A0A087YAP7_POEFO 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 (A0A3P9PKH5), UniProt , Accession A0A087YAP7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, 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	65	Low	92.7	Very high	148 Å²	148	108.5 Å²	108.5	73%	0.729	53%	0.534	S	S	*	.				0	123.5	0	-148.3	-174.2	-67	0	0	106.2	E5 Q6	M1-E5 VanDerWaalsContact CA-OE2 3.24Å; M1-E5 WeakPolarHBondContact CA-OE2 3.47Å; M1-E5 HydrophobicContact CG-CB 3.71Å; M1-E5 VanDerWaalsContact CG-OE2 3.31Å; M1-E5 WeakPolarHBondContact CG-OE2 3.39Å; M1-E5 HydrophobicContact SD-CB 4.46Å; M1-Q6 HydrophobicContact CB-CG 4.29Å; M1-Q6 HydrophobicContact CG-CG 4.24Å; M1-Q6 HydrophobicContact SD-CG 3.8Å
2	S	91.6	Very high	93	Very high	67 Å²	67	105.9 Å²	105.9	47%	0.469	52%	0.519	S	S	.	.			trans	-64.6	150.4	177	177.1	0	0	0	0	109.9	L4 E5 Q6	S2-L4 PolarHBondContact O-N 3.31Å; S2-L4 PolarHBondContact OG-N 3.18Å; S2-E5 PolarHBondContact N-OE2 3.15Å; S2-E5 WeakPolarHBondContact O-CB 3.35Å; S2-E5 PolarHBondContact O-N 3.4Å; S2-Q6 PolarHBondContact O-N 3.34Å; S2-Q6 VanDerWaalsContact O-N 3.09Å
3	E	95.2	Very high	93.4	Very high	147 Å²	147	106.4 Å²	106.4	69%	0.687	52%	0.52	S	S	*	.	H	α-helix	trans	-51.8	-37.7	173	-176.1	179.4	176.6	0	0	111.3	E5 Q6 L7	E3-E5 PolarHBondContact O-N 3.16Å; E3-Q6 PolarHBondContact O-N 3.07Å; E3-L7 HydrophobicContact CG-CD1 4.43Å; E3-L7 WeakPolarHBondContact O-CG 3.39Å; E3-L7 PolarHBondContact O-N 3.28Å
4	L	95.1	Very high	93.7	Very high	95 Å²	95	104.6 Å²	104.6	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-38.9	175.5	-177.9	65.9	0	0	0	113.1	S2 R8	S2-L4 PolarHBondContact O-N 3.31Å; S2-L4 PolarHBondContact OG-N 3.18Å; L4-R8 WeakPolarHBondContact O-CB 3.31Å; L4-R8 VanDerWaalsContact O-CG 3.27Å; L4-R8 WeakPolarHBondContact O-CG 3.28Å; L4-R8 PolarHBondContact O-N 2.89Å
5	E	95	Very high	93.8	Very high	103 Å²	103	108.1 Å²	108.1	48%	0.481	52%	0.518	S	S	.	.	H	α-helix	trans	-70	-38.5	178.7	-72.1	171.6	161.8	0	0	110.8	M1 S2 E3 R8 Q9	M1-E5 VanDerWaalsContact CA-OE2 3.24Å; M1-E5 WeakPolarHBondContact CA-OE2 3.47Å; M1-E5 HydrophobicContact CG-CB 3.71Å; M1-E5 VanDerWaalsContact CG-OE2 3.31Å; M1-E5 WeakPolarHBondContact CG-OE2 3.39Å; M1-E5 HydrophobicContact SD-CB 4.46Å; S2-E5 PolarHBondContact N-OE2 3.15Å; S2-E5 WeakPolarHBondContact O-CB 3.35Å; S2-E5 PolarHBondContact O-N 3.4Å; E3-E5 PolarHBondContact O-N 3.16Å; E5-R8 PolarHBondContact O-N 3.31Å; E5-Q9 WeakPolarHBondContact O-CB 2.96Å; E5-Q9 PolarHBondContact O-N 3.4Å
6	Q	96.1	Very high	94	Very high	107 Å²	107	104.8 Å²	104.8	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-49.7	175.4	-68.4	176.6	-12.6	0	0	111	M1 S2 E3 R8 Q9 E10	M1-Q6 HydrophobicContact CB-CG 4.29Å; M1-Q6 HydrophobicContact CG-CG 4.24Å; M1-Q6 HydrophobicContact SD-CG 3.8Å; S2-Q6 PolarHBondContact O-N 3.34Å; S2-Q6 VanDerWaalsContact O-N 3.09Å; E3-Q6 PolarHBondContact O-N 3.07Å; Q6-R8 VanDerWaalsContact C-N 3.33Å; Q6-R8 PolarHBondContact O-N 3.4Å; Q6-Q9 PolarHBondContact O-N 3.49Å; Q6-E10 WeakPolarHBondContact O-CB 3.43Å; Q6-E10 PolarHBondContact O-N 3.32Å
7	L	96.9	Very high	94.3	Very high	96 Å²	96	104.7 Å²	104.7	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-37.6	177.9	-69.9	172.7	0	0	0	112.6	E3 A11	E3-L7 HydrophobicContact CG-CD1 4.43Å; E3-L7 WeakPolarHBondContact O-CG 3.39Å; E3-L7 PolarHBondContact O-N 3.28Å; L7-A11 WeakPolarHBondContact O-CB 3.45Å; L7-A11 PolarHBondContact O-N 2.97Å
8	R	95.5	Very high	94.4	Very high	170 Å²	170	103.4 Å²	103.4	64%	0.642	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-43.3	174.5	-78.4	176	178.4	-176	-0.2	111.9	L4 E5 Q6 A11 E12	L4-R8 WeakPolarHBondContact O-CB 3.31Å; L4-R8 VanDerWaalsContact O-CG 3.27Å; L4-R8 WeakPolarHBondContact O-CG 3.28Å; L4-R8 PolarHBondContact O-N 2.89Å; E5-R8 PolarHBondContact O-N 3.31Å; Q6-R8 VanDerWaalsContact C-N 3.33Å; Q6-R8 PolarHBondContact O-N 3.4Å; R8-A11 PolarHBondContact O-N 3.42Å; R8-E12 PolarHBondContact O-N 3.24Å; R8-E12 VanDerWaalsContact O-N 3.09Å
9	Q	96.2	Very high	94.5	Very high	116 Å²	116	105.6 Å²	105.6	54%	0.542	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-41.9	178.5	-172.2	174.9	5.7	0	0	111.3	E5 Q6 E12 Q13	E5-Q9 WeakPolarHBondContact O-CB 2.96Å; E5-Q9 PolarHBondContact O-N 3.4Å; Q6-Q9 PolarHBondContact O-N 3.49Å; Q9-E12 PolarHBondContact O-N 3.48Å; Q9-Q13 WeakPolarHBondContact O-CB 3.44Å; Q9-Q13 PolarHBondContact O-N 3.42Å
10	E	97.6	Very high	94.7	Very high	105 Å²	105	105.6 Å²	105.6	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-46.5	174.9	-175.6	178.2	-175.2	0	0	111.6	Q6 E12 Q13 L14	Q6-E10 WeakPolarHBondContact O-CB 3.43Å; Q6-E10 PolarHBondContact O-N 3.32Å; E10-E12 VanDerWaalsContact C-N 3.32Å; E10-E12 PolarHBondContact O-N 2.93Å; E10-Q13 WeakPolarHBondContact O-CB 3.33Å; E10-Q13 PolarHBondContact O-N 2.84Å; E10-L14 HydrophobicContact CG-CD1 4.25Å; E10-L14 WeakPolarHBondContact O-CG 3.27Å; E10-L14 PolarHBondContact O-N 2.98Å
11	A	95.6	Very high	94.8	Very high	40 Å²	40	103.3 Å²	103.3	33%	0.331	50%	0.503	S	S	.	.	H	α-helix	trans	-59.7	-41.8	177.2	0	0	0	0	0	112.3	L7 R8 L14 R15	L7-A11 WeakPolarHBondContact O-CB 3.45Å; L7-A11 PolarHBondContact O-N 2.97Å; R8-A11 PolarHBondContact O-N 3.42Å; A11-L14 PolarHBondContact O-N 3.15Å; A11-R15 WeakPolarHBondContact O-CG 3.49Å; A11-R15 PolarHBondContact O-N 2.77Å
12	E	96.4	Very high	96.4	Very high	77 Å²	77	98 Å²	98	36%	0.36	48%	0.475	S	S	.	.	H	α-helix	trans	-69.5	-36.7	177.5	-166.4	58	-156.2	0	0	112	R8 Q9 E10 R15 N16	R8-E12 PolarHBondContact O-N 3.24Å; R8-E12 VanDerWaalsContact O-N 3.09Å; Q9-E12 PolarHBondContact O-N 3.48Å; E10-E12 VanDerWaalsContact C-N 3.32Å; E10-E12 PolarHBondContact O-N 2.93Å; E12-R15 PolarHBondContact O-N 3.3Å; E12-R15 IonicContact OE2-NH1 3.97Å; E12-R15 PolarHBondContact OE2-NH1 3.06Å; E12-R15 VanDerWaalsContact OE2-NH1 3.13Å; E12-N16 PolarHBondContact O-N 2.9Å; E12-N16 PolarHBondContact O-ND2 3.22Å; E12-N16 VanDerWaalsContact O-ND2 3.09Å
13	Q	97.9	Very high	96.6	Very high	112 Å²	112	102.5 Å²	102.5	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-62.4	-45.8	173.6	-174	176.4	2.6	0	0	111.6	Q9 E10 R15 N16 Q17	Q9-Q13 WeakPolarHBondContact O-CB 3.44Å; Q9-Q13 PolarHBondContact O-N 3.42Å; E10-Q13 WeakPolarHBondContact O-CB 3.33Å; E10-Q13 PolarHBondContact O-N 2.84Å; Q13-R15 VanDerWaalsContact C-N 3.35Å; Q13-R15 PolarHBondContact O-N 2.7Å; Q13-N16 PolarHBondContact O-N 2.62Å; Q13-Q17 WeakPolarHBondContact O-CG 3.45Å; Q13-Q17 PolarHBondContact O-N 3.19Å
14	L	97.9	Very high	96.6	Very high	82 Å²	82	99.5 Å²	99.5	43%	0.429	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-40.8	176.3	-71.2	170.8	0	0	0	111.8	E10 A11 N16 Q17 I18	E10-L14 HydrophobicContact CG-CD1 4.25Å; E10-L14 WeakPolarHBondContact O-CG 3.27Å; E10-L14 PolarHBondContact O-N 2.98Å; A11-L14 PolarHBondContact O-N 3.15Å; L14-N16 VanDerWaalsContact C-N 3.34Å; L14-N16 PolarHBondContact O-N 2.98Å; L14-Q17 PolarHBondContact O-N 3.45Å; L14-I18 WeakPolarHBondContact O-CG1 3.48Å; L14-I18 PolarHBondContact O-N 2.96Å
15	R	95.7	Very high	96.7	Very high	156 Å²	156	99.1 Å²	99.1	59%	0.589	49%	0.49	S	S	*	.	H	α-helix	trans	-60.7	-41.8	174	-75.4	171.8	-178.4	162.4	-1.8	112.5	A11 E12 Q13 I18 R19	A11-R15 WeakPolarHBondContact O-CG 3.49Å; A11-R15 PolarHBondContact O-N 2.77Å; E12-R15 PolarHBondContact O-N 3.3Å; E12-R15 IonicContact OE2-NH1 3.97Å; E12-R15 PolarHBondContact OE2-NH1 3.06Å; E12-R15 VanDerWaalsContact OE2-NH1 3.13Å; Q13-R15 VanDerWaalsContact C-N 3.35Å; Q13-R15 PolarHBondContact O-N 2.7Å; R15-I18 PolarHBondContact O-N 3.47Å; R15-R19 WeakPolarHBondContact O-CB 3.46Å; R15-R19 PolarHBondContact O-N 2.88Å
16	N	96.9	Very high	96.6	Very high	56 Å²	56	97.5 Å²	97.5	30%	0.299	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-42	176.8	-71.1	-36.9	0	0	0	111.4	E12 Q13 L14 I18 R19 D20	E12-N16 PolarHBondContact O-N 2.9Å; E12-N16 PolarHBondContact O-ND2 3.22Å; E12-N16 VanDerWaalsContact O-ND2 3.09Å; Q13-N16 PolarHBondContact O-N 2.62Å; L14-N16 VanDerWaalsContact C-N 3.34Å; L14-N16 PolarHBondContact O-N 2.98Å; N16-I18 VanDerWaalsContact C-N 3.33Å; N16-I18 PolarHBondContact O-N 3.31Å; N16-R19 WeakPolarHBondContact O-CB 3.37Å; N16-R19 PolarHBondContact O-N 3.14Å; N16-R19 PolarHBondContact OD1-NH1 3.42Å; N16-D20 VanDerWaalsContact O-CG 3.31Å; N16-D20 PolarHBondContact O-N 3.19Å
