydrophobicContact CB-CB 4.36Å; D312-D333 PolarHBondContact N-OD2 3.05Å; N313-D333 HydrophobicContact CB-CB 4.07Å; S331-D333 VanDerWaalsContact CB-OD1 3.29Å; S331-D333 WeakPolarHBondContact CB-OD1 3.47Å; S331-D333 PolarHBondContact O-N 3.12Å; S331-D333 PolarHBondContact OG-N 2.81Å; S331-D333 VanDerWaalsContact OG-N 3.16Å; S331-D333 PolarHBondContact OG-OD1 2.79Å; D333-F335 VanDerWaalsContact C-N 3.27Å; D333-F335 HydrophobicContact CB-CD2 4.2Å; D333-F335 VanDerWaalsContact O-CD2 3.25Å; D333-F335 WeakPolarHBondContact O-CD2 3.26Å; D333-F335 WeakPolarHBondContact O-CE2 3.39Å; D333-F335 PolarHBondContact O-N 2.96Å; D333-F335 WeakPolarHBondContact OD1-CB 3.32Å; D333-F335 PolarHBondContact OD1-N 3.07Å
334	S	98.3	Very high	98.2	Very high	24 Å²	24	28.5 Å²	28.5	17%	0.168	15%	0.152	C	C	.	.	S	Bend	trans	71.6	7.7	-178.9	75.8	0	0	0	0	116	A56 I58 S331 W332	A56-S334 WeakPolarHBondContact O-CA 3.2Å; A56-S334 WeakPolarHBondContact O-CB 3.25Å; I58-S334 VanDerWaalsContact CD1-C 3.4Å; I58-S334 WeakPolarHBondContact CD1-O 3.46Å; S331-S334 PolarHBondContact O-N 3.13Å; W332-S334 PolarHBondContact O-N 3.39Å
335	F	98.5	Very high	98.2	Very high	59 Å²	59	28.2 Å²	28.2	26%	0.259	14%	0.141	S	C	.	.			trans	-106.3	147.5	177.9	-58.7	-64.6	0	0	0	112.6	T50 R52 I58 H311 S331 D333	T50-F335 HydrophobicContact CG2-CB 4.3Å; T50-F335 HydrophobicContact CG2-CD1 4.15Å; T50-F335 HydrophobicContact CG2-CG 4.36Å; R52-F335 HydrophobicContact CB-CE1 4.39Å; R52-F335 HydrophobicContact CG-CD1 3.86Å; R52-F335 HydrophobicContact CG-CE1 3.77Å; I58-F335 WeakPolarHBondContact CD1-O 3.42Å; H311-F335 PolarHBondContact CE1-O 3.21Å; S331-F335 PolarHBondContact N-O 2.66Å; D333-F335 VanDerWaalsContact C-N 3.27Å; D333-F335 HydrophobicContact CB-CD2 4.2Å; D333-F335 VanDerWaalsContact O-CD2 3.25Å; D333-F335 WeakPolarHBondContact O-CD2 3.26Å; D333-F335 WeakPolarHBondContact O-CE2 3.39Å; D333-F335 PolarHBondContact O-N 2.96Å; D333-F335 WeakPolarHBondContact OD1-CB 3.32Å; D333-F335 PolarHBondContact OD1-N 3.07Å
336	L	98.8	Very high	98.3	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.6	157.4	-58.6	92.8	0	0	0	109.7	T50 L51 I58 M61 L70 W82 T329	T50-L336 CarbonylContact C-O 3.55Å; T50-L336 WeakPolarHBondContact CA-O 3.47Å; L51-L336 HydrophobicContact CB-CB 4.08Å; L51-L336 HydrophobicContact CB-CD1 4.45Å; L51-L336 HydrophobicContact CD1-CB 4.08Å; L51-L336 HydrophobicContact CG-CB 4.29Å; L51-L336 PolarHBondContact N-O 3.28Å; L51-L336 PolarHBondContact O-N 2.74Å; I58-L336 HydrophobicContact CD1-CD1 3.42Å; I58-L336 VanDerWaalsContact CD1-CD1 3.42Å; I58-L336 HydrophobicContact CD1-CG 3.86Å; I58-L336 HydrophobicContact CG1-CD1 4.42Å; M61-L336 HydrophobicContact CB-CD2 3.86Å; M61-L336 HydrophobicContact CG-CD2 4.27Å; L70-L336 HydrophobicContact CD1-CD2 3.8Å; W82-L336 HydrophobicContact CZ2-CD1 4.29Å; T329-L336 CarbonylContact O-C 3.56Å; T329-L336 VanDerWaalsContact O-CA 3.22Å; T329-L336 WeakPolarHBondContact O-CA 3.25Å
