A0A096N324_PAPAN Loading...

G protein subunit beta 4

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 , UniProt , Accession A0A096N324, Species PAPAN (Papio anubis, Olive baboon), Gene GNB4, Length 340 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	66.2	Low	92.9	Very high	141 Å²	141	106.7 Å²	106.7	70%	0.695	53%	0.526	S	S	*	.				0	122.6	0	-152.8	-174.4	-67.3	0	0	106.2	E5 Q6 Q9	M1-E5 WeakPolarHBondContact CA-OE2 2.99Å; M1-E5 HydrophobicContact CG-CB 3.64Å; M1-E5 VanDerWaalsContact CG-OE2 3.3Å; M1-E5 WeakPolarHBondContact CG-OE2 3.38Å; M1-E5 HydrophobicContact SD-CB 4.43Å; M1-Q6 HydrophobicContact CB-CG 4.33Å; M1-Q6 HydrophobicContact CG-CG 4.17Å; M1-Q6 HydrophobicContact SD-CG 3.74Å; M1-Q9 PolarHBondContact SD-OE1 3.48Å
2	S	91.8	Very high	93.2	Very high	68 Å²	68	107.9 Å²	107.9	48%	0.476	53%	0.529	S	S	.	.			trans	-65.3	151.6	177.5	-179.5	0	0	0	0	109.9	L4 E5 Q6	S2-L4 PolarHBondContact O-N 3.05Å; S2-E5 PolarHBondContact N-OE2 2.78Å; S2-E5 WeakPolarHBondContact O-CB 3.3Å; S2-E5 PolarHBondContact O-N 3.39Å; S2-Q6 PolarHBondContact O-N 3.44Å; S2-Q6 VanDerWaalsContact O-N 3.1Å
3	E	95.3	Very high	93.5	Very high	148 Å²	148	108.5 Å²	108.5	69%	0.692	53%	0.53	S	S	*	.	H	α-helix	trans	-51.9	-37.9	173.5	-176.5	179.8	174.8	0	0	111.3	E5 Q6 L7	E3-E5 PolarHBondContact O-N 3.15Å; E3-Q6 PolarHBondContact O-N 3.32Å; E3-L7 HydrophobicContact CG-CD1 4.43Å; E3-L7 WeakPolarHBondContact O-CG 3.27Å; E3-L7 PolarHBondContact O-N 2.76Å
4	L	95.4	Very high	93.8	Very high	96 Å²	96	106.8 Å²	106.8	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-38.5	175.4	-179.1	63.5	0	0	0	113.2	S2 R8	S2-L4 PolarHBondContact O-N 3.05Å; L4-R8 WeakPolarHBondContact O-CB 3.48Å; L4-R8 VanDerWaalsContact O-CG 3.27Å; L4-R8 WeakPolarHBondContact O-CG 3.48Å; L4-R8 PolarHBondContact O-N 2.93Å
5	E	95.3	Very high	93.9	Very high	98 Å²	98	111.5 Å²	111.5	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-70.4	-37.6	178.6	-71.9	171.5	163.1	0	0	110.9	M1 S2 E3 R8 Q9	M1-E5 WeakPolarHBondContact CA-OE2 2.99Å; M1-E5 HydrophobicContact CG-CB 3.64Å; M1-E5 VanDerWaalsContact CG-OE2 3.3Å; M1-E5 WeakPolarHBondContact CG-OE2 3.38Å; M1-E5 HydrophobicContact SD-CB 4.43Å; S2-E5 PolarHBondContact N-OE2 2.78Å; S2-E5 WeakPolarHBondContact O-CB 3.3Å; S2-E5 PolarHBondContact O-N 3.39Å; E3-E5 PolarHBondContact O-N 3.15Å; E5-R8 PolarHBondContact O-N 3.14Å; E5-Q9 WeakPolarHBondContact O-CG 3.49Å; E5-Q9 PolarHBondContact O-N 2.7Å
6	Q	96	Very high	94.1	Very high	107 Å²	107	109.6 Å²	109.6	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-49.5	175.2	-68.4	175.6	-12.1	0	0	111	M1 S2 E3 R8 Q9 E10	M1-Q6 HydrophobicContact CB-CG 4.33Å; M1-Q6 HydrophobicContact CG-CG 4.17Å; M1-Q6 HydrophobicContact SD-CG 3.74Å; S2-Q6 PolarHBondContact O-N 3.44Å; S2-Q6 VanDerWaalsContact O-N 3.1Å; E3-Q6 PolarHBondContact O-N 3.32Å; Q6-R8 VanDerWaalsContact C-N 3.3Å; Q6-R8 PolarHBondContact O-N 2.75Å; Q6-Q9 PolarHBondContact O-N 2.74Å; Q6-E10 WeakPolarHBondContact O-CB 3.44Å; Q6-E10 PolarHBondContact O-N 2.98Å
7	L	97	Very high	94.3	Very high	95 Å²	95	109.1 Å²	109.1	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-36.2	177.7	-70.3	172.3	0	0	0	112.5	E3 A11	E3-L7 HydrophobicContact CG-CD1 4.43Å; E3-L7 WeakPolarHBondContact O-CG 3.27Å; E3-L7 PolarHBondContact O-N 2.76Å; L7-A11 WeakPolarHBondContact O-CB 3.31Å; L7-A11 PolarHBondContact O-N 2.94Å
8	R	95.7	Very high	94.5	Very high	166 Å²	166	107.5 Å²	107.5	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-64.8	-46.1	174.6	-78.6	176.3	180	-173.3	-0	111.9	L4 E5 Q6 A11 E12	L4-R8 WeakPolarHBondContact O-CB 3.48Å; L4-R8 VanDerWaalsContact O-CG 3.27Å; L4-R8 WeakPolarHBondContact O-CG 3.48Å; L4-R8 PolarHBondContact O-N 2.93Å; E5-R8 PolarHBondContact O-N 3.14Å; Q6-R8 VanDerWaalsContact C-N 3.3Å; Q6-R8 PolarHBondContact O-N 2.75Å; R8-A11 PolarHBondContact O-N 3.27Å; R8-E12 WeakPolarHBondContact O-CB 3.5Å; R8-E12 PolarHBondContact O-N 3.17Å
9	Q	96.2	Very high	94.5	Very high	109 Å²	109	106.8 Å²	106.8	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-42.3	177.1	-75.4	-178.5	-2.3	0	0	111.6	M1 E5 Q6 E12 Q13	M1-Q9 PolarHBondContact SD-OE1 3.48Å; E5-Q9 WeakPolarHBondContact O-CG 3.49Å; E5-Q9 PolarHBondContact O-N 2.7Å; Q6-Q9 PolarHBondContact O-N 2.74Å; Q9-E12 PolarHBondContact O-N 3.44Å; Q9-Q13 WeakPolarHBondContact O-CB 3.47Å; Q9-Q13 PolarHBondContact O-N 3.23Å
10	E	97.5	Very high	94.7	Very high	106 Å²	106	106.2 Å²	106.2	50%	0.495	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-46	176.1	-174.8	178.6	-176.2	0	0	111.5	Q6 E12 Q13 L14	Q6-E10 WeakPolarHBondContact O-CB 3.44Å; Q6-E10 PolarHBondContact O-N 2.98Å; E10-E12 VanDerWaalsContact C-N 3.32Å; E10-E12 PolarHBondContact O-N 3.43Å; E10-Q13 PolarHBondContact O-N 3.23Å; E10-L14 HydrophobicContact CG-CD1 4.23Å; E10-L14 WeakPolarHBondContact O-CG 3.38Å; E10-L14 PolarHBondContact O-N 3.16Å
11	A	95.6	Very high	94.8	Very high	40 Å²	40	103.8 Å²	103.8	33%	0.331	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-40.1	177.1	0	0	0	0	0	112.5	L7 R8 R15	L7-A11 WeakPolarHBondContact O-CB 3.31Å; L7-A11 PolarHBondContact O-N 2.94Å; R8-A11 PolarHBondContact O-N 3.27Å; A11-R15 WeakPolarHBondContact O-CG 3.34Å; A11-R15 PolarHBondContact O-N 3.3Å
12	E	96.1	Very high	96.3	Very high	121 Å²	121	99 Å²	99	57%	0.565	49%	0.485	S	S	*	.	H	α-helix	trans	-68.7	-40	177.2	-159.5	167.4	-153.9	0	0	111.6	R8 Q9 E10 R15 N16	R8-E12 WeakPolarHBondContact O-CB 3.5Å; R8-E12 PolarHBondContact O-N 3.17Å; Q9-E12 PolarHBondContact O-N 3.44Å; E10-E12 VanDerWaalsContact C-N 3.32Å; E10-E12 PolarHBondContact O-N 3.43Å; E12-R15 PolarHBondContact O-N 3.08Å; E12-N16 PolarHBondContact O-N 3.31Å; E12-N16 PolarHBondContact O-ND2 2.9Å
13	Q	97.8	Very high	96.4	Very high	116 Å²	116	101.5 Å²	101.5	54%	0.542	49%	0.487	S	S	.	.	H	α-helix	trans	-62.3	-45.2	174	-174	177.8	5.1	0	0	111.9	Q9 E10 R15 N16 Q17	Q9-Q13 WeakPolarHBondContact O-CB 3.47Å; Q9-Q13 PolarHBondContact O-N 3.23Å; E10-Q13 PolarHBondContact O-N 3.23Å; Q13-R15 VanDerWaalsContact C-N 3.34Å; Q13-R15 PolarHBondContact O-N 3.22Å; Q13-N16 PolarHBondContact O-N 3.39Å; Q13-Q17 WeakPolarHBondContact O-CG 3.36Å; Q13-Q17 PolarHBondContact O-N 3.11Å
14	L	97.9	Very high	96.5	Very high	84 Å²	84	98.6 Å²	98.6	44%	0.44	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-39.7	176.5	-72.4	171.3	0	0	0	111.7	E10 Q17 I18	E10-L14 HydrophobicContact CG-CD1 4.23Å; E10-L14 WeakPolarHBondContact O-CG 3.38Å; E10-L14 PolarHBondContact O-N 3.16Å; L14-Q17 PolarHBondContact O-N 3.29Å; L14-I18 VanDerWaalsContact O-CG1 3.32Å; L14-I18 WeakPolarHBondContact O-CG1 3.37Å; L14-I18 PolarHBondContact O-N 2.9Å
15	R	95.4	Very high	96.5	Very high	177 Å²	177	98.2 Å²	98.2	67%	0.668	49%	0.493	S	S	*	.	H	α-helix	trans	-61.5	-43.5	174.1	-76.8	177.5	-176.2	147.2	-0.2	112.1	A11 E12 Q13 I18 Q19	A11-R15 WeakPolarHBondContact O-CG 3.34Å; A11-R15 PolarHBondContact O-N 3.3Å; E12-R15 PolarHBondContact O-N 3.08Å; Q13-R15 VanDerWaalsContact C-N 3.34Å; Q13-R15 PolarHBondContact O-N 3.22Å; R15-I18 PolarHBondContact O-N 3.13Å; R15-Q19 WeakPolarHBondContact O-CB 3.37Å; R15-Q19 PolarHBondContact O-N 3.45Å
16	N	96.5	Very high	96.4	Very high	81 Å²	81	97.8 Å²	97.8	43%	0.433	49%	0.494	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.9	-69.3	-23.1	0	0	0	111.3	E12 Q13 I18 Q19 D20	E12-N16 PolarHBondContact O-N 3.31Å; E12-N16 PolarHBondContact O-ND2 2.9Å; Q13-N16 PolarHBondContact O-N 3.39Å; N16-I18 VanDerWaalsContact C-N 3.35Å; N16-I18 PolarHBondContact O-N 3.32Å; N16-Q19 PolarHBondContact O-N 2.8Å; N16-D20 PolarHBondContact O-N 2.82Å
17	Q	97.9	Very high	96.3	Very high	101 Å²	101	100 Å²	100	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-43.6	175	-71.7	174.2	7.7	0	0	112.3	Q13 L14 D20 A21	Q13-Q17 WeakPolarHBondContact O-CG 3.36Å; Q13-Q17 PolarHBondContact O-N 3.11Å; L14-Q17 PolarHBondContact O-N 3.29Å; Q17-D20 PolarHBondContact O-N 3.3Å; Q17-A21 WeakPolarHBondContact O-CB 3.5Å; Q17-A21 PolarHBondContact O-N 3.17Å
18	I	97.1	Very high	96.2	Very high	81 Å²	81	97.2 Å²	97.2	42%	0.415	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-43.9	175.7	-68.7	163.6	0	0	0	110.5	L14 R15 N16 D20 A21 R22	L14-I18 VanDerWaalsContact O-CG1 3.32Å; L14-I18 WeakPolarHBondContact O-CG1 3.37Å; L14-I18 PolarHBondContact O-N 2.9Å; R15-I18 PolarHBondContact O-N 3.13Å; N16-I18 VanDerWaalsContact C-N 3.35Å; N16-I18 PolarHBondContact O-N 3.32Å; I18-D20 VanDerWaalsContact C-N 3.35Å; I18-D20 PolarHBondContact O-N 3.05Å; I18-A21 PolarHBondContact O-N 3.17Å; I18-R22 HydrophobicContact CG2-CG 4.48Å; I18-R22 WeakPolarHBondContact O-CG 3.37Å; I18-R22 PolarHBondContact O-N 3.4Å
19	Q	95.3	Very high	96.2	Very high	95 Å²	95	92.3 Å²	92.3	44%	0.444	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-42.4	179	-171.4	-179.4	14.3	0	0	111.8	R15 N16 R22 K23	R15-Q19 WeakPolarHBondContact O-CB 3.37Å; R15-Q19 PolarHBondContact O-N 3.45Å; N16-Q19 PolarHBondContact O-N 2.8Å; Q19-R22 PolarHBondContact O-N 3.35Å; Q19-K23 HydrophobicContact CG-CD 4.41Å; Q19-K23 WeakPolarHBondContact O-CB 3.38Å; Q19-K23 VanDerWaalsContact O-CG 3.31Å; Q19-K23 WeakPolarHBondContact O-CG 3.49Å; Q19-K23 PolarHBondContact O-N 3.47Å
20	D	97.4	Very high	96.1	Very high	94 Å²	94	88.6 Å²	88.6	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-68	-38.9	177.8	-69.7	-20.5	0	0	0	111.6	N16 Q17 I18 K23 A24	N16-D20 PolarHBondContact O-N 2.82Å; Q17-D20 PolarHBondContact O-N 3.3Å; I18-D20 VanDerWaalsContact C-N 3.35Å; I18-D20 PolarHBondContact O-N 3.05Å; D20-K23 PolarHBondContact O-N 3.43Å; D20-A24 WeakPolarHBondContact O-CB 3.33Å; D20-A24 PolarHBondContact O-N 2.89Å
21	A	97.8	Very high	95.9	Very high	56 Å²	56	86.5 Å²	86.5	46%	0.463	47%	0.466	S	S	.	.	H	α-helix	trans	-62.9	-43.7	174.1	0	0	0	0	0	112.3	Q17 I18 A24 C25	Q17-A21 WeakPolarHBondContact O-CB 3.5Å; Q17-A21 PolarHBondContact O-N 3.17Å; I18-A21 PolarHBondContact O-N 3.17Å; A21-A24 PolarHBondContact O-N 3.46Å; A21-C25 PolarHBondContact O-N 2.75Å
22	R	96.8	Very high	95.9	Very high	40 Å²	40	90.3 Å²	90.3	15%	0.151	48%	0.477	C	S	.	.	H	α-helix	trans	-62.2	-46.4	175.3	-73.7	173.6	179.5	177.1	-5.4	111.6	I18 Q19 A24 C25 N26 S221 T223 D258 Q259	I18-R22 HydrophobicContact CG2-CG 4.48Å; I18-R22 WeakPolarHBondContact O-CG 3.37Å; I18-R22 PolarHBondContact O-N 3.4Å; Q19-R22 PolarHBondContact O-N 3.35Å; R22-A24 VanDerWaalsContact C-N 3.31Å; R22-A24 PolarHBondContact O-N 3.28Å; R22-C25 PolarHBondContact O-N 2.95Å; R22-C25 VanDerWaalsContact O-N 3.13Å; R22-N26 PolarHBondContact O-N 2.93Å; R22-S221 PolarHBondContact NH2-O 2.98Å; R22-T223 PolarHBondContact NH1-OG1 3.41Å; R22-D258 VanDerWaalsContact CZ-O 3.26Å; R22-D258 IonicContact CZ-OD2 3.49Å; R22-D258 VanDerWaalsContact CZ-OD2 3.24Å; R22-D258 PolarHBondContact NE-O 3.04Å; R22-D258 IonicContact NE-OD2 3.44Å; R22-D258 PolarHBondContact NE-OD2 2.7Å; R22-D258 PolarHBondContact NH2-O 2.78Å; R22-D258 IonicContact NH2-OD1 3.34Å; R22-D258 IonicContact NH2-OD2 3.07Å; R22-D258 PolarHBondContact NH2-OD2 2.8Å; R22-Q259 HydrophobicContact CG-CB 4.49Å; R22-Q259 PolarHBondContact O-NE2 3.42Å; R22-Q259 PolarHBondContact O-OE1 2.97Å
23	K	95.1	Very high	95.9	Very high	121 Å²	121	90.2 Å²	90.2	53%	0.526	48%	0.479	S	S	.	.	H	α-helix	trans	-59.2	-40.2	175.4	-76	173	-176.2	165.5	0	112.3	Q19 D20 C25 N26	Q19-K23 HydrophobicContact CG-CD 4.41Å; Q19-K23 WeakPolarHBondContact O-CB 3.38Å; Q19-K23 VanDerWaalsContact O-CG 3.31Å; Q19-K23 WeakPolarHBondContact O-CG 3.49Å; Q19-K23 PolarHBondContact O-N 3.47Å; D20-K23 PolarHBondContact O-N 3.43Å; K23-C25 PolarHBondContact O-N 3.18Å; K23-N26 PolarHBondContact O-N 3.33Å; K23-N26 VanDerWaalsContact O-N 3.16Å
24	A	96.6	Very high	95.8	Very high	86 Å²	86	85 Å²	85	71%	0.711	46%	0.455	S	S	*	.	H	α-helix	trans	-63.2	-27.8	178.7	0	0	0	0	0	113	D20 A21 R22	D20-A24 WeakPolarHBondContact O-CB 3.33Å; D20-A24 PolarHBondContact O-N 2.89Å; A21-A24 PolarHBondContact O-N 3.46Å; R22-A24 VanDerWaalsContact C-N 3.31Å; R22-A24 PolarHBondContact O-N 3.28Å
25	C	95.8	Very high	95.6	Very high	88 Å²	88	84.4 Å²	84.4	60%	0.595	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	0.3	177.1	-63.4	0	0	0	0	114	A21 R22 K23 D27	A21-C25 PolarHBondContact O-N 2.75Å; R22-C25 PolarHBondContact O-N 2.95Å; R22-C25 VanDerWaalsContact O-N 3.13Å; K23-C25 PolarHBondContact O-N 3.18Å; C25-D27 PolarHBondContact O-N 2.94Å
26	N	92.4	Very high	95.6	Very high	90 Å²	90	83.4 Å²	83.4	48%	0.481	47%	0.466	S	S	.	.			trans	-91.4	72.6	-178.6	-166.9	4.9	0	0	0	110.7	R22 K23	R22-N26 PolarHBondContact O-N 2.93Å; K23-N26 PolarHBondContact O-N 3.33Å; K23-N26 VanDerWaalsContact O-N 3.16Å
27	D	95	Very high	95.5	Very high	154 Å²	154	84.3 Å²	84.3	82%	0.824	47%	0.469	S	S	*	.			trans	-85	-31.8	-172.9	62.3	-22.6	0	0	0	114.1	C25	C25-D27 PolarHBondContact O-N 2.94Å
28	A	94.8	Very high	95.3	Very high	36 Å²	36	86.2 Å²	86.2	30%	0.298	48%	0.482	S	S	.	.			trans	-149	161.3	178.2	0	0	0	0	0	112	I33	A28-I33 HydrophobicContact CB-CD1 4.28Å; A28-I33 HydrophobicContact CB-CG1 4.31Å
29	T	94.8	Very high	95	Very high	63 Å²	63	86 Å²	86	39%	0.387	49%	0.487	S	S	.	.			trans	-100.1	154.8	174.1	73	0	0	0	0	112.1	V31 Q32 I33	T29-V31 PolarHBondContact O-N 3.3Å; T29-Q32 WeakPolarHBondContact O-CB 3.29Å; T29-Q32 PolarHBondContact O-N 2.86Å; T29-Q32 VanDerWaalsContact O-N 3.08Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.27Å; T29-Q32 PolarHBondContact OG1-N 2.78Å; T29-I33 WeakPolarHBondContact O-CG1 3.47Å; T29-I33 PolarHBondContact O-N 3Å
30	L	95	Very high	95	Very high	31 Å²	31	83.6 Å²	83.6	16%	0.162	48%	0.479	C	S	.	.	H	α-helix	trans	-56.7	-38.6	178	-175.9	59.1	0	0	0	112	Q32 I33 T34 L252 L262 T299	L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.22Å; L30-I33 PolarHBondContact O-N 3.03Å; L30-T34 HydrophobicContact CD1-CG2 3.82Å; L30-T34 HydrophobicContact CG-CG2 4.22Å; L30-T34 WeakPolarHBondContact O-CB 3.42Å; L30-T34 VanDerWaalsContact O-CG2 3.27Å; L30-T34 WeakPolarHBondContact O-CG2 3.27Å; L30-T34 PolarHBondContact O-N 3.47Å; L30-T34 PolarHBondContact O-OG1 2.95Å; L30-L252 HydrophobicContact CD2-CD2 3.93Å; L30-L262 HydrophobicContact CD2-CB 4.18Å; L30-L262 HydrophobicContact CD2-CD2 4.12Å; L30-T299 WeakPolarHBondContact CD2-O 3.21Å
31	V	93.9	Very high	94.8	Very high	61 Å²	61	80.9 Å²	80.9	37%	0.37	47%	0.474	S	S	.	.	H	α-helix	trans	-63.5	-37.8	178.5	-175.5	0	0	0	0	112.2	T29 T34 S35 L262	T29-V31 PolarHBondContact O-N 3.3Å; V31-T34 PolarHBondContact O-OG1 2.89Å; V31-S35 PolarHBondContact O-N 2.93Å; V31-S35 VanDerWaalsContact O-N 3.14Å; V31-L262 HydrophobicContact CG2-CD1 3.45Å; V31-L262 VanDerWaalsContact CG2-CD1 3.45Å
32	Q	94.7	Very high	94.8	Very high	120 Å²	120	88 Å²	88	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-66.2	-45	176.2	-71	166.4	-17.5	0	0	110.9	T29 L30 T34 S35	T29-Q32 WeakPolarHBondContact O-CB 3.29Å; T29-Q32 PolarHBondContact O-N 2.86Å; T29-Q32 VanDerWaalsContact O-N 3.08Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.27Å; T29-Q32 PolarHBondContact OG1-N 2.78Å; L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.22Å; Q32-T34 VanDerWaalsContact C-N 3.32Å; Q32-T34 PolarHBondContact O-N 2.87Å; Q32-S35 VanDerWaalsContact O-CB 3.3Å; Q32-S35 WeakPolarHBondContact O-CB 3.41Å; Q32-S35 PolarHBondContact O-N 3.04Å; Q32-S35 PolarHBondContact O-OG 3.41Å
33	I	96.1	Very high	94.8	Very high	119 Å²	119	88 Å²	88	61%	0.61	49%	0.492	S	S	*	.	H	α-helix	trans	-65	-37.7	-179.3	-62.9	168.1	0	0	0	111	A28 T29 L30 S35	A28-I33 HydrophobicContact CB-CD1 4.28Å; A28-I33 HydrophobicContact CB-CG1 4.31Å; T29-I33 WeakPolarHBondContact O-CG1 3.47Å; T29-I33 PolarHBondContact O-N 3Å; L30-I33 PolarHBondContact O-N 3.03Å; I33-S35 VanDerWaalsContact C-N 3.34Å
34	T	95.6	Very high	94.8	Very high	6 Å²	6	88.2 Å²	88.2	4%	0.037	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	7.7	-177.4	65.7	0	0	0	0	113	L30 V31 Q32 N36 M37 L300 K301	L30-T34 HydrophobicContact CD1-CG2 3.82Å; L30-T34 HydrophobicContact CG-CG2 4.22Å; L30-T34 WeakPolarHBondContact O-CB 3.42Å; L30-T34 VanDerWaalsContact O-CG2 3.27Å; L30-T34 WeakPolarHBondContact O-CG2 3.27Å; L30-T34 PolarHBondContact O-N 3.47Å; L30-T34 PolarHBondContact O-OG1 2.95Å; V31-T34 PolarHBondContact O-OG1 2.89Å; Q32-T34 VanDerWaalsContact C-N 3.32Å; Q32-T34 PolarHBondContact O-N 2.87Å; T34-N36 PolarHBondContact O-N 2.66Å; T34-N36 VanDerWaalsContact O-N 3.15Å; T34-M37 WeakPolarHBondContact O-CB 3.38Å; T34-M37 PolarHBondContact O-N 2.75Å; T34-L300 HydrophobicContact CG2-CB 3.86Å; T34-L300 HydrophobicContact CG2-CD2 4.02Å; T34-L300 HydrophobicContact CG2-CG 4.35Å; T34-L300 PolarHBondContact OG1-O 2.68Å; T34-K301 PolarHBondContact O-NZ 3.49Å
35	S	93.5	Very high	94.9	Very high	72 Å²	72	86.3 Å²	86.3	50%	0.503	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-40.4	-176.5	53.2	0	0	0	0	113.3	V31 Q32 I33 M37 K301	V31-S35 PolarHBondContact O-N 2.93Å; V31-S35 VanDerWaalsContact O-N 3.14Å; Q32-S35 VanDerWaalsContact O-CB 3.3Å; Q32-S35 WeakPolarHBondContact O-CB 3.41Å; Q32-S35 PolarHBondContact O-N 3.04Å; Q32-S35 PolarHBondContact O-OG 3.41Å; I33-S35 VanDerWaalsContact C-N 3.34Å; S35-M37 VanDerWaalsContact C-N 3.31Å; S35-M37 PolarHBondContact O-N 3.23Å; S35-K301 PolarHBondContact O-NZ 3.42Å
36	N	95.1	Very high	94.9	Very high	156 Å²	156	90 Å²	90	83%	0.834	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.3	180	-64.1	-27.4	0	0	0	115	T34	T34-N36 PolarHBondContact O-N 2.66Å; T34-N36 VanDerWaalsContact O-N 3.15Å
37	M	94.3	Very high	95.2	Very high	101 Å²	101	87.9 Å²	87.9	50%	0.498	46%	0.463	S	S	.	.	S	Bend	trans	-81.3	143.6	177.3	-66.6	-154.2	-175.3	0	0	111.7	T34 S35 L300 K301	T34-M37 WeakPolarHBondContact O-CB 3.38Å; T34-M37 PolarHBondContact O-N 2.75Å; S35-M37 VanDerWaalsContact C-N 3.31Å; S35-M37 PolarHBondContact O-N 3.23Å; M37-L300 HydrophobicContact SD-CD1 3.6Å; M37-L300 VanDerWaalsContact SD-CD1 3.6Å; M37-K301 WeakPolarHBondContact O-CE 3.44Å; M37-K301 PolarHBondContact O-NZ 2.87Å
38	D	93.4	Very high	95.4	Very high	140 Å²	140	86.2 Å²	86.2	75%	0.749	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-67.8	146.7	173	-63.4	-42.2	0	0	0	111.4	R283	D38-R283 PolarHBondContact O-NH2 3.25Å
39	S	91.6	Very high	95.5	Very high	76 Å²	76	89.9 Å²	89.9	53%	0.531	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-66.2	146.4	170.1	178.8	0	0	0	0	110.3	G41	S39-G41 PolarHBondContact O-N 3.38Å; S39-G41 VanDerWaalsContact O-N 3.11Å; S39-G41 PolarHBondContact OG-N 2.92Å
40	V	94.6	Very high	95.7	Very high	45 Å²	45	88.2 Å²	88.2	27%	0.273	44%	0.441	S	S	.	.			trans	-62.8	-12.2	172	-67.9	0	0	0	0	113.7	R283 L284 D298 A305	V40-R283 HydrophobicContact CG1-CG 3.56Å; V40-R283 VanDerWaalsContact CG1-CZ 3.44Å; V40-L284 HydrophobicContact CG1-CD2 4.31Å; V40-L284 HydrophobicContact CG2-CD2 4.21Å; V40-D298 HydrophobicContact CG2-CB 4.02Å; V40-A305 HydrophobicContact CG2-CB 3.51Å
41	G	94.7	Very high	95.9	Very high	38 Å²	38	86.8 Å²	86.8	39%	0.392	43%	0.434	S	S	.	.			trans	72.3	-173.2	-174.1	0	0	0	0	0	112.5	S39 I43	S39-G41 PolarHBondContact O-N 3.38Å; S39-G41 VanDerWaalsContact O-N 3.11Å; S39-G41 PolarHBondContact OG-N 2.92Å; G41-I43 PolarHBondContact O-N 3.19Å
42	R	96.2	Very high	96	Very high	204 Å²	204	91.2 Å²	91.2	77%	0.77	44%	0.444	S	S	*	.			trans	-77.5	114.2	-176.4	-171.7	177	177.7	-179.9	3.8	111	Q44 A305	R42-Q44 HydrophobicContact CG-CG 4.17Å; R42-A305 CarbonylContact C-O 3.56Å; R42-A305 WeakPolarHBondContact CA-O 3.22Å
43	I	96.8	Very high	96.1	Very high	42 Å²	42	86.8 Å²	86.8	22%	0.215	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-83.2	120.4	175.1	-58.4	-61.3	0	0	0	109.4	G41 M45 L284 A305	G41-I43 PolarHBondContact O-N 3.19Å; I43-M45 HydrophobicContact CG2-CE 4.09Å; I43-M45 HydrophobicContact CG2-CG 3.9Å; I43-L284 HydrophobicContact CG1-CD2 4.37Å; I43-A305 HydrophobicContact CG1-CB 3.96Å; I43-A305 PolarHBondContact N-O 3.32Å
44	Q	96.4	Very high	96.2	Very high	124 Å²	124	81.5 Å²	81.5	58%	0.579	40%	0.403	S	S	*	.			trans	-122.8	80	177.6	-65.1	-174.5	-0.8	0	0	110.1	R42	R42-Q44 HydrophobicContact CG-CG 4.17Å
45	M	97.3	Very high	96.3	Very high	46 Å²	46	87.9 Å²	87.9	23%	0.227	44%	0.436	C	S	.	.			trans	-75.4	151	172.6	-56	179.2	170.5	0	0	110.2	I43 L284 L308 V327 W339	I43-M45 HydrophobicContact CG2-CE 4.09Å; I43-M45 HydrophobicContact CG2-CG 3.9Å; M45-L284 HydrophobicContact CE-CD1 4.46Å; M45-L308 HydrophobicContact CB-CD2 3.63Å; M45-L308 HydrophobicContact CG-CD2 4.06Å; M45-L308 HydrophobicContact SD-CD1 4.27Å; M45-L308 HydrophobicContact SD-CD2 3.98Å; M45-V327 HydrophobicContact SD-CG1 3.84Å; M45-W339 HydrophobicContact CB-CB 4.07Å; M45-W339 HydrophobicContact SD-CB 4.37Å
46	R	97.8	Very high	96.5	Very high	166 Å²	166	86 Å²	86	63%	0.626	43%	0.425	S	S	*	.			trans	-118.5	145.1	176.6	-64	-176	-179	-174.3	0.7	110.2	R48 W339 N340	R46-R48 PolarHBondContact O-N 3.43Å; R46-R48 VanDerWaalsContact O-N 3.16Å; R46-W339 WeakPolarHBondContact O-CA 3.41Å; R46-N340 PolarHBondContact N-O 3.37Å; R46-N340 VanDerWaalsContact N-O 3.13Å; R46-N340 PolarHBondContact O-N 3.09Å
47	T	98.2	Very high	96.6	Very high	46 Å²	46	82 Å²	82	28%	0.282	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	118.9	169.7	-50.7	0	0	0	0	109.1	R49 R337 I338 W339	T47-R49 VanDerWaalsContact CG2-O 3.25Å; T47-R49 WeakPolarHBondContact CG2-O 3.39Å; T47-R337 HydrophobicContact CG2-CB 4.03Å; T47-R337 HydrophobicContact CG2-CG 4.1Å; T47-I338 CarbonylContact C-O 3.48Å; T47-I338 WeakPolarHBondContact CA-O 3.4Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.49Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.26Å
48	R	98.1	Very high	96.8	Very high	118 Å²	118	77.2 Å²	77.2	45%	0.445	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-30.6	174.9	-59	-51.6	176.1	169.5	-0.5	112.9	R46 I338 N340	R46-R48 PolarHBondContact O-N 3.43Å; R46-R48 VanDerWaalsContact O-N 3.16Å; R48-I338 PolarHBondContact N-O 3.16Å; R48-N340 WeakPolarHBondContact CD-OD1 3.41Å; R48-N340 WeakPolarHBondContact CG-OD1 3.21Å; R48-N340 PolarHBondContact NE-O 3.01Å; R48-N340 PolarHBondContact NE-OD1 2.76Å; R48-N340 PolarHBondContact NH2-O 3.27Å; R48-N340 VanDerWaalsContact NH2-O 3.15Å
49	R	98.1	Very high	97.1	Very high	113 Å²	113	73.4 Å²	73.4	43%	0.426	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	147.8	180	-57.3	-68	-174.3	-89.6	-0.6	110.3	T47 Y85 T87 R337 I338	T47-R49 VanDerWaalsContact CG2-O 3.25Å; T47-R49 WeakPolarHBondContact CG2-O 3.39Å; R49-Y85 PolarHBondContact NE-O 2.81Å; R49-Y85 PolarHBondContact NH2-O 2.82Å; R49-T87 HydrophobicContact CB-CG2 4.09Å; R49-T87 HydrophobicContact CG-CG2 4.16Å; R49-R337 WeakPolarHBondContact O-CA 3.16Å; R49-I338 HydrophobicContact CB-CB 4.1Å; R49-I338 HydrophobicContact CB-CD1 4.09Å; R49-I338 HydrophobicContact CB-CG1 4.34Å; R49-I338 HydrophobicContact CG-CD1 4.47Å; R49-I338 PolarHBondContact N-O 3.32Å; R49-I338 PolarHBondContact O-N 2.92Å
50	T	98.3	Very high	97.4	Very high	28 Å²	28	70.4 Å²	70.4	17%	0.172	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	112.8	169.9	-53.8	0	0	0	0	107.6	R52 F335 L336	T50-R52 HydrophobicContact CG2-CG 4.19Å; T50-F335 HydrophobicContact CG2-CB 4.3Å; T50-F335 HydrophobicContact CG2-CD1 4.11Å; T50-F335 HydrophobicContact CG2-CG 4.35Å; T50-L336 CarbonylContact C-O 3.59Å; T50-L336 WeakPolarHBondContact CA-O 3.15Å
51	L	98.3	Very high	97.6	Very high	1 Å²	1	68.6 Å²	68.6	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	119.9	179.2	-52	-178.1	0	0	0	108.5	L70 W82 T87 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.23Å; L51-L70 HydrophobicContact CD1-CD2 4.01Å; L51-W82 HydrophobicContact CB-CD2 4.14Å; L51-W82 HydrophobicContact CB-CE3 3.89Å; L51-W82 HydrophobicContact CB-CH2 4.28Å; L51-W82 HydrophobicContact CB-CZ3 3.96Å; L51-W82 HydrophobicContact CD1-CB 3.91Å; L51-W82 HydrophobicContact CD1-CD2 4Å; L51-W82 HydrophobicContact CD1-CE3 4.34Å; L51-W82 HydrophobicContact CD1-CG 3.81Å; L51-W82 HydrophobicContact CD2-CE3 4.34Å; L51-W82 HydrophobicContact CG-CE3 4.42Å; L51-T87 HydrophobicContact CD2-CG2 3.81Å; L51-L336 HydrophobicContact CB-CB 4.08Å; L51-L336 HydrophobicContact CB-CD1 4.28Å; L51-L336 HydrophobicContact CD1-CB 4.11Å; L51-L336 HydrophobicContact CG-CB 4.31Å; L51-L336 PolarHBondContact N-O 3.3Å; L51-L336 PolarHBondContact O-N 3.27Å; L51-I338 HydrophobicContact CD1-CD1 4.28Å; L51-I338 HydrophobicContact CD2-CD1 4.47Å; L51-I338 HydrophobicContact CG-CD1 4.47Å
52	R	97.8	Very high	97.8	Very high	154 Å²	154	68.5 Å²	68.5	58%	0.581	31%	0.31	S	S	*	.			trans	-117.2	130	-176.3	-57.8	-169.9	172.3	80.6	-1.9	110.4	T50 W82 K89 F335	T50-R52 HydrophobicContact CG2-CG 4.19Å; R52-W82 WeakPolarHBondContact O-CH2 3.08Å; R52-W82 WeakPolarHBondContact O-CZ3 3.32Å; R52-K89 WeakPolarHBondContact O-CE 3.38Å; R52-K89 PolarHBondContact O-NZ 3.15Å; R52-F335 HydrophobicContact CB-CD1 4.49Å; R52-F335 HydrophobicContact CB-CE1 4.33Å; R52-F335 HydrophobicContact CG-CD1 3.82Å; R52-F335 HydrophobicContact CG-CE1 3.72Å
53	G	96.2	Very high	97.9	Very high	27 Å²	27	59.2 Å²	59.2	28%	0.278	28%	0.275	S	S	.	.			trans	163.8	-17.3	174.7	0	0	0	0	0	116.8
54	H	98.2	Very high	98	Very high	8 Å²	8	57.2 Å²	57.2	4%	0.037	26%	0.264	C	S	.	.			trans	-74.1	151	166.9	-73.3	-61.6	0	0	0	110.5	I58 S72 S74 D76 I80	H54-I58 HydrophobicContact CB-CG1 4.27Å; H54-S72 PolarHBondContact NE2-OG 2.85Å; H54-S74 VanDerWaalsContact CE1-CB 3.43Å; H54-S74 WeakPolarHBondContact CE1-CB 3.37Å; H54-S74 WeakPolarHBondContact ND1-CB 3.44Å; H54-S74 PolarHBondContact ND1-OG 3.03Å; H54-D76 WeakPolarHBondContact CA-OD2 3.49Å; H54-D76 IonicContact ND1-OD1 3.76Å; H54-D76 PolarHBondContact ND1-OD1 2.91Å; H54-D76 IonicContact ND1-OD2 2.76Å; H54-D76 PolarHBondContact ND1-OD2 3.44Å; H54-I80 VanDerWaalsContact CE1-CD1 3.45Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.32Å
55	L	97.1	Very high	97.9	Very high	141 Å²	141	55.7 Å²	55.7	74%	0.738	25%	0.254	S	S	*	.	S	Bend	trans	-110.5	-2.6	179.4	-58.5	178.3	0	0	0	112.6	D76	L55-D76 HydrophobicContact CB-CB 4.24Å; L55-D76 PolarHBondContact N-OD2 3.02Å
56	A	97.9	Very high	97.8	Very high	31 Å²	31	57.6 Å²	57.6	26%	0.256	27%	0.265	S	S	.	.	S	Bend	trans	-143.4	-173.7	-179.1	0	0	0	0	0	110.4	I58 Q75 D76 S334	A56-I58 PolarHBondContact O-N 3.41Å; A56-Q75 HydrophobicContact CB-CB 4.26Å; A56-D76 HydrophobicContact CB-CB 3.87Å; A56-S334 WeakPolarHBondContact O-CA 3.43Å; A56-S334 WeakPolarHBondContact O-CB 3.44Å