17	Q	98.1	Very high	96.5	Very high	103 Å²	103	99.4 Å²	99.4	48%	0.481	50%	0.504	S	S	.	.	H	α-helix	trans	-58.8	-43.7	174	-71	174.2	6.5	0	0	112.2	Q13 L14 D20 A21	Q13-Q17 WeakPolarHBondContact O-CG 3.45Å; Q13-Q17 PolarHBondContact O-N 3.19Å; L14-Q17 PolarHBondContact O-N 3.45Å; Q17-D20 PolarHBondContact O-N 3.41Å; Q17-A21 WeakPolarHBondContact O-CB 3.32Å; Q17-A21 PolarHBondContact O-N 3.45Å
18	I	97.4	Very high	96.4	Very high	82 Å²	82	97 Å²	97	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-44.4	176	-68.2	165	0	0	0	110.6	L14 R15 N16 D20 A21 R22	L14-I18 WeakPolarHBondContact O-CG1 3.48Å; L14-I18 PolarHBondContact O-N 2.96Å; R15-I18 PolarHBondContact O-N 3.47Å; N16-I18 VanDerWaalsContact C-N 3.33Å; N16-I18 PolarHBondContact O-N 3.31Å; I18-D20 VanDerWaalsContact C-N 3.34Å; I18-D20 PolarHBondContact O-N 3.09Å; I18-A21 PolarHBondContact O-N 3.23Å; I18-R22 HydrophobicContact CG2-CG 4.44Å; I18-R22 WeakPolarHBondContact O-CG 3.48Å; I18-R22 PolarHBondContact O-N 3.17Å
19	R	96.1	Very high	96.4	Very high	145 Å²	145	91.7 Å²	91.7	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-60.1	-44.8	177.8	-173.7	-173.8	-64.6	139.5	3.3	111.4	R15 N16 R22 K23	R15-R19 WeakPolarHBondContact O-CB 3.46Å; R15-R19 PolarHBondContact O-N 2.88Å; N16-R19 WeakPolarHBondContact O-CB 3.37Å; N16-R19 PolarHBondContact O-N 3.14Å; N16-R19 PolarHBondContact OD1-NH1 3.42Å; R19-R22 PolarHBondContact O-N 3.46Å; R19-K23 WeakPolarHBondContact O-CB 3.4Å; R19-K23 PolarHBondContact O-N 3.29Å
20	D	97.6	Very high	96.3	Very high	105 Å²	105	87.5 Å²	87.5	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-67.1	-39.7	179.2	-68.7	-22	0	0	0	111.4	N16 Q17 I18 K23 A24	N16-D20 VanDerWaalsContact O-CG 3.31Å; N16-D20 PolarHBondContact O-N 3.19Å; Q17-D20 PolarHBondContact O-N 3.41Å; I18-D20 VanDerWaalsContact C-N 3.34Å; I18-D20 PolarHBondContact O-N 3.09Å; D20-K23 PolarHBondContact O-N 2.99Å; D20-A24 WeakPolarHBondContact O-CB 3.43Å; D20-A24 PolarHBondContact O-N 2.95Å
21	A	98	Very high	96.1	Very high	57 Å²	57	85.2 Å²	85.2	47%	0.471	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-45.1	174.9	0	0	0	0	0	112.4	Q17 I18 A24 C25	Q17-A21 WeakPolarHBondContact O-CB 3.32Å; Q17-A21 PolarHBondContact O-N 3.45Å; I18-A21 PolarHBondContact O-N 3.23Å; A21-A24 PolarHBondContact O-N 3.46Å; A21-C25 PolarHBondContact O-N 3.48Å; A21-C25 PolarHBondContact O-SG 3.38Å
22	R	97.1	Very high	96	Very high	38 Å²	38	89.2 Å²	89.2	14%	0.143	47%	0.47	C	S	.	.	H	α-helix	trans	-60.9	-46	174.9	-73.5	173.8	-180	176.6	-5.6	111.4	I18 R19 A24 C25 S26 S221 T223 D258 Q259	I18-R22 HydrophobicContact CG2-CG 4.44Å; I18-R22 WeakPolarHBondContact O-CG 3.48Å; I18-R22 PolarHBondContact O-N 3.17Å; R19-R22 PolarHBondContact O-N 3.46Å; R22-A24 VanDerWaalsContact C-N 3.31Å; R22-A24 PolarHBondContact O-N 2.9Å; R22-C25 CarbonylContact O-C 3.51Å; R22-C25 PolarHBondContact O-N 3.19Å; R22-S26 PolarHBondContact O-N 3.3Å; R22-S26 VanDerWaalsContact O-N 3.15Å; R22-S221 PolarHBondContact NH2-O 3.49Å; R22-T223 PolarHBondContact NH1-OG1 2.96Å; R22-D258 WeakPolarHBondContact CD-O 3.41Å; R22-D258 VanDerWaalsContact CZ-O 3.27Å; R22-D258 IonicContact CZ-OD2 3.21Å; R22-D258 PolarHBondContact NE-O 3.46Å; R22-D258 IonicContact NE-OD2 3.13Å; R22-D258 PolarHBondContact NE-OD2 3.4Å; R22-D258 PolarHBondContact NH2-O 3.02Å; R22-D258 IonicContact NH2-OD1 2.85Å; R22-D258 PolarHBondContact NH2-OD1 2.8Å; R22-D258 IonicContact NH2-OD2 3.6Å; R22-D258 PolarHBondContact NH2-OD2 2.91Å; R22-Q259 PolarHBondContact O-NE2 2.91Å; R22-Q259 PolarHBondContact O-OE1 2.93Å
23	K	95.6	Very high	96	Very high	160 Å²	160	91.2 Å²	91.2	70%	0.696	48%	0.483	S	S	*	.	H	α-helix	trans	-61.7	-38.3	177.6	-171.6	176.7	-178.7	-179.4	0	112.2	R19 D20 C25 S26	R19-K23 WeakPolarHBondContact O-CB 3.4Å; R19-K23 PolarHBondContact O-N 3.29Å; D20-K23 PolarHBondContact O-N 2.99Å; K23-C25 PolarHBondContact O-N 2.92Å; K23-S26 PolarHBondContact O-N 2.95Å; K23-S26 VanDerWaalsContact O-N 3.16Å
24	A	97	Very high	95.9	Very high	84 Å²	84	86.2 Å²	86.2	69%	0.694	46%	0.46	S	S	*	.	H	α-helix	trans	-63.3	-28.2	175.8	0	0	0	0	0	112.9	D20 A21 R22	D20-A24 WeakPolarHBondContact O-CB 3.43Å; D20-A24 PolarHBondContact O-N 2.95Å; A21-A24 PolarHBondContact O-N 3.46Å; R22-A24 VanDerWaalsContact C-N 3.31Å; R22-A24 PolarHBondContact O-N 2.9Å
25	C	96.2	Very high	95.7	Very high	88 Å²	88	85.6 Å²	85.6	60%	0.595	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-1.3	176.2	-62.8	0	0	0	0	114	A21 R22 K23 D27	A21-C25 PolarHBondContact O-N 3.48Å; A21-C25 PolarHBondContact O-SG 3.38Å; R22-C25 CarbonylContact O-C 3.51Å; R22-C25 PolarHBondContact O-N 3.19Å; K23-C25 PolarHBondContact O-N 2.92Å; C25-D27 VanDerWaalsContact C-N 3.35Å; C25-D27 PolarHBondContact O-N 2.77Å
26	S	92.7	Very high	95.6	Very high	69 Å²	69	82 Å²	82	48%	0.483	48%	0.477	S	S	.	.			trans	-89.3	71	-179.7	-167.9	0	0	0	0	110.4	R22 K23	R22-S26 PolarHBondContact O-N 3.3Å; R22-S26 VanDerWaalsContact O-N 3.15Å; K23-S26 PolarHBondContact O-N 2.95Å; K23-S26 VanDerWaalsContact O-N 3.16Å
27	D	94.8	Very high	95.5	Very high	146 Å²	146	83.3 Å²	83.3	78%	0.781	48%	0.484	S	S	*	.			trans	-81.3	-28.5	-175	65.4	-15	0	0	0	113.8	C25	C25-D27 VanDerWaalsContact C-N 3.35Å; C25-D27 PolarHBondContact O-N 2.77Å
28	S	94.6	Very high	95.3	Very high	47 Å²	47	85.2 Å²	85.2	33%	0.329	50%	0.497	S	S	.	.			trans	-154	168.5	-175	61.2	0	0	0	0	111.4
29	T	94.5	Very high	95.1	Very high	58 Å²	58	84.9 Å²	84.9	36%	0.356	50%	0.503	S	S	.	.			trans	-110.2	153.5	173.6	68	0	0	0	0	111.4	S31 Q32 I33	T29-S31 PolarHBondContact O-N 3.49Å; T29-S31 PolarHBondContact OG1-OG 3.02Å; T29-Q32 PolarHBondContact O-N 3.25Å; T29-Q32 VanDerWaalsContact OG1-CG 3.28Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.34Å; T29-Q32 PolarHBondContact OG1-N 2.79Å; T29-I33 WeakPolarHBondContact O-CG1 3.37Å; T29-I33 PolarHBondContact O-N 3.45Å; T29-I33 VanDerWaalsContact O-N 3.14Å
30	L	95.1	Very high	95	Very high	27 Å²	27	80.1 Å²	80.1	14%	0.141	49%	0.489	C	S	.	.	H	α-helix	trans	-57.2	-37	175.9	179.6	62.7	0	0	0	111.7	Q32 I33 T34 L252 L261 M262 T299 L300	L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.47Å; L30-I33 PolarHBondContact O-N 3.47Å; L30-T34 HydrophobicContact CD1-CG2 3.74Å; L30-T34 HydrophobicContact CG-CG2 4.21Å; L30-T34 WeakPolarHBondContact O-CB 3.39Å; L30-T34 VanDerWaalsContact O-CG2 3.27Å; L30-T34 WeakPolarHBondContact O-CG2 3.24Å; L30-T34 PolarHBondContact O-N 3.21Å; L30-T34 PolarHBondContact O-OG1 3.13Å; L30-L252 HydrophobicContact CD2-CD2 3.9Å; L30-L261 HydrophobicContact CB-CB 4.44Å; L30-L261 HydrophobicContact CD2-CB 4.48Å; L30-M262 HydrophobicContact CB-CE 3.86Å; L30-M262 HydrophobicContact CD2-CB 4.14Å; L30-M262 HydrophobicContact CD2-CE 4.14Å; L30-M262 HydrophobicContact CD2-SD 4.11Å; L30-M262 HydrophobicContact CG-CE 3.97Å; L30-T299 WeakPolarHBondContact CD2-O 3.5Å; L30-L300 HydrophobicContact CD1-CD2 4.41Å
31	S	92.6	Very high	94.9	Very high	57 Å²	57	76.9 Å²	76.9	40%	0.399	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-35.1	176.6	51.9	0	0	0	0	113.9	T29 T34 A35	T29-S31 PolarHBondContact O-N 3.49Å; T29-S31 PolarHBondContact OG1-OG 3.02Å; S31-T34 PolarHBondContact O-OG1 3.44Å; S31-A35 PolarHBondContact O-N 2.76Å
32	Q	94.4	Very high	94.8	Very high	124 Å²	124	84 Å²	84	58%	0.579	50%	0.495	S	S	*	.	H	α-helix	trans	-71.3	-44.1	175.7	-72.8	168.5	-10.6	0	0	110.8	T29 L30 T34 A35	T29-Q32 PolarHBondContact O-N 3.25Å; T29-Q32 VanDerWaalsContact OG1-CG 3.28Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.34Å; T29-Q32 PolarHBondContact OG1-N 2.79Å; L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.47Å; Q32-T34 VanDerWaalsContact C-N 3.29Å; Q32-T34 PolarHBondContact O-N 2.79Å; Q32-A35 VanDerWaalsContact O-CB 3.31Å; Q32-A35 WeakPolarHBondContact O-CB 3.49Å; Q32-A35 PolarHBondContact O-N 3.19Å
33	I	96.3	Very high	94.7	Very high	120 Å²	120	84.2 Å²	84.2	62%	0.615	50%	0.499	S	S	*	.	H	α-helix	trans	-63.1	-38.3	179.8	-63.2	169.1	0	0	0	110.9	T29 L30	T29-I33 WeakPolarHBondContact O-CG1 3.37Å; T29-I33 PolarHBondContact O-N 3.45Å; T29-I33 VanDerWaalsContact O-N 3.14Å; L30-I33 PolarHBondContact O-N 3.47Å