337	K	98.8	Very high	98.3	Very high	34 Å²	34	22 Å²	22	15%	0.148	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.5	176.4	-66.9	-176.6	-172.1	-133	0	109.7	T47 R49 T50 G310 A328 T329 W339	T47-K337 HydrophobicContact CG2-CB 4.01Å; T47-K337 HydrophobicContact CG2-CD 4.3Å; T47-K337 HydrophobicContact CG2-CG 4.15Å; R49-K337 WeakPolarHBondContact O-CA 3.29Å; T50-K337 HydrophobicContact CG2-CG 4.43Å; G310-K337 WeakPolarHBondContact O-CE 3.4Å; G310-K337 PolarHBondContact O-NZ 2.77Å; A328-K337 CarbonylContact C-O 3.59Å; A328-K337 VanDerWaalsContact CA-O 3.25Å; A328-K337 WeakPolarHBondContact CA-O 3.1Å; T329-K337 PolarHBondContact N-O 2.81Å; T329-K337 PolarHBondContact O-N 3.3Å; K337-W339 HydrophobicContact CB-CZ2 3.89Å; K337-W339 HydrophobicContact CD-CH2 4.4Å; K337-W339 HydrophobicContact CD-CZ2 3.92Å; K337-W339 PolarHBondContact O-NE1 3.21Å
338	I	98.7	Very high	98.2	Very high	10 Å²	10	23.5 Å²	23.5	5%	0.051	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.5	176.2	-52	-175.8	0	0	0	108.1	T47 R48 R49 L51 W63 L70 A326 V327	T47-I338 CarbonylContact C-O 3.59Å; T47-I338 WeakPolarHBondContact CA-O 3.34Å; R48-I338 PolarHBondContact N-O 2.82Å; R49-I338 HydrophobicContact CB-CB 4.07Å; R49-I338 HydrophobicContact CB-CD1 4.1Å; R49-I338 HydrophobicContact CB-CG1 4.18Å; R49-I338 PolarHBondContact N-O 2.97Å; R49-I338 PolarHBondContact O-N 3.39Å; L51-I338 HydrophobicContact CD1-CD1 4.3Å; L51-I338 HydrophobicContact CD2-CD1 4.45Å; L51-I338 HydrophobicContact CG-CD1 4.49Å; W63-I338 HydrophobicContact CH2-CD1 4.08Å; L70-I338 HydrophobicContact CD2-CD1 4.41Å; A326-I338 HydrophobicContact CB-CG2 3.78Å; V327-I338 CarbonylContact O-C 3.52Å; V327-I338 WeakPolarHBondContact O-CA 3.4Å
339	W	98.7	Very high	98.2	Very high	9 Å²	9	25.5 Å²	25.5	3%	0.034	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.7	-174.8	-41	76.2	0	0	0	110.6	M45 R46 T47 L308 A326 V327 T329 K337	M45-W339 HydrophobicContact CB-CB 4.07Å; M45-W339 HydrophobicContact SD-CB 4.31Å; R46-W339 WeakPolarHBondContact O-CA 3.25Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.3Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.49Å; L308-W339 HydrophobicContact CB-CD2 4.36Å; L308-W339 HydrophobicContact CB-CE3 4.34Å; L308-W339 HydrophobicContact CB-CH2 4.2Å; L308-W339 HydrophobicContact CB-CZ2 4.23Å; L308-W339 HydrophobicContact CB-CZ3 4.25Å; L308-W339 HydrophobicContact CD1-CD2 4.19Å; L308-W339 HydrophobicContact CD1-CG 4.09Å; L308-W339 HydrophobicContact CD2-CD2 4.2Å; L308-W339 HydrophobicContact CD2-CE3 3.92Å; L308-W339 HydrophobicContact CD2-CZ3 4.41Å; L308-W339 HydrophobicContact CG-CD2 4.49Å; A326-W339 WeakPolarHBondContact CA-O 3.47Å; V327-W339 HydrophobicContact CG1-CB 3.67Å; V327-W339 HydrophobicContact CG1-CG 4.12Å; V327-W339 PolarHBondContact N-O 3.31Å; V327-W339 PolarHBondContact O-N 3.31Å; T329-W339 PolarHBondContact OG1-NE1 3.12Å; K337-W339 HydrophobicContact CB-CZ2 3.89Å; K337-W339 HydrophobicContact CD-CH2 4.4Å; K337-W339 HydrophobicContact CD-CZ2 3.92Å; K337-W339 PolarHBondContact O-NE1 3.21Å
340	N	93.3	Very high	98.1	Very high	95 Å²	95	27.7 Å²	27.7	51%	0.508	14%	0.135	S	C	.	.			trans	-158.8	0	162.3	72.2	11.6	0	0	0	112.8	R46 R48 M325	R46-N340 PolarHBondContact N-O 3.32Å; R46-N340 VanDerWaalsContact N-O 3.15Å; R46-N340 PolarHBondContact O-N 3.25Å; R48-N340 WeakPolarHBondContact CD-OD1 3.24Å; R48-N340 WeakPolarHBondContact CG-OD1 3.21Å; R48-N340 PolarHBondContact NE-O 2.85Å; R48-N340 PolarHBondContact NE-OD1 3.29Å; R48-N340 PolarHBondContact NH2-O 2.94Å; M325-N340 VanDerWaalsContact O-CB 3.29Å; M325-N340 WeakPolarHBondContact O-CB 3.27Å

Retrieved 340 of 340 residues in 322 ms (Link to these results)

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