57	K	98.3	Very high	97.8	Very high	74 Å²	74	50.2 Å²	50.2	32%	0.322	24%	0.239	S	C	.	.			trans	-60.4	128.7	-178.8	-60.4	174.3	177.3	-175.2	0	110.8	Y59 S74 Q75 W332	K57-Y59 HydrophobicContact CB-CD2 4.31Å; K57-Y59 HydrophobicContact CB-CE2 4Å; K57-Y59 HydrophobicContact CD-CE2 4.47Å; K57-S74 VanDerWaalsContact O-CA 3.28Å; K57-S74 WeakPolarHBondContact O-CA 3.42Å; K57-S74 PolarHBondContact O-OG 2.97Å; K57-Q75 PolarHBondContact O-N 3.16Å; K57-W332 HydrophobicContact CB-CB 4.22Å; K57-W332 HydrophobicContact CB-CD2 4.46Å; K57-W332 HydrophobicContact CB-CG 3.91Å; K57-W332 HydrophobicContact CD-CB 4.32Å; K57-W332 HydrophobicContact CD-CD2 3.63Å; K57-W332 HydrophobicContact CD-CE3 3.9Å; K57-W332 HydrophobicContact CD-CG 3.86Å; K57-W332 HydrophobicContact CD-CZ3 4.47Å; K57-W332 HydrophobicContact CG-CB 3.89Å; K57-W332 HydrophobicContact CG-CD2 4.15Å; K57-W332 HydrophobicContact CG-CG 3.82Å
58	I	98.7	Very high	97.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	140	168	-60.5	169.4	0	0	0	107.5	H54 A56 S316 S331 W332 L336	H54-I58 HydrophobicContact CB-CG1 4.27Å; A56-I58 PolarHBondContact O-N 3.41Å; I58-S316 WeakPolarHBondContact O-CB 3.39Å; I58-S316 PolarHBondContact O-OG 3.48Å; I58-S331 WeakPolarHBondContact CB-O 3.31Å; I58-S331 PolarHBondContact N-O 2.82Å; I58-W332 VanDerWaalsContact O-CD1 3.26Å; I58-L336 HydrophobicContact CD1-CD1 3.46Å; I58-L336 VanDerWaalsContact CD1-CD1 3.46Å; I58-L336 HydrophobicContact CD1-CG 3.76Å
59	Y	98.4	Very high	97.8	Very high	59 Å²	59	48.9 Å²	48.9	23%	0.231	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-46.2	177.6	-94.8	-108.8	0	0	0	111.5	K57 A73 Q75 C317 W332	K57-Y59 HydrophobicContact CB-CD2 4.31Å; K57-Y59 HydrophobicContact CB-CE2 4Å; K57-Y59 HydrophobicContact CD-CE2 4.47Å; Y59-A73 PolarHBondContact N-O 2.96Å; Y59-Q75 HydrophobicContact CD2-CG 3.76Å; Y59-Q75 HydrophobicContact CE2-CG 3.64Å; Y59-Q75 PolarHBondContact OH-NE2 3.09Å; Y59-C317 WeakPolarHBondContact O-CB 3.34Å; Y59-W332 HydrophobicContact CE2-CZ2 4.32Å; Y59-W332 AromaticContact CE2-NE1 3.69Å; Y59-W332 AromaticContact CZ-CZ2 3.88Å; Y59-W332 AromaticContact CZ-NE1 3.98Å; Y59-W332 WeakPolarHBondContact OH-CZ2 3.31Å
60	A	98.5	Very high	97.8	Very high	13 Å²	13	43.5 Å²	43.5	11%	0.107	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	152.4	-176.9	0	0	0	0	0	111.5	S72 A73 M101	A60-S72 WeakPolarHBondContact O-CA 3.16Å; A60-A73 HydrophobicContact CB-CB 4.49Å; A60-A73 PolarHBondContact O-N 3.4Å; A60-M101 WeakPolarHBondContact CB-O 3.43Å
61	M	98.6	Very high	97.8	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.039	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154	166.1	71.8	78.9	53.5	0	0	108.9	W63 L70 V71 C317 A328 L336	M61-W63 HydrophobicContact CE-CD2 4.33Å; M61-W63 HydrophobicContact CE-CG 4.25Å; M61-L70 HydrophobicContact CE-CB 4.06Å; M61-L70 HydrophobicContact CE-CD1 3.8Å; M61-L70 HydrophobicContact CE-CD2 4.47Å; M61-L70 HydrophobicContact CE-CG 4.32Å; M61-V71 CarbonylContact C-O 3.58Å; M61-V71 WeakPolarHBondContact CA-O 3.41Å; M61-V71 WeakPolarHBondContact CB-O 3.36Å; M61-C317 HydrophobicContact CG-CB 4.17Å; M61-C317 VanDerWaalsContact CG-SG 3.55Å; M61-A328 HydrophobicContact CE-CB 3.52Å; M61-A328 HydrophobicContact SD-CB 4.26Å; M61-L336 HydrophobicContact CB-CD2 3.87Å; M61-L336 HydrophobicContact CG-CD2 4.27Å
62	H	98.8	Very high	97.9	Very high	35 Å²	35	42.1 Å²	42.1	16%	0.162	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	130.4	173.2	-169	-160.9	0	0	0	109.2	L70 V71 Y105	H62-L70 WeakPolarHBondContact O-CA 3.11Å; H62-V71 HydrophobicContact CB-CG1 4.07Å; H62-V71 PolarHBondContact N-O 2.9Å; H62-V71 PolarHBondContact O-N 3.48Å; H62-Y105 PolarHBondContact ND1-N 3.37Å; H62-Y105 VanDerWaalsContact ND1-N 3.12Å
63	W	98.7	Very high	97.9	Very high	9 Å²	9	34.8 Å²	34.8	3%	0.034	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	146.2	170.9	-73.5	107.7	0	0	0	110.6	M61 L70 G319 T321 A328 I338	M61-W63 HydrophobicContact CE-CD2 4.33Å; M61-W63 HydrophobicContact CE-CG 4.25Å; W63-L70 HydrophobicContact CD2-CB 4.09Å; W63-L70 HydrophobicContact CD2-CD2 4.35Å; W63-L70 HydrophobicContact CE3-CB 3.72Å; W63-L70 HydrophobicContact CE3-CD2 3.84Å; W63-L70 HydrophobicContact CE3-CG 4.43Å; W63-L70 HydrophobicContact CH2-CD2 3.57Å; W63-L70 HydrophobicContact CZ2-CD2 4.11Å; W63-L70 HydrophobicContact CZ3-CB 4.17Å; W63-L70 HydrophobicContact CZ3-CD2 3.42Å; W63-L70 VanDerWaalsContact CZ3-CD2 3.42Å; W63-L70 HydrophobicContact CZ3-CG 4.41Å; W63-G319 PolarHBondContact NE1-O 3.42Å; W63-T321 HydrophobicContact CD2-CG2 3.63Å; W63-T321 HydrophobicContact CE3-CG2 3.78Å; W63-T321 HydrophobicContact CG-CG2 4.2Å; W63-T321 HydrophobicContact CH2-CG2 3.9Å; W63-T321 HydrophobicContact CZ2-CG2 3.73Å; W63-T321 HydrophobicContact CZ3-CG2 3.91Å; W63-A328 HydrophobicContact CH2-CB 4.45Å; W63-A328 HydrophobicContact CZ2-CB 3.43Å; W63-A328 VanDerWaalsContact CZ2-CB 3.43Å; W63-I338 HydrophobicContact CH2-CD1 4.08Å; W63-I338 HydrophobicContact CH2-CG1 4.4Å
64	G	97.4	Very high	98	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.			trans	-76.8	157.9	160.4	0	0	0	0	0	110.6	D66 S67 L69	G64-D66 PolarHBondContact O-N 2.75Å; G64-D66 VanDerWaalsContact O-N 3.14Å; G64-S67 PolarHBondContact O-N 2.85Å; G64-S67 VanDerWaalsContact O-N 3.07Å; G64-L69 PolarHBondContact N-O 2.89Å
65	Y	95.1	Very high	97.9	Very high	93 Å²	93	34.8 Å²	34.8	37%	0.365	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-7.5	-178.3	-74.8	-105	0	0	0	113.5	S67 P107 M196 D322	Y65-S67 PolarHBondContact O-N 2.98Å; Y65-P107 VanDerWaalsContact CD2-CA 3.44Å; Y65-P107 HydrophobicContact CD2-CB 4.04Å; Y65-P107 HydrophobicContact CD2-CG 4.4Å; Y65-P107 HydrophobicContact CE2-CB 3.84Å; Y65-P107 HydrophobicContact CE2-CG 3.73Å; Y65-P107 HydrophobicContact CG-CB 4.45Å; Y65-M196 WeakPolarHBondContact OH-CE 3.45Å; Y65-D322 VanDerWaalsContact CA-OD2 3.31Å; Y65-D322 WeakPolarHBondContact CA-OD2 3.46Å; Y65-D322 WeakPolarHBondContact CD1-OD2 3.43Å
66	D	96.4	Very high	97.9	Very high	86 Å²	86	29.9 Å²	29.9	46%	0.46	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-0.8	171.2	71	-10	0	0	0	113.1	G64 R68 L69	G64-D66 PolarHBondContact O-N 2.75Å; G64-D66 VanDerWaalsContact O-N 3.14Å; D66-R68 PolarHBondContact O-N 3.33Å; D66-R68 VanDerWaalsContact O-N 3.08Å; D66-R68 PolarHBondContact OD1-N 2.97Å; D66-L69 PolarHBondContact OD1-N 2.86Å; D66-L69 WeakPolarHBondContact OD2-CG 3.46Å
67	S	97.6	Very high	97.8	Very high	11 Å²	11	28.9 Å²	28.9	8%	0.077	14%	0.135	C	C	.	.	S	Bend	trans	56.1	21.9	-177.5	-61.6	0	0	0	0	113.9	G64 Y65 D322 D323	G64-S67 PolarHBondContact O-N 2.85Å; G64-S67 VanDerWaalsContact O-N 3.07Å; Y65-S67 PolarHBondContact O-N 2.98Å; S67-D322 PolarHBondContact OG-N 3.09Å; S67-D323 VanDerWaalsContact CB-CG 3.46Å; S67-D323 WeakPolarHBondContact CB-OD2 3.28Å; S67-D323 PolarHBondContact OG-N 3.06Å
68	R	97.4	Very high	97.7	Very high	100 Å²	100	29 Å²	29	38%	0.377	14%	0.136	S	C	.	.	S	Bend	trans	-132.1	-52.6	-176.5	178.3	180	175.9	-177.8	-3.3	111.9	D66 D83 S84 Y85	D66-R68 PolarHBondContact O-N 3.33Å; D66-R68 VanDerWaalsContact O-N 3.08Å; D66-R68 PolarHBondContact OD1-N 2.97Å; R68-D83 WeakPolarHBondContact CG-OD1 3.47Å; R68-D83 IonicContact CZ-OD1 3.47Å; R68-D83 IonicContact CZ-OD2 3.99Å; R68-D83 IonicContact NE-OD1 3.42Å; R68-D83 PolarHBondContact NE-OD1 2.82Å; R68-D83 IonicContact NE-OD2 3.52Å; R68-D83 PolarHBondContact NE-OD2 3.46Å; R68-D83 IonicContact NH2-OD1 3.48Å; R68-D83 IonicContact NH2-OD2 2.84Å; R68-D83 PolarHBondContact NH2-OD2 2.93Å; R68-S84 WeakPolarHBondContact CA-OG 3.48Å; R68-S84 WeakPolarHBondContact O-CB 3.35Å; R68-S84 PolarHBondContact O-N 3.33Å; R68-S84 PolarHBondContact O-OG 3.45Å; R68-Y85 HydrophobicContact CG-CD1 4.19Å; R68-Y85 HydrophobicContact CG-CD2 4.5Å; R68-Y85 HydrophobicContact CG-CE1 4.37Å; R68-Y85 HydrophobicContact CG-CG 4.25Å
69	L	98.2	Very high	97.7	Very high	35 Å²	35	29 Å²	29	18%	0.183	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	146.6	177	-64.5	177.6	0	0	0	109.2	G64 D66 W82 D83 M90 Y105	G64-L69 PolarHBondContact N-O 2.89Å; D66-L69 PolarHBondContact OD1-N 2.86Å; D66-L69 WeakPolarHBondContact OD2-CG 3.46Å; L69-W82 VanDerWaalsContact CA-O 3.31Å; L69-W82 WeakPolarHBondContact CA-O 3.39Å; L69-W82 WeakPolarHBondContact CD2-O 3.28Å; L69-D83 HydrophobicContact CD2-CB 4.18Å; L69-M90 HydrophobicContact CD2-CG 3.98Å; L69-Y105 WeakPolarHBondContact CD1-OH 3.33Å
70	L	98.5	Very high	97.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	149.6	170.6	68.9	103.7	0	0	0	110	L51 M61 H62 W63 I81 W82 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.23Å; L51-L70 HydrophobicContact CD1-CD2 4.01Å; M61-L70 HydrophobicContact CE-CB 4.06Å; M61-L70 HydrophobicContact CE-CD1 3.8Å; M61-L70 HydrophobicContact CE-CD2 4.47Å; M61-L70 HydrophobicContact CE-CG 4.32Å; H62-L70 WeakPolarHBondContact O-CA 3.11Å; W63-L70 HydrophobicContact CD2-CB 4.09Å; W63-L70 HydrophobicContact CD2-CD2 4.35Å; W63-L70 HydrophobicContact CE3-CB 3.72Å; W63-L70 HydrophobicContact CE3-CD2 3.84Å; W63-L70 HydrophobicContact CE3-CG 4.43Å; W63-L70 HydrophobicContact CH2-CD2 3.57Å; W63-L70 HydrophobicContact CZ2-CD2 4.11Å; W63-L70 HydrophobicContact CZ3-CB 4.17Å; W63-L70 HydrophobicContact CZ3-CD2 3.42Å; W63-L70 VanDerWaalsContact CZ3-CD2 3.42Å; W63-L70 HydrophobicContact CZ3-CG 4.41Å; L70-I81 CarbonylContact O-C 3.56Å; L70-I81 WeakPolarHBondContact O-CA 3.42Å; L70-W82 HydrophobicContact CD1-CB 4.47Å; L70-W82 HydrophobicContact CD1-CG 4.32Å; L70-W82 HydrophobicContact CG-CB 4.18Å; L70-W82 PolarHBondContact N-O 2.94Å; L70-W82 VanDerWaalsContact N-O 3.13Å; L70-W82 PolarHBondContact O-N 2.74Å; L70-L336 HydrophobicContact CD1-CD2 3.82Å; L70-I338 HydrophobicContact CD2-CD1 4.43Å
71	V	98.7	Very high	97.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.4	173.1	62.9	0	0	0	0	109.7	M61 H62 L79 I80 I81 C103 Y105 V112	M61-V71 CarbonylContact C-O 3.58Å; M61-V71 WeakPolarHBondContact CA-O 3.41Å; M61-V71 WeakPolarHBondContact CB-O 3.36Å; H62-V71 HydrophobicContact CB-CG1 4.07Å; H62-V71 PolarHBondContact N-O 2.9Å; H62-V71 PolarHBondContact O-N 3.48Å; V71-L79 HydrophobicContact CG2-CD1 3.5Å; V71-L79 VanDerWaalsContact CG2-CD1 3.5Å; V71-L79 HydrophobicContact CG2-CD2 4.01Å; V71-L79 HydrophobicContact CG2-CG 3.5Å; V71-I80 CarbonylContact C-O 3.57Å; V71-I80 WeakPolarHBondContact CA-O 3.4Å; V71-I81 HydrophobicContact CB-CG1 4.32Å; V71-I81 HydrophobicContact CG2-CG1 4.16Å; V71-C103 HydrophobicContact CG1-CB 4.31Å; V71-C103 HydrophobicContact CG2-CB 4.43Å; V71-Y105 HydrophobicContact CB-CD2 4.06Å; V71-Y105 HydrophobicContact CG1-CD2 4.01Å; V71-V112 HydrophobicContact CB-CG1 4.31Å; V71-V112 HydrophobicContact CG1-CG1 4.48Å; V71-V112 HydrophobicContact CG2-CG1 4.3Å
72	S	98.8	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.9	170.9	64.2	0	0	0	0	111.7	H54 A60 L79 I80 W82	H54-S72 PolarHBondContact NE2-OG 2.85Å; A60-S72 WeakPolarHBondContact O-CA 3.16Å; S72-L79 WeakPolarHBondContact O-CA 3.47Å; S72-I80 PolarHBondContact N-O 3.43Å; S72-I80 PolarHBondContact O-N 2.91Å; S72-W82 PolarHBondContact OG-NE1 3.09Å
73	A	98.5	Very high	97.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.2	-178.9	0	0	0	0	0	110.9	Y59 A60 L79 V100 C103	Y59-A73 PolarHBondContact N-O 2.96Å; A60-A73 HydrophobicContact CB-CB 4.49Å; A60-A73 PolarHBondContact O-N 3.4Å; A73-L79 HydrophobicContact CB-CD1 3.69Å; A73-V100 HydrophobicContact CB-CB 4.38Å; A73-V100 HydrophobicContact CB-CG1 3.73Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; A73-C103 HydrophobicContact CB-CB 3.9Å
74	S	98.3	Very high	97.5	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	154.2	-174.1	153.3	0	0	0	0	112	H54 K57 D76 G77 K78 V100	H54-S74 VanDerWaalsContact CE1-CB 3.43Å; H54-S74 WeakPolarHBondContact CE1-CB 3.37Å; H54-S74 WeakPolarHBondContact ND1-CB 3.44Å; H54-S74 PolarHBondContact ND1-OG 3.03Å; K57-S74 VanDerWaalsContact O-CA 3.28Å; K57-S74 WeakPolarHBondContact O-CA 3.42Å; K57-S74 PolarHBondContact O-OG 2.97Å; S74-D76 WeakPolarHBondContact CB-OD1 3.16Å; S74-D76 PolarHBondContact O-N 2.79Å; S74-D76 VanDerWaalsContact O-N 3.09Å; S74-D76 PolarHBondContact OG-N 2.89Å; S74-D76 PolarHBondContact OG-OD1 3.11Å; S74-G77 PolarHBondContact O-N 3.31Å; S74-G77 VanDerWaalsContact O-N 3.11Å; S74-K78 PolarHBondContact N-O 3.24Å; S74-V100 VanDerWaalsContact O-CG1 3.23Å; S74-V100 WeakPolarHBondContact O-CG1 3.19Å
75	Q	96.9	Very high	97.5	Very high	36 Å²	36	30.5 Å²	30.5	17%	0.168	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-1.8	180	-74.5	-174	-23.3	0	0	115.1	A56 K57 Y59 G77 S98 W99	A56-Q75 HydrophobicContact CB-CB 4.26Å; K57-Q75 PolarHBondContact O-N 3.16Å; Y59-Q75 HydrophobicContact CD2-CG 3.76Å; Y59-Q75 HydrophobicContact CE2-CG 3.64Å; Y59-Q75 PolarHBondContact OH-NE2 3.09Å; Q75-G77 PolarHBondContact O-N 2.81Å; Q75-S98 CarbonylContact C-O 3.56Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.48Å; Q75-W99 VanDerWaalsContact NE2-CE3 3.3Å
76	D	95.6	Very high	97.6	Very high	38 Å²	38	28.9 Å²	28.9	20%	0.203	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	5.7	167.1	65.2	-8.8	0	0	0	112.6	H54 L55 A56 S74 K78	H54-D76 WeakPolarHBondContact CA-OD2 3.49Å; H54-D76 IonicContact ND1-OD1 3.76Å; H54-D76 PolarHBondContact ND1-OD1 2.91Å; H54-D76 IonicContact ND1-OD2 2.76Å; H54-D76 PolarHBondContact ND1-OD2 3.44Å; L55-D76 HydrophobicContact CB-CB 4.24Å; L55-D76 PolarHBondContact N-OD2 3.02Å; A56-D76 HydrophobicContact CB-CB 3.87Å; S74-D76 WeakPolarHBondContact CB-OD1 3.16Å; S74-D76 PolarHBondContact O-N 2.79Å; S74-D76 VanDerWaalsContact O-N 3.09Å; S74-D76 PolarHBondContact OG-N 2.89Å; S74-D76 PolarHBondContact OG-OD1 3.11Å; D76-K78 VanDerWaalsContact C-N 3.35Å; D76-K78 WeakPolarHBondContact OD1-CB 3.49Å; D76-K78 PolarHBondContact OD1-N 3.02Å
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	70.7	31.2	-178.8	0	0	0	0	0	112.5	S74 Q75 L95	S74-G77 PolarHBondContact O-N 3.31Å; S74-G77 VanDerWaalsContact O-N 3.11Å; Q75-G77 PolarHBondContact O-N 2.81Å; G77-L95 WeakPolarHBondContact O-CB 3.32Å; G77-L95 PolarHBondContact O-N 2.89Å
78	K	97.1	Very high	97.7	Very high	77 Å²	77	31.6 Å²	31.6	34%	0.335	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.6	177.8	-63.1	-175.3	-178.6	175.4	0	112.1	S74 D76 I80 I93	S74-K78 PolarHBondContact N-O 3.24Å; D76-K78 VanDerWaalsContact C-N 3.35Å; D76-K78 WeakPolarHBondContact OD1-CB 3.49Å; D76-K78 PolarHBondContact OD1-N 3.02Å; K78-I80 HydrophobicContact CB-CG1 4.26Å; K78-I93 WeakPolarHBondContact CA-O 3.48Å
79	L	97.6	Very high	97.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.9	164.1	-166.4	73.8	0	0	0	107.8	V71 S72 A73 I93 L95 C103 V112 C114 Y124	V71-L79 HydrophobicContact CG2-CD1 3.5Å; V71-L79 VanDerWaalsContact CG2-CD1 3.5Å; V71-L79 HydrophobicContact CG2-CD2 4.01Å; V71-L79 HydrophobicContact CG2-CG 3.5Å; S72-L79 WeakPolarHBondContact O-CA 3.47Å; A73-L79 HydrophobicContact CB-CD1 3.69Å; L79-I93 HydrophobicContact CB-CB 4.23Å; L79-I93 HydrophobicContact CD2-CD1 4.21Å; L79-I93 PolarHBondContact N-O 2.82Å; L79-I93 PolarHBondContact O-N 2.6Å; L79-L95 HydrophobicContact CB-CD1 4.46Å; L79-L95 HydrophobicContact CB-CD2 3.98Å; L79-L95 HydrophobicContact CB-CG 4.38Å; L79-C103 HydrophobicContact CD1-CB 3.59Å; L79-V112 HydrophobicContact CD2-CB 4.19Å; L79-V112 HydrophobicContact CD2-CG2 3.64Å; L79-C114 HydrophobicContact CD1-CB 4.14Å; L79-C114 HydrophobicContact CD2-CB 4.29Å; L79-Y124 HydrophobicContact CD2-CD2 4.4Å
80	I	98.3	Very high	97.4	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.6	-177.4	-56.4	178.4	0	0	0	109.3	H54 V71 S72 K78 W82 K89 H91 A92	H54-I80 VanDerWaalsContact CE1-CD1 3.45Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.32Å; V71-I80 CarbonylContact C-O 3.57Å; V71-I80 WeakPolarHBondContact CA-O 3.4Å; S72-I80 PolarHBondContact N-O 3.43Å; S72-I80 PolarHBondContact O-N 2.91Å; K78-I80 HydrophobicContact CB-CG1 4.26Å; I80-W82 HydrophobicContact CB-CZ2 3.79Å; I80-W82 HydrophobicContact CD1-CH2 4.15Å; I80-W82 HydrophobicContact CD1-CZ2 3.74Å; I80-W82 HydrophobicContact CG1-CZ2 4.35Å; I80-W82 HydrophobicContact CG2-CD2 3.7Å; I80-W82 HydrophobicContact CG2-CE3 4.23Å; I80-W82 HydrophobicContact CG2-CG 4.2Å; I80-W82 HydrophobicContact CG2-CH2 4.05Å; I80-W82 HydrophobicContact CG2-CZ2 3.47Å; I80-W82 VanDerWaalsContact CG2-CZ2 3.47Å; I80-W82 HydrophobicContact CG2-CZ3 4.39Å; I80-W82 PolarHBondContact O-NE1 2.87Å; I80-K89 HydrophobicContact CG2-CB 4.19Å; I80-K89 HydrophobicContact CG2-CD 4.18Å; I80-K89 HydrophobicContact CG2-CG 3.96Å; I80-H91 WeakPolarHBondContact CA-O 3.3Å; I80-H91 WeakPolarHBondContact CG2-O 3.22Å; I80-A92 HydrophobicContact CG1-CB 4.41Å
81	I	98.1	Very high	97.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.7	171.5	-57.7	177.8	0	0	0	108	L70 V71 K89 M90 H91 Y105 V112 L126	L70-I81 CarbonylContact O-C 3.56Å; L70-I81 WeakPolarHBondContact O-CA 3.42Å; V71-I81 HydrophobicContact CB-CG1 4.32Å; V71-I81 HydrophobicContact CG2-CG1 4.16Å; I81-K89 CarbonylContact O-C 3.53Å; I81-M90 HydrophobicContact CB-CB 4.44Å; I81-M90 HydrophobicContact CG2-CB 4.2Å; I81-M90 PolarHBondContact O-N 2.84Å; I81-H91 HydrophobicContact CB-CB 4.21Å; I81-H91 HydrophobicContact CD1-CB 4.19Å; I81-H91 HydrophobicContact CG1-CB 4.34Å; I81-H91 PolarHBondContact N-O 3.47Å; I81-H91 PolarHBondContact O-N 3.09Å; I81-Y105 HydrophobicContact CD1-CE2 4.37Å; I81-Y105 HydrophobicContact CG2-CE2 4.24Å; I81-V112 HydrophobicContact CD1-CG1 3.92Å; I81-V112 HydrophobicContact CD1-CG2 4.37Å; I81-L126 HydrophobicContact CD1-CD1 3.42Å; I81-L126 VanDerWaalsContact CD1-CD1 3.42Å; I81-L126 HydrophobicContact CD1-CD2 3.36Å; I81-L126 HydrophobicContact CD1-CG 4.02Å
82	W	98.5	Very high	97.1	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.7	-174.1	-48.4	82.7	0	0	0	110.7	L51 R52 L69 L70 S72 I80 N88 K89 L336	L51-W82 HydrophobicContact CB-CD2 4.14Å; L51-W82 HydrophobicContact CB-CE3 3.89Å; L51-W82 HydrophobicContact CB-CH2 4.28Å; L51-W82 HydrophobicContact CB-CZ3 3.96Å; L51-W82 HydrophobicContact CD1-CB 3.91Å; L51-W82 HydrophobicContact CD1-CD2 4Å; L51-W82 HydrophobicContact CD1-CE3 4.34Å; L51-W82 HydrophobicContact CD1-CG 3.81Å; L51-W82 HydrophobicContact CD2-CE3 4.34Å; L51-W82 HydrophobicContact CG-CE3 4.42Å; R52-W82 WeakPolarHBondContact O-CH2 3.08Å; R52-W82 WeakPolarHBondContact O-CZ3 3.32Å; L69-W82 VanDerWaalsContact CA-O 3.31Å; L69-W82 WeakPolarHBondContact CA-O 3.39Å; L69-W82 WeakPolarHBondContact CD2-O 3.28Å; L70-W82 HydrophobicContact CD1-CB 4.47Å; L70-W82 HydrophobicContact CD1-CG 4.32Å; L70-W82 HydrophobicContact CG-CB 4.18Å; L70-W82 PolarHBondContact N-O 2.94Å; L70-W82 VanDerWaalsContact N-O 3.13Å; L70-W82 PolarHBondContact O-N 2.74Å; S72-W82 PolarHBondContact OG-NE1 3.09Å; I80-W82 HydrophobicContact CB-CZ2 3.79Å; I80-W82 HydrophobicContact CD1-CH2 4.15Å; I80-W82 HydrophobicContact CD1-CZ2 3.74Å; I80-W82 HydrophobicContact CG1-CZ2 4.35Å; I80-W82 HydrophobicContact CG2-CD2 3.7Å; I80-W82 HydrophobicContact CG2-CE3 4.23Å; I80-W82 HydrophobicContact CG2-CG 4.2Å; I80-W82 HydrophobicContact CG2-CH2 4.05Å; I80-W82 HydrophobicContact CG2-CZ2 3.47Å; I80-W82 VanDerWaalsContact CG2-CZ2 3.47Å; I80-W82 HydrophobicContact CG2-CZ3 4.39Å; I80-W82 PolarHBondContact O-NE1 2.87Å; W82-N88 WeakPolarHBondContact CA-O 3.33Å; W82-K89 HydrophobicContact CE3-CG 3.81Å; W82-K89 HydrophobicContact CH2-CD 4.35Å; W82-K89 HydrophobicContact CH2-CG 4.19Å; W82-K89 HydrophobicContact CZ3-CD 4.16Å; W82-K89 HydrophobicContact CZ3-CG 3.58Å; W82-L336 HydrophobicContact CZ2-CD1 4.23Å
83	D	98.2	Very high	96.9	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.043	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	109.9	157.4	175.8	4.4	0	0	0	108.8	R68 L69 Y85 T86 T87 N88 M90	R68-D83 WeakPolarHBondContact CG-OD1 3.47Å; R68-D83 IonicContact CZ-OD1 3.47Å; R68-D83 IonicContact CZ-OD2 3.99Å; R68-D83 IonicContact NE-OD1 3.42Å; R68-D83 PolarHBondContact NE-OD1 2.82Å; R68-D83 IonicContact NE-OD2 3.52Å; R68-D83 PolarHBondContact NE-OD2 3.46Å; R68-D83 IonicContact NH2-OD1 3.48Å; R68-D83 IonicContact NH2-OD2 2.84Å; R68-D83 PolarHBondContact NH2-OD2 2.93Å; L69-D83 HydrophobicContact CD2-CB 4.18Å; D83-Y85 PolarHBondContact O-N 3.43Å; D83-Y85 PolarHBondContact OD1-N 2.86Å; D83-T86 WeakPolarHBondContact CB-OG1 3.46Å; D83-T86 PolarHBondContact O-N 2.75Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.36Å; D83-T86 PolarHBondContact OD2-OG1 2.93Å; D83-T87 VanDerWaalsContact O-CA 3.24Å; D83-T87 WeakPolarHBondContact O-CA 3.44Å; D83-T87 PolarHBondContact O-N 3.04Å; D83-N88 PolarHBondContact N-O 3.32Å; D83-M90 HydrophobicContact CB-CG 4.29Å; D83-M90 HydrophobicContact CB-SD 4.44Å
84	S	97.4	Very high	96.7	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.042	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30	-178.6	55.9	0	0	0	0	113.9	R68	R68-S84 WeakPolarHBondContact CA-OG 3.48Å; R68-S84 WeakPolarHBondContact O-CB 3.35Å; R68-S84 PolarHBondContact O-N 3.33Å; R68-S84 PolarHBondContact O-OG 3.45Å
85	Y	96.8	Very high	96.6	Very high	135 Å²	135	46.9 Å²	46.9	53%	0.529	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-44.6	-173.6	-74.3	13.5	0	0	0	110.9	R49 R68 D83	R49-Y85 PolarHBondContact NE-O 2.81Å; R49-Y85 PolarHBondContact NH2-O 2.82Å; R68-Y85 HydrophobicContact CG-CD1 4.19Å; R68-Y85 HydrophobicContact CG-CD2 4.5Å; R68-Y85 HydrophobicContact CG-CE1 4.37Å; R68-Y85 HydrophobicContact CG-CG 4.25Å; D83-Y85 PolarHBondContact O-N 3.43Å; D83-Y85 PolarHBondContact OD1-N 2.86Å
86	T	97.4	Very high	96.2	Very high	60 Å²	60	54.4 Å²	54.4	37%	0.368	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.2	-175.3	63.8	0	0	0	0	113.5	D83 N88	D83-T86 WeakPolarHBondContact CB-OG1 3.46Å; D83-T86 PolarHBondContact O-N 2.75Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.36Å; D83-T86 PolarHBondContact OD2-OG1 2.93Å; T86-N88 PolarHBondContact O-N 3.04Å; T86-N88 WeakPolarHBondContact OG1-CB 3.41Å; T86-N88 PolarHBondContact OG1-N 3.39Å; T86-N88 PolarHBondContact OG1-ND2 3.26Å
87	T	97.5	Very high	96	Very high	55 Å²	55	53.9 Å²	53.9	34%	0.337	28%	0.275	S	S	.	.			trans	64.1	9.7	-171.7	72	0	0	0	0	115	R49 L51 D83	R49-T87 HydrophobicContact CB-CG2 4.09Å; R49-T87 HydrophobicContact CG-CG2 4.16Å; L51-T87 HydrophobicContact CD2-CG2 3.81Å; D83-T87 VanDerWaalsContact O-CA 3.24Å; D83-T87 WeakPolarHBondContact O-CA 3.44Å; D83-T87 PolarHBondContact O-N 3.04Å
88	N	97.5	Very high	95.9	Very high	99 Å²	99	55.9 Å²	55.9	53%	0.529	29%	0.288	S	S	.	.			trans	-72.2	145.9	178.8	-70.7	-24.7	0	0	0	111.2	W82 D83 T86	W82-N88 WeakPolarHBondContact CA-O 3.33Å; D83-N88 PolarHBondContact N-O 3.32Å; T86-N88 PolarHBondContact O-N 3.04Å; T86-N88 WeakPolarHBondContact OG1-CB 3.41Å; T86-N88 PolarHBondContact OG1-N 3.39Å; T86-N88 PolarHBondContact OG1-ND2 3.26Å
89	K	96.4	Very high	95.7	Very high	101 Å²	101	58.6 Å²	58.6	44%	0.439	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	110.9	170.4	-58.2	-179.8	-177.6	76.7	0	107.7	R52 I80 I81 W82	R52-K89 WeakPolarHBondContact O-CE 3.38Å; R52-K89 PolarHBondContact O-NZ 3.15Å; I80-K89 HydrophobicContact CG2-CB 4.19Å; I80-K89 HydrophobicContact CG2-CD 4.18Å; I80-K89 HydrophobicContact CG2-CG 3.96Å; I81-K89 CarbonylContact O-C 3.53Å; W82-K89 HydrophobicContact CE3-CG 3.81Å; W82-K89 HydrophobicContact CH2-CD 4.35Å; W82-K89 HydrophobicContact CH2-CG 4.19Å; W82-K89 HydrophobicContact CZ3-CD 4.16Å; W82-K89 HydrophobicContact CZ3-CG 3.58Å
90	M	94.3	Very high	95.7	Very high	102 Å²	102	58.8 Å²	58.8	50%	0.502	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-44.5	175.8	-65.8	-57.5	-63.4	0	0	110.7	L69 I81 D83	L69-M90 HydrophobicContact CD2-CG 3.98Å; I81-M90 HydrophobicContact CB-CB 4.44Å; I81-M90 HydrophobicContact CG2-CB 4.2Å; I81-M90 PolarHBondContact O-N 2.84Å; D83-M90 HydrophobicContact CB-CG 4.29Å; D83-M90 HydrophobicContact CB-SD 4.44Å
91	H	94.1	Very high	95.6	Very high	58 Å²	58	60.7 Å²	60.7	27%	0.269	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.8	176.3	-61.3	-73.5	0	0	0	110.6	I80 I81 I93	I80-H91 WeakPolarHBondContact CA-O 3.3Å; I80-H91 WeakPolarHBondContact CG2-O 3.22Å; I81-H91 HydrophobicContact CB-CB 4.21Å; I81-H91 HydrophobicContact CD1-CB 4.19Å; I81-H91 HydrophobicContact CG1-CB 4.34Å; I81-H91 PolarHBondContact N-O 3.47Å; I81-H91 PolarHBondContact O-N 3.09Å; H91-I93 HydrophobicContact CB-CG1 4.42Å
92	A	95.1	Very high	95.7	Very high	60 Å²	60	60.8 Å²	60.8	50%	0.496	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	100.5	168.6	0	0	0	0	0	107.8	I80	I80-A92 HydrophobicContact CG1-CB 4.41Å
93	I	95.5	Very high	95.7	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.1	-173.1	-56.6	161.1	0	0	0	107.8	K78 L79 H91 V112 Y124 L126 V133	K78-I93 WeakPolarHBondContact CA-O 3.48Å; L79-I93 HydrophobicContact CB-CB 4.23Å; L79-I93 HydrophobicContact CD2-CD1 4.21Å; L79-I93 PolarHBondContact N-O 2.82Å; L79-I93 PolarHBondContact O-N 2.6Å; H91-I93 HydrophobicContact CB-CG1 4.42Å; I93-V112 HydrophobicContact CD1-CG2 3.96Å; I93-Y124 HydrophobicContact CD1-CG 4.42Å; I93-Y124 HydrophobicContact CG2-CD1 3.59Å; I93-Y124 HydrophobicContact CG2-CE1 3.44Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.44Å; I93-Y124 HydrophobicContact CG2-CG 4.32Å; I93-L126 HydrophobicContact CD1-CD2 4.2Å; I93-V133 HydrophobicContact CD1-CB 4.41Å; I93-V133 HydrophobicContact CD1-CG1 3.62Å; I93-V133 HydrophobicContact CG1-CB 4.1Å; I93-V133 HydrophobicContact CG1-CG1 3.79Å
94	P	95.2	Very high	95.7	Very high	105 Å²	105	60.4 Å²	60.4	68%	0.682	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.2	171.9	30.2	-32.3	0	0	0	109.9
95	L	94.7	Very high	95.7	Very high	24 Å²	24	60.8 Å²	60.8	13%	0.126	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-90	151.8	177.2	-57	-178.2	0	0	0	110.2	G77 L79 S97 V100 C114 Y124	G77-L95 WeakPolarHBondContact O-CB 3.32Å; G77-L95 PolarHBondContact O-N 2.89Å; L79-L95 HydrophobicContact CB-CD1 4.46Å; L79-L95 HydrophobicContact CB-CD2 3.98Å; L79-L95 HydrophobicContact CB-CG 4.38Å; L95-S97 VanDerWaalsContact CB-O 3.31Å; L95-S97 WeakPolarHBondContact CB-O 3.29Å; L95-V100 HydrophobicContact CD1-CB 3.85Å; L95-V100 HydrophobicContact CD1-CG1 4.11Å; L95-V100 HydrophobicContact CD1-CG2 4.01Å; L95-C114 WeakPolarHBondContact CD2-SG 3.48Å; L95-Y124 HydrophobicContact CD2-CE2 4.18Å; L95-Y124 VanDerWaalsContact CD2-OH 3.26Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.21Å