34	T	95.8	Very high	94.8	Very high	7 Å²	7	82.6 Å²	82.6	4%	0.043	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	5.8	-176.6	63.7	0	0	0	0	113.2	L30 S31 Q32 G36 L37 L300 K301	L30-T34 HydrophobicContact CD1-CG2 3.74Å; L30-T34 HydrophobicContact CG-CG2 4.21Å; L30-T34 WeakPolarHBondContact O-CB 3.39Å; L30-T34 VanDerWaalsContact O-CG2 3.27Å; L30-T34 WeakPolarHBondContact O-CG2 3.24Å; L30-T34 PolarHBondContact O-N 3.21Å; L30-T34 PolarHBondContact O-OG1 3.13Å; S31-T34 PolarHBondContact O-OG1 3.44Å; Q32-T34 VanDerWaalsContact C-N 3.29Å; Q32-T34 PolarHBondContact O-N 2.79Å; T34-G36 PolarHBondContact O-N 2.94Å; T34-G36 VanDerWaalsContact O-N 3.15Å; T34-L37 HydrophobicContact CG2-CD1 4.03Å; T34-L37 WeakPolarHBondContact O-CB 3.37Å; T34-L37 PolarHBondContact O-N 2.74Å; T34-L300 WeakPolarHBondContact CB-O 3.31Å; T34-L300 HydrophobicContact CG2-CB 3.83Å; T34-L300 HydrophobicContact CG2-CD2 4.02Å; T34-L300 HydrophobicContact CG2-CG 4.37Å; T34-L300 PolarHBondContact OG1-O 3.38Å; T34-K301 PolarHBondContact O-NZ 2.9Å
35	A	92.9	Very high	94.8	Very high	69 Å²	69	80.9 Å²	80.9	57%	0.57	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-38.8	-174.4	0	0	0	0	0	112.7	S31 Q32 L37 K301	S31-A35 PolarHBondContact O-N 2.76Å; Q32-A35 VanDerWaalsContact O-CB 3.31Å; Q32-A35 WeakPolarHBondContact O-CB 3.49Å; Q32-A35 PolarHBondContact O-N 3.19Å; A35-L37 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 2.81Å; A35-K301 PolarHBondContact O-NZ 2.99Å
36	G	94.2	Very high	94.9	Very high	79 Å²	79	84.6 Å²	84.6	81%	0.814	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.4	179.3	0	0	0	0	0	116.3	T34	T34-G36 PolarHBondContact O-N 2.94Å; T34-G36 VanDerWaalsContact O-N 3.15Å
37	L	94.6	Very high	95.1	Very high	84 Å²	84	83.5 Å²	83.5	44%	0.44	46%	0.464	S	S	.	.	S	Bend	trans	-80	148.8	178.4	-64.6	178	0	0	0	111.9	T34 A35 L300 K301	T34-L37 HydrophobicContact CG2-CD1 4.03Å; T34-L37 WeakPolarHBondContact O-CB 3.37Å; T34-L37 PolarHBondContact O-N 2.74Å; A35-L37 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 2.81Å; L37-L300 HydrophobicContact CD1-CD1 3.67Å; L37-K301 WeakPolarHBondContact O-CE 3.32Å; L37-K301 PolarHBondContact O-NZ 3.26Å
38	D	94.1	Very high	95.3	Very high	143 Å²	143	82.3 Å²	82.3	77%	0.765	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-70.6	146.1	172	-64.8	-41.7	0	0	0	111.5	R283	D38-R283 PolarHBondContact O-NH2 2.9Å
39	S	92.4	Very high	95.4	Very high	76 Å²	76	85.3 Å²	85.3	53%	0.531	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-66.9	146.8	171.1	179.4	0	0	0	0	110.5	G41	S39-G41 PolarHBondContact O-N 3.46Å; S39-G41 VanDerWaalsContact O-N 3.12Å; S39-G41 PolarHBondContact OG-N 3.31Å
40	V	94.4	Very high	95.6	Very high	44 Å²	44	83.9 Å²	83.9	27%	0.267	44%	0.444	S	S	.	.			trans	-63.2	-12	171.6	-68.5	0	0	0	0	113.7	R283 L284 D298 A305	V40-R283 HydrophobicContact CG1-CG 3.57Å; V40-L284 HydrophobicContact CG1-CD2 4.33Å; V40-L284 HydrophobicContact CG2-CD2 4.22Å; V40-D298 HydrophobicContact CG2-CB 4.06Å; V40-A305 HydrophobicContact CG2-CB 3.53Å
41	G	94.7	Very high	95.8	Very high	37 Å²	37	82.7 Å²	82.7	38%	0.381	44%	0.438	S	S	.	.			trans	72.9	-175	-173.5	0	0	0	0	0	112.4	S39 I43	S39-G41 PolarHBondContact O-N 3.46Å; S39-G41 VanDerWaalsContact O-N 3.12Å; S39-G41 PolarHBondContact OG-N 3.31Å; G41-I43 PolarHBondContact O-N 2.82Å
42	R	96.1	Very high	96	Very high	207 Å²	207	87.2 Å²	87.2	78%	0.781	45%	0.446	S	S	*	.			trans	-76.9	113.9	-176.9	-172.6	176.1	176.8	-177.4	3.4	110.8	Q44 A305	R42-Q44 HydrophobicContact CG-CG 4.15Å; R42-A305 CarbonylContact C-O 3.49Å; R42-A305 WeakPolarHBondContact CA-O 3.36Å
43	I	96.7	Very high	96.1	Very high	43 Å²	43	82.5 Å²	82.5	22%	0.221	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-81.9	118.9	175.1	-58.1	-61.5	0	0	0	109.4	G41 M45 L284 A305	G41-I43 PolarHBondContact O-N 2.82Å; I43-M45 HydrophobicContact CG2-CG 3.94Å; I43-L284 HydrophobicContact CG1-CD1 4.49Å; I43-L284 HydrophobicContact CG1-CD2 4.39Å; I43-A305 HydrophobicContact CG1-CB 3.97Å; I43-A305 PolarHBondContact N-O 3.01Å
44	Q	96.3	Very high	96.2	Very high	126 Å²	126	77.2 Å²	77.2	59%	0.589	40%	0.404	S	S	*	.			trans	-121	79	177.8	-65.6	-174.1	-0.6	0	0	110.3	R42	R42-Q44 HydrophobicContact CG-CG 4.15Å
45	M	97.3	Very high	96.2	Very high	48 Å²	48	83.6 Å²	83.6	24%	0.236	44%	0.437	C	S	.	.			trans	-74.2	150.2	172.3	-62	176.5	144.2	0	0	110.5	I43 L308 V327 W339	I43-M45 HydrophobicContact CG2-CG 3.94Å; M45-L308 HydrophobicContact CB-CD2 3.62Å; M45-L308 HydrophobicContact CG-CD2 4.14Å; M45-L308 HydrophobicContact SD-CD1 4.26Å; M45-L308 HydrophobicContact SD-CD2 3.95Å; M45-V327 HydrophobicContact CE-CG1 4.27Å; M45-V327 HydrophobicContact SD-CG1 3.84Å; M45-W339 HydrophobicContact CB-CB 4.09Å; M45-W339 HydrophobicContact SD-CB 4.37Å
46	R	97.7	Very high	96.5	Very high	165 Å²	165	81.8 Å²	81.8	62%	0.623	42%	0.422	S	S	*	.			trans	-118.5	145	176.4	-64	-175.9	-179	-173.7	0.6	110.2	R48 W339 N340	R46-R48 PolarHBondContact O-N 3.09Å; R46-R48 VanDerWaalsContact O-N 3.15Å; R46-W339 WeakPolarHBondContact O-CA 3.21Å; R46-N340 PolarHBondContact N-O 3.36Å; R46-N340 VanDerWaalsContact N-O 3.12Å; R46-N340 PolarHBondContact O-N 2.75Å
47	T	98.2	Very high	96.7	Very high	46 Å²	46	81.7 Å²	81.7	28%	0.282	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	118.5	169.5	-51.3	0	0	0	0	109	R49 R337 I338 W339	T47-R49 VanDerWaalsContact CG2-O 3.25Å; T47-R49 WeakPolarHBondContact CG2-O 3.18Å; T47-R337 HydrophobicContact CG2-CB 4.03Å; T47-R337 HydrophobicContact CG2-CG 4.08Å; T47-I338 CarbonylContact C-O 3.58Å; T47-I338 WeakPolarHBondContact CA-O 3.5Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.42Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.2Å
48	R	98.1	Very high	96.8	Very high	122 Å²	122	77.7 Å²	77.7	46%	0.46	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-30.3	174.9	-59.7	-51.4	177	169.2	-0.9	112.8	R46 I338 N340	R46-R48 PolarHBondContact O-N 3.09Å; R46-R48 VanDerWaalsContact O-N 3.15Å; R48-I338 PolarHBondContact N-O 3.08Å; R48-N340 WeakPolarHBondContact CD-OD1 3.32Å; R48-N340 WeakPolarHBondContact CG-OD1 3.42Å; R48-N340 PolarHBondContact NE-O 3.47Å; R48-N340 PolarHBondContact NE-OD1 3.11Å; R48-N340 PolarHBondContact NH2-O 2.94Å
49	R	98.1	Very high	97.1	Very high	109 Å²	109	73.5 Å²	73.5	41%	0.411	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.2	-179.8	-57.5	-68	-174.6	-88.9	-0.5	110.1	T47 Y85 T87 R337 I338	T47-R49 VanDerWaalsContact CG2-O 3.25Å; T47-R49 WeakPolarHBondContact CG2-O 3.18Å; R49-Y85 PolarHBondContact NE-O 3.2Å; R49-Y85 VanDerWaalsContact NE-O 3.17Å; R49-T87 HydrophobicContact CB-CG2 4.09Å; R49-T87 HydrophobicContact CG-CG2 4.18Å; R49-R337 WeakPolarHBondContact O-CA 3.08Å; R49-I338 HydrophobicContact CB-CB 4.12Å; R49-I338 HydrophobicContact CB-CD1 3.88Å; R49-I338 HydrophobicContact CB-CG1 4.4Å; R49-I338 HydrophobicContact CG-CD1 4.32Å; R49-I338 PolarHBondContact N-O 3.32Å; R49-I338 PolarHBondContact O-N 2.87Å
50	T	98.3	Very high	97.3	Very high	29 Å²	29	70.5 Å²	70.5	18%	0.178	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	112.2	170.8	-53.9	0	0	0	0	107.5	R52 F335 L336	T50-R52 HydrophobicContact CG2-CG 4.19Å; T50-F335 HydrophobicContact CG2-CB 4.33Å; T50-F335 HydrophobicContact CG2-CD1 4.16Å; T50-F335 HydrophobicContact CG2-CG 4.39Å; T50-L336 CarbonylContact C-O 3.59Å; T50-L336 WeakPolarHBondContact CA-O 3.26Å
51	L	98.2	Very high	97.5	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.7	179.7	-50.6	-179.2	0	0	0	108.4	L70 W82 T87 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.24Å; L51-L70 HydrophobicContact CD1-CD2 4.01Å; L51-W82 HydrophobicContact CB-CD2 4.12Å; L51-W82 HydrophobicContact CB-CE3 3.86Å; L51-W82 HydrophobicContact CB-CH2 4.27Å; L51-W82 HydrophobicContact CB-CZ3 3.93Å; L51-W82 HydrophobicContact CD1-CB 3.92Å; L51-W82 HydrophobicContact CD1-CD2 4.01Å; L51-W82 HydrophobicContact CD1-CE3 4.35Å; L51-W82 HydrophobicContact CD1-CG 3.83Å; L51-W82 HydrophobicContact CD2-CE3 4.34Å; L51-W82 HydrophobicContact CG-CE3 4.41Å; L51-T87 HydrophobicContact CD2-CG2 3.83Å; L51-L336 HydrophobicContact CB-CB 4.08Å; L51-L336 HydrophobicContact CB-CD1 4.48Å; L51-L336 HydrophobicContact CD1-CB 4.08Å; L51-L336 HydrophobicContact CG-CB 4.3Å; L51-L336 PolarHBondContact N-O 3.09Å; L51-L336 PolarHBondContact O-N 2.85Å; L51-I338 HydrophobicContact CD1-CD1 4.16Å; L51-I338 HydrophobicContact CD2-CD1 4.26Å; L51-I338 HydrophobicContact CG-CD1 4.3Å