96	R	89.8	Confident	95.8	Very high	193 Å²	193	54.3 Å²	54.3	73%	0.728	28%	0.28	S	S	*	.	S	Bend	trans	-72.2	-42.6	173.2	-71.1	-179.2	178.1	175	-3.3	111.2	E138	R96-E138 IonicContact CZ-OE1 3.53Å; R96-E138 IonicContact NE-OE1 3.39Å; R96-E138 VanDerWaalsContact NH1-CD 3.27Å; R96-E138 IonicContact NH1-OE1 2.76Å; R96-E138 PolarHBondContact NH1-OE1 2.71Å; R96-E138 IonicContact NH1-OE2 3.39Å; R96-E138 PolarHBondContact NH1-OE2 3.22Å; R96-E138 VanDerWaalsContact NH1-OE2 3.08Å
97	S	91.6	Very high	95.7	Very high	27 Å²	27	53.6 Å²	53.6	19%	0.189	28%	0.277	C	S	.	.			trans	-98.4	132.8	173.7	-176	0	0	0	0	110.2	L95 W99 D118	L95-S97 VanDerWaalsContact CB-O 3.31Å; L95-S97 WeakPolarHBondContact CB-O 3.29Å; S97-W99 VanDerWaalsContact C-N 3.33Å; S97-W99 PolarHBondContact OG-N 3.39Å; S97-D118 WeakPolarHBondContact CB-OD2 3.1Å
98	S	91.9	Very high	95.6	Very high	53 Å²	53	53.5 Å²	53.5	37%	0.371	28%	0.278	S	S	.	.	S	Bend	trans	-75.1	-25.1	173.8	54.3	0	0	0	0	112.3	Q75 V100	Q75-S98 CarbonylContact C-O 3.56Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.48Å; S98-V100 VanDerWaalsContact C-N 3.29Å; S98-V100 PolarHBondContact O-N 2.89Å
99	W	94.1	Very high	95.5	Very high	133 Å²	133	49.6 Å²	49.6	50%	0.504	26%	0.261	S	S	.	.			trans	-87.7	64.9	-173.7	-64.9	96.2	0	0	0	112.1	Q75 S97 G116 L117	Q75-W99 VanDerWaalsContact NE2-CE3 3.3Å; S97-W99 VanDerWaalsContact C-N 3.33Å; S97-W99 PolarHBondContact OG-N 3.39Å; W99-G116 WeakPolarHBondContact O-CA 3.49Å; 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 3.92Å; W99-L117 HydrophobicContact CE3-CD1 4.04Å; W99-L117 HydrophobicContact CG-CD1 3.78Å; W99-L117 HydrophobicContact CG-CG 4.43Å; W99-L117 PolarHBondContact O-N 2.96Å
100	V	96.6	Very high	95.4	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.024	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.4	175	68	0	0	0	0	111	A73 S74 L95 S98 T102 C114	A73-V100 HydrophobicContact CB-CB 4.38Å; A73-V100 HydrophobicContact CB-CG1 3.73Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; S74-V100 VanDerWaalsContact O-CG1 3.23Å; S74-V100 WeakPolarHBondContact O-CG1 3.19Å; L95-V100 HydrophobicContact CD1-CB 3.85Å; L95-V100 HydrophobicContact CD1-CG1 4.11Å; L95-V100 HydrophobicContact CD1-CG2 4.01Å; S98-V100 VanDerWaalsContact C-N 3.29Å; S98-V100 PolarHBondContact O-N 2.89Å; V100-T102 WeakPolarHBondContact CG2-O 3.17Å; V100-C114 HydrophobicContact CG2-CB 3.89Å
101	M	97.9	Very high	95.5	Very high	44 Å²	44	42.9 Å²	42.9	22%	0.217	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-30.7	179.2	-65.6	179.7	67.8	0	0	112	A60 G115 L117 Y145 L146	A60-M101 WeakPolarHBondContact CB-O 3.43Å; M101-G115 PolarHBondContact N-O 3.18Å; M101-L117 HydrophobicContact SD-CD2 3.96Å; M101-L117 HydrophobicContact SD-CG 4.47Å; M101-Y145 HydrophobicContact CE-CD2 3.57Å; M101-Y145 HydrophobicContact CE-CE2 3.65Å; M101-Y145 HydrophobicContact CE-CG 4.48Å; M101-Y145 HydrophobicContact SD-CD2 3.54Å; M101-Y145 VanDerWaalsContact SD-CD2 3.54Å; M101-Y145 HydrophobicContact SD-CE2 4.25Å; M101-Y145 HydrophobicContact SD-CG 4.03Å; M101-L146 WeakPolarHBondContact CB-O 3.15Å
102	T	98.4	Very high	95.7	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.1	-178.5	-178.3	0	0	0	0	112.7	V100 C114 G115 L146 S147 C148 C149	V100-T102 WeakPolarHBondContact CG2-O 3.17Å; T102-C114 VanDerWaalsContact O-CA 3.23Å; T102-C114 WeakPolarHBondContact O-CA 3.44Å; T102-C114 WeakPolarHBondContact O-CB 3.07Å; T102-G115 PolarHBondContact N-O 3.32Å; T102-G115 PolarHBondContact O-N 3.22Å; T102-L146 HydrophobicContact CG2-CD2 3.66Å; T102-L146 HydrophobicContact CG2-CG 3.95Å; T102-S147 WeakPolarHBondContact CB-O 3.29Å; T102-C148 WeakPolarHBondContact OG1-CA 3.19Å; T102-C149 HydrophobicContact CG2-CB 4.37Å; T102-C149 PolarHBondContact OG1-N 3.37Å; T102-C149 VanDerWaalsContact OG1-N 3.13Å; T102-C149 PolarHBondContact OG1-SG 2.72Å; T102-C149 VanDerWaalsContact OG1-SG 3.41Å
103	C	98.3	Very high	95.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154	159.8	60.2	0	0	0	0	111.6	V71 A73 L79 A113 C114 R150	V71-C103 HydrophobicContact CG1-CB 4.31Å; V71-C103 HydrophobicContact CG2-CB 4.43Å; A73-C103 HydrophobicContact CB-CB 3.9Å; L79-C103 HydrophobicContact CD1-CB 3.59Å; C103-A113 CarbonylContact C-O 3.59Å; C103-A113 WeakPolarHBondContact CA-O 3.38Å; C103-A113 WeakPolarHBondContact CB-O 3.35Å; C103-C114 HydrophobicContact CB-CB 4.42Å; C103-R150 PolarHBondContact O-NH1 2.59Å
104	A	98.6	Very high	96	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.1	174.6	0	0	0	0	0	111.4	V112 A113 C149 F151	A104-V112 CarbonylContact O-C 3.56Å; A104-V112 WeakPolarHBondContact O-CA 3.41Å; A104-V112 WeakPolarHBondContact O-CB 3.3Å; A104-A113 HydrophobicContact CB-CB 4.41Å; A104-A113 PolarHBondContact N-O 3.39Å; A104-A113 PolarHBondContact O-N 2.95Å; A104-C149 WeakPolarHBondContact CB-O 3.38Å; A104-F151 HydrophobicContact CB-CD2 3.81Å; A104-F151 HydrophobicContact CB-CE2 3.93Å
105	Y	98.2	Very high	96.1	Very high	13 Å²	13	32.3 Å²	32.3	5%	0.051	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.5	170.6	-152.9	-89.7	0	0	0	108.1	H62 L69 V71 I81 V112 L126	H62-Y105 PolarHBondContact ND1-N 3.37Å; H62-Y105 VanDerWaalsContact ND1-N 3.12Å; L69-Y105 WeakPolarHBondContact CD1-OH 3.33Å; V71-Y105 HydrophobicContact CB-CD2 4.06Å; V71-Y105 HydrophobicContact CG1-CD2 4.01Å; I81-Y105 HydrophobicContact CD1-CE2 4.37Å; I81-Y105 HydrophobicContact CG2-CE2 4.24Å; Y105-V112 HydrophobicContact CD2-CG1 3.48Å; Y105-V112 VanDerWaalsContact CD2-CG1 3.48Å; Y105-V112 HydrophobicContact CE2-CG1 3.79Å; Y105-V112 HydrophobicContact CG-CG1 4.25Å; Y105-L126 HydrophobicContact CE2-CD1 4.14Å
106	A	97.9	Very high	96.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.157	C	C	.	.			trans	-71.4	146.4	178.4	0	0	0	0	0	110.9	S108 G109 F111 F151	A106-S108 PolarHBondContact O-N 2.85Å; A106-S108 VanDerWaalsContact O-N 3.16Å; A106-G109 PolarHBondContact O-N 2.63Å; A106-F111 HydrophobicContact CB-CB 3.89Å; A106-F111 WeakPolarHBondContact CB-O 3.02Å; A106-F111 PolarHBondContact N-O 3.13Å; A106-F151 HydrophobicContact CB-CB 4.33Å; A106-F151 HydrophobicContact CB-CD1 4.18Å; A106-F151 HydrophobicContact CB-CD2 3.89Å; A106-F151 HydrophobicContact CB-CE1 4.43Å; A106-F151 HydrophobicContact CB-CE2 4.15Å; A106-F151 HydrophobicContact CB-CG 3.89Å; A106-F151 HydrophobicContact CB-CZ 4.41Å
107	P	96.5	Very high	96.5	Very high	45 Å²	45	26.2 Å²	26.2	29%	0.292	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-32.6	178.7	-26.2	33.2	0	0	0	114.8	Y65 G109	Y65-P107 VanDerWaalsContact CD2-CA 3.44Å; Y65-P107 HydrophobicContact CD2-CB 4.04Å; Y65-P107 HydrophobicContact CD2-CG 4.4Å; Y65-P107 HydrophobicContact CE2-CB 3.84Å; Y65-P107 HydrophobicContact CE2-CG 3.73Å; Y65-P107 HydrophobicContact CG-CB 4.45Å; P107-G109 VanDerWaalsContact C-N 3.26Å; P107-G109 PolarHBondContact O-N 2.96Å
108	S	95.9	Very high	96.7	Very high	52 Å²	52	27.4 Å²	27.4	36%	0.364	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.9	176.1	68.4	0	0	0	0	114.4	A106 N110 D154	A106-S108 PolarHBondContact O-N 2.85Å; A106-S108 VanDerWaalsContact O-N 3.16Å; S108-N110 WeakPolarHBondContact CB-ND2 3.43Å; S108-N110 PolarHBondContact O-N 3.05Å; S108-N110 VanDerWaalsContact OG-CB 3.29Å; S108-N110 WeakPolarHBondContact OG-CB 3.3Å; S108-N110 VanDerWaalsContact OG-CG 3.32Å; S108-N110 PolarHBondContact OG-N 3.47Å; S108-N110 PolarHBondContact OG-ND2 3.45Å; S108-D154 WeakPolarHBondContact CB-OD1 3.12Å; S108-D154 WeakPolarHBondContact CB-OD2 3.14Å; S108-D154 PolarHBondContact OG-OD1 2.92Å; S108-D154 PolarHBondContact OG-OD2 2.95Å; S108-D154 VanDerWaalsContact OG-OD2 3.04Å
109	G	94.8	Very high	97	Very high	17 Å²	17	27.1 Å²	27.1	18%	0.175	14%	0.143	C	C	.	.	S	Bend	trans	68.2	13.6	-166.6	0	0	0	0	0	115.8	A106 P107	A106-G109 PolarHBondContact O-N 2.63Å; P107-G109 VanDerWaalsContact C-N 3.26Å; P107-G109 PolarHBondContact O-N 2.96Å
110	N	94	Very high	97.1	Very high	33 Å²	33	23 Å²	23	18%	0.176	13%	0.13	C	C	.	.	S	Bend	trans	-83.3	-30.8	177.8	-62.6	-28.6	0	0	0	112.7	S108 L126 K127 D154	S108-N110 WeakPolarHBondContact CB-ND2 3.43Å; S108-N110 PolarHBondContact O-N 3.05Å; S108-N110 VanDerWaalsContact OG-CB 3.29Å; S108-N110 WeakPolarHBondContact OG-CB 3.3Å; S108-N110 VanDerWaalsContact OG-CG 3.32Å; S108-N110 PolarHBondContact OG-N 3.47Å; S108-N110 PolarHBondContact OG-ND2 3.45Å; N110-L126 WeakPolarHBondContact O-CB 3.12Å; N110-L126 PolarHBondContact O-N 3.09Å; N110-K127 WeakPolarHBondContact OD1-CD 3.49Å; N110-K127 WeakPolarHBondContact OD1-CE 3.26Å; N110-K127 PolarHBondContact OD1-NZ 3.15Å; N110-D154 PolarHBondContact ND2-OD2 3.19Å
111	F	96.9	Very high	97.1	Very high	29 Å²	29	22.9 Å²	22.9	13%	0.127	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.4	-172.3	-58.6	-81.3	0	0	0	112.6	A106 I123 Y124 N125 F151 D154	A106-F111 HydrophobicContact CB-CB 3.89Å; A106-F111 WeakPolarHBondContact CB-O 3.02Å; A106-F111 PolarHBondContact N-O 3.13Å; F111-I123 HydrophobicContact CB-CG2 4.19Å; F111-I123 HydrophobicContact CD1-CG2 3.86Å; F111-I123 HydrophobicContact CG-CG2 4.28Å; F111-Y124 VanDerWaalsContact CA-O 3.24Å; F111-Y124 WeakPolarHBondContact CA-O 3.38Å; F111-N125 HydrophobicContact CD1-CB 3.98Å; F111-N125 HydrophobicContact CE1-CB 3.72Å; F111-F151 HydrophobicContact CB-CE1 4.26Å; F111-F151 HydrophobicContact CB-CZ 4Å; F111-D154 HydrophobicContact CD2-CB 4.08Å; F111-D154 HydrophobicContact CE2-CB 3.81Å
112	V	97.9	Very high	97.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.3	161.5	-67.4	0	0	0	0	109.4	V71 L79 I81 I93 A104 Y105 Y124 L126	V71-V112 HydrophobicContact CB-CG1 4.31Å; V71-V112 HydrophobicContact CG1-CG1 4.48Å; V71-V112 HydrophobicContact CG2-CG1 4.3Å; L79-V112 HydrophobicContact CD2-CB 4.19Å; L79-V112 HydrophobicContact CD2-CG2 3.64Å; I81-V112 HydrophobicContact CD1-CG1 3.92Å; I81-V112 HydrophobicContact CD1-CG2 4.37Å; I93-V112 HydrophobicContact CD1-CG2 3.96Å; A104-V112 CarbonylContact O-C 3.56Å; A104-V112 WeakPolarHBondContact O-CA 3.41Å; A104-V112 WeakPolarHBondContact O-CB 3.3Å; Y105-V112 HydrophobicContact CD2-CG1 3.48Å; Y105-V112 VanDerWaalsContact CD2-CG1 3.48Å; Y105-V112 HydrophobicContact CE2-CG1 3.79Å; Y105-V112 HydrophobicContact CG-CG1 4.25Å; V112-Y124 HydrophobicContact CG2-CD2 4.37Å; V112-Y124 HydrophobicContact CG2-CG 4.43Å; V112-Y124 PolarHBondContact N-O 2.63Å; V112-Y124 PolarHBondContact O-N 2.76Å; V112-L126 HydrophobicContact CG1-CD1 4.01Å; V112-L126 HydrophobicContact CG2-CD2 3.95Å
113	A	98.3	Very high	97.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	153.7	173.7	0	0	0	0	0	110.4	C103 A104 S122 I123 F151 I157	C103-A113 CarbonylContact C-O 3.59Å; C103-A113 WeakPolarHBondContact CA-O 3.38Å; C103-A113 WeakPolarHBondContact CB-O 3.35Å; A104-A113 HydrophobicContact CB-CB 4.41Å; A104-A113 PolarHBondContact N-O 3.39Å; A104-A113 PolarHBondContact O-N 2.95Å; A113-S122 CarbonylContact C-O 3.58Å; A113-S122 VanDerWaalsContact CA-O 3.23Å; A113-S122 WeakPolarHBondContact CA-O 3.29Å; A113-I123 HydrophobicContact CB-CG1 4.28Å; A113-F151 HydrophobicContact CB-CE2 3.55Å; A113-F151 HydrophobicContact CB-CZ 3.53Å; A113-I157 HydrophobicContact CB-CD1 3.61Å
114	C	98.1	Very high	97	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.034	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	164.9	165.5	70	0	0	0	0	111.3	L79 L95 V100 T102 C103 S122 Y124	L79-C114 HydrophobicContact CD1-CB 4.14Å; L79-C114 HydrophobicContact CD2-CB 4.29Å; L95-C114 WeakPolarHBondContact CD2-SG 3.48Å; V100-C114 HydrophobicContact CG2-CB 3.89Å; T102-C114 VanDerWaalsContact O-CA 3.23Å; T102-C114 WeakPolarHBondContact O-CA 3.44Å; T102-C114 WeakPolarHBondContact O-CB 3.07Å; C103-C114 HydrophobicContact CB-CB 4.42Å; C114-S122 PolarHBondContact N-O 2.86Å; C114-S122 PolarHBondContact O-N 3.33Å; C114-Y124 VanDerWaalsContact SG-CE2 3.58Å
115	G	97.4	Very high	96.8	Very high	2 Å²	2	23.2 Å²	23.2	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	174	169.7	0	0	0	0	0	111.3	M101 T102 I120	M101-G115 PolarHBondContact N-O 3.18Å; T102-G115 PolarHBondContact N-O 3.32Å; T102-G115 PolarHBondContact O-N 3.22Å; G115-I120 VanDerWaalsContact CA-O 3.31Å; G115-I120 WeakPolarHBondContact CA-O 3.43Å
116	G	96.9	Very high	96.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	-124.8	176.8	0	0	0	0	0	112.2	W99 D118 N119 Y145 L146	W99-G116 WeakPolarHBondContact O-CA 3.49Å; G116-D118 PolarHBondContact N-OD1 2.76Å; G116-D118 VanDerWaalsContact N-OD1 3.13Å; G116-D118 PolarHBondContact O-N 3.13Å; G116-D118 VanDerWaalsContact O-N 3.13Å; G116-N119 PolarHBondContact O-N 2.96Å; G116-N119 VanDerWaalsContact O-N 3.15Å; G116-Y145 CarbonylContact O-C 3.59Å; G116-Y145 WeakPolarHBondContact O-CA 3.29Å; G116-L146 PolarHBondContact O-N 2.98Å
117	L	96.6	Very high	95.7	Very high	90 Å²	90	30.5 Å²	30.5	47%	0.471	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-5.4	-175.1	-62.5	-174.9	0	0	0	114.7	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 3.92Å; W99-L117 HydrophobicContact CE3-CD1 4.04Å; W99-L117 HydrophobicContact CG-CD1 3.78Å; W99-L117 HydrophobicContact CG-CG 4.43Å; W99-L117 PolarHBondContact O-N 2.96Å; M101-L117 HydrophobicContact SD-CD2 3.96Å; M101-L117 HydrophobicContact SD-CG 4.47Å; L117-N119 VanDerWaalsContact C-N 3.25Å; L117-N119 PolarHBondContact O-OD1 2.88Å; L117-Y145 HydrophobicContact CD2-CD1 4.44Å; L117-Y145 HydrophobicContact CD2-CG 4.14Å
118	D	95.8	Very high	94.4	Very high	52 Å²	52	30.4 Å²	30.4	28%	0.278	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-3.1	172.8	54.9	-2.2	0	0	0	113.2	S97 G116 I120	S97-D118 WeakPolarHBondContact CB-OD2 3.1Å; G116-D118 PolarHBondContact N-OD1 2.76Å; G116-D118 VanDerWaalsContact N-OD1 3.13Å; G116-D118 PolarHBondContact O-N 3.13Å; G116-D118 VanDerWaalsContact O-N 3.13Å; D118-I120 WeakPolarHBondContact O-CG1 3.22Å; D118-I120 PolarHBondContact O-N 3.23Å; D118-I120 VanDerWaalsContact O-N 3.09Å
119	N	96.8	Very high	92.8	Very high	46 Å²	46	40.5 Å²	40.5	25%	0.246	19%	0.194	C	C	.	.			trans	60.1	15.1	179.4	-51.9	-6.6	0	0	0	113.8	G116 L117 T143 G144 Y145	G116-N119 PolarHBondContact O-N 2.96Å; G116-N119 VanDerWaalsContact O-N 3.15Å; L117-N119 VanDerWaalsContact C-N 3.25Å; L117-N119 PolarHBondContact O-OD1 2.88Å; N119-T143 PolarHBondContact ND2-O 3.32Å; N119-G144 VanDerWaalsContact CB-O 3.31Å; N119-G144 WeakPolarHBondContact CB-O 3.33Å; N119-G144 PolarHBondContact OD1-O 3.3Å; N119-G144 VanDerWaalsContact OD1-O 3.06Å; N119-Y145 VanDerWaalsContact OD1-CA 3.29Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.37Å; N119-Y145 PolarHBondContact OD1-N 2.99Å
120	I	97	Very high	91.2	Very high	46 Å²	46	46.2 Å²	46.2	24%	0.236	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.2	-175.8	-67	165.2	0	0	0	108.7	G115 D118 E138 P140	G115-I120 VanDerWaalsContact CA-O 3.31Å; G115-I120 WeakPolarHBondContact CA-O 3.43Å; D118-I120 WeakPolarHBondContact O-CG1 3.22Å; D118-I120 PolarHBondContact O-N 3.23Å; D118-I120 VanDerWaalsContact O-N 3.09Å; I120-E138 HydrophobicContact CG2-CB 3.85Å; I120-E138 HydrophobicContact CG2-CG 4.3Å; I120-P140 HydrophobicContact CG1-CB 4.46Å
121	C	97.8	Very high	90	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.014	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	108.8	165	-174	0	0	0	0	109.2	L139 L146 T159	C121-L139 HydrophobicContact CB-CB 4.12Å; C121-L139 HydrophobicContact CB-CD1 4.24Å; C121-L139 PolarHBondContact N-O 3.12Å; C121-L139 PolarHBondContact O-N 2.7Å; C121-L146 HydrophobicContact CB-CD2 3.63Å; C121-T159 HydrophobicContact CB-CG2 4.2Å
122	S	97.7	Very high	89.1	Confident	7 Å²	7	51.4 Å²	51.4	5%	0.049	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.5	175.8	-60.9	0	0	0	0	110.5	A113 C114	A113-S122 CarbonylContact C-O 3.58Å; A113-S122 VanDerWaalsContact CA-O 3.23Å; A113-S122 WeakPolarHBondContact CA-O 3.29Å; C114-S122 PolarHBondContact N-O 2.86Å; C114-S122 PolarHBondContact O-N 3.33Å
123	I	97.5	Very high	88.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.8	179.1	-61.6	170.7	0	0	0	108.9	F111 A113 V135 S136 R137 L139 F151 I157 I171	F111-I123 HydrophobicContact CB-CG2 4.19Å; F111-I123 HydrophobicContact CD1-CG2 3.86Å; F111-I123 HydrophobicContact CG-CG2 4.28Å; A113-I123 HydrophobicContact CB-CG1 4.28Å; I123-V135 CarbonylContact O-C 3.59Å; I123-S136 WeakPolarHBondContact O-CB 3.19Å; I123-S136 PolarHBondContact O-N 3.49Å; I123-R137 HydrophobicContact CB-CB 4.38Å; I123-R137 PolarHBondContact N-O 3.38Å; I123-R137 PolarHBondContact O-N 3.27Å; I123-L139 HydrophobicContact CD1-CD1 3.76Å; I123-L139 HydrophobicContact CD1-CG 4.18Å; I123-F151 HydrophobicContact CD1-CE1 4.49Å; I123-F151 HydrophobicContact CG1-CZ 4.5Å; I123-F151 HydrophobicContact CG2-CE1 4.44Å; I123-F151 HydrophobicContact CG2-CZ 4.32Å; I123-I157 HydrophobicContact CD1-CG2 4.35Å; I123-I171 HydrophobicContact CD1-CB 4.09Å; I123-I171 HydrophobicContact CD1-CD1 3.82Å; I123-I171 HydrophobicContact CD1-CG1 3.55Å; I123-I171 HydrophobicContact CD1-CG2 3.56Å; I123-I171 HydrophobicContact CG2-CG2 4.49Å
124	Y	96.3	Very high	87.8	Confident	8 Å²	8	59.8 Å²	59.8	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	133.6	-177.4	-60.2	-96.1	0	0	0	110.1	L79 I93 L95 F111 V112 C114 V133 V135	L79-Y124 HydrophobicContact CD2-CD2 4.4Å; I93-Y124 HydrophobicContact CD1-CG 4.42Å; I93-Y124 HydrophobicContact CG2-CD1 3.59Å; I93-Y124 HydrophobicContact CG2-CE1 3.44Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.44Å; I93-Y124 HydrophobicContact CG2-CG 4.32Å; L95-Y124 HydrophobicContact CD2-CE2 4.18Å; L95-Y124 VanDerWaalsContact CD2-OH 3.26Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.21Å; F111-Y124 VanDerWaalsContact CA-O 3.24Å; F111-Y124 WeakPolarHBondContact CA-O 3.38Å; V112-Y124 HydrophobicContact CG2-CD2 4.37Å; V112-Y124 HydrophobicContact CG2-CG 4.43Å; V112-Y124 PolarHBondContact N-O 2.63Å; V112-Y124 PolarHBondContact O-N 2.76Å; C114-Y124 VanDerWaalsContact SG-CE2 3.58Å; Y124-V133 HydrophobicContact CD1-CG1 4.31Å; Y124-V135 HydrophobicContact CD1-CG2 4Å; Y124-V135 HydrophobicContact CE1-CB 4.36Å; Y124-V135 HydrophobicContact CE1-CG2 3.39Å
125	N	94.1	Very high	87.4	Confident	41 Å²	41	62 Å²	62	22%	0.219	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.8	174.7	-172.2	-19.4	0	0	0	109.8	F111 K127 T128 R134	F111-N125 HydrophobicContact CD1-CB 3.98Å; F111-N125 HydrophobicContact CE1-CB 3.72Å; N125-K127 PolarHBondContact OD1-N 2.74Å; N125-T128 HydrophobicContact CB-CG2 4.4Å; N125-R134 PolarHBondContact N-O 3.02Å
126	L	90.6	Very high	87.1	Confident	20 Å²	20	64.5 Å²	64.5	11%	0.105	32%	0.324	C	S	.	.	S	Bend	trans	-82.6	-25.7	179.5	-56.2	-176.5	0	0	0	112.8	I81 I93 Y105 N110 V112 T128 V133	I81-L126 HydrophobicContact CD1-CD1 3.42Å; I81-L126 VanDerWaalsContact CD1-CD1 3.42Å; I81-L126 HydrophobicContact CD1-CD2 3.36Å; I81-L126 HydrophobicContact CD1-CG 4.02Å; I93-L126 HydrophobicContact CD1-CD2 4.2Å; Y105-L126 HydrophobicContact CE2-CD1 4.14Å; N110-L126 WeakPolarHBondContact O-CB 3.12Å; N110-L126 PolarHBondContact O-N 3.09Å; V112-L126 HydrophobicContact CG1-CD1 4.01Å; V112-L126 HydrophobicContact CG2-CD2 3.95Å; L126-T128 PolarHBondContact O-N 2.84Å; L126-V133 HydrophobicContact CD2-CG1 4.12Å; L126-V133 HydrophobicContact CD2-CG2 4.24Å
127	K	82.6	Confident	87	Confident	145 Å²	145	70 Å²	70	63%	0.63	35%	0.345	S	S	*	.			trans	-94.5	60.5	-179.7	-67.5	-170	-177.9	162.6	0	111.2	N110 N125	N110-K127 WeakPolarHBondContact OD1-CD 3.49Å; N110-K127 WeakPolarHBondContact OD1-CE 3.26Å; N110-K127 PolarHBondContact OD1-NZ 3.15Å; N125-K127 PolarHBondContact OD1-N 2.74Å
128	T	69.8	Low	86.9	Confident	44 Å²	44	68.7 Å²	68.7	27%	0.27	34%	0.337	S	S	.	.			trans	-90.8	129.3	172.2	47.2	0	0	0	0	111.3	N125 L126 E130 G131 N132	N125-T128 HydrophobicContact CB-CG2 4.4Å; L126-T128 PolarHBondContact O-N 2.84Å; T128-E130 PolarHBondContact O-N 3.34Å; T128-E130 VanDerWaalsContact O-N 3.09Å; T128-G131 PolarHBondContact O-N 3.32Å; T128-N132 PolarHBondContact OG1-O 3.16Å
129	R	62.6	Low	87	Confident	263 Å²	263	66.2 Å²	66.2	99%	0.992	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.1	176.2	-66.7	-176.8	-179.7	-176.3	0.2	113.6
130	E	61.7	Low	86.8	Confident	137 Å²	137	68 Å²	68	64%	0.64	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	5	-175.6	-61.9	-176.8	179.8	0	0	114.1	T128 N132 R134	T128-E130 PolarHBondContact O-N 3.34Å; T128-E130 VanDerWaalsContact O-N 3.09Å; E130-N132 PolarHBondContact O-N 3.04Å; E130-R134 IonicContact OE2-CZ 3.78Å; E130-R134 IonicContact OE2-NH1 2.84Å; E130-R134 IonicContact OE2-NH2 3.27Å; E130-R134 PolarHBondContact OE2-NH2 3.3Å
131	G	67.1	Low	86.3	Confident	58 Å²	58	68 Å²	68	60%	0.598	35%	0.348	S	S	*	.	S	Bend	trans	72.8	-22.4	176.8	0	0	0	0	0	116.2	T128	T128-G131 PolarHBondContact O-N 3.32Å
132	N	78.1	Confident	86.3	Confident	113 Å²	113	68.5 Å²	68.5	60%	0.604	35%	0.351	S	S	*	.	S	Bend	trans	-91.5	117	175	-76.9	-9.3	0	0	0	111.5	T128 E130 R134	T128-N132 PolarHBondContact OG1-O 3.16Å; E130-N132 PolarHBondContact O-N 3.04Å; N132-R134 PolarHBondContact O-N 2.93Å
133	V	85.4	Confident	86.2	Confident	31 Å²	31	73.9 Å²	73.9	19%	0.188	38%	0.383	C	S	.	.			trans	-64.9	122.3	173	179.6	0	0	0	0	109.4	I93 Y124 L126	I93-V133 HydrophobicContact CD1-CB 4.41Å; I93-V133 HydrophobicContact CD1-CG1 3.62Å; I93-V133 HydrophobicContact CG1-CB 4.1Å; I93-V133 HydrophobicContact CG1-CG1 3.79Å; Y124-V133 HydrophobicContact CD1-CG1 4.31Å; L126-V133 HydrophobicContact CD2-CG1 4.12Å; L126-V133 HydrophobicContact CD2-CG2 4.24Å
134	R	84.8	Confident	86.2	Confident	146 Å²	146	74.5 Å²	74.5	55%	0.551	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	157.3	177.4	-65.4	-173.9	-172.1	157.7	15.1	110.6	N125 E130 N132 S136	N125-R134 PolarHBondContact N-O 3.02Å; E130-R134 IonicContact OE2-CZ 3.78Å; E130-R134 IonicContact OE2-NH1 2.84Å; E130-R134 IonicContact OE2-NH2 3.27Å; E130-R134 PolarHBondContact OE2-NH2 3.3Å; N132-R134 PolarHBondContact O-N 2.93Å; R134-S136 PolarHBondContact O-N 2.89Å
135	V	89.4	Confident	86.3	Confident	51 Å²	51	76.5 Å²	76.5	31%	0.309	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	118.4	167.6	-177.1	0	0	0	0	107.6	I123 Y124 R137 E138	I123-V135 CarbonylContact O-C 3.59Å; Y124-V135 HydrophobicContact CD1-CG2 4Å; Y124-V135 HydrophobicContact CE1-CB 4.36Å; Y124-V135 HydrophobicContact CE1-CG2 3.39Å; V135-R137 WeakPolarHBondContact CG1-O 3.38Å; V135-E138 HydrophobicContact CG1-CG 3.68Å
136	S	90.4	Very high	86.5	Confident	54 Å²	54	74.6 Å²	74.6	38%	0.378	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-47.4	174	-168.1	0	0	0	0	109.9	I123 R134	I123-S136 WeakPolarHBondContact O-CB 3.19Å; I123-S136 PolarHBondContact O-N 3.49Å; R134-S136 PolarHBondContact O-N 2.89Å
137	R	94.5	Very high	86.8	Confident	115 Å²	115	74.2 Å²	74.2	43%	0.434	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	150.6	-176.4	-69.7	-65.7	-167.5	-149	6.5	111.2	I123 V135 I171 E172	I123-R137 HydrophobicContact CB-CB 4.38Å; I123-R137 PolarHBondContact N-O 3.38Å; I123-R137 PolarHBondContact O-N 3.27Å; V135-R137 WeakPolarHBondContact CG1-O 3.38Å; R137-I171 HydrophobicContact CB-CG2 4.5Å; R137-I171 HydrophobicContact CG-CG2 4.21Å; R137-I171 WeakPolarHBondContact CG-O 3.46Å; R137-E172 PolarHBondContact NE-O 2.95Å; R137-E172 PolarHBondContact NH2-O 3.34Å
138	E	96.1	Very high	87.6	Confident	63 Å²	63	67.7 Å²	67.7	29%	0.294	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.8	167.4	-66.8	-177.6	155.3	0	0	106.5	R96 I120 V135 P140	R96-E138 IonicContact CZ-OE1 3.53Å; R96-E138 IonicContact NE-OE1 3.39Å; R96-E138 VanDerWaalsContact NH1-CD 3.27Å; R96-E138 IonicContact NH1-OE1 2.76Å; R96-E138 PolarHBondContact NH1-OE1 2.71Å; R96-E138 IonicContact NH1-OE2 3.39Å; R96-E138 PolarHBondContact NH1-OE2 3.22Å; R96-E138 VanDerWaalsContact NH1-OE2 3.08Å; I120-E138 HydrophobicContact CG2-CB 3.85Å; I120-E138 HydrophobicContact CG2-CG 4.3Å; V135-E138 HydrophobicContact CG1-CG 3.68Å; E138-P140 VanDerWaalsContact C-CD 3.44Å; E138-P140 WeakPolarHBondContact O-CD 3.46Å
139	L	96.7	Very high	89	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	86.6	-179.1	-54.8	179.8	0	0	0	109	C121 I123 I157 W169 A174	C121-L139 HydrophobicContact CB-CB 4.12Å; C121-L139 HydrophobicContact CB-CD1 4.24Å; C121-L139 PolarHBondContact N-O 3.12Å; C121-L139 PolarHBondContact O-N 2.7Å; I123-L139 HydrophobicContact CD1-CD1 3.76Å; I123-L139 HydrophobicContact CD1-CG 4.18Å; L139-I157 HydrophobicContact CD1-CG2 3.56Å; L139-W169 HydrophobicContact CB-CD2 4.09Å; L139-W169 HydrophobicContact CB-CE3 3.83Å; L139-W169 HydrophobicContact CB-CH2 4.24Å; L139-W169 HydrophobicContact CB-CZ3 3.91Å; L139-W169 HydrophobicContact CD1-CB 3.81Å; L139-W169 HydrophobicContact CD1-CD2 4.04Å; L139-W169 HydrophobicContact CD1-CE3 4.32Å; L139-W169 HydrophobicContact CD1-CG 3.83Å; L139-W169 HydrophobicContact CD2-CE3 4.18Å; L139-W169 HydrophobicContact CG-CE3 4.34Å; L139-A174 HydrophobicContact CD2-CB 3.75Å
140	P	93.1	Very high	90.7	Very high	84 Å²	84	55.8 Å²	55.8	55%	0.545	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	135.9	173.9	33.4	-33.8	0	0	0	110.1	I120 E138 W169	I120-P140 HydrophobicContact CG1-CB 4.46Å; E138-P140 VanDerWaalsContact C-CD 3.44Å; E138-P140 WeakPolarHBondContact O-CD 3.46Å; P140-W169 WeakPolarHBondContact O-CH2 3.48Å
141	G	87.1	Confident	92.4	Very high	44 Å²	44	49.4 Å²	49.4	45%	0.454	28%	0.279	S	S	.	.			trans	165.2	-15.9	170.5	0	0	0	0	0	115.3
142	H	96.2	Very high	93.9	Very high	14 Å²	14	47.6 Å²	47.6	7%	0.065	26%	0.256	C	S	.	.			trans	-72.9	144.6	166.2	-78.4	-61.4	0	0	0	111.2	T159 S161 D163 T165	H142-T159 PolarHBondContact NE2-OG1 3.12Å; H142-T159 VanDerWaalsContact NE2-OG1 3.11Å; H142-S161 VanDerWaalsContact CG-CB 3.49Å; H142-S161 WeakPolarHBondContact ND1-CB 3.34Å; H142-D163 WeakPolarHBondContact CA-OD2 3.22Å; H142-D163 WeakPolarHBondContact CB-OD2 3.46Å; H142-D163 IonicContact CE1-OD2 3.08Å; H142-D163 IonicContact CG-OD2 3.33Å; H142-D163 IonicContact ND1-OD1 3.79Å; H142-D163 PolarHBondContact ND1-OD1 2.94Å; H142-D163 IonicContact ND1-OD2 2.69Å; H142-D163 PolarHBondContact ND1-OD2 2.85Å; H142-T165 PolarHBondContact CE1-OG1 3Å