52	R	97.7	Very high	97.7	Very high	152 Å²	152	69.4 Å²	69.4	57%	0.574	31%	0.314	S	S	*	.			trans	-115.7	130.5	-176.8	-58.1	-171.2	172.5	80.4	-1.4	110.2	T50 W82 K89 F335	T50-R52 HydrophobicContact CG2-CG 4.19Å; R52-W82 WeakPolarHBondContact O-CH2 3.45Å; R52-W82 WeakPolarHBondContact O-CZ3 3.29Å; R52-K89 VanDerWaalsContact O-CE 3.29Å; R52-K89 WeakPolarHBondContact O-CE 3.49Å; R52-K89 PolarHBondContact O-NZ 2.94Å; R52-F335 HydrophobicContact CB-CE1 4.36Å; R52-F335 HydrophobicContact CG-CD1 3.84Å; R52-F335 HydrophobicContact CG-CE1 3.74Å
53	G	95.9	Very high	97.9	Very high	26 Å²	26	60.3 Å²	60.3	27%	0.268	28%	0.279	S	S	.	.			trans	163.5	-17.1	174.9	0	0	0	0	0	116.6
54	H	98.1	Very high	97.9	Very high	8 Å²	8	58.6 Å²	58.6	4%	0.037	27%	0.272	C	S	.	.			trans	-74.2	151.7	166.5	-74.2	-61.5	0	0	0	110.5	I58 S72 S74 D76 I80	H54-I58 HydrophobicContact CB-CG1 4.25Å; H54-S72 PolarHBondContact NE2-OG 3.4Å; H54-S74 WeakPolarHBondContact CE1-CB 3.48Å; H54-S74 WeakPolarHBondContact ND1-CB 3.25Å; H54-D76 VanDerWaalsContact CA-OD2 3.26Å; H54-D76 WeakPolarHBondContact CA-OD2 3.44Å; H54-D76 WeakPolarHBondContact CB-OD2 3.45Å; H54-D76 IonicContact CG-OD2 3.68Å; H54-D76 IonicContact ND1-OD1 3.54Å; H54-D76 IonicContact ND1-OD2 3.09Å; H54-D76 PolarHBondContact ND1-OD2 2.77Å; H54-D76 VanDerWaalsContact ND1-OD2 3.09Å; H54-I80 VanDerWaalsContact CE1-CD1 3.47Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.44Å
55	L	96.9	Very high	97.7	Very high	142 Å²	142	55.6 Å²	55.6	74%	0.743	27%	0.265	S	S	*	.	S	Bend	trans	-112.1	-3.5	-180	-58.5	178.8	0	0	0	112.3	D76	L55-D76 HydrophobicContact CB-CB 4.27Å; L55-D76 PolarHBondContact N-OD2 3.25Å
56	A	97.8	Very high	97.5	Very high	31 Å²	31	59.9 Å²	59.9	26%	0.256	29%	0.285	S	S	.	.	S	Bend	trans	-143.2	-174.4	-179.3	0	0	0	0	0	110.2	I58 S74 Q75 D76 S334	A56-I58 PolarHBondContact O-N 3.09Å; A56-S74 PolarHBondContact O-OG 3.4Å; A56-Q75 HydrophobicContact CB-CB 4.28Å; A56-D76 HydrophobicContact CB-CB 3.86Å; A56-S334 WeakPolarHBondContact O-CA 3.42Å; A56-S334 WeakPolarHBondContact O-CB 3.38Å
57	K	98.3	Very high	97.4	Very high	76 Å²	76	52.2 Å²	52.2	33%	0.33	26%	0.257	S	S	.	.			trans	-60.3	128	-178.2	-60	175.3	177.7	-175.3	0	110.9	Y59 S74 Q75 W332	K57-Y59 HydrophobicContact CB-CD2 4.33Å; K57-Y59 HydrophobicContact CB-CE2 4.03Å; K57-Y59 HydrophobicContact CD-CE2 4.48Å; K57-S74 VanDerWaalsContact O-CA 3.31Å; K57-S74 WeakPolarHBondContact O-CA 3.5Å; K57-S74 PolarHBondContact O-OG 3.04Å; K57-Q75 PolarHBondContact O-N 3.03Å; K57-W332 HydrophobicContact CB-CB 4.21Å; K57-W332 HydrophobicContact CB-CG 3.93Å; K57-W332 HydrophobicContact CD-CB 4.3Å; K57-W332 HydrophobicContact CD-CD2 3.69Å; K57-W332 HydrophobicContact CD-CE3 3.95Å; K57-W332 HydrophobicContact CD-CG 3.87Å; K57-W332 HydrophobicContact CG-CB 3.89Å; K57-W332 HydrophobicContact CG-CD2 4.23Å; K57-W332 HydrophobicContact CG-CG 3.86Å
58	I	98.7	Very high	97.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.4	167.8	-63.7	156.6	0	0	0	107.7	H54 A56 A73 S316 S331 W332 S334 F335 L336	H54-I58 HydrophobicContact CB-CG1 4.25Å; A56-I58 PolarHBondContact O-N 3.09Å; I58-A73 WeakPolarHBondContact CA-O 3.49Å; I58-S316 WeakPolarHBondContact O-CB 3.41Å; I58-S316 PolarHBondContact O-OG 2.88Å; I58-S331 WeakPolarHBondContact CB-O 3.47Å; I58-S331 PolarHBondContact N-O 2.73Å; I58-W332 VanDerWaalsContact O-CD1 3.29Å; I58-S334 VanDerWaalsContact CD1-C 3.41Å; I58-S334 WeakPolarHBondContact CD1-O 3.22Å; I58-F335 VanDerWaalsContact CD1-C 3.49Å; I58-F335 WeakPolarHBondContact CD1-O 3.11Å; I58-L336 HydrophobicContact CD1-CD1 3.41Å; I58-L336 VanDerWaalsContact CD1-CD1 3.41Å; I58-L336 HydrophobicContact CD1-CG 3.87Å; I58-L336 HydrophobicContact CG1-CD1 4.39Å
59	Y	98.4	Very high	97.3	Very high	56 Å²	56	50.8 Å²	50.8	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-47.1	176.8	-94.8	-108.6	0	0	0	111.3	K57 A73 Q75 C317 W332	K57-Y59 HydrophobicContact CB-CD2 4.33Å; K57-Y59 HydrophobicContact CB-CE2 4.03Å; K57-Y59 HydrophobicContact CD-CE2 4.48Å; Y59-A73 PolarHBondContact N-O 2.91Å; Y59-Q75 HydrophobicContact CD2-CG 3.77Å; Y59-Q75 HydrophobicContact CE2-CG 3.66Å; Y59-Q75 PolarHBondContact OH-NE2 3.38Å; Y59-C317 WeakPolarHBondContact O-CB 3.42Å; Y59-W332 HydrophobicContact CE2-CZ2 4.45Å; Y59-W332 AromaticContact CE2-NE1 3.72Å; Y59-W332 AromaticContact CZ-CZ2 3.98Å; Y59-W332 AromaticContact CZ-NE1 3.98Å
60	A	98.5	Very high	97.3	Very high	12 Å²	12	45.6 Å²	45.6	10%	0.099	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	153.6	-176.6	0	0	0	0	0	111.9	S72 A73 M101 C103 C317	A60-S72 WeakPolarHBondContact O-CA 3.37Å; A60-A73 HydrophobicContact CB-CB 4.48Å; A60-A73 PolarHBondContact O-N 3.32Å; A60-M101 WeakPolarHBondContact CB-O 3.15Å; A60-C103 VanDerWaalsContact C-SG 3.58Å; A60-C317 VanDerWaalsContact C-SG 3.59Å
61	M	98.6	Very high	97.3	Very high	10 Å²	10	44.2 Å²	44.2	5%	0.049	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.4	167.1	72.3	79.3	53.9	0	0	109.1	W63 L70 V71 C317 A328 L336	M61-W63 HydrophobicContact CE-CD2 4.34Å; M61-W63 HydrophobicContact CE-CG 4.3Å; M61-L70 HydrophobicContact CE-CB 4.06Å; M61-L70 HydrophobicContact CE-CD1 3.78Å; M61-L70 HydrophobicContact CE-CD2 4.43Å; M61-L70 HydrophobicContact CE-CG 4.3Å; M61-V71 CarbonylContact C-O 3.5Å; M61-V71 WeakPolarHBondContact CA-O 3.4Å; M61-V71 WeakPolarHBondContact CB-O 3.22Å; M61-C317 HydrophobicContact CG-CB 4.19Å; M61-C317 VanDerWaalsContact CG-SG 3.57Å; M61-A328 HydrophobicContact CE-CB 3.48Å; M61-A328 VanDerWaalsContact CE-CB 3.48Å; M61-A328 HydrophobicContact SD-CB 4.26Å; M61-L336 HydrophobicContact CB-CD2 3.88Å; M61-L336 HydrophobicContact CG-CD2 4.31Å
62	H	98.8	Very high	97.3	Very high	48 Å²	48	44.1 Å²	44.1	22%	0.222	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	131	174.6	-167.5	-120.9	0	0	0	110.3	L70 V71 Y105	H62-L70 WeakPolarHBondContact O-CA 3.49Å; H62-L70 WeakPolarHBondContact O-CB 3.25Å; H62-V71 HydrophobicContact CB-CG1 3.97Å; H62-V71 PolarHBondContact N-O 2.93Å; H62-V71 PolarHBondContact O-N 3.18Å; H62-Y105 WeakPolarHBondContact ND1-CB 3.48Å; H62-Y105 PolarHBondContact ND1-N 3.38Å
63	W	98.6	Very high	97.4	Very high	17 Å²	17	36.9 Å²	36.9	6%	0.064	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	143.9	172.3	-73.4	107.6	0	0	0	110.7	M61 L70 G319 T321 A328 I338	M61-W63 HydrophobicContact CE-CD2 4.34Å; M61-W63 HydrophobicContact CE-CG 4.3Å; W63-L70 HydrophobicContact CD2-CB 4.06Å; W63-L70 HydrophobicContact CD2-CD2 4.35Å; W63-L70 HydrophobicContact CE3-CB 3.69Å; W63-L70 HydrophobicContact CE3-CD2 3.84Å; W63-L70 HydrophobicContact CE3-CG 4.41Å; W63-L70 HydrophobicContact CH2-CD2 3.5Å; W63-L70 VanDerWaalsContact CH2-CD2 3.5Å; W63-L70 HydrophobicContact CZ2-CD2 4.05Å; W63-L70 HydrophobicContact CZ3-CB 4.11Å; W63-L70 HydrophobicContact CZ3-CD2 3.38Å; W63-L70 HydrophobicContact CZ3-CG 4.36Å; W63-G319 PolarHBondContact NE1-O 3.33Å; W63-T321 HydrophobicContact CD2-CG2 3.7Å; W63-T321 HydrophobicContact CE3-CG2 3.87Å; W63-T321 HydrophobicContact CG-CG2 4.27Å; W63-T321 HydrophobicContact CH2-CG2 3.94Å; W63-T321 HydrophobicContact CZ2-CG2 3.74Å; W63-T321 HydrophobicContact CZ3-CG2 3.99Å; W63-A328 HydrophobicContact CH2-CB 4.43Å; W63-A328 HydrophobicContact CZ2-CB 3.41Å; W63-A328 VanDerWaalsContact CZ2-CB 3.41Å; W63-I338 HydrophobicContact CH2-CD1 4.3Å; W63-I338 HydrophobicContact CH2-CG1 4.3Å
64	G	96.9	Very high	97.5	Very high	7 Å²	7	35.7 Å²	35.7	7%	0.072	18%	0.18	C	C	.	.			trans	-73.9	158.9	162.5	0	0	0	0	0	111.1	E66 S67 L69	G64-E66 PolarHBondContact O-N 2.93Å; G64-S67 PolarHBondContact O-N 3.49Å; G64-S67 VanDerWaalsContact O-N 3.14Å; G64-L69 PolarHBondContact N-O 2.84Å