143	T	97.1	Very high	94.8	Very high	120 Å²	120	45.5 Å²	45.5	74%	0.736	24%	0.244	S	C	*	.	S	Bend	trans	-97.2	-5.1	175.4	59.8	0	0	0	0	112.5	N119 D163	N119-T143 PolarHBondContact ND2-O 3.32Å; T143-D163 PolarHBondContact N-OD2 2.79Å; T143-D163 VanDerWaalsContact OG1-CB 3.26Å; T143-D163 WeakPolarHBondContact OG1-CB 3.33Å
144	G	97	Very high	95.3	Very high	13 Å²	13	46.4 Å²	46.4	13%	0.134	25%	0.248	C	C	.	.	S	Bend	trans	-127.5	175.1	175.5	0	0	0	0	0	112.1	N119 S161	N119-G144 VanDerWaalsContact CB-O 3.31Å; N119-G144 WeakPolarHBondContact CB-O 3.33Å; N119-G144 PolarHBondContact OD1-O 3.3Å; N119-G144 VanDerWaalsContact OD1-O 3.06Å; G144-S161 VanDerWaalsContact C-OG 3.26Å; G144-S161 PolarHBondContact O-OG 2.98Å
145	Y	97.6	Very high	95.9	Very high	50 Å²	50	42 Å²	42	20%	0.196	24%	0.239	C	C	.	.			trans	-61.5	148.9	-177.5	60.7	-94.5	0	0	0	111.6	M101 G116 L117 N119 S161 G162 D186	M101-Y145 HydrophobicContact CE-CD2 3.57Å; M101-Y145 HydrophobicContact CE-CE2 3.65Å; M101-Y145 HydrophobicContact CE-CG 4.48Å; M101-Y145 HydrophobicContact SD-CD2 3.54Å; M101-Y145 VanDerWaalsContact SD-CD2 3.54Å; M101-Y145 HydrophobicContact SD-CE2 4.25Å; M101-Y145 HydrophobicContact SD-CG 4.03Å; G116-Y145 CarbonylContact O-C 3.59Å; G116-Y145 WeakPolarHBondContact O-CA 3.29Å; L117-Y145 HydrophobicContact CD2-CD1 4.44Å; L117-Y145 HydrophobicContact CD2-CG 4.14Å; N119-Y145 VanDerWaalsContact OD1-CA 3.29Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.37Å; N119-Y145 PolarHBondContact OD1-N 2.99Å; Y145-S161 CarbonylContact O-C 3.48Å; Y145-S161 WeakPolarHBondContact O-CA 3.22Å; Y145-S161 WeakPolarHBondContact O-CB 3.47Å; Y145-S161 PolarHBondContact O-OG 2.9Å; Y145-G162 PolarHBondContact O-N 3.34Å; Y145-D186 WeakPolarHBondContact CE1-OD2 3.26Å; Y145-D186 VanDerWaalsContact OH-CB 3.29Å; Y145-D186 WeakPolarHBondContact OH-CB 3.44Å; Y145-D186 PolarHBondContact OH-OD2 2.9Å
146	L	98.4	Very high	96.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	116	175.4	-167.1	72	0	0	0	109.9	M101 T102 G116 C121 C149 T159 S160	M101-L146 WeakPolarHBondContact CB-O 3.15Å; T102-L146 HydrophobicContact CG2-CD2 3.66Å; T102-L146 HydrophobicContact CG2-CG 3.95Å; G116-L146 PolarHBondContact O-N 2.98Å; C121-L146 HydrophobicContact CB-CD2 3.63Å; L146-C149 HydrophobicContact CD2-CB 4.46Å; L146-T159 HydrophobicContact CD1-CG2 3.91Å; L146-S160 WeakPolarHBondContact CD1-O 3.17Å
147	S	98.1	Very high	96.7	Very high	12 Å²	12	40 Å²	40	8%	0.084	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-40.5	-174.9	61	0	0	0	0	113.3	T102 S160 V187 M188	T102-S147 WeakPolarHBondContact CB-O 3.29Å; S147-S160 PolarHBondContact N-O 3.1Å; S147-S160 WeakPolarHBondContact OG-CB 3.3Å; S147-S160 PolarHBondContact OG-O 2.86Å; S147-S160 VanDerWaalsContact OG-O 3.04Å; S147-S160 PolarHBondContact OG-OG 3.1Å; S147-V187 WeakPolarHBondContact CB-O 3.5Å; S147-V187 PolarHBondContact OG-O 2.89Å; S147-M188 WeakPolarHBondContact CB-O 3.44Å
148	C	98.6	Very high	96.9	Very high	8 Å²	8	34.6 Å²	34.6	5%	0.054	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155.3	178.7	-165.9	0	0	0	0	111	T102 T159 S160 L190	T102-C148 WeakPolarHBondContact OG1-CA 3.19Å; C148-T159 WeakPolarHBondContact O-CA 3.42Å; C148-S160 VanDerWaalsContact CB-OG 3.27Å; C148-S160 WeakPolarHBondContact CB-OG 3.19Å; C148-S160 PolarHBondContact N-OG 2.9Å; C148-S160 PolarHBondContact O-N 3.07Å; C148-S160 PolarHBondContact O-OG 3.43Å; C148-L190 HydrophobicContact CB-CD2 4.49Å; C148-L190 HydrophobicContact CB-CG 4.18Å
149	C	98.4	Very high	97	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	147.6	171.5	63.9	0	0	0	0	111.3	T102 A104 L146 I157 V158 T159	T102-C149 HydrophobicContact CG2-CB 4.37Å; T102-C149 PolarHBondContact OG1-N 3.37Å; T102-C149 VanDerWaalsContact OG1-N 3.13Å; T102-C149 PolarHBondContact OG1-SG 2.72Å; T102-C149 VanDerWaalsContact OG1-SG 3.41Å; A104-C149 WeakPolarHBondContact CB-O 3.38Å; L146-C149 HydrophobicContact CD2-CB 4.46Å; C149-I157 HydrophobicContact CB-CD1 4.05Å; C149-I157 HydrophobicContact CB-CG1 4.41Å; C149-V158 CarbonylContact C-O 3.56Å; C149-V158 WeakPolarHBondContact CA-O 3.31Å; C149-T159 HydrophobicContact CB-CG2 4Å
150	R	98.6	Very high	97.1	Very high	58 Å²	58	31.5 Å²	31.5	22%	0.219	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	131.2	175.8	-68.6	-65.5	179	-99.8	5.1	110.8	C103 I157 V158 L190 L192	C103-R150 PolarHBondContact O-NH1 2.59Å; R150-I157 WeakPolarHBondContact O-CG1 3.45Å; R150-V158 PolarHBondContact N-O 3.03Å; R150-V158 PolarHBondContact O-N 3.06Å; R150-L190 HydrophobicContact CB-CD1 3.81Å; R150-L190 HydrophobicContact CG-CD1 3.57Å; R150-L192 HydrophobicContact CB-CD1 3.63Å; R150-L192 HydrophobicContact CB-CG 3.82Å; R150-L192 HydrophobicContact CG-CG 4.45Å
151	F	98.6	Very high	97.4	Very high	3 Å²	3	27.5 Å²	27.5	1%	0.013	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.2	173.5	-70.9	-84.8	0	0	0	110.4	A104 A106 F111 A113 I123 D153 I157 I171 L192	A104-F151 HydrophobicContact CB-CD2 3.81Å; A104-F151 HydrophobicContact CB-CE2 3.93Å; A106-F151 HydrophobicContact CB-CB 4.33Å; A106-F151 HydrophobicContact CB-CD1 4.18Å; A106-F151 HydrophobicContact CB-CD2 3.89Å; A106-F151 HydrophobicContact CB-CE1 4.43Å; A106-F151 HydrophobicContact CB-CE2 4.15Å; A106-F151 HydrophobicContact CB-CG 3.89Å; A106-F151 HydrophobicContact CB-CZ 4.41Å; F111-F151 HydrophobicContact CB-CE1 4.26Å; F111-F151 HydrophobicContact CB-CZ 4Å; A113-F151 HydrophobicContact CB-CE2 3.55Å; A113-F151 HydrophobicContact CB-CZ 3.53Å; I123-F151 HydrophobicContact CD1-CE1 4.49Å; I123-F151 HydrophobicContact CG1-CZ 4.5Å; I123-F151 HydrophobicContact CG2-CE1 4.44Å; I123-F151 HydrophobicContact CG2-CZ 4.32Å; F151-D153 WeakPolarHBondContact CD1-O 3.47Å; F151-I157 HydrophobicContact CD1-CB 4.09Å; F151-I157 HydrophobicContact CD1-CD1 4.07Å; F151-I157 HydrophobicContact CD1-CG1 4.25Å; F151-I157 HydrophobicContact CD2-CD1 4.26Å; F151-I157 HydrophobicContact CE1-CB 4.41Å; F151-I157 HydrophobicContact CE1-CD1 3.91Å; F151-I157 HydrophobicContact CE2-CD1 4.11Å; F151-I157 HydrophobicContact CG-CD1 4.25Å; F151-I157 HydrophobicContact CG-CG1 4.41Å; F151-I157 HydrophobicContact CZ-CD1 3.94Å; F151-I171 HydrophobicContact CD1-CD1 3.87Å; F151-I171 HydrophobicContact CE1-CD1 3.67Å; F151-L192 VanDerWaalsContact O-CD1 3.28Å; F151-L192 WeakPolarHBondContact O-CD1 3.27Å
152	L	97.9	Very high	97.9	Very high	20 Å²	20	26 Å²	26	11%	0.105	14%	0.144	C	C	.	.	S	Bend	trans	-84.1	-45.6	163.6	-73.9	157.5	0	0	0	109.6	Q156 V158 L168 L192 M196 I213	L152-Q156 HydrophobicContact CB-CB 4.08Å; L152-Q156 HydrophobicContact CD1-CB 4.06Å; L152-Q156 PolarHBondContact N-O 3.29Å; L152-V158 HydrophobicContact CD1-CG2 3.73Å; L152-V158 HydrophobicContact CG-CG2 4.18Å; L152-L168 HydrophobicContact CD1-CD1 3.36Å; L152-L192 HydrophobicContact CD2-CD1 4.02Å; L152-L192 HydrophobicContact CD2-CD2 4.11Å; L152-L192 HydrophobicContact CG-CD1 4.29Å; L152-M196 HydrophobicContact CD2-CB 3.82Å; L152-M196 HydrophobicContact CD2-CG 4.49Å; L152-M196 WeakPolarHBondContact CD2-O 3.22Å; L152-M196 HydrophobicContact CD2-SD 4.24Å; L152-I213 HydrophobicContact CD1-CD1 4.29Å; L152-I213 HydrophobicContact CD1-CG2 4.15Å; L152-I213 HydrophobicContact CD2-CD1 3.7Å
153	D	96.8	Very high	98	Very high	68 Å²	68	26.7 Å²	26.7	36%	0.364	15%	0.149	S	C	.	.	S	Bend	trans	-153.8	-163.1	174	60	34.7	0	0	0	109.7	F151 S155 Q156	F151-D153 WeakPolarHBondContact CD1-O 3.47Å; D153-S155 PolarHBondContact O-N 3.47Å; D153-S155 VanDerWaalsContact OD1-CA 3.3Å; D153-S155 WeakPolarHBondContact OD1-CA 3.37Å; D153-S155 WeakPolarHBondContact OD1-CB 3.47Å; D153-S155 PolarHBondContact OD1-N 3.46Å; D153-S155 PolarHBondContact OD1-OG 3.05Å; D153-Q156 PolarHBondContact N-O 3.24Å; D153-Q156 PolarHBondContact OD1-N 2.96Å
154	D	96.6	Very high	98.1	Very high	51 Å²	51	23.3 Å²	23.3	27%	0.273	13%	0.128	S	C	.	.	S	Bend	trans	-74.4	-12.9	179.7	-79.5	4	0	0	0	113.9	S108 N110 F111 I171	S108-D154 WeakPolarHBondContact CB-OD1 3.12Å; S108-D154 WeakPolarHBondContact CB-OD2 3.14Å; S108-D154 PolarHBondContact OG-OD1 2.92Å; S108-D154 PolarHBondContact OG-OD2 2.95Å; S108-D154 VanDerWaalsContact OG-OD2 3.04Å; N110-D154 PolarHBondContact ND2-OD2 3.19Å; F111-D154 HydrophobicContact CD2-CB 4.08Å; F111-D154 HydrophobicContact CE2-CB 3.81Å; D154-I171 WeakPolarHBondContact O-CD1 3.14Å
155	S	97.1	Very high	98.2	Very high	52 Å²	52	23.8 Å²	23.8	36%	0.364	13%	0.128	S	C	.	.	S	Bend	trans	-107.3	-22.1	-177.9	71.6	0	0	0	0	113.3	D153 I171	D153-S155 PolarHBondContact O-N 3.47Å; D153-S155 VanDerWaalsContact OD1-CA 3.3Å; D153-S155 WeakPolarHBondContact OD1-CA 3.37Å; D153-S155 WeakPolarHBondContact OD1-CB 3.47Å; D153-S155 PolarHBondContact OD1-N 3.46Å; D153-S155 PolarHBondContact OD1-OG 3.05Å; S155-I171 WeakPolarHBondContact O-CB 3.36Å; S155-I171 VanDerWaalsContact O-CG1 3.3Å; S155-I171 WeakPolarHBondContact O-CG1 3.27Å; S155-I171 PolarHBondContact O-N 2.98Å
156	Q	98.1	Very high	98.2	Very high	65 Å²	65	21.4 Å²	21.4	30%	0.304	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	137.5	-174.7	-68	-172.6	-23.9	0	0	113.4	L152 D153 L168 W169	L152-Q156 HydrophobicContact CB-CB 4.08Å; L152-Q156 HydrophobicContact CD1-CB 4.06Å; L152-Q156 PolarHBondContact N-O 3.29Å; D153-Q156 PolarHBondContact N-O 3.24Å; D153-Q156 PolarHBondContact OD1-N 2.96Å; Q156-L168 HydrophobicContact CB-CD1 4.26Å; Q156-W169 WeakPolarHBondContact CA-O 3.32Å
157	I	98.6	Very high	98.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139.2	175.7	-170.6	168	0	0	0	110.6	A113 I123 L139 C149 R150 F151 W169 I171	A113-I157 HydrophobicContact CB-CD1 3.61Å; I123-I157 HydrophobicContact CD1-CG2 4.35Å; L139-I157 HydrophobicContact CD1-CG2 3.56Å; C149-I157 HydrophobicContact CB-CD1 4.05Å; C149-I157 HydrophobicContact CB-CG1 4.41Å; R150-I157 WeakPolarHBondContact O-CG1 3.45Å; F151-I157 HydrophobicContact CD1-CB 4.09Å; F151-I157 HydrophobicContact CD1-CD1 4.07Å; F151-I157 HydrophobicContact CD1-CG1 4.25Å; F151-I157 HydrophobicContact CD2-CD1 4.26Å; F151-I157 HydrophobicContact CE1-CB 4.41Å; F151-I157 HydrophobicContact CE1-CD1 3.91Å; F151-I157 HydrophobicContact CE2-CD1 4.11Å; F151-I157 HydrophobicContact CG-CD1 4.25Å; F151-I157 HydrophobicContact CG-CG1 4.41Å; F151-I157 HydrophobicContact CZ-CD1 3.94Å; I157-W169 HydrophobicContact CG2-CB 3.82Å; I157-W169 HydrophobicContact CG2-CG 4.32Å; I157-W169 PolarHBondContact N-O 3.23Å; I157-W169 PolarHBondContact O-N 3.4Å; I157-I171 HydrophobicContact CB-CD1 4.21Å; I157-I171 HydrophobicContact CB-CG1 4.46Å; I157-I171 HydrophobicContact CG2-CD1 4.23Å; I157-I171 HydrophobicContact CG2-CG1 3.95Å
158	V	98.7	Very high	98.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	141.2	171.4	-173.7	0	0	0	0	108.9	C149 R150 L152 A167 L168 L190 L192 F199	C149-V158 CarbonylContact C-O 3.56Å; C149-V158 WeakPolarHBondContact CA-O 3.31Å; R150-V158 PolarHBondContact N-O 3.03Å; R150-V158 PolarHBondContact O-N 3.06Å; L152-V158 HydrophobicContact CD1-CG2 3.73Å; L152-V158 HydrophobicContact CG-CG2 4.18Å; V158-A167 CarbonylContact C-O 3.52Å; V158-A167 WeakPolarHBondContact CA-O 3.41Å; V158-L168 HydrophobicContact CG2-CD1 3.78Å; V158-L190 HydrophobicContact CG1-CD2 3.95Å; V158-L192 HydrophobicContact CB-CD2 4.43Å; V158-L192 HydrophobicContact CG2-CD2 4.11Å; V158-F199 HydrophobicContact CG1-CD1 4.35Å; V158-F199 HydrophobicContact CG1-CD2 4.48Å; V158-F199 HydrophobicContact CG1-CE1 4.18Å; V158-F199 HydrophobicContact CG1-CE2 4.32Å; V158-F199 HydrophobicContact CG1-CG 4.49Å; V158-F199 HydrophobicContact CG1-CZ 4.17Å
159	T	98.8	Very high	98.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.1	-177.3	52.6	0	0	0	0	110.3	C121 H142 L146 C148 C149 C166 A167 W169	C121-T159 HydrophobicContact CB-CG2 4.2Å; H142-T159 PolarHBondContact NE2-OG1 3.12Å; H142-T159 VanDerWaalsContact NE2-OG1 3.11Å; L146-T159 HydrophobicContact CD1-CG2 3.91Å; C148-T159 WeakPolarHBondContact O-CA 3.42Å; C149-T159 HydrophobicContact CB-CG2 4Å; T159-C166 CarbonylContact O-C 3.55Å; T159-C166 WeakPolarHBondContact O-CA 3.06Å; T159-C166 VanDerWaalsContact O-CB 3.22Å; T159-C166 WeakPolarHBondContact O-CB 3.17Å; T159-A167 PolarHBondContact N-O 3.02Å; T159-A167 PolarHBondContact O-N 3.31Å; T159-A167 PolarHBondContact OG1-O 3.08Å; T159-W169 PolarHBondContact OG1-NE1 3.37Å
160	S	98.6	Very high	98.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147.5	168.7	56.2	0	0	0	0	110.2	L146 S147 C148	L146-S160 WeakPolarHBondContact CD1-O 3.17Å; S147-S160 PolarHBondContact N-O 3.1Å; S147-S160 WeakPolarHBondContact OG-CB 3.3Å; S147-S160 PolarHBondContact OG-O 2.86Å; S147-S160 VanDerWaalsContact OG-O 3.04Å; S147-S160 PolarHBondContact OG-OG 3.1Å; C148-S160 VanDerWaalsContact CB-OG 3.27Å; C148-S160 WeakPolarHBondContact CB-OG 3.19Å; C148-S160 PolarHBondContact N-OG 2.9Å; C148-S160 PolarHBondContact O-N 3.07Å; C148-S160 PolarHBondContact O-OG 3.43Å
161	S	98.6	Very high	98.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.9	-175.9	179.1	0	0	0	0	113.4	H142 G144 Y145 D163 T164 T165 V187	H142-S161 VanDerWaalsContact CG-CB 3.49Å; H142-S161 WeakPolarHBondContact ND1-CB 3.34Å; G144-S161 VanDerWaalsContact C-OG 3.26Å; G144-S161 PolarHBondContact O-OG 2.98Å; Y145-S161 CarbonylContact O-C 3.48Å; Y145-S161 WeakPolarHBondContact O-CA 3.22Å; Y145-S161 WeakPolarHBondContact O-CB 3.47Å; Y145-S161 PolarHBondContact O-OG 2.9Å; S161-D163 WeakPolarHBondContact CB-OD1 3.31Å; S161-D163 PolarHBondContact O-N 3.18Å; S161-D163 PolarHBondContact OG-N 2.94Å; S161-D163 VanDerWaalsContact OG-N 3.16Å; S161-D163 PolarHBondContact OG-OD1 2.91Å; S161-D163 PolarHBondContact OG-OD2 3.47Å; S161-T164 PolarHBondContact O-N 3.21Å; S161-T165 PolarHBondContact N-O 2.93Å; S161-V187 PolarHBondContact O-N 3.19Å; S161-V187 VanDerWaalsContact O-N 3.15Å
162	G	98.4	Very high	98	Very high	12 Å²	12	27.3 Å²	27.3	12%	0.124	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-5.8	166.4	0	0	0	0	0	114.1	Y145 T164	Y145-G162 PolarHBondContact O-N 3.34Å; G162-T164 PolarHBondContact O-N 2.94Å
163	D	98.1	Very high	97.9	Very high	29 Å²	29	30 Å²	30	16%	0.155	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	12.9	169.7	67	20.2	0	0	0	114.2	H142 T143 S161 T165	H142-D163 WeakPolarHBondContact CA-OD2 3.22Å; H142-D163 WeakPolarHBondContact CB-OD2 3.46Å; H142-D163 IonicContact CE1-OD2 3.08Å; H142-D163 IonicContact CG-OD2 3.33Å; H142-D163 IonicContact ND1-OD1 3.79Å; H142-D163 PolarHBondContact ND1-OD1 2.94Å; H142-D163 IonicContact ND1-OD2 2.69Å; H142-D163 PolarHBondContact ND1-OD2 2.85Å; T143-D163 PolarHBondContact N-OD2 2.79Å; T143-D163 VanDerWaalsContact OG1-CB 3.26Å; T143-D163 WeakPolarHBondContact OG1-CB 3.33Å; S161-D163 WeakPolarHBondContact CB-OD1 3.31Å; S161-D163 PolarHBondContact O-N 3.18Å; S161-D163 PolarHBondContact OG-N 2.94Å; S161-D163 VanDerWaalsContact OG-N 3.16Å; S161-D163 PolarHBondContact OG-OD1 2.91Å; S161-D163 PolarHBondContact OG-OD2 3.47Å; D163-T165 VanDerWaalsContact C-N 3.25Å; D163-T165 PolarHBondContact O-N 3.05Å; D163-T165 WeakPolarHBondContact OD1-CB 3.38Å; D163-T165 PolarHBondContact OD1-N 3.03Å; D163-T165 PolarHBondContact OD1-OG1 3.43Å
164	T	98.5	Very high	97.9	Very high	49 Å²	49	27.7 Å²	27.7	30%	0.301	16%	0.156	S	C	.	.	S	Bend	trans	71.7	8.1	-178.7	77.1	0	0	0	0	115.2	S161 G162	S161-T164 PolarHBondContact O-N 3.21Å; G162-T164 PolarHBondContact O-N 2.94Å
165	T	98.4	Very high	97.8	Very high	22 Å²	22	31.2 Å²	31.2	14%	0.135	17%	0.171	C	C	.	.			trans	-115.6	157.9	-178.9	76.2	0	0	0	0	113	H142 S161 D163 T179 T181	H142-T165 PolarHBondContact CE1-OG1 3Å; S161-T165 PolarHBondContact N-O 2.93Å; D163-T165 VanDerWaalsContact C-N 3.25Å; D163-T165 PolarHBondContact O-N 3.05Å; D163-T165 WeakPolarHBondContact OD1-CB 3.38Å; D163-T165 PolarHBondContact OD1-N 3.03Å; D163-T165 PolarHBondContact OD1-OG1 3.43Å; T165-T179 HydrophobicContact CG2-CG2 4.43Å; T165-T181 HydrophobicContact CG2-CG2 3.99Å
166	C	98.8	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	156.4	157.7	-60.9	0	0	0	0	109.2	T159 F180 F199	T159-C166 CarbonylContact O-C 3.55Å; T159-C166 WeakPolarHBondContact O-CA 3.06Å; T159-C166 VanDerWaalsContact O-CB 3.22Å; T159-C166 WeakPolarHBondContact O-CB 3.17Å; C166-F180 HydrophobicContact CB-CB 4.03Å; C166-F180 HydrophobicContact CB-CD2 4.05Å; C166-F180 HydrophobicContact CB-CG 4.44Å; C166-F180 PolarHBondContact N-O 3.45Å; C166-F180 VanDerWaalsContact N-O 3.09Å; C166-F180 PolarHBondContact O-N 2.77Å; C166-F199 HydrophobicContact CB-CE2 4.03Å; C166-F199 HydrophobicContact CB-CZ 3.92Å
167	A	98.6	Very high	97.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	141.5	175.9	0	0	0	0	0	111.8	V158 T159 W169 Q176 T178	V158-A167 CarbonylContact C-O 3.52Å; V158-A167 WeakPolarHBondContact CA-O 3.41Å; T159-A167 PolarHBondContact N-O 3.02Å; T159-A167 PolarHBondContact O-N 3.31Å; T159-A167 PolarHBondContact OG1-O 3.08Å; A167-W169 HydrophobicContact CB-CZ2 4.35Å; A167-Q176 HydrophobicContact CB-CG 4.33Å; A167-T178 CarbonylContact C-O 3.5Å; A167-T178 WeakPolarHBondContact CA-O 3.4Å
168	L	98.7	Very high	97.8	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	133.9	164.4	179.2	67.8	0	0	0	108.3	L152 Q156 V158 T177 T178 F180 I213	L152-L168 HydrophobicContact CD1-CD1 3.36Å; Q156-L168 HydrophobicContact CB-CD1 4.26Å; V158-L168 HydrophobicContact CG2-CD1 3.78Å; L168-T177 VanDerWaalsContact CD2-OG1 3.28Å; L168-T177 WeakPolarHBondContact CD2-OG1 3.16Å; L168-T177 WeakPolarHBondContact CG-OG1 3.42Å; L168-T177 PolarHBondContact O-N 3.21Å; L168-T177 PolarHBondContact O-OG1 3.01Å; L168-T177 VanDerWaalsContact O-OG1 3.13Å; L168-T178 PolarHBondContact N-O 3.41Å; L168-T178 PolarHBondContact O-N 2.93Å; L168-F180 HydrophobicContact CB-CE2 3.91Å; L168-F180 HydrophobicContact CB-CZ 4.35Å; L168-I213 HydrophobicContact CD1-CG2 4.38Å; L168-I213 HydrophobicContact CD2-CG2 3.86Å
169	W	98.6	Very high	97.7	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.1	-177.4	-59.7	82.1	0	0	0	111.1	L139 P140 Q156 I157 T159 A167 Q175 Q176	L139-W169 HydrophobicContact CB-CD2 4.09Å; L139-W169 HydrophobicContact CB-CE3 3.83Å; L139-W169 HydrophobicContact CB-CH2 4.24Å; L139-W169 HydrophobicContact CB-CZ3 3.91Å; L139-W169 HydrophobicContact CD1-CB 3.81Å; L139-W169 HydrophobicContact CD1-CD2 4.04Å; L139-W169 HydrophobicContact CD1-CE3 4.32Å; L139-W169 HydrophobicContact CD1-CG 3.83Å; L139-W169 HydrophobicContact CD2-CE3 4.18Å; L139-W169 HydrophobicContact CG-CE3 4.34Å; P140-W169 WeakPolarHBondContact O-CH2 3.48Å; Q156-W169 WeakPolarHBondContact CA-O 3.32Å; I157-W169 HydrophobicContact CG2-CB 3.82Å; I157-W169 HydrophobicContact CG2-CG 4.32Å; I157-W169 PolarHBondContact N-O 3.23Å; I157-W169 PolarHBondContact O-N 3.4Å; T159-W169 PolarHBondContact OG1-NE1 3.37Å; A167-W169 HydrophobicContact CB-CZ2 4.35Å; W169-Q175 WeakPolarHBondContact CA-O 3.45Å; W169-Q176 HydrophobicContact CD2-CG 3.79Å; W169-Q176 HydrophobicContact CE3-CB 4.37Å; W169-Q176 HydrophobicContact CE3-CG 3.56Å; W169-Q176 HydrophobicContact CH2-CG 3.31Å; W169-Q176 HydrophobicContact CZ2-CG 3.53Å; W169-Q176 HydrophobicContact CZ3-CB 4.43Å; W169-Q176 HydrophobicContact CZ3-CG 3.32Å
170	D	97.9	Very high	97.7	Very high	40 Å²	40	36.9 Å²	36.9	21%	0.214	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	117.3	159.4	172.3	-2	0	0	0	108.2	E172 T173 A174 Q175 T177	D170-E172 VanDerWaalsContact C-N 3.35Å; D170-E172 WeakPolarHBondContact OD1-CB 3.17Å; D170-E172 PolarHBondContact OD1-N 3.13Å; D170-T173 WeakPolarHBondContact CB-OG1 3.34Å; D170-T173 PolarHBondContact OD1-N 3.04Å; D170-T173 VanDerWaalsContact OD2-CG2 3.31Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.4Å; D170-T173 PolarHBondContact OD2-OG1 3.4Å; D170-A174 VanDerWaalsContact O-CA 3.28Å; D170-A174 WeakPolarHBondContact O-CA 3.45Å; D170-A174 PolarHBondContact O-N 3.08Å; D170-Q175 PolarHBondContact N-O 3.35Å; D170-Q175 PolarHBondContact O-N 3.28Å; D170-T177 HydrophobicContact CB-CG2 3.62Å
171	I	96.9	Very high	97.7	Very high	9 Å²	9	41.5 Å²	41.5	5%	0.046	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-35.5	-176.9	-62.1	172.3	0	0	0	110.7	I123 R137 F151 D154 S155 I157	I123-I171 HydrophobicContact CD1-CB 4.09Å; I123-I171 HydrophobicContact CD1-CD1 3.82Å; I123-I171 HydrophobicContact CD1-CG1 3.55Å; I123-I171 HydrophobicContact CD1-CG2 3.56Å; I123-I171 HydrophobicContact CG2-CG2 4.49Å; R137-I171 HydrophobicContact CB-CG2 4.5Å; R137-I171 HydrophobicContact CG-CG2 4.21Å; R137-I171 WeakPolarHBondContact CG-O 3.46Å; F151-I171 HydrophobicContact CD1-CD1 3.87Å; F151-I171 HydrophobicContact CE1-CD1 3.67Å; D154-I171 WeakPolarHBondContact O-CD1 3.14Å; S155-I171 WeakPolarHBondContact O-CB 3.36Å; S155-I171 VanDerWaalsContact O-CG1 3.3Å; S155-I171 WeakPolarHBondContact O-CG1 3.27Å; S155-I171 PolarHBondContact O-N 2.98Å; I157-I171 HydrophobicContact CB-CD1 4.21Å; I157-I171 HydrophobicContact CB-CG1 4.46Å; I157-I171 HydrophobicContact CG2-CD1 4.23Å; I157-I171 HydrophobicContact CG2-CG1 3.95Å
172	E	95.2	Very high	97.6	Very high	147 Å²	147	43.7 Å²	43.7	69%	0.687	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-46.5	-176.1	-174.5	173.4	-178.9	0	0	110.9	R137 D170	R137-E172 PolarHBondContact NE-O 2.95Å; R137-E172 PolarHBondContact NH2-O 3.34Å; D170-E172 VanDerWaalsContact C-N 3.35Å; D170-E172 WeakPolarHBondContact OD1-CB 3.17Å; D170-E172 PolarHBondContact OD1-N 3.13Å
173	T	96.1	Very high	97.6	Very high	75 Å²	75	43.8 Å²	43.8	46%	0.46	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-14	-179	61.1	0	0	0	0	113.6	D170 Q175	D170-T173 WeakPolarHBondContact CB-OG1 3.34Å; D170-T173 PolarHBondContact OD1-N 3.04Å; D170-T173 VanDerWaalsContact OD2-CG2 3.31Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.4Å; D170-T173 PolarHBondContact OD2-OG1 3.4Å; T173-Q175 PolarHBondContact O-N 3.07Å
174	A	96	Very high	97.6	Very high	20 Å²	20	47.4 Å²	47.4	17%	0.165	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	32.5	-173.7	0	0	0	0	0	113.3	L139 D170	L139-A174 HydrophobicContact CD2-CB 3.75Å; D170-A174 VanDerWaalsContact O-CA 3.28Å; D170-A174 WeakPolarHBondContact O-CA 3.45Å; D170-A174 PolarHBondContact O-N 3.08Å
175	Q	96.3	Very high	97.6	Very high	125 Å²	125	45.6 Å²	45.6	58%	0.584	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	149.2	179.3	-62.8	-58.1	-53.9	0	0	111.1	W169 D170 T173 T177	W169-Q175 WeakPolarHBondContact CA-O 3.45Å; D170-Q175 PolarHBondContact N-O 3.35Å; D170-Q175 PolarHBondContact O-N 3.28Å; T173-Q175 PolarHBondContact O-N 3.07Å; Q175-T177 PolarHBondContact O-N 2.73Å
176	Q	97.1	Very high	97.6	Very high	69 Å²	69	47.2 Å²	47.2	32%	0.322	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	120.6	167.4	-65.6	-176.5	-8.9	0	0	108.7	A167 W169 T179	A167-Q176 HydrophobicContact CB-CG 4.33Å; W169-Q176 HydrophobicContact CD2-CG 3.79Å; W169-Q176 HydrophobicContact CE3-CB 4.37Å; W169-Q176 HydrophobicContact CE3-CG 3.56Å; W169-Q176 HydrophobicContact CH2-CG 3.31Å; W169-Q176 HydrophobicContact CZ2-CG 3.53Å; W169-Q176 HydrophobicContact CZ3-CB 4.43Å; W169-Q176 HydrophobicContact CZ3-CG 3.32Å; Q176-T179 PolarHBondContact OE1-OG1 2.82Å
177	T	97.1	Very high	97.6	Very high	67 Å²	67	47.2 Å²	47.2	41%	0.411	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-32.5	174.3	58.7	0	0	0	0	111.2	L168 D170 Q175	L168-T177 VanDerWaalsContact CD2-OG1 3.28Å; L168-T177 WeakPolarHBondContact CD2-OG1 3.16Å; L168-T177 WeakPolarHBondContact CG-OG1 3.42Å; L168-T177 PolarHBondContact O-N 3.21Å; L168-T177 PolarHBondContact O-OG1 3.01Å; L168-T177 VanDerWaalsContact O-OG1 3.13Å; D170-T177 HydrophobicContact CB-CG2 3.62Å; Q175-T177 PolarHBondContact O-N 2.73Å
178	T	98	Very high	97.6	Very high	36 Å²	36	49.4 Å²	49.4	22%	0.221	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	136.7	-177	-48.7	0	0	0	0	110.1	A167 L168 F180	A167-T178 CarbonylContact C-O 3.5Å; A167-T178 WeakPolarHBondContact CA-O 3.4Å; L168-T178 PolarHBondContact N-O 3.41Å; L168-T178 PolarHBondContact O-N 2.93Å; T178-F180 HydrophobicContact CG2-CE1 4.1Å; T178-F180 HydrophobicContact CG2-CE2 4.33Å; T178-F180 HydrophobicContact CG2-CZ 3.94Å
179	T	98.1	Very high	97.6	Very high	62 Å²	62	49.9 Å²	49.9	38%	0.38	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128	173.5	-47.8	0	0	0	0	108.8	T165 Q176 T181	T165-T179 HydrophobicContact CG2-CG2 4.43Å; Q176-T179 PolarHBondContact OE1-OG1 2.82Å; T179-T181 HydrophobicContact CG2-CG2 3.88Å
180	F	98.6	Very high	97.6	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	103.4	178.5	-55.2	-85.8	0	0	0	108.7	C166 L168 T178 F199 W211	C166-F180 HydrophobicContact CB-CB 4.03Å; C166-F180 HydrophobicContact CB-CD2 4.05Å; C166-F180 HydrophobicContact CB-CG 4.44Å; C166-F180 PolarHBondContact N-O 3.45Å; C166-F180 VanDerWaalsContact N-O 3.09Å; C166-F180 PolarHBondContact O-N 2.77Å; L168-F180 HydrophobicContact CB-CE2 3.91Å; L168-F180 HydrophobicContact CB-CZ 4.35Å; T178-F180 HydrophobicContact CG2-CE1 4.1Å; T178-F180 HydrophobicContact CG2-CE2 4.33Å; T178-F180 HydrophobicContact CG2-CZ 3.94Å; F180-F199 HydrophobicContact CB-CZ 4.32Å; F180-F199 HydrophobicContact CD1-CE1 4.04Å; 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 3.68Å; F180-F199 HydrophobicContact CD2-CZ 3.68Å; F180-F199 AromaticContact CE1-CE1 3.82Å; F180-F199 HydrophobicContact CE1-CE1 3.82Å; F180-F199 HydrophobicContact CE1-CZ 4.35Å; F180-F199 AromaticContact CE2-CE1 3.69Å; F180-F199 HydrophobicContact CE2-CE1 3.69Å; F180-F199 AromaticContact CE2-CZ 3.96Å; F180-F199 HydrophobicContact CE2-CZ 3.96Å; F180-F199 HydrophobicContact CG-CE1 4.08Å; F180-F199 AromaticContact CG-CZ 3.78Å; F180-F199 HydrophobicContact CG-CZ 3.78Å; F180-F199 AromaticContact CZ-CE1 3.67Å; F180-F199 HydrophobicContact CZ-CE1 3.67Å; F180-F199 HydrophobicContact CZ-CZ 4.31Å; F180-W211 HydrophobicContact CB-CD2 4.01Å; F180-W211 HydrophobicContact CB-CE3 3.71Å; F180-W211 HydrophobicContact CB-CH2 4.28Å; F180-W211 HydrophobicContact CB-CZ3 3.84Å; F180-W211 HydrophobicContact CD1-CB 4.04Å; F180-W211 HydrophobicContact CD1-CD2 4.18Å; F180-W211 AromaticContact CD1-CE3 3.79Å; F180-W211 HydrophobicContact CD1-CE3 3.79Å; F180-W211 HydrophobicContact CD1-CG 4.31Å; F180-W211 HydrophobicContact CE1-CB 4.29Å; F180-W211 HydrophobicContact CG-CD2 4.4Å; F180-W211 HydrophobicContact CG-CE3 4.18Å