65	S	93.3	Very high	97.4	Very high	63 Å²	63	37 Å²	37	44%	0.441	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-29	-179.2	50.4	0	0	0	0	113.6	S67 P107 S322	S65-S67 PolarHBondContact O-N 3.2Å; S65-P107 PolarHBondContact OG-O 2.94Å; S65-S322 PolarHBondContact O-OG 3.25Å
66	E	93	Very high	97.4	Very high	137 Å²	137	32.1 Å²	32.1	64%	0.64	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.2	178.8	-59.5	-175.3	169.9	0	0	114.7	G64 R68	G64-E66 PolarHBondContact O-N 2.93Å; E66-R68 PolarHBondContact O-N 2.93Å
67	S	95.1	Very high	97.3	Very high	5 Å²	5	31.1 Å²	31.1	4%	0.035	15%	0.153	C	C	.	.	S	Bend	trans	58.5	19.8	-179.6	-66.8	0	0	0	0	115.3	G64 S65 T321 S322 D323	G64-S67 PolarHBondContact O-N 3.49Å; G64-S67 VanDerWaalsContact O-N 3.14Å; S65-S67 PolarHBondContact O-N 3.2Å; S67-T321 WeakPolarHBondContact OG-CB 3.44Å; S67-S322 PolarHBondContact OG-N 2.97Å; S67-S322 PolarHBondContact OG-OG 2.85Å; S67-D323 VanDerWaalsContact CB-CG 3.47Å; S67-D323 WeakPolarHBondContact CB-OD2 3.31Å; S67-D323 PolarHBondContact OG-N 3.06Å; S67-D323 PolarHBondContact OG-OD1 2.76Å
68	R	96.2	Very high	97.2	Very high	100 Å²	100	31.1 Å²	31.1	38%	0.377	15%	0.153	S	C	.	.	S	Bend	trans	-125.8	-53.5	-179.3	-179.9	178.2	175.9	-175.9	-2.1	112.8	E66 D83 S84 Y85	E66-R68 PolarHBondContact O-N 2.93Å; R68-D83 WeakPolarHBondContact CG-OD1 3.14Å; R68-D83 IonicContact CZ-OD1 3.7Å; R68-D83 IonicContact CZ-OD2 3.48Å; R68-D83 IonicContact NE-OD1 2.85Å; R68-D83 PolarHBondContact NE-OD1 3.45Å; R68-D83 IonicContact NE-OD2 3.41Å; R68-D83 PolarHBondContact NE-OD2 2.87Å; R68-D83 IonicContact NH2-OD1 3.68Å; R68-D83 IonicContact NH2-OD2 2.74Å; R68-D83 PolarHBondContact NH2-OD2 3.16Å; R68-S84 WeakPolarHBondContact O-CB 3.39Å; R68-S84 PolarHBondContact O-N 2.93Å; R68-S84 PolarHBondContact O-OG 2.73Å; R68-Y85 HydrophobicContact CG-CD1 4.25Å; R68-Y85 HydrophobicContact CG-CD2 4.44Å; R68-Y85 HydrophobicContact CG-CE1 4.41Å; R68-Y85 HydrophobicContact CG-CG 4.26Å
69	L	97.8	Very high	97.2	Very high	37 Å²	37	31.1 Å²	31.1	19%	0.194	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	145.9	177.6	-59.8	-178.3	0	0	0	110	G64 W82 D83 M90 Y105	G64-L69 PolarHBondContact N-O 2.84Å; L69-W82 VanDerWaalsContact CA-O 3.3Å; L69-W82 WeakPolarHBondContact CA-O 3.45Å; L69-D83 HydrophobicContact CD2-CB 4.11Å; L69-M90 HydrophobicContact CD2-CG 4.14Å; L69-Y105 HydrophobicContact CB-CE2 4.27Å
70	L	98.4	Very high	97.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	151	170.7	68.8	104	0	0	0	110.3	L51 M61 H62 W63 I81 W82 L336	L51-L70 HydrophobicContact CD1-CD1 4.24Å; L51-L70 HydrophobicContact CD1-CD2 4.01Å; M61-L70 HydrophobicContact CE-CB 4.06Å; M61-L70 HydrophobicContact CE-CD1 3.78Å; M61-L70 HydrophobicContact CE-CD2 4.43Å; M61-L70 HydrophobicContact CE-CG 4.3Å; H62-L70 WeakPolarHBondContact O-CA 3.49Å; H62-L70 WeakPolarHBondContact O-CB 3.25Å; W63-L70 HydrophobicContact CD2-CB 4.06Å; W63-L70 HydrophobicContact CD2-CD2 4.35Å; W63-L70 HydrophobicContact CE3-CB 3.69Å; W63-L70 HydrophobicContact CE3-CD2 3.84Å; W63-L70 HydrophobicContact CE3-CG 4.41Å; W63-L70 HydrophobicContact CH2-CD2 3.5Å; W63-L70 VanDerWaalsContact CH2-CD2 3.5Å; W63-L70 HydrophobicContact CZ2-CD2 4.05Å; W63-L70 HydrophobicContact CZ3-CB 4.11Å; W63-L70 HydrophobicContact CZ3-CD2 3.38Å; W63-L70 HydrophobicContact CZ3-CG 4.36Å; L70-I81 WeakPolarHBondContact O-CA 3.25Å; L70-W82 HydrophobicContact CD1-CB 4.46Å; L70-W82 HydrophobicContact CD1-CG 4.3Å; L70-W82 HydrophobicContact CG-CB 4.17Å; L70-W82 PolarHBondContact N-O 2.97Å; L70-W82 VanDerWaalsContact N-O 3.13Å; L70-W82 PolarHBondContact O-N 3.35Å; L70-L336 HydrophobicContact CD1-CD2 3.77Å
71	V	98.6	Very high	97.1	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	143.7	173.2	64.2	0	0	0	0	109.5	M61 H62 L79 I80 I81 C103 Y105 V112	M61-V71 CarbonylContact C-O 3.5Å; M61-V71 WeakPolarHBondContact CA-O 3.4Å; M61-V71 WeakPolarHBondContact CB-O 3.22Å; H62-V71 HydrophobicContact CB-CG1 3.97Å; H62-V71 PolarHBondContact N-O 2.93Å; H62-V71 PolarHBondContact O-N 3.18Å; V71-L79 HydrophobicContact CG2-CD1 3.56Å; V71-L79 HydrophobicContact CG2-CD2 4.02Å; V71-L79 HydrophobicContact CG2-CG 3.49Å; V71-L79 VanDerWaalsContact CG2-CG 3.49Å; V71-I80 CarbonylContact C-O 3.59Å; V71-I80 WeakPolarHBondContact CA-O 3.4Å; V71-I81 HydrophobicContact CB-CG1 4.31Å; V71-I81 HydrophobicContact CG2-CG1 4.14Å; V71-C103 HydrophobicContact CG1-CB 4.27Å; V71-C103 HydrophobicContact CG2-CB 4.45Å; V71-Y105 HydrophobicContact CB-CD2 3.95Å; V71-Y105 HydrophobicContact CG1-CD2 3.97Å; V71-Y105 HydrophobicContact CG1-CG 4.48Å; V71-V112 HydrophobicContact CB-CG1 4.28Å; V71-V112 HydrophobicContact CG2-CG1 4.25Å
72	S	98.7	Very high	97.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144	171.3	64.7	0	0	0	0	111.6	H54 A60 L79 I80 W82	H54-S72 PolarHBondContact NE2-OG 3.4Å; A60-S72 WeakPolarHBondContact O-CA 3.37Å; S72-L79 WeakPolarHBondContact O-CA 3.32Å; S72-I80 PolarHBondContact N-O 3.43Å; S72-I80 PolarHBondContact O-N 2.9Å; S72-W82 PolarHBondContact OG-NE1 2.71Å
73	A	98.5	Very high	97.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.4	-178.1	0	0	0	0	0	110.9	I58 Y59 A60 L79 V100 C103	I58-A73 WeakPolarHBondContact CA-O 3.49Å; Y59-A73 PolarHBondContact N-O 2.91Å; A60-A73 HydrophobicContact CB-CB 4.48Å; A60-A73 PolarHBondContact O-N 3.32Å; A73-L79 HydrophobicContact CB-CD1 3.69Å; A73-V100 HydrophobicContact CB-CB 4.37Å; A73-V100 HydrophobicContact CB-CG1 3.73Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; A73-C103 HydrophobicContact CB-CB 3.89Å
74	S	98.3	Very high	97	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153.5	-175.2	169.9	0	0	0	0	112.2	H54 A56 K57 D76 G77 K78 V100	H54-S74 WeakPolarHBondContact CE1-CB 3.48Å; H54-S74 WeakPolarHBondContact ND1-CB 3.25Å; A56-S74 PolarHBondContact O-OG 3.4Å; K57-S74 VanDerWaalsContact O-CA 3.31Å; K57-S74 WeakPolarHBondContact O-CA 3.5Å; K57-S74 PolarHBondContact O-OG 3.04Å; S74-D76 VanDerWaalsContact CB-OD1 3.26Å; S74-D76 WeakPolarHBondContact CB-OD1 3.33Å; S74-D76 PolarHBondContact O-N 2.93Å; S74-D76 VanDerWaalsContact O-N 3.08Å; S74-D76 PolarHBondContact OG-N 2.62Å; S74-D76 PolarHBondContact OG-OD1 3.28Å; S74-D76 PolarHBondContact OG-OD2 2.89Å; S74-G77 PolarHBondContact O-N 2.77Å; S74-G77 VanDerWaalsContact O-N 3.11Å; S74-K78 PolarHBondContact N-O 2.96Å; S74-V100 WeakPolarHBondContact O-CG1 3.27Å
75	Q	96.8	Very high	96.9	Very high	37 Å²	37	31.3 Å²	31.3	17%	0.173	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-1	176.5	-75	-173.5	-20.9	0	0	114.8	A56 K57 Y59 G77 S98 W99	A56-Q75 HydrophobicContact CB-CB 4.28Å; K57-Q75 PolarHBondContact O-N 3.03Å; Y59-Q75 HydrophobicContact CD2-CG 3.77Å; Y59-Q75 HydrophobicContact CE2-CG 3.66Å; Y59-Q75 PolarHBondContact OH-NE2 3.38Å; Q75-G77 PolarHBondContact O-N 3.02Å; Q75-S98 CarbonylContact C-O 3.59Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.44Å; Q75-W99 VanDerWaalsContact NE2-CE3 3.34Å
76	D	95.3	Very high	97.1	Very high	39 Å²	39	31.1 Å²	31.1	21%	0.209	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	3	167.4	60.7	19.8	0	0	0	112.7	H54 L55 A56 S74 K78	H54-D76 VanDerWaalsContact CA-OD2 3.26Å; H54-D76 WeakPolarHBondContact CA-OD2 3.44Å; H54-D76 WeakPolarHBondContact CB-OD2 3.45Å; H54-D76 IonicContact CG-OD2 3.68Å; H54-D76 IonicContact ND1-OD1 3.54Å; H54-D76 IonicContact ND1-OD2 3.09Å; H54-D76 PolarHBondContact ND1-OD2 2.77Å; H54-D76 VanDerWaalsContact ND1-OD2 3.09Å; L55-D76 HydrophobicContact CB-CB 4.27Å; L55-D76 PolarHBondContact N-OD2 3.25Å; A56-D76 HydrophobicContact CB-CB 3.86Å; S74-D76 VanDerWaalsContact CB-OD1 3.26Å; S74-D76 WeakPolarHBondContact CB-OD1 3.33Å; S74-D76 PolarHBondContact O-N 2.93Å; S74-D76 VanDerWaalsContact O-N 3.08Å; S74-D76 PolarHBondContact OG-N 2.62Å; S74-D76 PolarHBondContact OG-OD1 3.28Å; S74-D76 PolarHBondContact OG-OD2 2.89Å; D76-K78 WeakPolarHBondContact OD1-CB 3.4Å; D76-K78 WeakPolarHBondContact OD1-CG 3.47Å; D76-K78 PolarHBondContact OD1-N 3.12Å
77	G	95.9	Very high	97.3	Very high	9 Å²	9	27.4 Å²	27.4	9%	0.093	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	29.6	-177.8	0	0	0	0	0	112.7	S74 Q75 L95	S74-G77 PolarHBondContact O-N 2.77Å; S74-G77 VanDerWaalsContact O-N 3.11Å; Q75-G77 PolarHBondContact O-N 3.02Å; G77-L95 WeakPolarHBondContact O-CB 3.5Å; G77-L95 PolarHBondContact O-N 3.1Å
78	K	97.1	Very high	97.4	Very high	77 Å²	77	31.8 Å²	31.8	34%	0.335	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.8	176.2	-58.1	-176.8	-179.5	176.6	0	112.4	S74 D76 I80 I93	S74-K78 PolarHBondContact N-O 2.96Å; D76-K78 WeakPolarHBondContact OD1-CB 3.4Å; D76-K78 WeakPolarHBondContact OD1-CG 3.47Å; D76-K78 PolarHBondContact OD1-N 3.12Å; K78-I80 HydrophobicContact CB-CG1 4.22Å; K78-I93 WeakPolarHBondContact CA-O 3.41Å
79	L	97.6	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.8	162.6	-162	68.9	0	0	0	107.8	V71 S72 A73 I93 L95 C103 V112 C114 Y124	V71-L79 HydrophobicContact CG2-CD1 3.56Å; V71-L79 HydrophobicContact CG2-CD2 4.02Å; V71-L79 HydrophobicContact CG2-CG 3.49Å; V71-L79 VanDerWaalsContact CG2-CG 3.49Å; S72-L79 WeakPolarHBondContact O-CA 3.32Å; A73-L79 HydrophobicContact CB-CD1 3.69Å; L79-I93 HydrophobicContact CB-CB 4.18Å; L79-I93 HydrophobicContact CD2-CD1 4.22Å; L79-I93 PolarHBondContact N-O 2.85Å; L79-I93 PolarHBondContact O-N 2.8Å; L79-L95 HydrophobicContact CB-CD2 4.04Å; L79-L95 HydrophobicContact CB-CG 4.43Å; L79-C103 HydrophobicContact CD1-CB 3.61Å; L79-V112 HydrophobicContact CD2-CB 4.19Å; L79-V112 HydrophobicContact CD2-CG2 3.66Å; L79-C114 HydrophobicContact CD1-CB 4.13Å; L79-C114 HydrophobicContact CD2-CB 4.23Å; L79-Y124 HydrophobicContact CD2-CD2 4.41Å
80	I	98.2	Very high	97.2	Very high	2 Å²	2	35 Å²	35	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.9	-178.6	-56.4	178.5	0	0	0	109.4	H54 V71 S72 K78 W82 K89 H91 A92	H54-I80 VanDerWaalsContact CE1-CD1 3.47Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.44Å; V71-I80 CarbonylContact C-O 3.59Å; V71-I80 WeakPolarHBondContact CA-O 3.4Å; S72-I80 PolarHBondContact N-O 3.43Å; S72-I80 PolarHBondContact O-N 2.9Å; K78-I80 HydrophobicContact CB-CG1 4.22Å; I80-W82 HydrophobicContact CB-CZ2 3.78Å; I80-W82 HydrophobicContact CD1-CH2 4.16Å; 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 4.21Å; I80-W82 HydrophobicContact CG2-CH2 4.04Å; I80-W82 HydrophobicContact CG2-CZ2 3.46Å; I80-W82 VanDerWaalsContact CG2-CZ2 3.46Å; I80-W82 HydrophobicContact CG2-CZ3 4.39Å; I80-W82 PolarHBondContact O-NE1 2.76Å; I80-K89 HydrophobicContact CG2-CB 4.2Å; I80-K89 HydrophobicContact CG2-CD 4.28Å; I80-K89 HydrophobicContact CG2-CG 3.98Å; I80-H91 WeakPolarHBondContact CA-O 3.46Å; I80-H91 WeakPolarHBondContact CG2-O 3.49Å; I80-A92 HydrophobicContact CG1-CB 4.42Å
81	I	97.8	Very high	97	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.3	171.5	-59.6	177.3	0	0	0	108.3	L70 V71 K89 M90 H91 Y105 V112 L126	L70-I81 WeakPolarHBondContact O-CA 3.25Å; V71-I81 HydrophobicContact CB-CG1 4.31Å; V71-I81 HydrophobicContact CG2-CG1 4.14Å; I81-K89 CarbonylContact O-C 3.56Å; I81-M90 HydrophobicContact CB-CB 4.42Å; I81-M90 HydrophobicContact CG2-CB 4.13Å; I81-M90 PolarHBondContact O-N 3.44Å; I81-H91 HydrophobicContact CB-CB 4.22Å; I81-H91 HydrophobicContact CD1-CB 4.22Å; I81-H91 HydrophobicContact CG1-CB 4.39Å; I81-H91 PolarHBondContact N-O 2.94Å; I81-H91 PolarHBondContact O-N 3.49Å; I81-Y105 HydrophobicContact CG2-CE2 4.14Å; I81-V112 HydrophobicContact CD1-CG1 3.88Å; I81-V112 HydrophobicContact CD1-CG2 4.36Å; I81-L126 HydrophobicContact CD1-CD1 3.44Å; I81-L126 VanDerWaalsContact CD1-CD1 3.44Å; I81-L126 HydrophobicContact CD1-CD2 3.3Å; I81-L126 HydrophobicContact CD1-CG 4Å
82	W	98.3	Very high	96.8	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.1	-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 4.12Å; L51-W82 HydrophobicContact CB-CE3 3.86Å; L51-W82 HydrophobicContact CB-CH2 4.27Å; L51-W82 HydrophobicContact CB-CZ3 3.93Å; L51-W82 HydrophobicContact CD1-CB 3.92Å; L51-W82 HydrophobicContact CD1-CD2 4.01Å; L51-W82 HydrophobicContact CD1-CE3 4.35Å; L51-W82 HydrophobicContact CD1-CG 3.83Å; L51-W82 HydrophobicContact CD2-CE3 4.34Å; L51-W82 HydrophobicContact CG-CE3 4.41Å; R52-W82 WeakPolarHBondContact O-CH2 3.45Å; R52-W82 WeakPolarHBondContact O-CZ3 3.29Å; L69-W82 VanDerWaalsContact CA-O 3.3Å; L69-W82 WeakPolarHBondContact CA-O 3.45Å; L70-W82 HydrophobicContact CD1-CB 4.46Å; L70-W82 HydrophobicContact CD1-CG 4.3Å; L70-W82 HydrophobicContact CG-CB 4.17Å; L70-W82 PolarHBondContact N-O 2.97Å; L70-W82 VanDerWaalsContact N-O 3.13Å; L70-W82 PolarHBondContact O-N 3.35Å; S72-W82 PolarHBondContact OG-NE1 2.71Å; I80-W82 HydrophobicContact CB-CZ2 3.78Å; I80-W82 HydrophobicContact CD1-CH2 4.16Å; 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 4.21Å; I80-W82 HydrophobicContact CG2-CH2 4.04Å; I80-W82 HydrophobicContact CG2-CZ2 3.46Å; I80-W82 VanDerWaalsContact CG2-CZ2 3.46Å; I80-W82 HydrophobicContact CG2-CZ3 4.39Å; I80-W82 PolarHBondContact O-NE1 2.76Å; W82-N88 WeakPolarHBondContact CA-O 3.14Å; W82-K89 HydrophobicContact CE3-CG 3.81Å; W82-K89 HydrophobicContact CH2-CD 4.38Å; W82-K89 HydrophobicContact CH2-CG 4.18Å; W82-K89 HydrophobicContact CZ3-CD 4.17Å; W82-K89 HydrophobicContact CZ3-CG 3.57Å; W82-L336 HydrophobicContact CZ2-CD1 4.35Å
83	D	97.8	Very high	96.7	Very high	7 Å²	7	41 Å²	41	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	110.4	157.3	176.9	4.7	0	0	0	108.8	R68 L69 Y85 T86 T87 N88 M90	R68-D83 WeakPolarHBondContact CG-OD1 3.14Å; R68-D83 IonicContact CZ-OD1 3.7Å; R68-D83 IonicContact CZ-OD2 3.48Å; R68-D83 IonicContact NE-OD1 2.85Å; R68-D83 PolarHBondContact NE-OD1 3.45Å; R68-D83 IonicContact NE-OD2 3.41Å; R68-D83 PolarHBondContact NE-OD2 2.87Å; R68-D83 IonicContact NH2-OD1 3.68Å; R68-D83 IonicContact NH2-OD2 2.74Å; R68-D83 PolarHBondContact NH2-OD2 3.16Å; L69-D83 HydrophobicContact CD2-CB 4.11Å; D83-Y85 PolarHBondContact O-N 2.95Å; D83-Y85 PolarHBondContact OD1-N 3.42Å; D83-Y85 VanDerWaalsContact OD1-N 3.07Å; D83-T86 WeakPolarHBondContact CB-OG1 3.16Å; D83-T86 PolarHBondContact O-N 2.87Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.36Å; D83-T86 PolarHBondContact OD2-OG1 3.47Å; D83-T87 VanDerWaalsContact O-CA 3.26Å; D83-T87 WeakPolarHBondContact O-CA 3.32Å; D83-T87 PolarHBondContact O-N 3.44Å; D83-N88 PolarHBondContact N-O 2.95Å; D83-M90 HydrophobicContact CB-CG 4.31Å; D83-M90 HydrophobicContact CB-SD 4.45Å
84	S	96.9	Very high	96.5	Very high	8 Å²	8	46 Å²	46	6%	0.056	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.2	-177.9	60	0	0	0	0	113.7	R68 I338	R68-S84 WeakPolarHBondContact O-CB 3.39Å; R68-S84 PolarHBondContact O-N 2.93Å; R68-S84 PolarHBondContact O-OG 2.73Å; S84-I338 VanDerWaalsContact CB-CD1 3.43Å
85	Y	96.2	Very high	96.4	Very high	134 Å²	134	47.2 Å²	47.2	53%	0.525	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-45.4	-175	-73.2	11.4	0	0	0	111.1	R49 R68 D83	R49-Y85 PolarHBondContact NE-O 3.2Å; R49-Y85 VanDerWaalsContact NE-O 3.17Å; R68-Y85 HydrophobicContact CG-CD1 4.25Å; R68-Y85 HydrophobicContact CG-CD2 4.44Å; R68-Y85 HydrophobicContact CG-CE1 4.41Å; R68-Y85 HydrophobicContact CG-CG 4.26Å; D83-Y85 PolarHBondContact O-N 2.95Å; D83-Y85 PolarHBondContact OD1-N 3.42Å; D83-Y85 VanDerWaalsContact OD1-N 3.07Å
86	T	97.1	Very high	96	Very high	60 Å²	60	54.7 Å²	54.7	37%	0.368	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-13.1	-175.2	62.8	0	0	0	0	113.5	D83 N88	D83-T86 WeakPolarHBondContact CB-OG1 3.16Å; D83-T86 PolarHBondContact O-N 2.87Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.36Å; D83-T86 PolarHBondContact OD2-OG1 3.47Å; T86-N88 PolarHBondContact O-N 3.37Å; T86-N88 WeakPolarHBondContact OG1-CB 3.49Å; T86-N88 PolarHBondContact OG1-N 2.88Å; T86-N88 PolarHBondContact OG1-ND2 3Å
87	T	97.2	Very high	95.8	Very high	58 Å²	58	54.2 Å²	54.2	36%	0.356	28%	0.277	S	S	.	.			trans	64	9.3	-171.9	72	0	0	0	0	115	R49 L51 D83	R49-T87 HydrophobicContact CB-CG2 4.09Å; R49-T87 HydrophobicContact CG-CG2 4.18Å; L51-T87 HydrophobicContact CD2-CG2 3.83Å; D83-T87 VanDerWaalsContact O-CA 3.26Å; D83-T87 WeakPolarHBondContact O-CA 3.32Å; D83-T87 PolarHBondContact O-N 3.44Å