181	T	97.9	Very high	97.6	Very high	97 Å²	97	48.9 Å²	48.9	60%	0.595	29%	0.289	S	S	*	.			trans	-108.1	140.9	179.8	59	0	0	0	0	110.3	T165 T179 W211	T165-T181 HydrophobicContact CG2-CG2 3.99Å; T179-T181 HydrophobicContact CG2-CG2 3.88Å; T181-W211 WeakPolarHBondContact O-CH2 3.44Å
182	G	97	Very high	97.7	Very high	47 Å²	47	49.5 Å²	49.5	49%	0.485	29%	0.293	S	S	.	.			trans	155.1	-14.1	176.6	0	0	0	0	0	115.6	K209	G182-K209 WeakPolarHBondContact O-CE 3.29Å; G182-K209 PolarHBondContact O-NZ 2.94Å
183	H	98.4	Very high	97.8	Very high	13 Å²	13	42.6 Å²	42.6	6%	0.06	26%	0.26	C	S	.	.			trans	-73.2	152.8	165.5	-81.1	-67.3	0	0	0	110.8	V187 S201 A203 D205 W211	H183-V187 HydrophobicContact CB-CG2 4.04Å; H183-S201 PolarHBondContact NE2-OG 3.44Å; H183-A203 HydrophobicContact CB-CB 4.34Å; H183-A203 VanDerWaalsContact ND1-CB 3.33Å; H183-A203 WeakPolarHBondContact ND1-CB 3.35Å; H183-D205 WeakPolarHBondContact CA-OD2 3.28Å; H183-D205 WeakPolarHBondContact CB-OD2 3.46Å; H183-D205 IonicContact CE1-OD1 3.58Å; H183-D205 IonicContact CG-OD2 2.68Å; H183-D205 IonicContact ND1-OD1 2.81Å; H183-D205 PolarHBondContact ND1-OD1 2.91Å; H183-D205 IonicContact ND1-OD2 3.51Å; H183-D205 PolarHBondContact ND1-OD2 2.96Å; H183-W211 AromaticContact CD2-CZ2 3.93Å
184	S	97.8	Very high	97.8	Very high	105 Å²	105	42.5 Å²	42.5	73%	0.734	26%	0.261	S	S	*	.	S	Bend	trans	-111.9	6.2	176.9	57.5	0	0	0	0	113.6	D205	S184-D205 PolarHBondContact N-OD2 3.08Å; S184-D205 VanDerWaalsContact OG-CB 3.3Å; S184-D205 WeakPolarHBondContact OG-CB 3.4Å
185	G	98.1	Very high	97.8	Very high	12 Å²	12	46.1 Å²	46.1	12%	0.124	28%	0.278	C	S	.	.	S	Bend	trans	-146.3	173.8	175.1	0	0	0	0	0	110.5	V187	G185-V187 PolarHBondContact O-N 2.87Å
186	D	98.6	Very high	97.8	Very high	55 Å²	55	42.9 Å²	42.9	29%	0.294	26%	0.264	S	S	.	.			trans	-53.7	128.1	-178.1	-61.3	17.3	0	0	0	110.7	Y145 M188 A203 C204	Y145-D186 WeakPolarHBondContact CE1-OD2 3.26Å; Y145-D186 VanDerWaalsContact OH-CB 3.29Å; Y145-D186 WeakPolarHBondContact OH-CB 3.44Å; Y145-D186 PolarHBondContact OH-OD2 2.9Å; D186-M188 HydrophobicContact CB-SD 4.43Å; D186-M188 PolarHBondContact O-N 2.83Å; D186-A203 CarbonylContact O-C 3.59Å; D186-A203 WeakPolarHBondContact O-CA 3.5Å; D186-A203 VanDerWaalsContact O-CB 3.27Å; D186-A203 WeakPolarHBondContact O-CB 3.36Å; D186-C204 HydrophobicContact CB-CB 4.4Å; D186-C204 PolarHBondContact O-N 2.77Å
187	V	98.8	Very high	97.8	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.8	175.8	-171.6	0	0	0	0	107.4	S147 S161 H183 G185 A203	S147-V187 WeakPolarHBondContact CB-O 3.5Å; S147-V187 PolarHBondContact OG-O 2.89Å; S161-V187 PolarHBondContact O-N 3.19Å; S161-V187 VanDerWaalsContact O-N 3.15Å; H183-V187 HydrophobicContact CB-CG2 4.04Å; G185-V187 PolarHBondContact O-N 2.87Å; V187-A203 HydrophobicContact CG2-CB 4.4Å
188	M	98.6	Very high	97.9	Very high	47 Å²	47	46.1 Å²	46.1	23%	0.232	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-32.9	-171.4	-66.1	-59.9	-72.7	0	0	113	S147 D186 G202 I229	S147-M188 WeakPolarHBondContact CB-O 3.44Å; D186-M188 HydrophobicContact CB-SD 4.43Å; D186-M188 PolarHBondContact O-N 2.83Å; M188-G202 PolarHBondContact N-O 3.39Å; M188-I229 WeakPolarHBondContact CB-O 3.24Å
189	S	98.3	Very high	97.9	Very high	18 Å²	18	44.4 Å²	44.4	13%	0.126	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155.5	-175.7	-167.1	0	0	0	0	111.9	S201 G202 N230	S189-S201 VanDerWaalsContact O-CA 3.3Å; S189-S201 WeakPolarHBondContact O-CA 3.33Å; S189-G202 PolarHBondContact N-O 3.33Å; S189-G202 PolarHBondContact O-N 2.6Å; S189-N230 WeakPolarHBondContact CB-O 3.47Å
190	L	98.6	Very high	98	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.8	171.9	71.1	86.7	0	0	0	110.8	C148 R150 V158 F199 V200	C148-L190 HydrophobicContact CB-CD2 4.49Å; C148-L190 HydrophobicContact CB-CG 4.18Å; R150-L190 HydrophobicContact CB-CD1 3.81Å; R150-L190 HydrophobicContact CG-CD1 3.57Å; V158-L190 HydrophobicContact CG1-CD2 3.95Å; L190-F199 HydrophobicContact CB-CD2 4.26Å; L190-V200 CarbonylContact C-O 3.57Å; L190-V200 WeakPolarHBondContact CA-O 3.26Å
191	S	98.7	Very high	98	Very high	19 Å²	19	41.3 Å²	41.3	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	131.3	173.7	-171.5	0	0	0	0	109.3	F199 V200 F234	S191-F199 VanDerWaalsContact O-CA 3.31Å; S191-F199 WeakPolarHBondContact O-CA 3.45Å; S191-F199 WeakPolarHBondContact O-CB 3.19Å; S191-V200 PolarHBondContact N-O 3.36Å; S191-V200 PolarHBondContact O-N 3.49Å; S191-F234 WeakPolarHBondContact O-CD2 3.41Å; S191-F234 WeakPolarHBondContact O-CE2 3.29Å; S191-F234 PolarHBondContact OG-N 3.23Å
192	L	98.6	Very high	98	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.11	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.7	174.2	-63.9	177.4	0	0	0	109.8	R150 F151 L152 V158 M196 F199 I213 F234	R150-L192 HydrophobicContact CB-CD1 3.63Å; R150-L192 HydrophobicContact CB-CG 3.82Å; R150-L192 HydrophobicContact CG-CG 4.45Å; F151-L192 VanDerWaalsContact O-CD1 3.28Å; F151-L192 WeakPolarHBondContact O-CD1 3.27Å; L152-L192 HydrophobicContact CD2-CD1 4.02Å; L152-L192 HydrophobicContact CD2-CD2 4.11Å; L152-L192 HydrophobicContact CG-CD1 4.29Å; V158-L192 HydrophobicContact CB-CD2 4.43Å; V158-L192 HydrophobicContact CG2-CD2 4.11Å; L192-M196 HydrophobicContact CB-SD 3.73Å; L192-M196 HydrophobicContact CD1-CE 4.43Å; L192-M196 HydrophobicContact CD1-SD 3.6Å; L192-M196 VanDerWaalsContact CD1-SD 3.6Å; L192-M196 HydrophobicContact CG-SD 4.26Å; L192-F199 HydrophobicContact CD2-CB 3.75Å; L192-I213 HydrophobicContact CD2-CD1 4.23Å; L192-F234 WeakPolarHBondContact O-CD2 3.27Å
193	S	97.7	Very high	98.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.014	19%	0.188	C	C	.	.			trans	-66.5	153.6	171.1	53.3	0	0	0	0	110.9	D195 M196 R197 T198 F234	S193-D195 PolarHBondContact O-N 3.49Å; S193-D195 VanDerWaalsContact O-N 3.13Å; S193-D195 PolarHBondContact OG-OD1 2.96Å; S193-M196 PolarHBondContact O-N 2.93Å; S193-R197 PolarHBondContact OG-N 2.98Å; S193-T198 WeakPolarHBondContact CB-O 3.33Å; S193-T198 VanDerWaalsContact CB-OG1 3.3Å; S193-T198 WeakPolarHBondContact CB-OG1 3.36Å; S193-T198 PolarHBondContact N-O 2.54Å; S193-T198 PolarHBondContact OG-N 3.24Å; S193-T198 PolarHBondContact OG-O 3.05Å; S193-T198 PolarHBondContact OG-OG1 3.41Å; S193-T198 VanDerWaalsContact OG-OG1 3.09Å; S193-F234 VanDerWaalsContact N-CE2 3.26Å
194	P	96.2	Very high	98.1	Very high	74 Å²	74	35.5 Å²	35.5	48%	0.481	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.7	178.8	-26.1	35	0	0	0	114.6	P236	P194-P236 WeakPolarHBondContact CG-O 3.2Å
195	D	95.8	Very high	98.1	Very high	95 Å²	95	32.3 Å²	32.3	51%	0.508	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.4	177.1	74.8	-2.9	0	0	0	113.8	S193 R197	S193-D195 PolarHBondContact O-N 3.49Å; S193-D195 VanDerWaalsContact O-N 3.13Å; S193-D195 PolarHBondContact OG-OD1 2.96Å; D195-R197 HydrophobicContact CB-CG 4.42Å; D195-R197 PolarHBondContact O-N 2.84Å; D195-R197 WeakPolarHBondContact OD1-CB 3.17Å; D195-R197 PolarHBondContact OD1-N 2.85Å; D195-R197 WeakPolarHBondContact OD2-CD 3.3Å
196	M	96.8	Very high	98.1	Very high	58 Å²	58	32.7 Å²	32.7	29%	0.286	17%	0.173	S	C	.	.	S	Bend	trans	58.1	22	-179.5	-58.4	-63.2	-176.6	0	0	114.3	Y65 L152 L192 S193	Y65-M196 WeakPolarHBondContact OH-CE 3.45Å; L152-M196 HydrophobicContact CD2-CB 3.82Å; L152-M196 HydrophobicContact CD2-CG 4.49Å; L152-M196 WeakPolarHBondContact CD2-O 3.22Å; L152-M196 HydrophobicContact CD2-SD 4.24Å; L192-M196 HydrophobicContact CB-SD 3.73Å; L192-M196 HydrophobicContact CD1-CE 4.43Å; L192-M196 HydrophobicContact CD1-SD 3.6Å; L192-M196 VanDerWaalsContact CD1-SD 3.6Å; L192-M196 HydrophobicContact CG-SD 4.26Å; S193-M196 PolarHBondContact O-N 2.93Å
197	R	96.9	Very high	98.1	Very high	176 Å²	176	30.5 Å²	30.5	66%	0.664	16%	0.162	S	C	*	.	S	Bend	trans	-98.1	-28.8	179.2	-62	-176.8	179.3	-162	-1.1	113.3	S193 D195 I213	S193-R197 PolarHBondContact OG-N 2.98Å; D195-R197 HydrophobicContact CB-CG 4.42Å; D195-R197 PolarHBondContact O-N 2.84Å; D195-R197 WeakPolarHBondContact OD1-CB 3.17Å; D195-R197 PolarHBondContact OD1-N 2.85Å; D195-R197 WeakPolarHBondContact OD2-CD 3.3Å; R197-I213 VanDerWaalsContact O-CB 3.32Å; R197-I213 WeakPolarHBondContact O-CB 3.29Å; R197-I213 WeakPolarHBondContact O-CG1 3.04Å; R197-I213 PolarHBondContact O-N 3.24Å
198	T	98.3	Very high	98.1	Very high	27 Å²	27	30.6 Å²	30.6	17%	0.166	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	162.6	179.6	63	0	0	0	0	110.8	S193 W211	S193-T198 WeakPolarHBondContact CB-O 3.33Å; S193-T198 VanDerWaalsContact CB-OG1 3.3Å; S193-T198 WeakPolarHBondContact CB-OG1 3.36Å; S193-T198 PolarHBondContact N-O 2.54Å; S193-T198 PolarHBondContact OG-N 3.24Å; S193-T198 PolarHBondContact OG-O 3.05Å; S193-T198 PolarHBondContact OG-OG1 3.41Å; S193-T198 VanDerWaalsContact OG-OG1 3.09Å; T198-W211 CarbonylContact C-O 3.58Å; T198-W211 WeakPolarHBondContact CA-O 3.34Å; T198-W211 VanDerWaalsContact CB-O 3.22Å; T198-W211 WeakPolarHBondContact CB-O 3.18Å
199	F	98.8	Very high	98.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.6	168	74	-86.4	0	0	0	110.6	V158 C166 F180 L190 S191 L192 W211 I213	V158-F199 HydrophobicContact CG1-CD1 4.35Å; V158-F199 HydrophobicContact CG1-CD2 4.48Å; V158-F199 HydrophobicContact CG1-CE1 4.18Å; V158-F199 HydrophobicContact CG1-CE2 4.32Å; V158-F199 HydrophobicContact CG1-CG 4.49Å; V158-F199 HydrophobicContact CG1-CZ 4.17Å; C166-F199 HydrophobicContact CB-CE2 4.03Å; C166-F199 HydrophobicContact CB-CZ 3.92Å; F180-F199 HydrophobicContact CB-CZ 4.32Å; F180-F199 HydrophobicContact CD1-CE1 4.04Å; 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 3.68Å; F180-F199 HydrophobicContact CD2-CZ 3.68Å; F180-F199 AromaticContact CE1-CE1 3.82Å; F180-F199 HydrophobicContact CE1-CE1 3.82Å; F180-F199 HydrophobicContact CE1-CZ 4.35Å; F180-F199 AromaticContact CE2-CE1 3.69Å; F180-F199 HydrophobicContact CE2-CE1 3.69Å; F180-F199 AromaticContact CE2-CZ 3.96Å; F180-F199 HydrophobicContact CE2-CZ 3.96Å; F180-F199 HydrophobicContact CG-CE1 4.08Å; F180-F199 AromaticContact CG-CZ 3.78Å; F180-F199 HydrophobicContact CG-CZ 3.78Å; F180-F199 AromaticContact CZ-CE1 3.67Å; F180-F199 HydrophobicContact CZ-CE1 3.67Å; F180-F199 HydrophobicContact CZ-CZ 4.31Å; L190-F199 HydrophobicContact CB-CD2 4.26Å; S191-F199 VanDerWaalsContact O-CA 3.31Å; S191-F199 WeakPolarHBondContact O-CA 3.45Å; S191-F199 WeakPolarHBondContact O-CB 3.19Å; L192-F199 HydrophobicContact CD2-CB 3.75Å; F199-W211 HydrophobicContact CD1-CB 3.78Å; F199-W211 HydrophobicContact CD1-CG 4.47Å; F199-W211 HydrophobicContact CD2-CB 4.48Å; F199-W211 AromaticContact CD2-CD1 3.75Å; F199-W211 HydrophobicContact CD2-CG 4.41Å; F199-W211 HydrophobicContact CE1-CB 3.36Å; F199-W211 AromaticContact CE1-CG 3.87Å; F199-W211 HydrophobicContact CE1-CG 3.87Å; F199-W211 HydrophobicContact CE2-CB 4.12Å; F199-W211 AromaticContact CE2-CD1 3.24Å; F199-W211 AromaticContact CE2-CG 3.79Å; F199-W211 HydrophobicContact CE2-CG 3.79Å; F199-W211 AromaticContact CE2-NE1 3.87Å; F199-W211 HydrophobicContact CG-CB 4.33Å; F199-W211 HydrophobicContact CZ-CB 3.55Å; F199-W211 AromaticContact CZ-CD1 3.45Å; F199-W211 VanDerWaalsContact CZ-CD1 3.45Å; F199-W211 HydrophobicContact CZ-CD2 4.3Å; F199-W211 AromaticContact CZ-CG 3.48Å; F199-W211 HydrophobicContact CZ-CG 3.48Å; F199-W211 VanDerWaalsContact CZ-CG 3.48Å; F199-W211 PolarHBondContact N-O 2.81Å; F199-W211 PolarHBondContact O-N 2.87Å; F199-I213 HydrophobicContact CD1-CD1 4.2Å; F199-I213 HydrophobicContact CD1-CG1 3.68Å; F199-I213 HydrophobicContact CE1-CG1 4.26Å
200	V	98.8	Very high	98.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.9	170.7	-68.8	0	0	0	0	109.6	L190 S191 K209 L210 V232 F234 F241	L190-V200 CarbonylContact C-O 3.57Å; L190-V200 WeakPolarHBondContact CA-O 3.26Å; S191-V200 PolarHBondContact N-O 3.36Å; S191-V200 PolarHBondContact O-N 3.49Å; V200-K209 CarbonylContact C-O 3.5Å; V200-K209 VanDerWaalsContact CA-O 3.22Å; V200-K209 WeakPolarHBondContact CA-O 3.3Å; V200-L210 HydrophobicContact CG1-CB 4.34Å; V200-L210 HydrophobicContact CG1-CD1 3.68Å; V200-V232 HydrophobicContact CB-CG1 4.11Å; V200-V232 HydrophobicContact CG2-CB 4.36Å; V200-V232 HydrophobicContact CG2-CG1 3.31Å; V200-F234 HydrophobicContact CB-CE2 4.15Å; V200-F234 HydrophobicContact CB-CZ 4.37Å; V200-F234 HydrophobicContact CG1-CE1 4.29Å; V200-F234 HydrophobicContact CG1-CE2 3.9Å; V200-F234 HydrophobicContact CG1-CZ 3.62Å; V200-F234 HydrophobicContact CG2-CD2 3.79Å; V200-F234 HydrophobicContact CG2-CE2 3.56Å; V200-F234 HydrophobicContact CG2-CZ 4.12Å; V200-F241 HydrophobicContact CG1-CD1 4.02Å; V200-F241 HydrophobicContact CG1-CE1 4.23Å; V200-F241 HydrophobicContact CG1-CG 4.25Å; V200-F241 HydrophobicContact CG2-CB 4.34Å; V200-F241 HydrophobicContact CG2-CD2 4.48Å; V200-F241 HydrophobicContact CG2-CG 4.35Å
201	S	98.8	Very high	98.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.1	171.8	58.7	0	0	0	0	110.9	H183 S189 S208 K209 W211	H183-S201 PolarHBondContact NE2-OG 3.44Å; S189-S201 VanDerWaalsContact O-CA 3.3Å; S189-S201 WeakPolarHBondContact O-CA 3.33Å; S201-S208 CarbonylContact O-C 3.52Å; S201-S208 WeakPolarHBondContact O-CA 3.38Å; S201-S208 WeakPolarHBondContact O-CB 3.25Å; S201-K209 PolarHBondContact N-O 3.24Å; S201-K209 PolarHBondContact O-N 2.79Å; S201-W211 PolarHBondContact OG-NE1 2.84Å
202	G	98.7	Very high	98.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	140.9	172.6	0	0	0	0	0	110.3	M188 S189 I229	M188-G202 PolarHBondContact N-O 3.39Å; S189-G202 PolarHBondContact N-O 3.33Å; S189-G202 PolarHBondContact O-N 2.6Å; G202-I229 CarbonylContact C-O 3.57Å
203	A	98.8	Very high	98.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	170.9	-171.4	0	0	0	0	0	113.3	H183 D186 V187 D205 A206 S207 I229	H183-A203 HydrophobicContact CB-CB 4.34Å; H183-A203 VanDerWaalsContact ND1-CB 3.33Å; H183-A203 WeakPolarHBondContact ND1-CB 3.35Å; D186-A203 CarbonylContact O-C 3.59Å; D186-A203 WeakPolarHBondContact O-CA 3.5Å; D186-A203 VanDerWaalsContact O-CB 3.27Å; D186-A203 WeakPolarHBondContact O-CB 3.36Å; V187-A203 HydrophobicContact CG2-CB 4.4Å; A203-D205 PolarHBondContact O-N 2.88Å; A203-A206 PolarHBondContact O-N 2.95Å; A203-S207 PolarHBondContact N-O 3.07Å; A203-I229 PolarHBondContact O-N 3.31Å
204	C	98.7	Very high	98	Very high	34 Å²	34	40.2 Å²	40.2	23%	0.23	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-1.4	173.3	-63.9	0	0	0	0	113.8	D186 A206 D228	D186-C204 HydrophobicContact CB-CB 4.4Å; D186-C204 PolarHBondContact O-N 2.77Å; C204-A206 PolarHBondContact O-N 2.89Å; C204-D228 HydrophobicContact CB-CB 4.3Å; C204-D228 VanDerWaalsContact SG-CG 3.57Å; C204-D228 PolarHBondContact SG-OD2 3.31Å
205	D	98.1	Very high	97.9	Very high	39 Å²	39	40.6 Å²	40.6	21%	0.209	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	12.5	170.1	64.4	19.8	0	0	0	113.3	H183 S184 A203 S207	H183-D205 WeakPolarHBondContact CA-OD2 3.28Å; H183-D205 WeakPolarHBondContact CB-OD2 3.46Å; H183-D205 IonicContact CE1-OD1 3.58Å; H183-D205 IonicContact CG-OD2 2.68Å; H183-D205 IonicContact ND1-OD1 2.81Å; H183-D205 PolarHBondContact ND1-OD1 2.91Å; H183-D205 IonicContact ND1-OD2 3.51Å; H183-D205 PolarHBondContact ND1-OD2 2.96Å; S184-D205 PolarHBondContact N-OD2 3.08Å; S184-D205 VanDerWaalsContact OG-CB 3.3Å; S184-D205 WeakPolarHBondContact OG-CB 3.4Å; A203-D205 PolarHBondContact O-N 2.88Å; D205-S207 VanDerWaalsContact CG-OG 3.27Å; D205-S207 PolarHBondContact O-N 2.87Å; D205-S207 VanDerWaalsContact O-N 3.1Å; D205-S207 WeakPolarHBondContact OD1-CA 3.32Å; D205-S207 VanDerWaalsContact OD1-CB 3.29Å; D205-S207 WeakPolarHBondContact OD1-CB 3.15Å; D205-S207 PolarHBondContact OD1-N 3.45Å; D205-S207 PolarHBondContact OD1-OG 3.01Å; D205-S207 PolarHBondContact OD2-OG 3.14Å
206	A	98.3	Very high	97.9	Very high	20 Å²	20	36.7 Å²	36.7	17%	0.165	17%	0.173	C	C	.	.	S	Bend	trans	56.7	18.9	-176.1	0	0	0	0	0	114.3	A203 C204 H225 S227	A203-A206 PolarHBondContact O-N 2.95Å; C204-A206 PolarHBondContact O-N 2.89Å; A206-H225 HydrophobicContact CB-CB 4.33Å; A206-S227 WeakPolarHBondContact CA-O 3.38Å; A206-S227 VanDerWaalsContact CB-O 3.26Å; A206-S227 WeakPolarHBondContact CB-O 3.28Å
207	S	98.2	Very high	97.9	Very high	9 Å²	9	39.9 Å²	39.9	6%	0.063	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	150.3	177.7	83.5	0	0	0	0	112.1	A203 D205 F222	A203-S207 PolarHBondContact N-O 3.07Å; D205-S207 VanDerWaalsContact CG-OG 3.27Å; D205-S207 PolarHBondContact O-N 2.87Å; D205-S207 VanDerWaalsContact O-N 3.1Å; D205-S207 WeakPolarHBondContact OD1-CA 3.32Å; D205-S207 VanDerWaalsContact OD1-CB 3.29Å; D205-S207 WeakPolarHBondContact OD1-CB 3.15Å; D205-S207 PolarHBondContact OD1-N 3.45Å; D205-S207 PolarHBondContact OD1-OG 3.01Å; D205-S207 PolarHBondContact OD2-OG 3.14Å; S207-F222 VanDerWaalsContact CA-O 3.32Å; S207-F222 WeakPolarHBondContact CA-O 3.46Å
208	S	98.6	Very high	97.9	Very high	1 Å²	1	34 Å²	34	1%	0.007	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	143.4	165.8	-58.5	0	0	0	0	109.9	S201 S221 F222 I229 T243	S201-S208 CarbonylContact O-C 3.52Å; S201-S208 WeakPolarHBondContact O-CA 3.38Å; S201-S208 WeakPolarHBondContact O-CB 3.25Å; S208-S221 CarbonylContact O-C 3.49Å; S208-S221 WeakPolarHBondContact O-CA 3.4Å; S208-F222 PolarHBondContact N-O 2.88Å; S208-F222 PolarHBondContact O-N 2.72Å; S208-I229 VanDerWaalsContact OG-CD1 3.22Å; S208-I229 WeakPolarHBondContact OG-CD1 3.28Å; S208-T243 WeakPolarHBondContact OG-CG2 3.48Å
209	K	98.8	Very high	97.9	Very high	27 Å²	27	39 Å²	39	12%	0.117	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.3	-179.8	-70.2	177.1	-169.5	-72.8	0	111	G182 V200 S201 W211 Q220 S221	G182-K209 WeakPolarHBondContact O-CE 3.29Å; G182-K209 PolarHBondContact O-NZ 2.94Å; V200-K209 CarbonylContact C-O 3.5Å; V200-K209 VanDerWaalsContact CA-O 3.22Å; V200-K209 WeakPolarHBondContact CA-O 3.3Å; S201-K209 PolarHBondContact N-O 3.24Å; S201-K209 PolarHBondContact O-N 2.79Å; K209-W211 HydrophobicContact CB-CZ2 3.74Å; K209-W211 HydrophobicContact CD-CH2 4.02Å; K209-W211 HydrophobicContact CD-CZ2 3.54Å; K209-W211 HydrophobicContact CG-CZ2 4.28Å; K209-W211 PolarHBondContact O-NE1 3.41Å; K209-Q220 WeakPolarHBondContact CA-O 3.17Å; K209-S221 PolarHBondContact NZ-OG 2.73Å
210	L	98.8	Very high	97.9	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.058	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128.1	171.5	178.7	74	0	0	0	109	V200 C218 R219 Q220 F222 F234 L255	V200-L210 HydrophobicContact CG1-CB 4.34Å; V200-L210 HydrophobicContact CG1-CD1 3.68Å; L210-C218 CarbonylContact O-C 3.5Å; L210-R219 HydrophobicContact CD2-CB 4.1Å; L210-R219 HydrophobicContact CG-CB 4.41Å; L210-R219 PolarHBondContact O-N 3.44Å; L210-Q220 HydrophobicContact CB-CB 4.24Å; L210-Q220 PolarHBondContact N-O 2.91Å; L210-F222 HydrophobicContact CB-CE2 4.12Å; L210-F234 HydrophobicContact CD1-CZ 4.06Å; L210-L255 HydrophobicContact CD1-CD1 4.3Å; L210-L255 HydrophobicContact CD1-CD2 4.31Å; L210-L255 HydrophobicContact CD2-CD1 4.15Å; L210-L255 HydrophobicContact CD2-CD2 4.09Å
211	W	98.8	Very high	97.9	Very high	2 Å²	2	43 Å²	43	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139	-177.7	-53	91.7	0	0	0	110.8	F180 T181 H183 T198 F199 S201 K209 C218	F180-W211 HydrophobicContact CB-CD2 4.01Å; F180-W211 HydrophobicContact CB-CE3 3.71Å; F180-W211 HydrophobicContact CB-CH2 4.28Å; F180-W211 HydrophobicContact CB-CZ3 3.84Å; F180-W211 HydrophobicContact CD1-CB 4.04Å; F180-W211 HydrophobicContact CD1-CD2 4.18Å; F180-W211 AromaticContact CD1-CE3 3.79Å; F180-W211 HydrophobicContact CD1-CE3 3.79Å; F180-W211 HydrophobicContact CD1-CG 4.31Å; F180-W211 HydrophobicContact CE1-CB 4.29Å; F180-W211 HydrophobicContact CG-CD2 4.4Å; F180-W211 HydrophobicContact CG-CE3 4.18Å; T181-W211 WeakPolarHBondContact O-CH2 3.44Å; H183-W211 AromaticContact CD2-CZ2 3.93Å; T198-W211 CarbonylContact C-O 3.58Å; T198-W211 WeakPolarHBondContact CA-O 3.34Å; T198-W211 VanDerWaalsContact CB-O 3.22Å; T198-W211 WeakPolarHBondContact CB-O 3.18Å; F199-W211 HydrophobicContact CD1-CB 3.78Å; F199-W211 HydrophobicContact CD1-CG 4.47Å; F199-W211 HydrophobicContact CD2-CB 4.48Å; F199-W211 AromaticContact CD2-CD1 3.75Å; F199-W211 HydrophobicContact CD2-CG 4.41Å; F199-W211 HydrophobicContact CE1-CB 3.36Å; F199-W211 AromaticContact CE1-CG 3.87Å; F199-W211 HydrophobicContact CE1-CG 3.87Å; F199-W211 HydrophobicContact CE2-CB 4.12Å; F199-W211 AromaticContact CE2-CD1 3.24Å; F199-W211 AromaticContact CE2-CG 3.79Å; F199-W211 HydrophobicContact CE2-CG 3.79Å; F199-W211 AromaticContact CE2-NE1 3.87Å; F199-W211 HydrophobicContact CG-CB 4.33Å; F199-W211 HydrophobicContact CZ-CB 3.55Å; F199-W211 AromaticContact CZ-CD1 3.45Å; F199-W211 VanDerWaalsContact CZ-CD1 3.45Å; F199-W211 HydrophobicContact CZ-CD2 4.3Å; F199-W211 AromaticContact CZ-CG 3.48Å; F199-W211 HydrophobicContact CZ-CG 3.48Å; F199-W211 VanDerWaalsContact CZ-CG 3.48Å; F199-W211 PolarHBondContact N-O 2.81Å; F199-W211 PolarHBondContact O-N 2.87Å; S201-W211 PolarHBondContact OG-NE1 2.84Å; K209-W211 HydrophobicContact CB-CZ2 3.74Å; K209-W211 HydrophobicContact CD-CH2 4.02Å; K209-W211 HydrophobicContact CD-CZ2 3.54Å; K209-W211 HydrophobicContact CG-CZ2 4.28Å; K209-W211 PolarHBondContact O-NE1 3.41Å; W211-C218 HydrophobicContact CD2-CB 4.37Å; W211-C218 HydrophobicContact CE3-CB 3.67Å; W211-C218 HydrophobicContact CH2-CB 4Å; W211-C218 HydrophobicContact CZ3-CB 3.47Å; W211-C218 VanDerWaalsContact CZ3-CB 3.47Å
212	D	98.3	Very high	97.9	Very high	28 Å²	28	43.1 Å²	43.1	15%	0.15	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119.6	168.8	-170.1	-50.9	0	0	0	109.4	R214 D215 G216 M217 R219	D212-R214 VanDerWaalsContact C-N 3.3Å; D212-R214 PolarHBondContact O-N 3.37Å; D212-R214 PolarHBondContact OD1-N 3.45Å; D212-D215 HydrophobicContact CB-CB 4.15Å; D212-D215 PolarHBondContact OD1-N 3.22Å; D212-D215 VanDerWaalsContact OD1-N 3.08Å; D212-G216 WeakPolarHBondContact O-CA 3.33Å; D212-G216 PolarHBondContact O-N 2.84Å; D212-M217 PolarHBondContact N-O 2.77Å; D212-R219 HydrophobicContact CB-CG 4.09Å; D212-R219 IonicContact OD2-CZ 3.58Å; D212-R219 IonicContact OD2-NE 3.72Å; D212-R219 PolarHBondContact OD2-NE 3.34Å; D212-R219 IonicContact OD2-NH2 3.86Å; D212-R219 PolarHBondContact OD2-NH2 3.11Å
213	I	97.4	Very high	97.8	Very high	15 Å²	15	47.2 Å²	47.2	8%	0.077	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-35.4	-173.6	-66.2	172.7	0	0	0	111.1	L152 L168 L192 R197 F199	L152-I213 HydrophobicContact CD1-CD1 4.29Å; L152-I213 HydrophobicContact CD1-CG2 4.15Å; L152-I213 HydrophobicContact CD2-CD1 3.7Å; L168-I213 HydrophobicContact CD1-CG2 4.38Å; L168-I213 HydrophobicContact CD2-CG2 3.86Å; L192-I213 HydrophobicContact CD2-CD1 4.23Å; R197-I213 VanDerWaalsContact O-CB 3.32Å; R197-I213 WeakPolarHBondContact O-CB 3.29Å; R197-I213 WeakPolarHBondContact O-CG1 3.04Å; R197-I213 PolarHBondContact O-N 3.24Å; F199-I213 HydrophobicContact CD1-CD1 4.2Å; F199-I213 HydrophobicContact CD1-CG1 3.68Å; F199-I213 HydrophobicContact CE1-CG1 4.26Å
214	R	95.9	Very high	97.6	Very high	228 Å²	228	48.8 Å²	48.8	86%	0.86	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-44.1	-176.6	-179.6	-179.9	178	178	-0.5	111.4	D212 G216	D212-R214 VanDerWaalsContact C-N 3.3Å; D212-R214 PolarHBondContact O-N 3.37Å; D212-R214 PolarHBondContact OD1-N 3.45Å; R214-G216 VanDerWaalsContact C-N 3.35Å
215	D	95.3	Very high	97.6	Very high	83 Å²	83	47.8 Å²	47.8	44%	0.444	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.7	-176.6	-73	2.1	0	0	0	112.1	D212 M217 R219	D212-D215 HydrophobicContact CB-CB 4.15Å; D212-D215 PolarHBondContact OD1-N 3.22Å; D212-D215 VanDerWaalsContact OD1-N 3.08Å; D215-M217 PolarHBondContact O-N 3.38Å; D215-R219 IonicContact OD2-CZ 3.65Å; D215-R219 IonicContact OD2-NH1 3.28Å; D215-R219 IonicContact OD2-NH2 2.82Å; D215-R219 PolarHBondContact OD2-NH2 3.31Å
216	G	95.5	Very high	97.6	Very high	13 Å²	13	51.9 Å²	51.9	13%	0.134	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	12.4	-179.9	0	0	0	0	0	114.1	D212 R214	D212-G216 WeakPolarHBondContact O-CA 3.33Å; D212-G216 PolarHBondContact O-N 2.84Å; R214-G216 VanDerWaalsContact C-N 3.35Å
217	M	95.9	Very high	97.6	Very high	125 Å²	125	53 Å²	53	62%	0.616	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	147	-167.8	-65.6	-66.6	173.8	0	0	112.7	D212 D215 R219	D212-M217 PolarHBondContact N-O 2.77Å; D215-M217 PolarHBondContact O-N 3.38Å; M217-R219 PolarHBondContact O-N 2.79Å
218	C	98.1	Very high	97.6	Very high	52 Å²	52	55 Å²	55	35%	0.351	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	123.2	168.3	-174.4	0	0	0	0	109.4	L210 W211 Q220	L210-C218 CarbonylContact O-C 3.5Å; W211-C218 HydrophobicContact CD2-CB 4.37Å; W211-C218 HydrophobicContact CE3-CB 3.67Å; W211-C218 HydrophobicContact CH2-CB 4Å; W211-C218 HydrophobicContact CZ3-CB 3.47Å; W211-C218 VanDerWaalsContact CZ3-CB 3.47Å; C218-Q220 PolarHBondContact SG-O 3.44Å; C218-Q220 VanDerWaalsContact SG-O 3.37Å
219	R	98.1	Very high	97.6	Very high	131 Å²	131	55 Å²	55	49%	0.494	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-43.1	175.9	-64	-61.7	-165.5	-178.7	1.9	112.1	L210 D212 D215 M217	L210-R219 HydrophobicContact CD2-CB 4.1Å; L210-R219 HydrophobicContact CG-CB 4.41Å; L210-R219 PolarHBondContact O-N 3.44Å; D212-R219 HydrophobicContact CB-CG 4.09Å; D212-R219 IonicContact OD2-CZ 3.58Å; D212-R219 IonicContact OD2-NE 3.72Å; D212-R219 PolarHBondContact OD2-NE 3.34Å; D212-R219 IonicContact OD2-NH2 3.86Å; D212-R219 PolarHBondContact OD2-NH2 3.11Å; D215-R219 IonicContact OD2-CZ 3.65Å; D215-R219 IonicContact OD2-NH1 3.28Å; D215-R219 IonicContact OD2-NH2 2.82Å; D215-R219 PolarHBondContact OD2-NH2 3.31Å; M217-R219 PolarHBondContact O-N 2.79Å
220	Q	98.3	Very high	97.6	Very high	48 Å²	48	55.1 Å²	55.1	22%	0.224	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.3	-174.3	-70.6	175.7	-50.2	0	0	111.2	K209 L210 C218 F222 L255 D258	K209-Q220 WeakPolarHBondContact CA-O 3.17Å; L210-Q220 HydrophobicContact CB-CB 4.24Å; L210-Q220 PolarHBondContact N-O 2.91Å; C218-Q220 PolarHBondContact SG-O 3.44Å; C218-Q220 VanDerWaalsContact SG-O 3.37Å; Q220-F222 HydrophobicContact CB-CD2 4.48Å; Q220-F222 HydrophobicContact CB-CE2 3.68Å; Q220-F222 HydrophobicContact CB-CZ 3.85Å; Q220-L255 PolarHBondContact NE2-O 2.9Å; Q220-L255 PolarHBondContact OE1-O 2.86Å; Q220-D258 PolarHBondContact NE2-OD1 3.48Å; Q220-D258 VanDerWaalsContact NE2-OD1 3.16Å
221	S	98.2	Very high	97.6	Very high	38 Å²	38	54.8 Å²	54.8	27%	0.266	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	116.2	174.9	-161	0	0	0	0	109.3	R22 S208 K209	R22-S221 PolarHBondContact NH2-O 2.98Å; S208-S221 CarbonylContact O-C 3.49Å; S208-S221 WeakPolarHBondContact O-CA 3.4Å; K209-S221 PolarHBondContact NZ-OG 2.73Å
222	F	98.5	Very high	97.6	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.009	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128.6	-178.9	-56.9	-91.7	0	0	0	109.3	S207 S208 L210 Q220 F241 F253 L255	S207-F222 VanDerWaalsContact CA-O 3.32Å; S207-F222 WeakPolarHBondContact CA-O 3.46Å; S208-F222 PolarHBondContact N-O 2.88Å; S208-F222 PolarHBondContact O-N 2.72Å; L210-F222 HydrophobicContact CB-CE2 4.12Å; Q220-F222 HydrophobicContact CB-CD2 4.48Å; Q220-F222 HydrophobicContact CB-CE2 3.68Å; Q220-F222 HydrophobicContact CB-CZ 3.85Å; F222-F241 HydrophobicContact CB-CZ 4.11Å; F222-F241 HydrophobicContact CD1-CE1 4.26Å; F222-F241 HydrophobicContact CD1-CZ 4.11Å; F222-F241 AromaticContact CD2-CE1 3.78Å; F222-F241 HydrophobicContact CD2-CE1 3.78Å; F222-F241 AromaticContact CD2-CZ 3.47Å; F222-F241 HydrophobicContact CD2-CZ 3.47Å; F222-F241 VanDerWaalsContact CD2-CZ 3.47Å; F222-F241 HydrophobicContact CE1-CE1 4.12Å; F222-F241 HydrophobicContact CE1-CZ 4.42Å; F222-F241 AromaticContact CE2-CE1 3.64Å; F222-F241 HydrophobicContact CE2-CE1 3.64Å; F222-F241 AromaticContact CE2-CZ 3.85Å; F222-F241 HydrophobicContact CE2-CZ 3.85Å; F222-F241 HydrophobicContact CG-CE1 4.1Å; F222-F241 AromaticContact CG-CZ 3.62Å; F222-F241 HydrophobicContact CG-CZ 3.62Å; F222-F241 AromaticContact CZ-CE1 3.83Å; F222-F241 HydrophobicContact CZ-CE1 3.83Å; F222-F241 HydrophobicContact CZ-CZ 4.32Å; F222-F253 HydrophobicContact CB-CD1 3.95Å; F222-F253 HydrophobicContact CB-CE1 4.02Å; F222-F253 HydrophobicContact CB-CG 4.38Å; F222-F253 HydrophobicContact CD1-CB 4.12Å; F222-F253 AromaticContact CD1-CD1 3.8Å; F222-F253 HydrophobicContact CD1-CD1 3.8Å; F222-F253 HydrophobicContact CD1-CG 4.21Å; F222-F253 HydrophobicContact CE1-CB 4.46Å; F222-F253 HydrophobicContact CG-CD1 4.22Å; F222-F253 HydrophobicContact CG-CG 4.48Å; F222-L255 HydrophobicContact CE1-CD2 4.49Å; F222-L255 HydrophobicContact CE2-CD2 4.03Å; F222-L255 HydrophobicContact CZ-CD2 3.58Å
223	T	96.9	Very high	97.6	Very high	86 Å²	86	54.8 Å²	54.8	53%	0.528	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.4	179.2	55.4	0	0	0	0	108.7	R22	R22-T223 PolarHBondContact NH1-OG1 3.41Å
224	G	95.8	Very high	97.7	Very high	32 Å²	32	54.8 Å²	54.8	33%	0.33	29%	0.291	S	S	.	.			trans	165.3	-39.9	175.7	0	0	0	0	0	112	R251	G224-R251 VanDerWaalsContact C-NH2 3.33Å; G224-R251 VanDerWaalsContact CA-NH1 3.25Å; G224-R251 PolarHBondContact O-NH1 2.95Å; G224-R251 PolarHBondContact O-NH2 3.03Å
225	H	98.1	Very high	97.8	Very high	14 Å²	14	45.9 Å²	45.9	7%	0.065	26%	0.259	C	S	.	.			trans	-60.2	152.8	175.2	-79.4	-66.2	0	0	0	112.2	A206 I229 T243 S245 D247 T249	A206-H225 HydrophobicContact CB-CB 4.33Å; H225-I229 HydrophobicContact CB-CD1 4.36Å; H225-I229 HydrophobicContact CB-CG1 4.19Å; H225-T243 WeakPolarHBondContact NE2-CB 3.22Å; H225-T243 PolarHBondContact NE2-OG1 2.82Å; H225-S245 VanDerWaalsContact CE1-CB 3.43Å; H225-S245 WeakPolarHBondContact CE1-CB 3.38Å; H225-S245 WeakPolarHBondContact ND1-CB 3.32Å; H225-D247 WeakPolarHBondContact CA-OD2 3.22Å; H225-D247 IonicContact CE1-OD1 2.73Å; H225-D247 IonicContact CE1-OD2 3.62Å; H225-D247 IonicContact CG-OD2 2.72Å; H225-D247 IonicContact ND1-OD1 2.72Å; H225-D247 PolarHBondContact ND1-OD1 2.92Å; H225-D247 IonicContact ND1-OD2 3.49Å; H225-D247 PolarHBondContact ND1-OD2 3.35Å; H225-T249 PolarHBondContact CE1-O 3.15Å; H225-T249 PolarHBondContact CE1-OG1 3.25Å
226	V	97.6	Very high	97.9	Very high	125 Å²	125	44.6 Å²	44.6	76%	0.758	26%	0.255	S	S	*	.	S	Bend	trans	-100.2	-15.7	-179.3	-174.9	0	0	0	0	111.6	D247	V226-D247 HydrophobicContact CB-CB 4.21Å; V226-D247 PolarHBondContact N-OD2 3.21Å
227	S	98.2	Very high	97.9	Very high	42 Å²	42	48 Å²	48	29%	0.294	27%	0.27	S	S	.	.	S	Bend	trans	-143.2	-169.4	-178.8	-164	0	0	0	0	110.8	A206 S245	A206-S227 WeakPolarHBondContact CA-O 3.38Å; A206-S227 VanDerWaalsContact CB-O 3.26Å; A206-S227 WeakPolarHBondContact CB-O 3.28Å; S227-S245 PolarHBondContact O-OG 2.72Å
228	D	98.5	Very high	98	Very high	52 Å²	52	42.7 Å²	42.7	28%	0.278	25%	0.248	S	C	.	.			trans	-61.5	139.9	-169.2	-61.5	4.2	0	0	0	111.1	C204 S245 D246	C204-D228 HydrophobicContact CB-CB 4.3Å; C204-D228 VanDerWaalsContact SG-CG 3.57Å; C204-D228 PolarHBondContact SG-OD2 3.31Å; D228-S245 CarbonylContact O-C 3.6Å; D228-S245 WeakPolarHBondContact O-CA 3.49Å; D228-S245 WeakPolarHBondContact O-CB 3.22Å; D228-S245 PolarHBondContact O-OG 3.46Å; D228-D246 PolarHBondContact O-N 2.81Å
229	I	98.8	Very high	98	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	102.8	175.4	-58	-179.8	0	0	0	108.3	M188 G202 A203 S208 H225 V232 T243	M188-I229 WeakPolarHBondContact CB-O 3.24Å; G202-I229 CarbonylContact C-O 3.57Å; A203-I229 PolarHBondContact O-N 3.31Å; S208-I229 VanDerWaalsContact OG-CD1 3.22Å; S208-I229 WeakPolarHBondContact OG-CD1 3.28Å; H225-I229 HydrophobicContact CB-CD1 4.36Å; H225-I229 HydrophobicContact CB-CG1 4.19Å; I229-V232 HydrophobicContact CG2-CG2 3.86Å; I229-T243 HydrophobicContact CG2-CG2 4.14Å
230	N	98.7	Very high	98	Very high	28 Å²	28	40.6 Å²	40.6	15%	0.15	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-28.3	-176.9	-67.3	-42.4	0	0	0	113.5	S189 G244 D246 I273	S189-N230 WeakPolarHBondContact CB-O 3.47Å; N230-G244 PolarHBondContact N-O 3.23Å; N230-D246 VanDerWaalsContact ND2-CG 3.29Å; N230-D246 PolarHBondContact ND2-OD1 2.63Å; N230-I273 VanDerWaalsContact CB-O 3.26Å; N230-I273 WeakPolarHBondContact CB-O 3.16Å; N230-I273 PolarHBondContact ND2-O 2.85Å
231	A	98.5	Very high	98	Very high	5 Å²	5	38.3 Å²	38.3	4%	0.041	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	141.8	-172.7	0	0	0	0	0	112.3	T243 G244 S275 V276	A231-T243 CarbonylContact O-C 3.6Å; A231-T243 VanDerWaalsContact O-CA 3.29Å; A231-T243 WeakPolarHBondContact O-CA 3.46Å; A231-G244 PolarHBondContact N-O 2.72Å; A231-G244 PolarHBondContact O-N 3.06Å; A231-S275 VanDerWaalsContact CB-CA 3.49Å; A231-V276 HydrophobicContact CB-CG2 3.91Å
232	V	98.6	Very high	98.1	Very high	9 Å²	9	36.5 Å²	36.5	6%	0.055	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.1	174.3	-167.7	0	0	0	0	109.7	V200 I229 F241 A242 T243	V200-V232 HydrophobicContact CB-CG1 4.11Å; V200-V232 HydrophobicContact CG2-CB 4.36Å; V200-V232 HydrophobicContact CG2-CG1 3.31Å; I229-V232 HydrophobicContact CG2-CG2 3.86Å; V232-F241 HydrophobicContact CG1-CD2 3.74Å; V232-F241 HydrophobicContact CG1-CE2 4.38Å; V232-F241 HydrophobicContact CG1-CG 4.5Å; V232-A242 CarbonylContact C-O 3.54Å; V232-A242 WeakPolarHBondContact CA-O 3.12Å; V232-T243 HydrophobicContact CG1-CG2 4.26Å; V232-T243 HydrophobicContact CG2-CG2 4.22Å
233	S	98.6	Very high	98.1	Very high	21 Å²	21	36.4 Å²	36.4	15%	0.147	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	127.6	176.6	-174.4	0	0	0	0	111.1	F241 A242 V276	S233-F241 CarbonylContact O-C 3.6Å; S233-F241 VanDerWaalsContact O-CA 3.28Å; S233-F241 WeakPolarHBondContact O-CA 3.27Å; S233-F241 WeakPolarHBondContact O-CB 3.43Å; S233-A242 PolarHBondContact N-O 3.49Å; S233-A242 PolarHBondContact O-N 3.5Å; S233-V276 WeakPolarHBondContact CB-O 3.42Å
234	F	98.6	Very high	98.2	Very high	15 Å²	15	32.3 Å²	32.3	7%	0.066	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	141.1	171.7	-95.2	-77.9	0	0	0	112.1	S191 L192 S193 V200 L210 F241 L255 F278	S191-F234 WeakPolarHBondContact O-CD2 3.41Å; S191-F234 WeakPolarHBondContact O-CE2 3.29Å; S191-F234 PolarHBondContact OG-N 3.23Å; L192-F234 WeakPolarHBondContact O-CD2 3.27Å; S193-F234 VanDerWaalsContact N-CE2 3.26Å; V200-F234 HydrophobicContact CB-CE2 4.15Å; V200-F234 HydrophobicContact CB-CZ 4.37Å; V200-F234 HydrophobicContact CG1-CE1 4.29Å; V200-F234 HydrophobicContact CG1-CE2 3.9Å; V200-F234 HydrophobicContact CG1-CZ 3.62Å; V200-F234 HydrophobicContact CG2-CD2 3.79Å; V200-F234 HydrophobicContact CG2-CE2 3.56Å; V200-F234 HydrophobicContact CG2-CZ 4.12Å; L210-F234 HydrophobicContact CD1-CZ 4.06Å; F234-F241 HydrophobicContact CD1-CB 4.37Å; F234-L255 HydrophobicContact CE1-CD1 4.34Å; F234-F278 WeakPolarHBondContact O-CD2 3.47Å
235	F	98.5	Very high	98.3	Very high	40 Å²	40	30.8 Å²	30.8	18%	0.175	17%	0.17	C	C	.	.			trans	-68.8	146.8	165.9	-169.8	-90.8	0	0	0	109.6	N237 G238 A240 F278 G282	F235-N237 HydrophobicContact CD1-CB 4.1Å; F235-N237 VanDerWaalsContact CD1-CG 3.42Å; F235-N237 VanDerWaalsContact CD1-OD1 3.26Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.4Å; F235-N237 HydrophobicContact CE1-CB 4.31Å; F235-N237 PolarHBondContact O-N 2.88Å; F235-G238 PolarHBondContact O-N 3.17Å; F235-A240 HydrophobicContact CB-CB 3.81Å; F235-A240 WeakPolarHBondContact CB-O 3.33Å; F235-A240 HydrophobicContact CG-CB 4.29Å; F235-A240 PolarHBondContact N-O 3.2Å; F235-F278 HydrophobicContact CB-CD2 4.4Å; F235-F278 HydrophobicContact CB-CE2 4.06Å; F235-F278 HydrophobicContact CB-CZ 4.36Å; F235-F278 AromaticContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD2 4.33Å; F235-F278 AromaticContact CD2-CE1 3.62Å; F235-F278 HydrophobicContact CD2-CE1 3.62Å; F235-F278 HydrophobicContact CD2-CE2 4.12Å; F235-F278 HydrophobicContact CD2-CG 4.17Å; F235-F278 AromaticContact CD2-CZ 3.75Å; F235-F278 HydrophobicContact CD2-CZ 3.75Å; F235-F278 HydrophobicContact CE2-CD1 4.21Å; F235-F278 HydrophobicContact CE2-CE1 4.15Å; F235-G282 VanDerWaalsContact CE2-CA 3.47Å; F235-G282 WeakPolarHBondContact CE2-O 3.39Å
236	P	97.6	Very high	98.3	Very high	56 Å²	56	33.1 Å²	33.1	36%	0.364	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.7	-172.2	-30.3	36.1	0	0	0	116.7	P194 F278	P194-P236 WeakPolarHBondContact CG-O 3.2Å; P236-F278 HydrophobicContact CG-CB 4.3Å
237	N	96.7	Very high	98.3	Very high	85 Å²	85	28.9 Å²	28.9	46%	0.455	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.5	178.2	73.4	7.7	0	0	0	114.4	F235 Y239	F235-N237 HydrophobicContact CD1-CB 4.1Å; F235-N237 VanDerWaalsContact CD1-CG 3.42Å; F235-N237 VanDerWaalsContact CD1-OD1 3.26Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.4Å; F235-N237 HydrophobicContact CE1-CB 4.31Å; F235-N237 PolarHBondContact O-N 2.88Å; N237-Y239 VanDerWaalsContact C-N 3.31Å; N237-Y239 HydrophobicContact CB-CD2 4.17Å; N237-Y239 WeakPolarHBondContact O-CD2 3.31Å; N237-Y239 PolarHBondContact O-N 2.85Å; N237-Y239 PolarHBondContact OD1-N 2.82Å
238	G	97.3	Very high	98.3	Very high	14 Å²	14	27.3 Å²	27.3	14%	0.144	15%	0.146	C	C	.	.	S	Bend	trans	78.2	-0.8	-179.3	0	0	0	0	0	116.5	F235 L255	F235-G238 PolarHBondContact O-N 3.17Å; G238-L255 WeakPolarHBondContact O-CD1 3.41Å
239	Y	98	Very high	98.3	Very high	130 Å²	130	25.7 Å²	25.7	51%	0.51	14%	0.138	S	C	.	.	S	Bend	trans	-97.1	-8.1	-179.1	-63.1	-63.1	0	0	0	114.4	N237 L255	N237-Y239 VanDerWaalsContact C-N 3.31Å; N237-Y239 HydrophobicContact CB-CD2 4.17Å; N237-Y239 WeakPolarHBondContact O-CD2 3.31Å; N237-Y239 PolarHBondContact O-N 2.85Å; N237-Y239 PolarHBondContact OD1-N 2.82Å; Y239-L255 WeakPolarHBondContact O-CG 3.35Å; Y239-L255 PolarHBondContact O-N 2.84Å
240	A	98.5	Very high	98.3	Very high	8 Å²	8	25.6 Å²	25.6	7%	0.066	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	165.7	179.4	0	0	0	0	0	110.3	F235 L252 F253	F235-A240 HydrophobicContact CB-CB 3.81Å; F235-A240 WeakPolarHBondContact CB-O 3.33Å; F235-A240 HydrophobicContact CG-CB 4.29Å; F235-A240 PolarHBondContact N-O 3.2Å; A240-L252 HydrophobicContact CB-CD1 4.09Å; A240-F253 CarbonylContact C-O 3.58Å; A240-F253 WeakPolarHBondContact CA-O 3.36Å; A240-F253 WeakPolarHBondContact CB-O 3.16Å
241	F	98.8	Very high	98.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	154.4	173.6	65	-86.6	0	0	0	110.7	V200 F222 V232 S233 F234 T243 F253 L255	V200-F241 HydrophobicContact CG1-CD1 4.02Å; V200-F241 HydrophobicContact CG1-CE1 4.23Å; V200-F241 HydrophobicContact CG1-CG 4.25Å; V200-F241 HydrophobicContact CG2-CB 4.34Å; V200-F241 HydrophobicContact CG2-CD2 4.48Å; V200-F241 HydrophobicContact CG2-CG 4.35Å; F222-F241 HydrophobicContact CB-CZ 4.11Å; F222-F241 HydrophobicContact CD1-CE1 4.26Å; F222-F241 HydrophobicContact CD1-CZ 4.11Å; F222-F241 AromaticContact CD2-CE1 3.78Å; F222-F241 HydrophobicContact CD2-CE1 3.78Å; F222-F241 AromaticContact CD2-CZ 3.47Å; F222-F241 HydrophobicContact CD2-CZ 3.47Å; F222-F241 VanDerWaalsContact CD2-CZ 3.47Å; F222-F241 HydrophobicContact CE1-CE1 4.12Å; F222-F241 HydrophobicContact CE1-CZ 4.42Å; F222-F241 AromaticContact CE2-CE1 3.64Å; F222-F241 HydrophobicContact CE2-CE1 3.64Å; F222-F241 AromaticContact CE2-CZ 3.85Å; F222-F241 HydrophobicContact CE2-CZ 3.85Å; F222-F241 HydrophobicContact CG-CE1 4.1Å; F222-F241 AromaticContact CG-CZ 3.62Å; F222-F241 HydrophobicContact CG-CZ 3.62Å; F222-F241 AromaticContact CZ-CE1 3.83Å; F222-F241 HydrophobicContact CZ-CE1 3.83Å; F222-F241 HydrophobicContact CZ-CZ 4.32Å; V232-F241 HydrophobicContact CG1-CD2 3.74Å; V232-F241 HydrophobicContact CG1-CE2 4.38Å; V232-F241 HydrophobicContact CG1-CG 4.5Å; S233-F241 CarbonylContact O-C 3.6Å; S233-F241 VanDerWaalsContact O-CA 3.28Å; S233-F241 WeakPolarHBondContact O-CA 3.27Å; S233-F241 WeakPolarHBondContact O-CB 3.43Å; F234-F241 HydrophobicContact CD1-CB 4.37Å; F241-T243 HydrophobicContact CD2-CG2 3.91Å; F241-T243 HydrophobicContact CE2-CG2 3.66Å; F241-F253 HydrophobicContact CD1-CB 4.07Å; F241-F253 HydrophobicContact CD2-CB 4.38Å; F241-F253 HydrophobicContact CD2-CD2 4.3Å; F241-F253 HydrophobicContact CE1-CB 3.54Å; F241-F253 HydrophobicContact CE1-CG 4.36Å; F241-F253 HydrophobicContact CE2-CB 3.91Å; F241-F253 AromaticContact CE2-CD2 3.61Å; F241-F253 HydrophobicContact CE2-CD2 3.61Å; F241-F253 HydrophobicContact CE2-CE2 4.46Å; F241-F253 HydrophobicContact CE2-CG 4.01Å; F241-F253 HydrophobicContact CG-CB 4.46Å; F241-F253 HydrophobicContact CZ-CB 3.45Å; F241-F253 VanDerWaalsContact CZ-CB 3.45Å; F241-F253 AromaticContact CZ-CD2 3.86Å; F241-F253 HydrophobicContact CZ-CD2 3.86Å; F241-F253 AromaticContact CZ-CG 3.77Å; F241-F253 HydrophobicContact CZ-CG 3.77Å; F241-F253 PolarHBondContact N-O 3.09Å; F241-F253 PolarHBondContact O-N 2.92Å; F241-L255 HydrophobicContact CD1-CD2 3.8Å; F241-L255 HydrophobicContact CE1-CD2 3.71Å
242	A	98.8	Very high	98.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148.7	172	0	0	0	0	0	111.5	V232 S233 R251 F278 L285	V232-A242 CarbonylContact C-O 3.54Å; V232-A242 WeakPolarHBondContact CA-O 3.12Å; S233-A242 PolarHBondContact N-O 3.49Å; S233-A242 PolarHBondContact O-N 3.5Å; A242-R251 CarbonylContact C-O 3.55Å; A242-R251 WeakPolarHBondContact CA-O 3.47Å; A242-F278 HydrophobicContact CB-CE1 4.38Å; A242-F278 HydrophobicContact CB-CE2 3.55Å; A242-F278 HydrophobicContact CB-CZ 3.39Å; A242-L285 HydrophobicContact CB-CD1 3.72Å; A242-L285 HydrophobicContact CB-CD2 4.15Å
243	T	98.8	Very high	98.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151.5	173.9	53.1	0	0	0	0	109.9	S208 H225 I229 A231 V232 F241 C250 R251 F253	S208-T243 WeakPolarHBondContact OG-CG2 3.48Å; H225-T243 WeakPolarHBondContact NE2-CB 3.22Å; H225-T243 PolarHBondContact NE2-OG1 2.82Å; I229-T243 HydrophobicContact CG2-CG2 4.14Å; A231-T243 CarbonylContact O-C 3.6Å; A231-T243 VanDerWaalsContact O-CA 3.29Å; A231-T243 WeakPolarHBondContact O-CA 3.46Å; V232-T243 HydrophobicContact CG1-CG2 4.26Å; V232-T243 HydrophobicContact CG2-CG2 4.22Å; F241-T243 HydrophobicContact CD2-CG2 3.91Å; F241-T243 HydrophobicContact CE2-CG2 3.66Å; T243-C250 CarbonylContact O-C 3.58Å; T243-C250 WeakPolarHBondContact O-CA 3.42Å; T243-C250 WeakPolarHBondContact O-CB 3.36Å; T243-R251 PolarHBondContact N-O 3.12Å; T243-R251 PolarHBondContact O-N 2.77Å; T243-R251 VanDerWaalsContact O-N 3.09Å; T243-R251 PolarHBondContact OG1-O 2.86Å; T243-F253 HydrophobicContact CG2-CD2 4.13Å; T243-F253 HydrophobicContact CG2-CE2 4Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.38Å
244	G	98.7	Very high	98.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.4	169.2	0	0	0	0	0	110	N230 A231	N230-G244 PolarHBondContact N-O 3.23Å; A231-G244 PolarHBondContact N-O 2.72Å; A231-G244 PolarHBondContact O-N 3.06Å
245	S	98.7	Very high	98.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	162.9	-170.8	176.5	0	0	0	0	113.1	H225 S227 D228 D247 A248 T249 I273	H225-S245 VanDerWaalsContact CE1-CB 3.43Å; H225-S245 WeakPolarHBondContact CE1-CB 3.38Å; H225-S245 WeakPolarHBondContact ND1-CB 3.32Å; S227-S245 PolarHBondContact O-OG 2.72Å; D228-S245 CarbonylContact O-C 3.6Å; D228-S245 WeakPolarHBondContact O-CA 3.49Å; D228-S245 WeakPolarHBondContact O-CB 3.22Å; D228-S245 PolarHBondContact O-OG 3.46Å; S245-D247 WeakPolarHBondContact CB-OD1 3.44Å; S245-D247 PolarHBondContact O-N 3.07Å; S245-D247 PolarHBondContact OG-N 3.13Å; S245-D247 PolarHBondContact OG-OD1 2.93Å; S245-A248 PolarHBondContact O-N 2.52Å; S245-T249 PolarHBondContact N-O 3.33Å; S245-I273 PolarHBondContact O-N 3.13Å; S245-I273 VanDerWaalsContact O-N 3.07Å
246	D	98.4	Very high	98.3	Very high	63 Å²	63	32.3 Å²	32.3	34%	0.337	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.1	168	-79.6	-18.8	0	0	0	113.6	D228 N230 A248	D228-D246 PolarHBondContact O-N 2.81Å; N230-D246 VanDerWaalsContact ND2-CG 3.29Å; N230-D246 PolarHBondContact ND2-OD1 2.63Å; D246-A248 PolarHBondContact O-N 2.75Å; D246-A248 VanDerWaalsContact O-N 3.12Å
247	D	97.8	Very high	98.2	Very high	36 Å²	36	31.2 Å²	31.2	19%	0.193	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	9.9	169.4	73.4	12	0	0	0	114.1	H225 V226 S245 T249 R251	H225-D247 WeakPolarHBondContact CA-OD2 3.22Å; H225-D247 IonicContact CE1-OD1 2.73Å; H225-D247 IonicContact CE1-OD2 3.62Å; H225-D247 IonicContact CG-OD2 2.72Å; H225-D247 IonicContact ND1-OD1 2.72Å; H225-D247 PolarHBondContact ND1-OD1 2.92Å; H225-D247 IonicContact ND1-OD2 3.49Å; H225-D247 PolarHBondContact ND1-OD2 3.35Å; V226-D247 HydrophobicContact CB-CB 4.21Å; V226-D247 PolarHBondContact N-OD2 3.21Å; S245-D247 WeakPolarHBondContact CB-OD1 3.44Å; S245-D247 PolarHBondContact O-N 3.07Å; S245-D247 PolarHBondContact OG-N 3.13Å; S245-D247 PolarHBondContact OG-OD1 2.93Å; D247-T249 PolarHBondContact O-N 3.5Å; D247-T249 WeakPolarHBondContact OD1-CB 3.36Å; D247-T249 PolarHBondContact OD1-N 3.04Å; D247-T249 PolarHBondContact OD1-OG1 3.36Å; D247-T249 PolarHBondContact OD2-OG1 3.25Å; D247-R251 IonicContact OD2-NH2 3.46Å
248	A	98	Very high	98.3	Very high	9 Å²	9	28.9 Å²	28.9	7%	0.074	14%	0.141	C	C	.	.	S	Bend	trans	63.7	13.3	-178.7	0	0	0	0	0	115.1	S245 D246 I269 C271	S245-A248 PolarHBondContact O-N 2.52Å; D246-A248 PolarHBondContact O-N 2.75Å; D246-A248 VanDerWaalsContact O-N 3.12Å; A248-I269 HydrophobicContact CB-CG2 4.46Å; A248-I269 WeakPolarHBondContact CB-O 3.3Å; A248-C271 WeakPolarHBondContact CA-O 3.11Å; A248-C271 WeakPolarHBondContact CB-O 3.36Å
249	T	98.3	Very high	98.3	Very high	18 Å²	18	29.6 Å²	29.6	11%	0.11	14%	0.14	C	C	.	.			trans	-113.9	144.3	178.8	75.7	0	0	0	0	112.8	H225 S245 D247 L263 I273	H225-T249 PolarHBondContact CE1-O 3.15Å; H225-T249 PolarHBondContact CE1-OG1 3.25Å; S245-T249 PolarHBondContact N-O 3.33Å; D247-T249 PolarHBondContact O-N 3.5Å; D247-T249 WeakPolarHBondContact OD1-CB 3.36Å; D247-T249 PolarHBondContact OD1-N 3.04Å; D247-T249 PolarHBondContact OD1-OG1 3.36Å; D247-T249 PolarHBondContact OD2-OG1 3.25Å; T249-L263 HydrophobicContact CG2-CD1 3.97Å; T249-I273 WeakPolarHBondContact O-CD1 3.36Å
250	C	98.6	Very high	98.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	148.2	159.5	-56	0	0	0	0	109.1	T243 Y264 I273 L285 A287	T243-C250 CarbonylContact O-C 3.58Å; T243-C250 WeakPolarHBondContact O-CA 3.42Å; T243-C250 WeakPolarHBondContact O-CB 3.36Å; C250-Y264 HydrophobicContact CB-CD2 3.85Å; C250-Y264 HydrophobicContact CB-CG 4.38Å; C250-Y264 PolarHBondContact N-O 2.67Å; C250-Y264 WeakPolarHBondContact O-CD2 3.32Å; C250-Y264 PolarHBondContact O-N 3.41Å; C250-I273 HydrophobicContact CB-CD1 4.5Å; C250-I273 WeakPolarHBondContact SG-CD1 3.19Å; C250-L285 HydrophobicContact CB-CD2 4.02Å; C250-A287 VanDerWaalsContact SG-CB 3.59Å
251	R	98.6	Very high	98.2	Very high	23 Å²	23	29.6 Å²	29.6	9%	0.087	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.2	173	-67.6	173.9	-170.5	-137.3	10.8	110.6	G224 A242 T243 D247 F253 E260 L262 L263	G224-R251 VanDerWaalsContact C-NH2 3.33Å; G224-R251 VanDerWaalsContact CA-NH1 3.25Å; G224-R251 PolarHBondContact O-NH1 2.95Å; G224-R251 PolarHBondContact O-NH2 3.03Å; A242-R251 CarbonylContact C-O 3.55Å; A242-R251 WeakPolarHBondContact CA-O 3.47Å; T243-R251 PolarHBondContact N-O 3.12Å; T243-R251 PolarHBondContact O-N 2.77Å; T243-R251 VanDerWaalsContact O-N 3.09Å; T243-R251 PolarHBondContact OG1-O 2.86Å; D247-R251 IonicContact OD2-NH2 3.46Å; R251-F253 HydrophobicContact CB-CD2 4.2Å; R251-F253 HydrophobicContact CB-CE2 3.57Å; R251-F253 HydrophobicContact CB-CZ 4.03Å; R251-E260 VanDerWaalsContact CD-OE2 3.27Å; R251-E260 WeakPolarHBondContact CD-OE2 3.42Å; R251-E260 IonicContact CZ-OE2 3.57Å; R251-E260 IonicContact NE-OE2 3.98Å; R251-E260 IonicContact NH1-OE1 2.79Å; R251-E260 IonicContact NH1-OE2 3.94Å; R251-E260 PolarHBondContact NH1-OE2 3.04Å; R251-L262 WeakPolarHBondContact CA-O 3.3Å; R251-L263 HydrophobicContact CG-CD1 3.53Å
252	L	98.7	Very high	98.1	Very high	9 Å²	9	30.4 Å²	30.4	5%	0.047	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.9	169.4	177.9	69.3	0	0	0	108.4	L30 A240 E260 L261 L262 Y264 F278	L30-L252 HydrophobicContact CD2-CD2 3.93Å; A240-L252 HydrophobicContact CB-CD1 4.09Å; L252-E260 CarbonylContact O-C 3.56Å; L252-E260 WeakPolarHBondContact O-CA 3.29Å; L252-L261 HydrophobicContact CD2-CB 4.26Å; L252-L261 HydrophobicContact CD2-CD1 4.3Å; L252-L261 HydrophobicContact CG-CB 4.37Å; L252-L261 PolarHBondContact O-N 2.5Å; L252-L262 HydrophobicContact CB-CB 4.37Å; L252-L262 PolarHBondContact N-O 2.74Å; L252-Y264 HydrophobicContact CB-CE2 3.96Å; L252-F278 HydrophobicContact CD1-CE1 4.41Å; L252-F278 HydrophobicContact CD1-CZ 3.8Å
253	F	98.7	Very high	98.1	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.009	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	145.7	175.9	-67.8	-85.9	0	0	0	110.5	F222 A240 F241 T243 R251 E260	F222-F253 HydrophobicContact CB-CD1 3.95Å; F222-F253 HydrophobicContact CB-CE1 4.02Å; F222-F253 HydrophobicContact CB-CG 4.38Å; F222-F253 HydrophobicContact CD1-CB 4.12Å; F222-F253 AromaticContact CD1-CD1 3.8Å; F222-F253 HydrophobicContact CD1-CD1 3.8Å; F222-F253 HydrophobicContact CD1-CG 4.21Å; F222-F253 HydrophobicContact CE1-CB 4.46Å; F222-F253 HydrophobicContact CG-CD1 4.22Å; F222-F253 HydrophobicContact CG-CG 4.48Å; A240-F253 CarbonylContact C-O 3.58Å; A240-F253 WeakPolarHBondContact CA-O 3.36Å; A240-F253 WeakPolarHBondContact CB-O 3.16Å; F241-F253 HydrophobicContact CD1-CB 4.07Å; F241-F253 HydrophobicContact CD2-CB 4.38Å; F241-F253 HydrophobicContact CD2-CD2 4.3Å; F241-F253 HydrophobicContact CE1-CB 3.54Å; F241-F253 HydrophobicContact CE1-CG 4.36Å; F241-F253 HydrophobicContact CE2-CB 3.91Å; F241-F253 AromaticContact CE2-CD2 3.61Å; F241-F253 HydrophobicContact CE2-CD2 3.61Å; F241-F253 HydrophobicContact CE2-CE2 4.46Å; F241-F253 HydrophobicContact CE2-CG 4.01Å; F241-F253 HydrophobicContact CG-CB 4.46Å; F241-F253 HydrophobicContact CZ-CB 3.45Å; F241-F253 VanDerWaalsContact CZ-CB 3.45Å; F241-F253 AromaticContact CZ-CD2 3.86Å; F241-F253 HydrophobicContact CZ-CD2 3.86Å; F241-F253 AromaticContact CZ-CG 3.77Å; F241-F253 HydrophobicContact CZ-CG 3.77Å; F241-F253 PolarHBondContact N-O 3.09Å; F241-F253 PolarHBondContact O-N 2.92Å; T243-F253 HydrophobicContact CG2-CD2 4.13Å; T243-F253 HydrophobicContact CG2-CE2 4Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.38Å; R251-F253 HydrophobicContact CB-CD2 4.2Å; R251-F253 HydrophobicContact CB-CE2 3.57Å; R251-F253 HydrophobicContact CB-CZ 4.03Å; F253-E260 HydrophobicContact CD1-CB 3.9Å; F253-E260 HydrophobicContact CE1-CB 3.68Å; F253-E260 HydrophobicContact CZ-CB 4.28Å
254	D	98.4	Very high	98	Very high	18 Å²	18	33.8 Å²	33.8	10%	0.096	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.7	170.9	178.3	-68.8	0	0	0	110.3	R256 A257 D258 Q259 L261	D254-R256 VanDerWaalsContact C-N 3.33Å; D254-R256 PolarHBondContact O-N 3.01Å; D254-R256 WeakPolarHBondContact OD1-CA 3.35Å; D254-R256 WeakPolarHBondContact OD1-CB 3.44Å; D254-R256 PolarHBondContact OD1-N 2.9Å; D254-R256 IonicContact OD1-NE 2.89Å; D254-R256 IonicContact OD2-NE 3.96Å; D254-R256 IonicContact OD2-NH2 3.39Å; D254-R256 PolarHBondContact OD2-NH2 2.92Å; D254-A257 HydrophobicContact CB-CB 4.03Å; D254-A257 PolarHBondContact OD1-N 3.16Å; D254-D258 PolarHBondContact O-N 3.4Å; D254-Q259 PolarHBondContact N-O 3.27Å; D254-L261 HydrophobicContact CB-CD1 3.62Å; D254-L261 HydrophobicContact CB-CD2 4.08Å; D254-L261 HydrophobicContact CB-CG 3.79Å
255	L	98.2	Very high	97.9	Very high	22 Å²	22	36.6 Å²	36.6	12%	0.115	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-31.5	-174.9	-59.4	-174.5	0	0	0	112.7	L210 Q220 F222 F234 G238 Y239 F241	L210-L255 HydrophobicContact CD1-CD1 4.3Å; L210-L255 HydrophobicContact CD1-CD2 4.31Å; L210-L255 HydrophobicContact CD2-CD1 4.15Å; L210-L255 HydrophobicContact CD2-CD2 4.09Å; Q220-L255 PolarHBondContact NE2-O 2.9Å; Q220-L255 PolarHBondContact OE1-O 2.86Å; F222-L255 HydrophobicContact CE1-CD2 4.49Å; F222-L255 HydrophobicContact CE2-CD2 4.03Å; F222-L255 HydrophobicContact CZ-CD2 3.58Å; F234-L255 HydrophobicContact CE1-CD1 4.34Å; G238-L255 WeakPolarHBondContact O-CD1 3.41Å; Y239-L255 WeakPolarHBondContact O-CG 3.35Å; Y239-L255 PolarHBondContact O-N 2.84Å; F241-L255 HydrophobicContact CD1-CD2 3.8Å; F241-L255 HydrophobicContact CE1-CD2 3.71Å