88	N	97.3	Very high	95.6	Very high	97 Å²	97	56.2 Å²	56.2	52%	0.519	29%	0.29	S	S	.	.			trans	-72.2	145.7	178.7	-70.8	-23.2	0	0	0	111.1	W82 D83 T86	W82-N88 WeakPolarHBondContact CA-O 3.14Å; D83-N88 PolarHBondContact N-O 2.95Å; T86-N88 PolarHBondContact O-N 3.37Å; T86-N88 WeakPolarHBondContact OG1-CB 3.49Å; T86-N88 PolarHBondContact OG1-N 2.88Å; T86-N88 PolarHBondContact OG1-ND2 3Å
89	K	96.3	Very high	95.4	Very high	106 Å²	106	59 Å²	59	46%	0.461	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	110.6	170.8	-59	177.3	-175.7	72.8	0	107.5	R52 I80 I81 W82	R52-K89 VanDerWaalsContact O-CE 3.29Å; R52-K89 WeakPolarHBondContact O-CE 3.49Å; R52-K89 PolarHBondContact O-NZ 2.94Å; I80-K89 HydrophobicContact CG2-CB 4.2Å; I80-K89 HydrophobicContact CG2-CD 4.28Å; I80-K89 HydrophobicContact CG2-CG 3.98Å; I81-K89 CarbonylContact O-C 3.56Å; W82-K89 HydrophobicContact CE3-CG 3.81Å; W82-K89 HydrophobicContact CH2-CD 4.38Å; W82-K89 HydrophobicContact CH2-CG 4.18Å; W82-K89 HydrophobicContact CZ3-CD 4.17Å; W82-K89 HydrophobicContact CZ3-CG 3.57Å
90	M	93.8	Very high	95.4	Very high	99 Å²	99	59.1 Å²	59.1	49%	0.488	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-44.5	176.2	-66	-56.9	-60.2	0	0	110.7	L69 I81 D83	L69-M90 HydrophobicContact CD2-CG 4.14Å; I81-M90 HydrophobicContact CB-CB 4.42Å; I81-M90 HydrophobicContact CG2-CB 4.13Å; I81-M90 PolarHBondContact O-N 3.44Å; D83-M90 HydrophobicContact CB-CG 4.31Å; D83-M90 HydrophobicContact CB-SD 4.45Å
91	H	93.8	Very high	95.4	Very high	58 Å²	58	61.1 Å²	61.1	27%	0.269	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.9	176.7	-60.2	-74.4	0	0	0	110.4	I80 I81 I93	I80-H91 WeakPolarHBondContact CA-O 3.46Å; I80-H91 WeakPolarHBondContact CG2-O 3.49Å; I81-H91 HydrophobicContact CB-CB 4.22Å; I81-H91 HydrophobicContact CD1-CB 4.22Å; I81-H91 HydrophobicContact CG1-CB 4.39Å; I81-H91 PolarHBondContact N-O 2.94Å; I81-H91 PolarHBondContact O-N 3.49Å; H91-I93 HydrophobicContact CB-CG1 4.45Å
92	A	95.1	Very high	95.4	Very high	62 Å²	62	61.2 Å²	61.2	51%	0.512	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	101.2	168.7	0	0	0	0	0	107.8	I80	I80-A92 HydrophobicContact CG1-CB 4.42Å
93	I	95.4	Very high	95.4	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.9	-173.4	-55	161.8	0	0	0	107.7	K78 L79 H91 V112 Y124 L126 V133	K78-I93 WeakPolarHBondContact CA-O 3.41Å; L79-I93 HydrophobicContact CB-CB 4.18Å; L79-I93 HydrophobicContact CD2-CD1 4.22Å; L79-I93 PolarHBondContact N-O 2.85Å; L79-I93 PolarHBondContact O-N 2.8Å; H91-I93 HydrophobicContact CB-CG1 4.45Å; I93-V112 HydrophobicContact CD1-CG2 3.91Å; I93-Y124 HydrophobicContact CD1-CG 4.42Å; I93-Y124 HydrophobicContact CG2-CD1 3.61Å; I93-Y124 HydrophobicContact CG2-CE1 3.47Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.47Å; I93-Y124 HydrophobicContact CG2-CG 4.36Å; I93-L126 HydrophobicContact CD1-CD2 4.29Å; I93-V133 HydrophobicContact CD1-CB 4.43Å; I93-V133 HydrophobicContact CD1-CG1 3.58Å; I93-V133 HydrophobicContact CG1-CB 4.11Å; I93-V133 HydrophobicContact CG1-CG1 3.73Å
94	P	95.2	Very high	95.5	Very high	106 Å²	106	60.9 Å²	60.9	69%	0.688	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.8	171.9	30.3	-32.4	0	0	0	109.9
95	L	94.6	Very high	95.5	Very high	25 Å²	25	61.1 Å²	61.1	13%	0.131	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-89.6	151.5	177	-57.3	-178.3	0	0	0	110.2	G77 L79 S97 V100 C114 Y124	G77-L95 WeakPolarHBondContact O-CB 3.5Å; G77-L95 PolarHBondContact O-N 3.1Å; L79-L95 HydrophobicContact CB-CD2 4.04Å; L79-L95 HydrophobicContact CB-CG 4.43Å; L95-S97 VanDerWaalsContact CB-O 3.32Å; L95-S97 WeakPolarHBondContact CB-O 3.23Å; L95-V100 HydrophobicContact CD1-CB 3.85Å; L95-V100 HydrophobicContact CD1-CG1 4.11Å; L95-V100 HydrophobicContact CD1-CG2 4.02Å; L95-C114 WeakPolarHBondContact CD2-SG 3.46Å; L95-Y124 HydrophobicContact CD2-CE2 4.22Å; L95-Y124 VanDerWaalsContact CD2-OH 3.27Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.37Å
96	R	89.5	Confident	95.6	Very high	194 Å²	194	54.7 Å²	54.7	73%	0.732	28%	0.282	S	S	*	.	S	Bend	trans	-72.9	-42.7	173.2	-69.1	-175.6	-177.9	164.3	9.8	111.4	E138	R96-E138 IonicContact CZ-OE1 3.1Å; R96-E138 IonicContact NE-OE1 3.73Å; R96-E138 VanDerWaalsContact NH1-CD 3.32Å; R96-E138 IonicContact NH1-OE1 2.73Å; R96-E138 PolarHBondContact NH1-OE1 3.46Å; R96-E138 IonicContact NH1-OE2 3.09Å; R96-E138 PolarHBondContact NH1-OE2 3.32Å; R96-E138 VanDerWaalsContact NH1-OE2 3.09Å; R96-E138 IonicContact NH2-OE1 3.56Å
97	S	91.2	Very high	95.5	Very high	28 Å²	28	54.4 Å²	54.4	20%	0.196	28%	0.281	C	S	.	.			trans	-97.2	131.6	173.3	-176	0	0	0	0	110.1	L95 W99 D118	L95-S97 VanDerWaalsContact CB-O 3.32Å; L95-S97 WeakPolarHBondContact CB-O 3.23Å; S97-W99 VanDerWaalsContact C-N 3.3Å; S97-W99 PolarHBondContact OG-N 3.41Å; S97-D118 WeakPolarHBondContact CB-OD2 3.5Å
98	S	91.3	Very high	95.5	Very high	52 Å²	52	54 Å²	54	36%	0.364	28%	0.281	S	S	.	.	S	Bend	trans	-74.5	-24	173.7	55.4	0	0	0	0	112.3	Q75 V100	Q75-S98 CarbonylContact C-O 3.59Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.44Å; S98-V100 VanDerWaalsContact C-N 3.29Å; S98-V100 PolarHBondContact O-N 3.05Å
99	W	94	Very high	95.3	Very high	135 Å²	135	50.2 Å²	50.2	51%	0.511	27%	0.265	S	S	.	.			trans	-88.3	62.5	-172.7	-63.1	98.2	0	0	0	112.3	Q75 S97 G116 L117	Q75-W99 VanDerWaalsContact NE2-CE3 3.34Å; S97-W99 VanDerWaalsContact C-N 3.3Å; S97-W99 PolarHBondContact OG-N 3.41Å; W99-G116 WeakPolarHBondContact O-CA 3.32Å; W99-L117 HydrophobicContact CB-CB 3.83Å; W99-L117 HydrophobicContact CB-CD1 3.69Å; W99-L117 HydrophobicContact CB-CG 3.78Å; W99-L117 HydrophobicContact CD2-CD1 3.98Å; W99-L117 HydrophobicContact CE3-CD1 4.09Å; W99-L117 HydrophobicContact CG-CD1 3.82Å; W99-L117 HydrophobicContact CG-CG 4.45Å; W99-L117 PolarHBondContact O-N 3.23Å
100	V	96.6	Very high	95.2	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	137.4	175.6	68	0	0	0	0	111	A73 S74 L95 S98 T102 C114 G115	A73-V100 HydrophobicContact CB-CB 4.37Å; A73-V100 HydrophobicContact CB-CG1 3.73Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; S74-V100 WeakPolarHBondContact O-CG1 3.27Å; L95-V100 HydrophobicContact CD1-CB 3.85Å; L95-V100 HydrophobicContact CD1-CG1 4.11Å; L95-V100 HydrophobicContact CD1-CG2 4.02Å; S98-V100 VanDerWaalsContact C-N 3.29Å; S98-V100 PolarHBondContact O-N 3.05Å; V100-T102 WeakPolarHBondContact CG2-O 3.29Å; V100-C114 HydrophobicContact CG2-CB 3.88Å; V100-G115 WeakPolarHBondContact CG2-O 3.07Å
101	M	97.9	Very high	95.3	Very high	44 Å²	44	44.7 Å²	44.7	22%	0.217	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-30.2	179.1	-65.9	179.7	67.5	0	0	112	A60 G115 L117 Y145 L146	A60-M101 WeakPolarHBondContact CB-O 3.15Å; M101-G115 PolarHBondContact N-O 3.45Å; M101-L117 HydrophobicContact SD-CD2 3.87Å; M101-L117 HydrophobicContact SD-CG 4.41Å; M101-Y145 HydrophobicContact CE-CD2 3.59Å; M101-Y145 HydrophobicContact CE-CE2 3.68Å; M101-Y145 HydrophobicContact CE-CG 4.49Å; M101-Y145 HydrophobicContact SD-CD2 3.57Å; M101-Y145 VanDerWaalsContact SD-CD2 3.57Å; M101-Y145 HydrophobicContact SD-CE2 4.28Å; M101-Y145 HydrophobicContact SD-CG 4.05Å; M101-L146 WeakPolarHBondContact CB-O 3.27Å
102	T	98.4	Very high	95.5	Very high	3 Å²	3	42 Å²	42	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.2	-178.8	-178.3	0	0	0	0	112.5	V100 C114 G115 L146 S147 C148 C149	V100-T102 WeakPolarHBondContact CG2-O 3.29Å; T102-C114 VanDerWaalsContact O-CA 3.24Å; T102-C114 WeakPolarHBondContact O-CA 3.31Å; T102-C114 WeakPolarHBondContact O-CB 3.2Å; T102-G115 PolarHBondContact N-O 2.83Å; T102-G115 VanDerWaalsContact N-O 3.08Å; T102-G115 PolarHBondContact O-N 2.79Å; T102-L146 HydrophobicContact CG2-CD2 3.58Å; T102-L146 HydrophobicContact CG2-CG 3.86Å; T102-S147 WeakPolarHBondContact CB-O 3.46Å; T102-C148 WeakPolarHBondContact OG1-CA 3.13Å; T102-C149 HydrophobicContact CG2-CB 4.36Å; T102-C149 PolarHBondContact OG1-N 2.75Å; T102-C149 VanDerWaalsContact OG1-N 3.13Å; T102-C149 PolarHBondContact OG1-SG 2.92Å
103	C	98.3	Very high	95.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	152	160.1	60.3	0	0	0	0	111.4	A60 V71 A73 L79 A113 C114 R150	A60-C103 VanDerWaalsContact C-SG 3.58Å; V71-C103 HydrophobicContact CG1-CB 4.27Å; V71-C103 HydrophobicContact CG2-CB 4.45Å; A73-C103 HydrophobicContact CB-CB 3.89Å; L79-C103 HydrophobicContact CD1-CB 3.61Å; C103-A113 CarbonylContact C-O 3.58Å; C103-A113 WeakPolarHBondContact CA-O 3.3Å; C103-A113 WeakPolarHBondContact CB-O 3.49Å; C103-C114 HydrophobicContact CB-CB 4.44Å; C103-R150 PolarHBondContact O-NH1 2.89Å