256	R	97.9	Very high	97.6	Very high	186 Å²	186	39.8 Å²	39.8	70%	0.702	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-34	-178.6	-57.9	169.1	-65.2	169.7	4.6	111.3	D254 D258	D254-R256 VanDerWaalsContact C-N 3.33Å; D254-R256 PolarHBondContact O-N 3.01Å; D254-R256 WeakPolarHBondContact OD1-CA 3.35Å; D254-R256 WeakPolarHBondContact OD1-CB 3.44Å; D254-R256 PolarHBondContact OD1-N 2.9Å; D254-R256 IonicContact OD1-NE 2.89Å; D254-R256 IonicContact OD2-NE 3.96Å; D254-R256 IonicContact OD2-NH2 3.39Å; D254-R256 PolarHBondContact OD2-NH2 2.92Å; R256-D258 VanDerWaalsContact C-N 3.28Å
257	A	97.2	Very high	97	Very high	33 Å²	33	44.2 Å²	44.2	27%	0.273	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-22.6	173.6	0	0	0	0	0	112.4	D254 Q259 L261	D254-A257 HydrophobicContact CB-CB 4.03Å; D254-A257 PolarHBondContact OD1-N 3.16Å; A257-Q259 HydrophobicContact CB-CG 4.08Å; A257-Q259 WeakPolarHBondContact O-CG 3.17Å; A257-Q259 PolarHBondContact O-N 2.87Å; A257-L261 HydrophobicContact CB-CD2 4.33Å
258	D	98.1	Very high	96.6	Very high	36 Å²	36	49.1 Å²	49.1	19%	0.193	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	24.9	-175.8	-166.9	61	0	0	0	113.3	R22 Q220 D254 R256	R22-D258 VanDerWaalsContact CZ-O 3.26Å; R22-D258 IonicContact CZ-OD2 3.49Å; R22-D258 VanDerWaalsContact CZ-OD2 3.24Å; R22-D258 PolarHBondContact NE-O 3.04Å; R22-D258 IonicContact NE-OD2 3.44Å; R22-D258 PolarHBondContact NE-OD2 2.7Å; R22-D258 PolarHBondContact NH2-O 2.78Å; R22-D258 IonicContact NH2-OD1 3.34Å; R22-D258 IonicContact NH2-OD2 3.07Å; R22-D258 PolarHBondContact NH2-OD2 2.8Å; Q220-D258 PolarHBondContact NE2-OD1 3.48Å; Q220-D258 VanDerWaalsContact NE2-OD1 3.16Å; D254-D258 PolarHBondContact O-N 3.4Å; R256-D258 VanDerWaalsContact C-N 3.28Å
259	Q	96.8	Very high	96.3	Very high	29 Å²	29	49.5 Å²	49.5	14%	0.136	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	172.3	-177	66.1	-172.5	-21.8	0	0	112.1	R22 D254 A257	R22-Q259 HydrophobicContact CG-CB 4.49Å; R22-Q259 PolarHBondContact O-NE2 3.42Å; R22-Q259 PolarHBondContact O-OE1 2.97Å; D254-Q259 PolarHBondContact N-O 3.27Å; A257-Q259 HydrophobicContact CB-CG 4.08Å; A257-Q259 WeakPolarHBondContact O-CG 3.17Å; A257-Q259 PolarHBondContact O-N 2.87Å
260	E	97.4	Very high	96.1	Very high	78 Å²	78	56 Å²	56	36%	0.364	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	139.2	175.2	68	-176.8	-179.9	0	0	111.3	R251 L252 F253	R251-E260 VanDerWaalsContact CD-OE2 3.27Å; R251-E260 WeakPolarHBondContact CD-OE2 3.42Å; R251-E260 IonicContact CZ-OE2 3.57Å; R251-E260 IonicContact NE-OE2 3.98Å; R251-E260 IonicContact NH1-OE1 2.79Å; R251-E260 IonicContact NH1-OE2 3.94Å; R251-E260 PolarHBondContact NH1-OE2 3.04Å; L252-E260 CarbonylContact O-C 3.56Å; L252-E260 WeakPolarHBondContact O-CA 3.29Å; F253-E260 HydrophobicContact CD1-CB 3.9Å; F253-E260 HydrophobicContact CE1-CB 3.68Å; F253-E260 HydrophobicContact CZ-CB 4.28Å
261	L	97.4	Very high	96	Very high	59 Å²	59	57.4 Å²	57.4	31%	0.309	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-35.9	173.5	-65.5	-171.4	0	0	0	112.4	L252 D254 A257	L252-L261 HydrophobicContact CD2-CB 4.26Å; L252-L261 HydrophobicContact CD2-CD1 4.3Å; L252-L261 HydrophobicContact CG-CB 4.37Å; L252-L261 PolarHBondContact O-N 2.5Å; D254-L261 HydrophobicContact CB-CD1 3.62Å; D254-L261 HydrophobicContact CB-CD2 4.08Å; D254-L261 HydrophobicContact CB-CG 3.79Å; A257-L261 HydrophobicContact CB-CD2 4.33Å
262	L	97.6	Very high	95.9	Very high	17 Å²	17	56.6 Å²	56.6	9%	0.089	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	141.1	-174.8	-167.2	60.4	0	0	0	112	L30 V31 R251 L252 Y264 T299	L30-L262 HydrophobicContact CD2-CB 4.18Å; L30-L262 HydrophobicContact CD2-CD2 4.12Å; V31-L262 HydrophobicContact CG2-CD1 3.45Å; V31-L262 VanDerWaalsContact CG2-CD1 3.45Å; R251-L262 WeakPolarHBondContact CA-O 3.3Å; L252-L262 HydrophobicContact CB-CB 4.37Å; L252-L262 PolarHBondContact N-O 2.74Å; L262-Y264 HydrophobicContact CD2-CD1 4.31Å; L262-Y264 HydrophobicContact CD2-CE1 3.52Å; L262-Y264 HydrophobicContact CG-CE1 4.14Å; L262-T299 VanDerWaalsContact CD2-O 3.29Å; L262-T299 WeakPolarHBondContact CD2-O 3.26Å
263	L	97.6	Very high	95.9	Very high	72 Å²	72	56.2 Å²	56.2	38%	0.377	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.6	171.7	-177	73.8	0	0	0	109.1	T249 R251	T249-L263 HydrophobicContact CG2-CD1 3.97Å; R251-L263 HydrophobicContact CG-CD1 3.53Å
264	Y	97.7	Very high	95.9	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.7	172.4	-47.3	-90.6	0	0	0	108.8	C250 L252 L262 L285 W297 T299	C250-Y264 HydrophobicContact CB-CD2 3.85Å; C250-Y264 HydrophobicContact CB-CG 4.38Å; C250-Y264 PolarHBondContact N-O 2.67Å; C250-Y264 WeakPolarHBondContact O-CD2 3.32Å; C250-Y264 PolarHBondContact O-N 3.41Å; L252-Y264 HydrophobicContact CB-CE2 3.96Å; L262-Y264 HydrophobicContact CD2-CD1 4.31Å; L262-Y264 HydrophobicContact CD2-CE1 3.52Å; L262-Y264 HydrophobicContact CG-CE1 4.14Å; Y264-L285 HydrophobicContact CD2-CD2 3.7Å; Y264-L285 HydrophobicContact CE2-CD2 3.59Å; Y264-L285 HydrophobicContact CG-CD2 4.26Å; Y264-W297 HydrophobicContact CD1-CB 3.93Å; Y264-W297 HydrophobicContact CD1-CD2 4.44Å; Y264-W297 HydrophobicContact CD1-CE3 4.35Å; Y264-W297 HydrophobicContact CD1-CG 4.29Å; Y264-W297 HydrophobicContact CE1-CB 4.39Å; Y264-T299 VanDerWaalsContact OH-CA 3.27Å; Y264-T299 WeakPolarHBondContact OH-CA 3.32Å; Y264-T299 PolarHBondContact OH-O 2.88Å
265	S	95.3	Very high	95.9	Very high	58 Å²	58	56.6 Å²	56.6	41%	0.406	30%	0.295	S	S	.	.			trans	-147.6	163.4	179.6	63.3	0	0	0	0	110.2
266	H	92.3	Very high	95.9	Very high	68 Å²	68	56.1 Å²	56.1	32%	0.315	29%	0.292	S	S	.	.			trans	-149.9	138.9	173	-171.6	65.3	0	0	0	109.1	N268 I269 W297	H266-N268 PolarHBondContact NE2-ND2 2.8Å; H266-N268 PolarHBondContact O-N 3.26Å; H266-I269 HydrophobicContact CB-CD1 3.8Å; H266-I269 HydrophobicContact CB-CG1 4.01Å; H266-I269 PolarHBondContact O-N 2.81Å; H266-W297 HydrophobicContact CB-CH2 4.05Å
267	D	87.1	Confident	95.9	Very high	156 Å²	156	47.7 Å²	47.7	83%	0.834	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-26.1	-170.8	-57.8	-28.8	0	0	0	114.2
268	N	89.4	Confident	96	Very high	139 Å²	139	46.8 Å²	46.8	74%	0.743	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-6.9	178.3	-61.7	-48.1	0	0	0	113.7	H266	H266-N268 PolarHBondContact NE2-ND2 2.8Å; H266-N268 PolarHBondContact O-N 3.26Å
269	I	91.5	Very high	96	Very high	17 Å²	17	45.9 Å²	45.9	9%	0.087	25%	0.249	C	C	.	.			trans	-102.3	106.1	-178.6	-56.8	176.9	0	0	0	107.9	A248 H266 Y289 W297	A248-I269 HydrophobicContact CB-CG2 4.46Å; A248-I269 WeakPolarHBondContact CB-O 3.3Å; H266-I269 HydrophobicContact CB-CD1 3.8Å; H266-I269 HydrophobicContact CB-CG1 4.01Å; H266-I269 PolarHBondContact O-N 2.81Å; 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 4.18Å; I269-W297 HydrophobicContact CD1-CZ2 3.95Å
270	I	93.6	Very high	96.1	Very high	155 Å²	155	50.7 Å²	50.7	80%	0.795	27%	0.269	S	S	*	.			trans	-117.8	4.9	179.3	60.6	169.6	0	0	0	112.6
271	C	95.8	Very high	96.1	Very high	28 Å²	28	51.2 Å²	51.2	19%	0.189	28%	0.282	C	S	.	.	S	Bend	trans	-99	152.5	-177.3	63.8	0	0	0	0	111.2	A248 D290 D291	A248-C271 WeakPolarHBondContact CA-O 3.11Å; A248-C271 WeakPolarHBondContact CB-O 3.36Å; C271-D290 HydrophobicContact CB-CB 4.08Å; C271-D291 VanDerWaalsContact SG-CB 3.59Å
272	G	96.8	Very high	96.1	Very high	7 Å²	7	48.5 Å²	48.5	7%	0.072	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-65.6	153	-178.9	0	0	0	0	0	113.2	D290	G272-D290 PolarHBondContact O-N 3.41Å
273	I	98.6	Very high	96.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	134.6	173.9	-64.9	144.5	0	0	0	108.7	N230 S245 T249 C250 V276 A287 G288 Y289	N230-I273 VanDerWaalsContact CB-O 3.26Å; N230-I273 WeakPolarHBondContact CB-O 3.16Å; N230-I273 PolarHBondContact ND2-O 2.85Å; S245-I273 PolarHBondContact O-N 3.13Å; S245-I273 VanDerWaalsContact O-N 3.07Å; T249-I273 WeakPolarHBondContact O-CD1 3.36Å; C250-I273 HydrophobicContact CB-CD1 4.5Å; C250-I273 WeakPolarHBondContact SG-CD1 3.19Å; I273-V276 HydrophobicContact CG2-CG1 3.84Å; I273-A287 HydrophobicContact CG2-CB 4.29Å; I273-G288 WeakPolarHBondContact CA-O 3.35Å; I273-Y289 HydrophobicContact CD1-CE1 3.86Å; I273-Y289 HydrophobicContact CG1-CD1 3.64Å; 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	96.1	Very high	18 Å²	18	48.2 Å²	48.2	11%	0.11	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-28.2	-176.4	64.1	0	0	0	0	113.2	G288 D290 R314 V315	T274-G288 PolarHBondContact N-O 2.93Å; T274-G288 PolarHBondContact OG1-O 2.64Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.13Å; T274-R314 VanDerWaalsContact CG2-NH2 3.27Å; T274-V315 VanDerWaalsContact CB-O 3.28Å; T274-V315 WeakPolarHBondContact CB-O 3.31Å; T274-V315 VanDerWaalsContact CG2-O 3.24Å; T274-V315 WeakPolarHBondContact CG2-O 3.42Å; T274-V315 PolarHBondContact OG1-O 3.4Å
275	S	98.3	Very high	96.2	Very high	11 Å²	11	48.2 Å²	48.2	8%	0.077	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	144.7	-169.4	52.1	0	0	0	0	110.8	A231 A287 G288 L318	A231-S275 VanDerWaalsContact CB-CA 3.49Å; S275-A287 CarbonylContact O-C 3.53Å; S275-A287 VanDerWaalsContact O-CA 3.3Å; S275-A287 WeakPolarHBondContact O-CA 3.38Å; S275-G288 PolarHBondContact O-N 2.89Å; S275-L318 WeakPolarHBondContact OG-CD2 3.48Å; S275-L318 PolarHBondContact OG-N 3.37Å
276	V	98.7	Very high	96.3	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.067	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	144.6	178.5	-64.6	0	0	0	0	110.4	A231 S233 I273 L285 L286 A287	A231-V276 HydrophobicContact CB-CG2 3.91Å; S233-V276 WeakPolarHBondContact CB-O 3.42Å; I273-V276 HydrophobicContact CG2-CG1 3.84Å; V276-L285 HydrophobicContact CB-CD1 4.21Å; V276-L286 CarbonylContact C-O 3.6Å; V276-L286 VanDerWaalsContact CA-O 3.29Å; V276-L286 WeakPolarHBondContact CA-O 3.44Å; V276-A287 HydrophobicContact CG1-CB 4.11Å
277	A	98.6	Very high	96.6	Very high	10 Å²	10	42.4 Å²	42.4	8%	0.083	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	147.8	170.5	0	0	0	0	0	111.6	L286 L318 V320	A277-L286 PolarHBondContact N-O 3.39Å; A277-L286 PolarHBondContact O-N 2.78Å; A277-L318 HydrophobicContact CB-CD1 3.3Å; A277-V320 HydrophobicContact CB-CG2 4.13Å
278	F	98.7	Very high	97.2	Very high	14 Å²	14	35 Å²	35	6%	0.061	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	147.7	172.1	-69.9	-78.6	0	0	0	112	F234 F235 P236 A242 L252 L284 L285 T299 V320	F234-F278 WeakPolarHBondContact O-CD2 3.47Å; F235-F278 HydrophobicContact CB-CD2 4.4Å; F235-F278 HydrophobicContact CB-CE2 4.06Å; F235-F278 HydrophobicContact CB-CZ 4.36Å; F235-F278 AromaticContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD2 4.33Å; F235-F278 AromaticContact CD2-CE1 3.62Å; F235-F278 HydrophobicContact CD2-CE1 3.62Å; F235-F278 HydrophobicContact CD2-CE2 4.12Å; F235-F278 HydrophobicContact CD2-CG 4.17Å; F235-F278 AromaticContact CD2-CZ 3.75Å; F235-F278 HydrophobicContact CD2-CZ 3.75Å; F235-F278 HydrophobicContact CE2-CD1 4.21Å; F235-F278 HydrophobicContact CE2-CE1 4.15Å; P236-F278 HydrophobicContact CG-CB 4.3Å; A242-F278 HydrophobicContact CB-CE1 4.38Å; A242-F278 HydrophobicContact CB-CE2 3.55Å; A242-F278 HydrophobicContact CB-CZ 3.39Å; L252-F278 HydrophobicContact CD1-CE1 4.41Å; L252-F278 HydrophobicContact CD1-CZ 3.8Å; F278-L284 WeakPolarHBondContact CA-O 3.43Å; F278-L285 HydrophobicContact CD1-CB 4.26Å; F278-L285 HydrophobicContact CD1-CD1 4.22Å; F278-L285 HydrophobicContact CE1-CB 4.14Å; F278-L285 HydrophobicContact CE1-CD1 4.02Å; F278-L285 HydrophobicContact CZ-CD1 4.2Å; F278-T299 HydrophobicContact CD1-CG2 4.01Å; F278-T299 HydrophobicContact CE1-CG2 3.73Å; F278-V320 WeakPolarHBondContact O-CG2 3.45Å
279	S	98.4	Very high	97.6	Very high	17 Å²	17	28.4 Å²	28.4	12%	0.119	15%	0.154	C	C	.	.			trans	-62.3	160.5	157.1	57.8	0	0	0	0	111.4	S281 G282 R283 L284	S279-S281 VanDerWaalsContact C-N 3.26Å; S279-S281 PolarHBondContact O-N 3.31Å; S279-S281 VanDerWaalsContact O-N 3.15Å; S279-G282 WeakPolarHBondContact O-CA 3.24Å; S279-G282 PolarHBondContact O-N 3.2Å; S279-R283 PolarHBondContact OG-N 3.43Å; S279-L284 PolarHBondContact N-O 2.81Å; S279-L284 WeakPolarHBondContact OG-CB 3.45Å; S279-L284 PolarHBondContact OG-N 3.41Å; S279-L284 PolarHBondContact OG-O 3.27Å; S279-L284 VanDerWaalsContact OG-O 3.09Å
280	K	97.9	Very high	97.9	Very high	129 Å²	129	30 Å²	30	56%	0.561	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-37.7	-178.6	-176.6	174.5	-171.8	67.9	0	114.5	G282 D322 D323	K280-G282 VanDerWaalsContact C-N 3.3Å; K280-D322 PolarHBondContact NZ-O 3.01Å; K280-D323 VanDerWaalsContact CD-O 3.32Å; K280-D323 WeakPolarHBondContact CD-O 3.12Å
281	S	97.6	Very high	98.1	Very high	90 Å²	90	25.4 Å²	25.4	63%	0.629	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80	-13.7	177.3	63.2	0	0	0	0	113.4	S279 R283	S279-S281 VanDerWaalsContact C-N 3.26Å; S279-S281 PolarHBondContact O-N 3.31Å; S279-S281 VanDerWaalsContact O-N 3.15Å; S281-R283 PolarHBondContact O-N 2.89Å; S281-R283 WeakPolarHBondContact OG-CB 3.45Å; S281-R283 PolarHBondContact OG-N 3.14Å
282	G	97.4	Very high	98.2	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.021	15%	0.149	C	C	.	.	S	Bend	trans	75.7	2.1	-170	0	0	0	0	0	114.2	F235 S279 K280 T299	F235-G282 VanDerWaalsContact CE2-CA 3.47Å; F235-G282 WeakPolarHBondContact CE2-O 3.39Å; S279-G282 WeakPolarHBondContact O-CA 3.24Å; S279-G282 PolarHBondContact O-N 3.2Å; K280-G282 VanDerWaalsContact C-N 3.3Å; G282-T299 WeakPolarHBondContact O-CB 3.35Å; G282-T299 WeakPolarHBondContact O-CG2 3.46Å; G282-T299 PolarHBondContact O-OG1 2.97Å
283	R	97.6	Very high	98.2	Very high	60 Å²	60	29.9 Å²	29.9	23%	0.226	16%	0.157	C	C	.	.	S	Bend	trans	-72.6	-30	-178.4	-175.7	58.6	-174.4	-89.4	-1.5	113.4	D38 V40 S279 S281 D298 T299	D38-R283 PolarHBondContact O-NH2 3.25Å; V40-R283 HydrophobicContact CG1-CG 3.56Å; V40-R283 VanDerWaalsContact CG1-CZ 3.44Å; S279-R283 PolarHBondContact OG-N 3.43Å; S281-R283 PolarHBondContact O-N 2.89Å; S281-R283 WeakPolarHBondContact OG-CB 3.45Å; S281-R283 PolarHBondContact OG-N 3.14Å; R283-D298 IonicContact CZ-OD1 3.51Å; R283-D298 IonicContact CZ-OD2 3.59Å; R283-D298 IonicContact NE-OD1 3.35Å; R283-D298 PolarHBondContact NE-OD1 3.33Å; R283-D298 IonicContact NE-OD2 3.95Å; R283-D298 PolarHBondContact NE-OD2 2.92Å; R283-D298 IonicContact NH2-OD1 2.8Å; R283-D298 IonicContact NH2-OD2 3.88Å; R283-D298 PolarHBondContact NH2-OD2 2.9Å; R283-T299 WeakPolarHBondContact CA-OG1 3.46Å; R283-T299 PolarHBondContact O-N 3.19Å; R283-T299 PolarHBondContact O-OG1 3.38Å; R283-T299 VanDerWaalsContact O-OG1 3.04Å
284	L	98.4	Very high	98.2	Very high	23 Å²	23	30 Å²	30	12%	0.12	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.2	175	-51.5	177.1	0	0	0	110.3	V40 I43 M45 F278 S279 L286 V296 W297	V40-L284 HydrophobicContact CG1-CD2 4.31Å; V40-L284 HydrophobicContact CG2-CD2 4.21Å; I43-L284 HydrophobicContact CG1-CD2 4.37Å; M45-L284 HydrophobicContact CE-CD1 4.46Å; F278-L284 WeakPolarHBondContact CA-O 3.43Å; S279-L284 PolarHBondContact N-O 2.81Å; S279-L284 WeakPolarHBondContact OG-CB 3.45Å; S279-L284 PolarHBondContact OG-N 3.41Å; S279-L284 PolarHBondContact OG-O 3.27Å; S279-L284 VanDerWaalsContact OG-O 3.09Å; L284-L286 HydrophobicContact CB-CD1 4.38Å; L284-V296 HydrophobicContact CB-CG1 4.05Å; L284-V296 HydrophobicContact CD1-CG1 4.03Å; L284-V296 HydrophobicContact CD2-CG1 4.03Å; L284-V296 HydrophobicContact CG-CG1 4.26Å; L284-W297 WeakPolarHBondContact CA-O 3.38Å
285	L	98.7	Very high	98.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.3	165.4	170.8	66.7	0	0	0	107.9	A242 C250 Y264 V276 F278 W297 T299	A242-L285 HydrophobicContact CB-CD1 3.72Å; A242-L285 HydrophobicContact CB-CD2 4.15Å; C250-L285 HydrophobicContact CB-CD2 4.02Å; Y264-L285 HydrophobicContact CD2-CD2 3.7Å; Y264-L285 HydrophobicContact CE2-CD2 3.59Å; Y264-L285 HydrophobicContact CG-CD2 4.26Å; V276-L285 HydrophobicContact CB-CD1 4.21Å; F278-L285 HydrophobicContact CD1-CB 4.26Å; F278-L285 HydrophobicContact CD1-CD1 4.22Å; F278-L285 HydrophobicContact CE1-CB 4.14Å; F278-L285 HydrophobicContact CE1-CD1 4.02Å; F278-L285 HydrophobicContact CZ-CD1 4.2Å; L285-W297 HydrophobicContact CB-CB 4.28Å; L285-W297 PolarHBondContact N-O 2.95Å; L285-W297 PolarHBondContact O-N 3.07Å; L285-T299 HydrophobicContact CB-CG2 3.54Å
286	L	98.8	Very high	98.2	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.1	176.7	-60.8	95.5	0	0	0	108.3	V276 A277 L284 N295 V296 L308 L318 V320 V327	V276-L286 CarbonylContact C-O 3.6Å; V276-L286 VanDerWaalsContact CA-O 3.29Å; V276-L286 WeakPolarHBondContact CA-O 3.44Å; A277-L286 PolarHBondContact N-O 3.39Å; A277-L286 PolarHBondContact O-N 2.78Å; L284-L286 HydrophobicContact CB-CD1 4.38Å; L286-N295 WeakPolarHBondContact CA-O 3.2Å; L286-V296 HydrophobicContact CD2-CG2 4.05Å; L286-V296 HydrophobicContact CG-CG1 4.48Å; L286-V296 HydrophobicContact CG-CG2 4.28Å; L286-L308 HydrophobicContact CD2-CD1 4.2Å; L286-L318 HydrophobicContact CB-CD1 4.28Å; L286-V320 HydrophobicContact CD1-CG2 3.88Å; L286-V327 HydrophobicContact CD2-CB 4.18Å; L286-V327 HydrophobicContact CD2-CG1 4.06Å; L286-V327 HydrophobicContact CD2-CG2 3.95Å
287	A	98.8	Very high	98.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.5	-178.9	0	0	0	0	0	110.4	C250 I273 S275 V276 Y289 C294 N295	C250-A287 VanDerWaalsContact SG-CB 3.59Å; I273-A287 HydrophobicContact CG2-CB 4.29Å; S275-A287 CarbonylContact O-C 3.53Å; S275-A287 VanDerWaalsContact O-CA 3.3Å; S275-A287 WeakPolarHBondContact O-CA 3.38Å; V276-A287 HydrophobicContact CG1-CB 4.11Å; A287-Y289 HydrophobicContact CB-CD2 4.42Å; A287-Y289 HydrophobicContact CB-CE2 3.56Å; A287-Y289 WeakPolarHBondContact O-CD2 3.39Å; A287-Y289 WeakPolarHBondContact O-CE2 3.45Å; A287-C294 CarbonylContact O-C 3.56Å; A287-C294 WeakPolarHBondContact O-CA 3.36Å; A287-C294 PolarHBondContact O-SG 2.75Å; A287-N295 PolarHBondContact N-O 3.13Å; A287-N295 PolarHBondContact O-N 3.41Å
288	G	98.5	Very high	98.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	135.8	176.5	0	0	0	0	0	110.6	I273 T274 S275	I273-G288 WeakPolarHBondContact CA-O 3.35Å; T274-G288 PolarHBondContact N-O 2.93Å; T274-G288 PolarHBondContact OG1-O 2.64Å; S275-G288 PolarHBondContact O-N 2.89Å
289	Y	98.5	Very high	98	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	160.7	-172.3	-70.6	-99	0	0	0	111.9	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 3.86Å; I273-Y289 HydrophobicContact CG1-CD1 3.64Å; 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 4.42Å; A287-Y289 HydrophobicContact CB-CE2 3.56Å; A287-Y289 WeakPolarHBondContact O-CD2 3.39Å; A287-Y289 WeakPolarHBondContact O-CE2 3.45Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.37Å; Y289-D291 PolarHBondContact O-N 2.92Å; Y289-F292 PolarHBondContact O-N 2.78Å; Y289-N293 PolarHBondContact N-O 2.89Å; Y289-N295 HydrophobicContact CD2-CB 4.35Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.29Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.23Å; Y289-N295 HydrophobicContact CE2-CB 3.71Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.35Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.44Å; Y289-W297 PolarHBondContact OH-NE1 2.87Å; Y289-W297 VanDerWaalsContact OH-NE1 3.09Å; Y289-V315 PolarHBondContact O-N 3.33Å
290	D	97.8	Very high	97.9	Very high	50 Å²	50	28.5 Å²	28.5	27%	0.267	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-14.6	175.4	-79	-12.2	0	0	0	114	C271 G272 T274 F292 R314	C271-D290 HydrophobicContact CB-CB 4.08Å; G272-D290 PolarHBondContact O-N 3.41Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.13Å; D290-F292 WeakPolarHBondContact O-CD1 3.45Å; D290-F292 VanDerWaalsContact O-CE1 3.32Å; D290-F292 WeakPolarHBondContact O-CE1 3.19Å; D290-F292 PolarHBondContact O-N 3.39Å; D290-R314 IonicContact OD1-CZ 2.86Å; D290-R314 IonicContact OD1-NE 2.63Å; D290-R314 PolarHBondContact OD1-NE 2.63Å; D290-R314 IonicContact OD1-NH2 3.52Å; D290-R314 PolarHBondContact OD1-NH2 3.26Å; D290-R314 IonicContact OD2-NH2 3.48Å; D290-R314 PolarHBondContact OD2-NH2 3.22Å
291	D	97	Very high	97.8	Very high	60 Å²	60	24 Å²	24	32%	0.321	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	13.1	172.1	76.9	-15.7	0	0	0	114.1	C271 Y289 N293	C271-D291 VanDerWaalsContact SG-CB 3.59Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.37Å; Y289-D291 PolarHBondContact O-N 2.92Å; D291-N293 PolarHBondContact O-N 2.85Å; D291-N293 PolarHBondContact O-ND2 2.93Å; D291-N293 WeakPolarHBondContact OD1-CB 3.49Å; D291-N293 PolarHBondContact OD1-N 2.91Å; D291-N293 VanDerWaalsContact OD1-N 3.08Å; D291-N293 PolarHBondContact OD2-ND2 3.29Å
292	F	97.8	Very high	97.6	Very high	87 Å²	87	20.4 Å²	20.4	38%	0.382	10%	0.102	S	C	.	.	S	Bend	trans	77.5	-1.9	175.7	-38.2	-22.9	0	0	0	114.1	Y289 D290 N313 R314 V315	Y289-F292 PolarHBondContact O-N 2.78Å; D290-F292 WeakPolarHBondContact O-CD1 3.45Å; D290-F292 VanDerWaalsContact O-CE1 3.32Å; D290-F292 WeakPolarHBondContact O-CE1 3.19Å; D290-F292 PolarHBondContact O-N 3.39Å; F292-N313 WeakPolarHBondContact CB-O 3.33Å; F292-N313 VanDerWaalsContact CD1-CA 3.49Å; F292-N313 VanDerWaalsContact CG-C 3.48Å; F292-R314 HydrophobicContact CD1-CB 4.35Å; F292-V315 WeakPolarHBondContact O-CG2 3.23Å
293	N	97.4	Very high	97.4	Very high	42 Å²	42	25 Å²	25	23%	0.225	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	161.5	179.7	-60.1	-55.2	0	0	0	111.8	Y289 D291 V307 A309	Y289-N293 PolarHBondContact N-O 2.89Å; D291-N293 PolarHBondContact O-N 2.85Å; D291-N293 PolarHBondContact O-ND2 2.93Å; D291-N293 WeakPolarHBondContact OD1-CB 3.49Å; D291-N293 PolarHBondContact OD1-N 2.91Å; D291-N293 VanDerWaalsContact OD1-N 3.08Å; D291-N293 PolarHBondContact OD2-ND2 3.29Å; N293-V307 HydrophobicContact CB-CG1 4.08Å; N293-A309 WeakPolarHBondContact OD1-CB 3.18Å
294	C	98.2	Very high	97.4	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.007	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.6	162.9	167.9	0	0	0	0	109	A287 V307 L308 T329	A287-C294 CarbonylContact O-C 3.56Å; A287-C294 WeakPolarHBondContact O-CA 3.36Å; A287-C294 PolarHBondContact O-SG 2.75Å; C294-V307 CarbonylContact O-C 3.52Å; C294-V307 WeakPolarHBondContact O-CA 3.03Å; C294-L308 HydrophobicContact CB-CB 4.07Å; C294-L308 HydrophobicContact CB-CD1 4.42Å; C294-L308 PolarHBondContact N-O 2.91Å; C294-L308 VanDerWaalsContact N-O 3.13Å; C294-L308 PolarHBondContact O-N 2.74Å; C294-T329 HydrophobicContact CB-CG2 4.47Å
295	N	98.3	Very high	97.3	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	141.6	177.2	-64.8	-63.5	0	0	0	109.8	L286 A287 Y289 W297 R304	L286-N295 WeakPolarHBondContact CA-O 3.2Å; A287-N295 PolarHBondContact N-O 3.13Å; A287-N295 PolarHBondContact O-N 3.41Å; Y289-N295 HydrophobicContact CD2-CB 4.35Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.29Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.23Å; Y289-N295 HydrophobicContact CE2-CB 3.71Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.35Å; N295-W297 HydrophobicContact CB-CZ2 4.23Å; N295-R304 HydrophobicContact CB-CG 4.43Å; N295-R304 WeakPolarHBondContact OD1-CD 3.24Å; N295-R304 PolarHBondContact OD1-NH1 3.48Å
296	V	98.4	Very high	97.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.9	175.2	-175.8	0	0	0	0	107.8	L284 L286 R304 A305 G306 L308	L284-V296 HydrophobicContact CB-CG1 4.05Å; L284-V296 HydrophobicContact CD1-CG1 4.03Å; L284-V296 HydrophobicContact CD2-CG1 4.03Å; L284-V296 HydrophobicContact CG-CG1 4.26Å; L286-V296 HydrophobicContact CD2-CG2 4.05Å; L286-V296 HydrophobicContact CG-CG1 4.48Å; L286-V296 HydrophobicContact CG-CG2 4.28Å; V296-R304 CarbonylContact O-C 3.55Å; V296-A305 WeakPolarHBondContact O-CA 3.42Å; V296-A305 PolarHBondContact O-N 3.47Å; V296-G306 PolarHBondContact N-O 3.05Å; V296-G306 PolarHBondContact O-N 2.79Å; V296-G306 VanDerWaalsContact O-N 3.11Å; V296-L308 HydrophobicContact CG2-CD1 4.44Å; V296-L308 HydrophobicContact CG2-CD2 4.39Å; V296-L308 HydrophobicContact CG2-CG 4.1Å
297	W	98.4	Very high	97.2	Very high	3 Å²	3	29.8 Å²	29.8	1%	0.011	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140.1	-176.5	-59.4	97.2	0	0	0	111.2	Y264 H266 I269 L284 L285 Y289 N295 T299 R304	Y264-W297 HydrophobicContact CD1-CB 3.93Å; Y264-W297 HydrophobicContact CD1-CD2 4.44Å; Y264-W297 HydrophobicContact CD1-CE3 4.35Å; Y264-W297 HydrophobicContact CD1-CG 4.29Å; Y264-W297 HydrophobicContact CE1-CB 4.39Å; H266-W297 HydrophobicContact CB-CH2 4.05Å; I269-W297 HydrophobicContact CD1-CH2 4.18Å; I269-W297 HydrophobicContact CD1-CZ2 3.95Å; L284-W297 WeakPolarHBondContact CA-O 3.38Å; L285-W297 HydrophobicContact CB-CB 4.28Å; L285-W297 PolarHBondContact N-O 2.95Å; L285-W297 PolarHBondContact O-N 3.07Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.44Å; Y289-W297 PolarHBondContact OH-NE1 2.87Å; Y289-W297 VanDerWaalsContact OH-NE1 3.09Å; N295-W297 HydrophobicContact CB-CZ2 4.23Å; W297-T299 PolarHBondContact O-N 3.16Å; W297-R304 HydrophobicContact CE3-CB 3.97Å; W297-R304 HydrophobicContact CH2-CB 4.34Å; W297-R304 HydrophobicContact CZ3-CB 3.86Å
298	D	97.8	Very high	97.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	113.5	166.1	-174.1	-24.3	0	0	0	108.7	V40 R283 L300 K301 G302 D303	V40-D298 HydrophobicContact CG2-CB 4.02Å; R283-D298 IonicContact CZ-OD1 3.51Å; R283-D298 IonicContact CZ-OD2 3.59Å; R283-D298 IonicContact NE-OD1 3.35Å; R283-D298 PolarHBondContact NE-OD1 3.33Å; R283-D298 IonicContact NE-OD2 3.95Å; R283-D298 PolarHBondContact NE-OD2 2.92Å; R283-D298 IonicContact NH2-OD1 2.8Å; R283-D298 IonicContact NH2-OD2 3.88Å; R283-D298 PolarHBondContact NH2-OD2 2.9Å; D298-L300 PolarHBondContact O-N 2.91Å; D298-L300 PolarHBondContact OD1-N 3.11Å; D298-K301 HydrophobicContact CB-CB 4.2Å; D298-K301 PolarHBondContact O-N 2.6Å; D298-G302 PolarHBondContact O-N 2.84Å; D298-D303 PolarHBondContact N-O 2.98Å
299	T	97	Very high	97.1	Very high	4 Å²	4	33.2 Å²	33.2	3%	0.025	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.4	-173.3	54.6	0	0	0	0	114.2	L30 L262 Y264 F278 G282 R283 L285 W297	L30-T299 WeakPolarHBondContact CD2-O 3.21Å; L262-T299 VanDerWaalsContact CD2-O 3.29Å; L262-T299 WeakPolarHBondContact CD2-O 3.26Å; Y264-T299 VanDerWaalsContact OH-CA 3.27Å; Y264-T299 WeakPolarHBondContact OH-CA 3.32Å; Y264-T299 PolarHBondContact OH-O 2.88Å; F278-T299 HydrophobicContact CD1-CG2 4.01Å; F278-T299 HydrophobicContact CE1-CG2 3.73Å; G282-T299 WeakPolarHBondContact O-CB 3.35Å; G282-T299 WeakPolarHBondContact O-CG2 3.46Å; G282-T299 PolarHBondContact O-OG1 2.97Å; R283-T299 WeakPolarHBondContact CA-OG1 3.46Å; R283-T299 PolarHBondContact O-N 3.19Å; R283-T299 PolarHBondContact O-OG1 3.38Å; R283-T299 VanDerWaalsContact O-OG1 3.04Å; L285-T299 HydrophobicContact CB-CG2 3.54Å; W297-T299 PolarHBondContact O-N 3.16Å
300	L	96.3	Very high	97	Very high	41 Å²	41	34.3 Å²	34.3	22%	0.215	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-28.2	-178.4	-62.3	-176.9	0	0	0	112.2	T34 M37 D298	T34-L300 HydrophobicContact CG2-CB 3.86Å; T34-L300 HydrophobicContact CG2-CD2 4.02Å; T34-L300 HydrophobicContact CG2-CG 4.35Å; T34-L300 PolarHBondContact OG1-O 2.68Å; M37-L300 HydrophobicContact SD-CD1 3.6Å; M37-L300 VanDerWaalsContact SD-CD1 3.6Å; D298-L300 PolarHBondContact O-N 2.91Å; D298-L300 PolarHBondContact OD1-N 3.11Å
301	K	94.2	Very high	97	Very high	36 Å²	36	32.4 Å²	32.4	16%	0.157	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-25.6	-174.4	-63.7	-64.1	-169.1	174.8	0	113.6	T34 S35 M37 D298 D303	T34-K301 PolarHBondContact O-NZ 3.49Å; S35-K301 PolarHBondContact O-NZ 3.42Å; M37-K301 WeakPolarHBondContact O-CE 3.44Å; M37-K301 PolarHBondContact O-NZ 2.87Å; D298-K301 HydrophobicContact CB-CB 4.2Å; D298-K301 PolarHBondContact O-N 2.6Å; K301-D303 HydrophobicContact CB-CB 4.36Å; K301-D303 PolarHBondContact O-N 3.45Å
302	G	93.8	Very high	97.1	Very high	14 Å²	14	35.5 Å²	35.5	14%	0.144	20%	0.199	C	C	.	.			trans	81.4	-3.1	-172.2	0	0	0	0	0	113.6	D298	D298-G302 PolarHBondContact O-N 2.84Å
303	D	94.5	Very high	97.1	Very high	97 Å²	97	33.9 Å²	33.9	52%	0.519	19%	0.194	S	C	.	.			trans	-81.9	146.6	-177.2	-65.7	-36.7	0	0	0	112.2	D298 K301 A305	D298-D303 PolarHBondContact N-O 2.98Å; K301-D303 HydrophobicContact CB-CB 4.36Å; K301-D303 PolarHBondContact O-N 3.45Å; D303-A305 PolarHBondContact O-N 2.84Å
304	R	96.1	Very high	97.1	Very high	109 Å²	109	34.7 Å²	34.7	41%	0.411	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	107.4	170.8	-174.4	172.3	63.2	174.3	-5	110.4	N295 V296 W297	N295-R304 HydrophobicContact CB-CG 4.43Å; N295-R304 WeakPolarHBondContact OD1-CD 3.24Å; N295-R304 PolarHBondContact OD1-NH1 3.48Å; V296-R304 CarbonylContact O-C 3.55Å; W297-R304 HydrophobicContact CE3-CB 3.97Å; W297-R304 HydrophobicContact CH2-CB 4.34Å; W297-R304 HydrophobicContact CZ3-CB 3.86Å
305	A	96.9	Very high	97.2	Very high	11 Å²	11	34.7 Å²	34.7	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-28.4	179.1	0	0	0	0	0	113.5	V40 R42 I43 V296 D303	V40-A305 HydrophobicContact CG2-CB 3.51Å; R42-A305 CarbonylContact C-O 3.56Å; R42-A305 WeakPolarHBondContact CA-O 3.22Å; I43-A305 HydrophobicContact CG1-CB 3.96Å; I43-A305 PolarHBondContact N-O 3.32Å; V296-A305 WeakPolarHBondContact O-CA 3.42Å; V296-A305 PolarHBondContact O-N 3.47Å; D303-A305 PolarHBondContact O-N 2.84Å
306	G	97.1	Very high	97.2	Very high	7 Å²	7	35.4 Å²	35.4	7%	0.072	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	171.5	-177	0	0	0	0	0	114.1	V296	V296-G306 PolarHBondContact N-O 3.05Å; V296-G306 PolarHBondContact O-N 2.79Å; V296-G306 VanDerWaalsContact O-N 3.11Å
307	V	97.8	Very high	97.2	Very high	62 Å²	62	35.9 Å²	35.9	38%	0.376	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	129	176.6	-175.5	0	0	0	0	109	N293 C294 A309	N293-V307 HydrophobicContact CB-CG1 4.08Å; C294-V307 CarbonylContact O-C 3.52Å; C294-V307 WeakPolarHBondContact O-CA 3.03Å; V307-A309 HydrophobicContact CG1-CB 4.33Å
308	L	98.1	Very high	97.2	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	90.2	171	-49.7	-176	0	0	0	108.1	M45 L286 C294 V296 V327 W339	M45-L308 HydrophobicContact CB-CD2 3.63Å; M45-L308 HydrophobicContact CG-CD2 4.06Å; M45-L308 HydrophobicContact SD-CD1 4.27Å; M45-L308 HydrophobicContact SD-CD2 3.98Å; L286-L308 HydrophobicContact CD2-CD1 4.2Å; C294-L308 HydrophobicContact CB-CB 4.07Å; C294-L308 HydrophobicContact CB-CD1 4.42Å; C294-L308 PolarHBondContact N-O 2.91Å; C294-L308 VanDerWaalsContact N-O 3.13Å; C294-L308 PolarHBondContact O-N 2.74Å; V296-L308 HydrophobicContact CG2-CD1 4.44Å; V296-L308 HydrophobicContact CG2-CD2 4.39Å; V296-L308 HydrophobicContact CG2-CG 4.1Å; L308-V327 HydrophobicContact CD1-CG1 4.07Å; L308-W339 HydrophobicContact CB-CD2 4.34Å; L308-W339 HydrophobicContact CB-CE3 4.3Å; L308-W339 HydrophobicContact CB-CH2 4.2Å; L308-W339 HydrophobicContact CB-CZ2 4.24Å; L308-W339 HydrophobicContact CB-CZ3 4.23Å; L308-W339 HydrophobicContact CD1-CD2 4.25Å; L308-W339 HydrophobicContact CD1-CG 4.16Å; L308-W339 HydrophobicContact CD2-CD2 4.41Å; L308-W339 HydrophobicContact CD2-CE3 4.12Å
309	A	97.6	Very high	97.2	Very high	67 Å²	67	37 Å²	37	55%	0.554	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.5	176.8	0	0	0	0	0	109.3	N293 V307	N293-A309 WeakPolarHBondContact OD1-CB 3.18Å; V307-A309 HydrophobicContact CG1-CB 4.33Å
310	G	96.8	Very high	97.3	Very high	23 Å²	23	38 Å²	38	24%	0.237	22%	0.218	C	C	.	.			trans	-175.7	-0.7	177.3	0	0	0	0	0	115.5	R337	G310-R337 PolarHBondContact O-NE 3.39Å; G310-R337 PolarHBondContact O-NH2 3.02Å
311	H	98.3	Very high	97.4	Very high	11 Å²	11	36.3 Å²	36.3	5%	0.051	21%	0.209	C	C	.	.			trans	-96.5	149.7	171.9	-73.6	-71.6	0	0	0	110.5	V315 T329 S331 D333 F335	H311-V315 HydrophobicContact CB-CG2 4.46Å; H311-T329 PolarHBondContact NE2-OG1 2.85Å; H311-S331 VanDerWaalsContact CG-CB 3.46Å; H311-S331 WeakPolarHBondContact ND1-CB 3.41Å; H311-D333 WeakPolarHBondContact CA-OD2 3.46Å; H311-D333 WeakPolarHBondContact CB-OD2 3.28Å; H311-D333 IonicContact CE1-OD1 3.66Å; H311-D333 IonicContact CE1-OD2 3.68Å; H311-D333 IonicContact CG-OD2 2.75Å; H311-D333 IonicContact ND1-OD1 3.24Å; H311-D333 PolarHBondContact ND1-OD1 3.33Å; H311-D333 IonicContact ND1-OD2 3.6Å; H311-D333 PolarHBondContact ND1-OD2 3.42Å; H311-F335 PolarHBondContact CE1-O 2.84Å
312	D	97.9	Very high	97.5	Very high	125 Å²	125	38.2 Å²	38.2	67%	0.668	22%	0.221	S	C	*	.	S	Bend	trans	-97.3	5.8	179.2	-60.7	-44.1	0	0	0	112	D333	D312-D333 HydrophobicContact CB-CB 4.39Å; D312-D333 PolarHBondContact N-OD2 3.42Å
313	N	98.4	Very high	97.7	Very high	53 Å²	53	40.3 Å²	40.3	28%	0.283	23%	0.229	S	C	.	.	S	Bend	trans	-156	173.3	178.8	-151.1	-35.8	0	0	0	109.9	F292 V315 S331 W332 D333	F292-N313 WeakPolarHBondContact CB-O 3.33Å; F292-N313 VanDerWaalsContact CD1-CA 3.49Å; F292-N313 VanDerWaalsContact CG-C 3.48Å; N313-V315 PolarHBondContact O-N 2.84Å; N313-S331 PolarHBondContact O-OG 2.97Å; N313-W332 HydrophobicContact CB-CB 3.9Å; N313-D333 HydrophobicContact CB-CB 4.08Å
314	R	97.9	Very high	97.8	Very high	58 Å²	58	37.3 Å²	37.3	22%	0.219	22%	0.221	C	C	.	.			trans	-51.3	134.8	-174.7	66.6	-176.8	-68	-157.7	14.9	112.1	T274 D290 F292 S316 S331 W332	T274-R314 VanDerWaalsContact CG2-NH2 3.27Å; D290-R314 IonicContact OD1-CZ 2.86Å; D290-R314 IonicContact OD1-NE 2.63Å; D290-R314 PolarHBondContact OD1-NE 2.63Å; D290-R314 IonicContact OD1-NH2 3.52Å; D290-R314 PolarHBondContact OD1-NH2 3.26Å; D290-R314 IonicContact OD2-NH2 3.48Å; D290-R314 PolarHBondContact OD2-NH2 3.22Å; F292-R314 HydrophobicContact CD1-CB 4.35Å; R314-S316 PolarHBondContact O-N 3.41Å; R314-S331 VanDerWaalsContact O-CA 3.29Å; R314-S331 WeakPolarHBondContact O-CA 3.48Å; R314-S331 WeakPolarHBondContact O-CB 3.29Å; R314-S331 PolarHBondContact O-OG 3.03Å; R314-W332 VanDerWaalsContact CD-CE2 3.47Å; R314-W332 VanDerWaalsContact CD-CZ3 3.43Å; R314-W332 HydrophobicContact CG-CB 3.98Å; R314-W332 HydrophobicContact CG-CD2 3.35Å; R314-W332 HydrophobicContact CG-CE3 3.58Å; R314-W332 HydrophobicContact CG-CG 3.51Å; R314-W332 HydrophobicContact CG-CZ2 4.49Å; R314-W332 HydrophobicContact CG-CZ3 4.22Å; R314-W332 PolarHBondContact O-N 3.46Å; R314-W332 VanDerWaalsContact O-N 3.11Å
315	V	98.7	Very high	97.9	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	116	170.4	179.7	0	0	0	0	105.4	T274 Y289 F292 H311 N313 T329 G330	T274-V315 VanDerWaalsContact CB-O 3.28Å; T274-V315 WeakPolarHBondContact CB-O 3.31Å; T274-V315 VanDerWaalsContact CG2-O 3.24Å; T274-V315 WeakPolarHBondContact CG2-O 3.42Å; T274-V315 PolarHBondContact OG1-O 3.4Å; Y289-V315 PolarHBondContact O-N 3.33Å; F292-V315 WeakPolarHBondContact O-CG2 3.23Å; H311-V315 HydrophobicContact CB-CG2 4.46Å; N313-V315 PolarHBondContact O-N 2.84Å; V315-T329 HydrophobicContact CG1-CG2 4.46Å; V315-G330 CarbonylContact C-O 3.45Å
316	S	98.6	Very high	98	Very high	16 Å²	16	38.6 Å²	38.6	11%	0.112	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	-27.6	-175.3	59.6	0	0	0	0	112.4	I58 R314 G330	I58-S316 WeakPolarHBondContact O-CB 3.39Å; I58-S316 PolarHBondContact O-OG 3.48Å; R314-S316 PolarHBondContact O-N 3.41Å; S316-G330 PolarHBondContact N-O 3.36Å; S316-G330 PolarHBondContact OG-O 3.09Å
317	C	98.4	Very high	98	Very high	11 Å²	11	38.4 Å²	38.4	7%	0.074	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	153.2	-177.5	57.5	0	0	0	0	110.9	Y59 M61 T329 G330	Y59-C317 WeakPolarHBondContact O-CB 3.34Å; M61-C317 HydrophobicContact CG-CB 4.17Å; M61-C317 VanDerWaalsContact CG-SG 3.55Å; C317-T329 WeakPolarHBondContact O-CA 3.46Å; C317-G330 PolarHBondContact N-O 3.27Å; C317-G330 PolarHBondContact O-N 2.85Å
318	L	98.5	Very high	98.1	Very high	16 Å²	16	35.5 Å²	35.5	8%	0.084	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.5	172.1	69.5	86.9	0	0	0	110.2	S275 A277 L286 A328 T329	S275-L318 WeakPolarHBondContact OG-CD2 3.48Å; S275-L318 PolarHBondContact OG-N 3.37Å; A277-L318 HydrophobicContact CB-CD1 3.3Å; L286-L318 HydrophobicContact CB-CD1 4.28Å; L318-A328 CarbonylContact C-O 3.52Å; L318-A328 WeakPolarHBondContact CA-O 3.34Å; L318-T329 HydrophobicContact CB-CG2 4.14Å
319	G	98.3	Very high	98.1	Very high	12 Å²	12	35.3 Å²	35.3	12%	0.124	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	141.5	175.1	0	0	0	0	0	111.3	W63 V327 A328	W63-G319 PolarHBondContact NE1-O 3.42Å; G319-V327 CarbonylContact O-C 3.56Å; G319-V327 WeakPolarHBondContact O-CA 3.23Å; G319-V327 WeakPolarHBondContact O-CG2 3.24Å; G319-A328 PolarHBondContact N-O 3.34Å; G319-A328 PolarHBondContact O-N 3.04Å
320	V	98.6	Very high	98.2	Very high	25 Å²	25	32.1 Å²	32.1	15%	0.152	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	143.8	171.8	-177.3	0	0	0	0	108.2	A277 F278 L286 V327	A277-V320 HydrophobicContact CB-CG2 4.13Å; F278-V320 WeakPolarHBondContact O-CG2 3.45Å; L286-V320 HydrophobicContact CD1-CG2 3.88Å; V320-V327 HydrophobicContact CG2-CB 4.3Å; V320-V327 HydrophobicContact CG2-CG2 4.22Å
321	T	98.5	Very high	98.3	Very high	5 Å²	5	31 Å²	31	3%	0.031	18%	0.175	C	C	.	.			trans	-68.2	151.9	174.7	54.8	0	0	0	0	111.6	W63 D323 G324 M325 A326	W63-T321 HydrophobicContact CD2-CG2 3.63Å; W63-T321 HydrophobicContact CE3-CG2 3.78Å; W63-T321 HydrophobicContact CG-CG2 4.2Å; W63-T321 HydrophobicContact CH2-CG2 3.9Å; W63-T321 HydrophobicContact CZ2-CG2 3.73Å; W63-T321 HydrophobicContact CZ3-CG2 3.91Å; T321-D323 WeakPolarHBondContact CB-OD1 3.4Å; T321-D323 PolarHBondContact O-N 3.11Å; T321-D323 PolarHBondContact OG1-OD1 2.95Å; T321-G324 WeakPolarHBondContact O-CA 3.45Å; T321-G324 PolarHBondContact O-N 3.13Å; T321-G324 PolarHBondContact OG1-N 2.87Å; T321-M325 PolarHBondContact OG1-N 3.38Å; T321-A326 HydrophobicContact CG2-CB 4.19Å; T321-A326 PolarHBondContact N-O 3.15Å; T321-A326 PolarHBondContact OG1-N 3.06Å; T321-A326 VanDerWaalsContact OG1-N 3.12Å; T321-A326 PolarHBondContact OG1-O 3.13Å
322	D	97	Very high	98.3	Very high	76 Å²	76	33 Å²	33	41%	0.406	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.5	-179.8	-70.8	-13.6	0	0	0	112.8	Y65 S67 K280 G324	Y65-D322 VanDerWaalsContact CA-OD2 3.31Å; Y65-D322 WeakPolarHBondContact CA-OD2 3.46Å; Y65-D322 WeakPolarHBondContact CD1-OD2 3.43Å; S67-D322 PolarHBondContact OG-N 3.09Å; K280-D322 PolarHBondContact NZ-O 3.01Å; D322-G324 VanDerWaalsContact C-N 3.29Å
323	D	97.6	Very high	98.3	Very high	58 Å²	58	28 Å²	28	31%	0.31	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.1	173.5	69.8	1.4	0	0	0	113.9	S67 K280 T321 M325	S67-D323 VanDerWaalsContact CB-CG 3.46Å; S67-D323 WeakPolarHBondContact CB-OD2 3.28Å; S67-D323 PolarHBondContact OG-N 3.06Å; K280-D323 VanDerWaalsContact CD-O 3.32Å; K280-D323 WeakPolarHBondContact CD-O 3.12Å; T321-D323 WeakPolarHBondContact CB-OD1 3.4Å; T321-D323 PolarHBondContact O-N 3.11Å; T321-D323 PolarHBondContact OG1-OD1 2.95Å; D323-M325 VanDerWaalsContact C-N 3.27Å; D323-M325 HydrophobicContact CB-CG 4.23Å; D323-M325 PolarHBondContact O-N 2.81Å; D323-M325 VanDerWaalsContact OD1-CB 3.27Å; D323-M325 WeakPolarHBondContact OD1-CB 3.43Å; D323-M325 WeakPolarHBondContact OD1-CG 3.12Å; D323-M325 PolarHBondContact OD1-N 3.17Å; D323-M325 WeakPolarHBondContact OD2-CG 3.15Å
324	G	97.6	Very high	98.3	Very high	34 Å²	34	26.6 Å²	26.6	35%	0.351	15%	0.15	S	C	.	.	S	Bend	trans	73.5	8.8	-178.8	0	0	0	0	0	115.2	T321 D322	T321-G324 WeakPolarHBondContact O-CA 3.45Å; T321-G324 PolarHBondContact O-N 3.13Å; T321-G324 PolarHBondContact OG1-N 2.87Å; D322-G324 VanDerWaalsContact C-N 3.29Å
325	M	97.7	Very high	98.3	Very high	129 Å²	129	26.5 Å²	26.5	64%	0.635	15%	0.151	S	C	*	.	S	Bend	trans	-74.1	-25.7	-175.3	-70.7	-68.7	178.3	0	0	114.4	T321 D323 N340	T321-M325 PolarHBondContact OG1-N 3.38Å; D323-M325 VanDerWaalsContact C-N 3.27Å; D323-M325 HydrophobicContact CB-CG 4.23Å; D323-M325 PolarHBondContact O-N 2.81Å; D323-M325 VanDerWaalsContact OD1-CB 3.27Å; D323-M325 WeakPolarHBondContact OD1-CB 3.43Å; D323-M325 WeakPolarHBondContact OD1-CG 3.12Å; D323-M325 PolarHBondContact OD1-N 3.17Å; D323-M325 WeakPolarHBondContact OD2-CG 3.15Å; M325-N340 VanDerWaalsContact O-CB 3.3Å; M325-N340 WeakPolarHBondContact O-CB 3.42Å
326	A	98.2	Very high	98.3	Very high	17 Å²	17	26.5 Å²	26.5	14%	0.14	15%	0.151	C	C	.	.			trans	-148.7	157.2	-177.7	0	0	0	0	0	112.7	T321 I338 W339	T321-A326 HydrophobicContact CG2-CB 4.19Å; T321-A326 PolarHBondContact N-O 3.15Å; T321-A326 PolarHBondContact OG1-N 3.06Å; T321-A326 VanDerWaalsContact OG1-N 3.12Å; T321-A326 PolarHBondContact OG1-O 3.13Å; A326-I338 HydrophobicContact CB-CG2 3.79Å; A326-W339 WeakPolarHBondContact CA-O 3.26Å
327	V	98.6	Very high	98.3	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.024	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.1	164.1	58.5	0	0	0	0	109.1	M45 L286 L308 G319 V320 I338 W339	M45-V327 HydrophobicContact SD-CG1 3.84Å; L286-V327 HydrophobicContact CD2-CB 4.18Å; L286-V327 HydrophobicContact CD2-CG1 4.06Å; L286-V327 HydrophobicContact CD2-CG2 3.95Å; L308-V327 HydrophobicContact CD1-CG1 4.07Å; G319-V327 CarbonylContact O-C 3.56Å; G319-V327 WeakPolarHBondContact O-CA 3.23Å; G319-V327 WeakPolarHBondContact O-CG2 3.24Å; V320-V327 HydrophobicContact CG2-CB 4.3Å; V320-V327 HydrophobicContact CG2-CG2 4.22Å; V327-I338 CarbonylContact O-C 3.57Å; V327-I338 WeakPolarHBondContact O-CA 3.31Å; V327-W339 HydrophobicContact CG1-CB 3.63Å; V327-W339 HydrophobicContact CG1-CG 4.06Å; V327-W339 PolarHBondContact N-O 3.08Å; V327-W339 PolarHBondContact O-N 3.2Å
328	A	98.8	Very high	98.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.1	166.7	0	0	0	0	0	110.2	M61 W63 L318 G319 R337 I338	M61-A328 HydrophobicContact CE-CB 3.52Å; M61-A328 HydrophobicContact SD-CB 4.26Å; W63-A328 HydrophobicContact CH2-CB 4.45Å; W63-A328 HydrophobicContact CZ2-CB 3.43Å; W63-A328 VanDerWaalsContact CZ2-CB 3.43Å; L318-A328 CarbonylContact C-O 3.52Å; L318-A328 WeakPolarHBondContact CA-O 3.34Å; G319-A328 PolarHBondContact N-O 3.34Å; G319-A328 PolarHBondContact O-N 3.04Å; A328-R337 CarbonylContact C-O 3.53Å; A328-R337 VanDerWaalsContact CA-O 3.26Å; A328-R337 WeakPolarHBondContact CA-O 3.44Å; A328-I338 HydrophobicContact CB-CG1 4.49Å
329	T	98.8	Very high	98.4	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.5	169.7	57.1	0	0	0	0	108.9	C294 H311 V315 C317 L318 L336 R337 W339	C294-T329 HydrophobicContact CB-CG2 4.47Å; H311-T329 PolarHBondContact NE2-OG1 2.85Å; V315-T329 HydrophobicContact CG1-CG2 4.46Å; C317-T329 WeakPolarHBondContact O-CA 3.46Å; L318-T329 HydrophobicContact CB-CG2 4.14Å; T329-L336 CarbonylContact O-C 3.55Å; T329-L336 VanDerWaalsContact O-CA 3.22Å; T329-L336 WeakPolarHBondContact O-CA 3.49Å; T329-R337 PolarHBondContact N-O 2.8Å; T329-R337 PolarHBondContact O-N 3.39Å; T329-W339 PolarHBondContact OG1-NE1 2.69Å
330	G	98.8	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.2	171.5	0	0	0	0	0	110.3	V315 S316 C317	V315-G330 CarbonylContact C-O 3.45Å; S316-G330 PolarHBondContact N-O 3.36Å; S316-G330 PolarHBondContact OG-O 3.09Å; C317-G330 PolarHBondContact N-O 3.27Å; C317-G330 PolarHBondContact O-N 2.85Å
331	S	98.8	Very high	98.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	163.1	-174.6	167.8	0	0	0	0	112.3	I58 H311 N313 R314 D333 S334 F335	I58-S331 WeakPolarHBondContact CB-O 3.31Å; I58-S331 PolarHBondContact N-O 2.82Å; H311-S331 VanDerWaalsContact CG-CB 3.46Å; H311-S331 WeakPolarHBondContact ND1-CB 3.41Å; N313-S331 PolarHBondContact O-OG 2.97Å; R314-S331 VanDerWaalsContact O-CA 3.29Å; R314-S331 WeakPolarHBondContact O-CA 3.48Å; R314-S331 WeakPolarHBondContact O-CB 3.29Å; R314-S331 PolarHBondContact O-OG 3.03Å; S331-D333 VanDerWaalsContact CB-OD1 3.29Å; S331-D333 WeakPolarHBondContact CB-OD1 3.35Å; S331-D333 PolarHBondContact O-N 2.73Å; S331-D333 PolarHBondContact OG-N 3.24Å; S331-D333 VanDerWaalsContact OG-N 3.14Å; S331-D333 PolarHBondContact OG-OD1 2.87Å; S331-S334 PolarHBondContact O-N 3.31Å; S331-F335 PolarHBondContact N-O 3.4Å
332	W	98.6	Very high	98	Very high	51 Å²	51	33.7 Å²	33.7	19%	0.193	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-8.6	169.6	-76.9	16.3	0	0	0	114	K57 I58 Y59 N313 R314 S334	K57-W332 HydrophobicContact CB-CB 4.22Å; K57-W332 HydrophobicContact CB-CD2 4.46Å; K57-W332 HydrophobicContact CB-CG 3.91Å; K57-W332 HydrophobicContact CD-CB 4.32Å; K57-W332 HydrophobicContact CD-CD2 3.63Å; K57-W332 HydrophobicContact CD-CE3 3.9Å; K57-W332 HydrophobicContact CD-CG 3.86Å; K57-W332 HydrophobicContact CD-CZ3 4.47Å; K57-W332 HydrophobicContact CG-CB 3.89Å; K57-W332 HydrophobicContact CG-CD2 4.15Å; K57-W332 HydrophobicContact CG-CG 3.82Å; I58-W332 VanDerWaalsContact O-CD1 3.26Å; Y59-W332 HydrophobicContact CE2-CZ2 4.32Å; Y59-W332 AromaticContact CE2-NE1 3.69Å; Y59-W332 AromaticContact CZ-CZ2 3.88Å; Y59-W332 AromaticContact CZ-NE1 3.98Å; Y59-W332 WeakPolarHBondContact OH-CZ2 3.31Å; N313-W332 HydrophobicContact CB-CB 3.9Å; R314-W332 VanDerWaalsContact CD-CE2 3.47Å; R314-W332 VanDerWaalsContact CD-CZ3 3.43Å; R314-W332 HydrophobicContact CG-CB 3.98Å; R314-W332 HydrophobicContact CG-CD2 3.35Å; R314-W332 HydrophobicContact CG-CE3 3.58Å; R314-W332 HydrophobicContact CG-CG 3.51Å; R314-W332 HydrophobicContact CG-CZ2 4.49Å; R314-W332 HydrophobicContact CG-CZ3 4.22Å; R314-W332 PolarHBondContact O-N 3.46Å; R314-W332 VanDerWaalsContact O-N 3.11Å; W332-S334 PolarHBondContact O-N 2.92Å
333	D	98.3	Very high	98.1	Very high	21 Å²	21	31.4 Å²	31.4	11%	0.112	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	3.6	170.1	72.1	6.2	0	0	0	113.9	H311 D312 N313 S331 F335	H311-D333 WeakPolarHBondContact CA-OD2 3.46Å; H311-D333 WeakPolarHBondContact CB-OD2 3.28Å; H311-D333 IonicContact CE1-OD1 3.66Å; H311-D333 IonicContact CE1-OD2 3.68Å; H311-D333 IonicContact CG-OD2 2.75Å; H311-D333 IonicContact ND1-OD1 3.24Å; H311-D333 PolarHBondContact ND1-OD1 3.33Å; H311-D333 IonicContact ND1-OD2 3.6Å; H311-D333 PolarHBondContact ND1-OD2 3.42Å; D312-D333 HydrophobicContact CB-CB 4.39Å; D312-D333 PolarHBondContact N-OD2 3.42Å; N313-D333 HydrophobicContact CB-CB 4.08Å; S331-D333 VanDerWaalsContact CB-OD1 3.29Å; S331-D333 WeakPolarHBondContact CB-OD1 3.35Å; S331-D333 PolarHBondContact O-N 2.73Å; S331-D333 PolarHBondContact OG-N 3.24Å; S331-D333 VanDerWaalsContact OG-N 3.14Å; S331-D333 PolarHBondContact OG-OD1 2.87Å; D333-F335 VanDerWaalsContact C-N 3.28Å; D333-F335 HydrophobicContact CB-CD2 4.22Å; D333-F335 WeakPolarHBondContact O-CD2 3.34Å; D333-F335 WeakPolarHBondContact O-CE2 3.42Å; D333-F335 PolarHBondContact O-N 2.89Å; D333-F335 WeakPolarHBondContact OD1-CB 3.09Å; D333-F335 PolarHBondContact OD1-N 2.89Å
334	S	98.3	Very high	98.1	Very high	24 Å²	24	29.8 Å²	29.8	17%	0.168	16%	0.158	C	C	.	.	S	Bend	trans	72.1	7.2	-179	76	0	0	0	0	116.1	A56 S331 W332	A56-S334 WeakPolarHBondContact O-CA 3.43Å; A56-S334 WeakPolarHBondContact O-CB 3.44Å; S331-S334 PolarHBondContact O-N 3.31Å; W332-S334 PolarHBondContact O-N 2.92Å
335	F	98.4	Very high	98.2	Very high	56 Å²	56	29.6 Å²	29.6	25%	0.246	15%	0.146	C	C	.	.			trans	-107.6	146.4	179.2	-59.8	-66.2	0	0	0	112.4	T50 R52 H311 S331 D333	T50-F335 HydrophobicContact CG2-CB 4.3Å; T50-F335 HydrophobicContact CG2-CD1 4.11Å; T50-F335 HydrophobicContact CG2-CG 4.35Å; R52-F335 HydrophobicContact CB-CD1 4.49Å; R52-F335 HydrophobicContact CB-CE1 4.33Å; R52-F335 HydrophobicContact CG-CD1 3.82Å; R52-F335 HydrophobicContact CG-CE1 3.72Å; H311-F335 PolarHBondContact CE1-O 2.84Å; S331-F335 PolarHBondContact N-O 3.4Å; D333-F335 VanDerWaalsContact C-N 3.28Å; D333-F335 HydrophobicContact CB-CD2 4.22Å; D333-F335 WeakPolarHBondContact O-CD2 3.34Å; D333-F335 WeakPolarHBondContact O-CE2 3.42Å; D333-F335 PolarHBondContact O-N 2.89Å; D333-F335 WeakPolarHBondContact OD1-CB 3.09Å; D333-F335 PolarHBondContact OD1-N 2.89Å
336	L	98.7	Very high	98.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	140.1	156.9	-55.3	95.3	0	0	0	110	T50 L51 I58 M61 L70 W82 T329	T50-L336 CarbonylContact C-O 3.59Å; T50-L336 WeakPolarHBondContact CA-O 3.15Å; L51-L336 HydrophobicContact CB-CB 4.08Å; L51-L336 HydrophobicContact CB-CD1 4.28Å; L51-L336 HydrophobicContact CD1-CB 4.11Å; L51-L336 HydrophobicContact CG-CB 4.31Å; L51-L336 PolarHBondContact N-O 3.3Å; L51-L336 PolarHBondContact O-N 3.27Å; I58-L336 HydrophobicContact CD1-CD1 3.46Å; I58-L336 VanDerWaalsContact CD1-CD1 3.46Å; I58-L336 HydrophobicContact CD1-CG 3.76Å; M61-L336 HydrophobicContact CB-CD2 3.87Å; M61-L336 HydrophobicContact CG-CD2 4.27Å; L70-L336 HydrophobicContact CD1-CD2 3.82Å; W82-L336 HydrophobicContact CZ2-CD1 4.23Å; T329-L336 CarbonylContact O-C 3.55Å; T329-L336 VanDerWaalsContact O-CA 3.22Å; T329-L336 WeakPolarHBondContact O-CA 3.49Å
337	R	98.7	Very high	98.2	Very high	50 Å²	50	23.4 Å²	23.4	19%	0.189	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.1	175.1	-69.2	179.3	178.5	-106.9	3.2	109.7	T47 R49 G310 A328 T329 W339	T47-R337 HydrophobicContact CG2-CB 4.03Å; T47-R337 HydrophobicContact CG2-CG 4.1Å; R49-R337 WeakPolarHBondContact O-CA 3.16Å; G310-R337 PolarHBondContact O-NE 3.39Å; G310-R337 PolarHBondContact O-NH2 3.02Å; A328-R337 CarbonylContact C-O 3.53Å; A328-R337 VanDerWaalsContact CA-O 3.26Å; A328-R337 WeakPolarHBondContact CA-O 3.44Å; T329-R337 PolarHBondContact N-O 2.8Å; T329-R337 PolarHBondContact O-N 3.39Å; R337-W339 HydrophobicContact CB-CZ2 3.91Å; R337-W339 HydrophobicContact CG-CZ2 4.47Å; R337-W339 PolarHBondContact O-NE1 3.22Å
338	I	98.6	Very high	98.2	Very high	9 Å²	9	24.8 Å²	24.8	5%	0.046	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.1	174.5	-57.6	174.8	0	0	0	108.1	T47 R48 R49 L51 W63 L70 A326 V327 A328	T47-I338 CarbonylContact C-O 3.48Å; T47-I338 WeakPolarHBondContact CA-O 3.4Å; R48-I338 PolarHBondContact N-O 3.16Å; R49-I338 HydrophobicContact CB-CB 4.1Å; R49-I338 HydrophobicContact CB-CD1 4.09Å; R49-I338 HydrophobicContact CB-CG1 4.34Å; R49-I338 HydrophobicContact CG-CD1 4.47Å; R49-I338 PolarHBondContact N-O 3.32Å; R49-I338 PolarHBondContact O-N 2.92Å; L51-I338 HydrophobicContact CD1-CD1 4.28Å; L51-I338 HydrophobicContact CD2-CD1 4.47Å; L51-I338 HydrophobicContact CG-CD1 4.47Å; W63-I338 HydrophobicContact CH2-CD1 4.08Å; W63-I338 HydrophobicContact CH2-CG1 4.4Å; L70-I338 HydrophobicContact CD2-CD1 4.43Å; A326-I338 HydrophobicContact CB-CG2 3.79Å; V327-I338 CarbonylContact O-C 3.57Å; V327-I338 WeakPolarHBondContact O-CA 3.31Å; A328-I338 HydrophobicContact CB-CG1 4.49Å
339	W	98.6	Very high	98.1	Very high	9 Å²	9	26.9 Å²	26.9	3%	0.034	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.6	-175.7	-40.4	74.6	0	0	0	110.7	M45 R46 T47 L308 A326 V327 T329 R337	M45-W339 HydrophobicContact CB-CB 4.07Å; M45-W339 HydrophobicContact SD-CB 4.37Å; R46-W339 WeakPolarHBondContact O-CA 3.41Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.49Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.26Å; L308-W339 HydrophobicContact CB-CD2 4.34Å; L308-W339 HydrophobicContact CB-CE3 4.3Å; L308-W339 HydrophobicContact CB-CH2 4.2Å; L308-W339 HydrophobicContact CB-CZ2 4.24Å; L308-W339 HydrophobicContact CB-CZ3 4.23Å; L308-W339 HydrophobicContact CD1-CD2 4.25Å; L308-W339 HydrophobicContact CD1-CG 4.16Å; L308-W339 HydrophobicContact CD2-CD2 4.41Å; L308-W339 HydrophobicContact CD2-CE3 4.12Å; A326-W339 WeakPolarHBondContact CA-O 3.26Å; V327-W339 HydrophobicContact CG1-CB 3.63Å; V327-W339 HydrophobicContact CG1-CG 4.06Å; V327-W339 PolarHBondContact N-O 3.08Å; V327-W339 PolarHBondContact O-N 3.2Å; T329-W339 PolarHBondContact OG1-NE1 2.69Å; R337-W339 HydrophobicContact CB-CZ2 3.91Å; R337-W339 HydrophobicContact CG-CZ2 4.47Å; R337-W339 PolarHBondContact O-NE1 3.22Å
340	N	92.6	Very high	98	Very high	102 Å²	102	29.3 Å²	29.3	55%	0.545	14%	0.139	S	C	.	.			trans	-159.7	0	162.7	72.2	11.2	0	0	0	112.6	R46 R48 M325	R46-N340 PolarHBondContact N-O 3.37Å; R46-N340 VanDerWaalsContact N-O 3.13Å; R46-N340 PolarHBondContact O-N 3.09Å; R48-N340 WeakPolarHBondContact CD-OD1 3.41Å; R48-N340 WeakPolarHBondContact CG-OD1 3.21Å; R48-N340 PolarHBondContact NE-O 3.01Å; R48-N340 PolarHBondContact NE-OD1 2.76Å; R48-N340 PolarHBondContact NH2-O 3.27Å; R48-N340 VanDerWaalsContact NH2-O 3.15Å; M325-N340 VanDerWaalsContact O-CB 3.3Å; M325-N340 WeakPolarHBondContact O-CB 3.42Å

Retrieved 340 of 340 residues in 193.1 ms (Link to these results)

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