104	A	98.6	Very high	95.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.2	175.5	0	0	0	0	0	110.9	V112 A113 C149 F151	A104-V112 CarbonylContact O-C 3.53Å; A104-V112 VanDerWaalsContact O-CA 3.23Å; A104-V112 WeakPolarHBondContact O-CA 3.43Å; A104-V112 WeakPolarHBondContact O-CB 3.47Å; A104-A113 HydrophobicContact CB-CB 4.37Å; A104-A113 PolarHBondContact N-O 2.95Å; A104-A113 PolarHBondContact O-N 3.48Å; A104-C149 WeakPolarHBondContact CB-O 3.49Å; A104-F151 HydrophobicContact CB-CD2 3.79Å; A104-F151 HydrophobicContact CB-CE2 3.91Å
105	Y	98.1	Very high	95.9	Very high	13 Å²	13	34 Å²	34	5%	0.051	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	124.8	173.8	-153.3	-57.9	0	0	0	107.5	H62 L69 V71 I81 V112 L126	H62-Y105 WeakPolarHBondContact ND1-CB 3.48Å; H62-Y105 PolarHBondContact ND1-N 3.38Å; L69-Y105 HydrophobicContact CB-CE2 4.27Å; V71-Y105 HydrophobicContact CB-CD2 3.95Å; V71-Y105 HydrophobicContact CG1-CD2 3.97Å; V71-Y105 HydrophobicContact CG1-CG 4.48Å; I81-Y105 HydrophobicContact CG2-CE2 4.14Å; Y105-V112 HydrophobicContact CD2-CG1 3.92Å; Y105-V112 HydrophobicContact CE2-CG1 4.11Å; Y105-V112 HydrophobicContact CG-CG1 4.16Å; Y105-L126 HydrophobicContact CE1-CD1 4.39Å; Y105-L126 HydrophobicContact CE2-CD1 4.47Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.36Å
106	A	97.8	Very high	96	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.			trans	-67.5	140.8	179.8	0	0	0	0	0	111.6	S108 G109 Y111 F151	A106-S108 PolarHBondContact O-N 2.78Å; A106-G109 PolarHBondContact O-N 2.82Å; A106-Y111 WeakPolarHBondContact CB-O 3.48Å; A106-Y111 PolarHBondContact N-O 3.17Å; A106-F151 HydrophobicContact CB-CB 4.31Å; A106-F151 HydrophobicContact CB-CD1 4.16Å; A106-F151 HydrophobicContact CB-CD2 3.85Å; A106-F151 HydrophobicContact CB-CE1 4.41Å; A106-F151 HydrophobicContact CB-CE2 4.12Å; A106-F151 HydrophobicContact CB-CG 3.86Å; A106-F151 HydrophobicContact CB-CZ 4.38Å
107	P	96.1	Very high	96.3	Very high	53 Å²	53	27.8 Å²	27.8	34%	0.344	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-29.1	-179.1	-27.8	34.2	0	0	0	114.5	S65 G109	S65-P107 PolarHBondContact OG-O 2.94Å; P107-G109 VanDerWaalsContact C-N 3.33Å; P107-G109 PolarHBondContact O-N 3.38Å
108	S	95.6	Very high	96.6	Very high	51 Å²	51	28.9 Å²	28.9	36%	0.357	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-18	-179.5	67	0	0	0	0	115.3	A106 N110 D154	A106-S108 PolarHBondContact O-N 2.78Å; S108-N110 VanDerWaalsContact C-N 3.33Å; S108-N110 WeakPolarHBondContact OG-CB 3.49Å; S108-N110 PolarHBondContact OG-N 2.96Å; S108-N110 PolarHBondContact OG-ND2 3.48Å; S108-D154 WeakPolarHBondContact CB-OD1 3.15Å; S108-D154 VanDerWaalsContact CB-OD2 3.29Å; S108-D154 WeakPolarHBondContact CB-OD2 3.48Å; S108-D154 PolarHBondContact OG-OD1 3.16Å; S108-D154 PolarHBondContact OG-OD2 3.34Å; S108-D154 VanDerWaalsContact OG-OD2 3.06Å
109	G	94.1	Very high	96.8	Very high	17 Å²	17	28.6 Å²	28.6	18%	0.175	15%	0.149	C	C	.	.	S	Bend	trans	90.8	-13.1	-168.3	0	0	0	0	0	114.8	A106 P107	A106-G109 PolarHBondContact O-N 2.82Å; P107-G109 VanDerWaalsContact C-N 3.33Å; P107-G109 PolarHBondContact O-N 3.38Å
110	N	93.4	Very high	97	Very high	35 Å²	35	24.4 Å²	24.4	19%	0.187	14%	0.136	C	C	.	.	S	Bend	trans	-89.2	-30.6	-162.2	-63	-30.7	0	0	0	114.6	S108 L126 K127 D154	S108-N110 VanDerWaalsContact C-N 3.33Å; S108-N110 WeakPolarHBondContact OG-CB 3.49Å; S108-N110 PolarHBondContact OG-N 2.96Å; S108-N110 PolarHBondContact OG-ND2 3.48Å; N110-L126 WeakPolarHBondContact O-CB 3.36Å; N110-L126 PolarHBondContact O-N 3.41Å; N110-K127 VanDerWaalsContact OD1-CD 3.27Å; N110-K127 WeakPolarHBondContact OD1-CD 3.39Å; N110-K127 WeakPolarHBondContact OD1-CE 3.18Å; N110-K127 PolarHBondContact OD1-NZ 3.48Å; N110-D154 PolarHBondContact ND2-OD2 3.39Å
111	Y	96.5	Very high	97	Very high	54 Å²	54	24.3 Å²	24.3	21%	0.212	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.7	-173.8	-59.7	-84.6	0	0	0	112.3	A106 I123 Y124 T136 D154	A106-Y111 WeakPolarHBondContact CB-O 3.48Å; A106-Y111 PolarHBondContact N-O 3.17Å; Y111-I123 HydrophobicContact CD1-CG2 3.84Å; Y111-I123 HydrophobicContact CG-CG2 4.32Å; Y111-Y124 VanDerWaalsContact CA-O 3.24Å; Y111-Y124 WeakPolarHBondContact CA-O 3.39Å; Y111-T136 HydrophobicContact CE1-CG2 4.28Å; Y111-D154 HydrophobicContact CD2-CB 4.08Å; Y111-D154 HydrophobicContact CE2-CB 3.82Å
112	V	97.9	Very high	97	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.5	161.8	-66.8	0	0	0	0	109.3	V71 L79 I81 I93 A104 Y105 Y124 L126	V71-V112 HydrophobicContact CB-CG1 4.28Å; V71-V112 HydrophobicContact CG2-CG1 4.25Å; L79-V112 HydrophobicContact CD2-CB 4.19Å; L79-V112 HydrophobicContact CD2-CG2 3.66Å; I81-V112 HydrophobicContact CD1-CG1 3.88Å; I81-V112 HydrophobicContact CD1-CG2 4.36Å; I93-V112 HydrophobicContact CD1-CG2 3.91Å; A104-V112 CarbonylContact O-C 3.53Å; A104-V112 VanDerWaalsContact O-CA 3.23Å; A104-V112 WeakPolarHBondContact O-CA 3.43Å; A104-V112 WeakPolarHBondContact O-CB 3.47Å; Y105-V112 HydrophobicContact CD2-CG1 3.92Å; Y105-V112 HydrophobicContact CE2-CG1 4.11Å; Y105-V112 HydrophobicContact CG-CG1 4.16Å; V112-Y124 HydrophobicContact CG2-CD2 4.38Å; V112-Y124 HydrophobicContact CG2-CG 4.45Å; V112-Y124 PolarHBondContact N-O 2.81Å; V112-Y124 PolarHBondContact O-N 3.16Å; V112-L126 HydrophobicContact CG1-CD1 4.02Å; V112-L126 HydrophobicContact CG1-CD2 4.48Å; V112-L126 HydrophobicContact CG1-CG 4.49Å; V112-L126 HydrophobicContact CG2-CD2 3.94Å
113	A	98.3	Very high	97	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.9	174.1	0	0	0	0	0	110.5	C103 A104 S122 I123 F151 I157	C103-A113 CarbonylContact C-O 3.58Å; C103-A113 WeakPolarHBondContact CA-O 3.3Å; C103-A113 WeakPolarHBondContact CB-O 3.49Å; A104-A113 HydrophobicContact CB-CB 4.37Å; A104-A113 PolarHBondContact N-O 2.95Å; A104-A113 PolarHBondContact O-N 3.48Å; A113-S122 CarbonylContact C-O 3.56Å; A113-S122 WeakPolarHBondContact CA-O 3.49Å; A113-I123 HydrophobicContact CB-CG1 4.25Å; A113-F151 HydrophobicContact CB-CE2 3.57Å; A113-F151 HydrophobicContact CB-CZ 3.55Å; A113-I157 HydrophobicContact CB-CD1 3.57Å
114	C	98.1	Very high	96.9	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.027	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	166.6	167.5	69.5	0	0	0	0	111.2	L79 L95 V100 T102 C103 S122 Y124	L79-C114 HydrophobicContact CD1-CB 4.13Å; L79-C114 HydrophobicContact CD2-CB 4.23Å; L95-C114 WeakPolarHBondContact CD2-SG 3.46Å; V100-C114 HydrophobicContact CG2-CB 3.88Å; T102-C114 VanDerWaalsContact O-CA 3.24Å; T102-C114 WeakPolarHBondContact O-CA 3.31Å; T102-C114 WeakPolarHBondContact O-CB 3.2Å; C103-C114 HydrophobicContact CB-CB 4.44Å; C114-S122 PolarHBondContact N-O 3.46Å; C114-S122 PolarHBondContact O-N 3.03Å; C114-Y124 VanDerWaalsContact SG-CE2 3.59Å
115	G	97.5	Very high	96.6	Very high	2 Å²	2	23.6 Å²	23.6	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	176.3	167.7	0	0	0	0	0	111.2	V100 M101 T102 I120	V100-G115 WeakPolarHBondContact CG2-O 3.07Å; M101-G115 PolarHBondContact N-O 3.45Å; T102-G115 PolarHBondContact N-O 2.83Å; T102-G115 VanDerWaalsContact N-O 3.08Å; T102-G115 PolarHBondContact O-N 2.79Å; G115-I120 VanDerWaalsContact CA-O 3.3Å; G115-I120 WeakPolarHBondContact CA-O 3.1Å
116	G	96.9	Very high	96.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	-123.6	177.4	0	0	0	0	0	112.2	W99 D118 N119 Y145 L146	W99-G116 WeakPolarHBondContact O-CA 3.32Å; G116-D118 PolarHBondContact N-OD1 2.86Å; G116-D118 VanDerWaalsContact N-OD1 3.09Å; G116-D118 PolarHBondContact O-N 3.06Å; G116-D118 VanDerWaalsContact O-N 3.12Å; G116-N119 PolarHBondContact O-N 3.13Å; G116-N119 VanDerWaalsContact O-N 3.14Å; G116-Y145 CarbonylContact O-C 3.56Å; G116-Y145 WeakPolarHBondContact O-CA 3.49Å; G116-L146 PolarHBondContact O-N 2.94Å
117	L	96.7	Very high	95.4	Very high	89 Å²	89	31 Å²	31	47%	0.466	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.3	-175.4	-61	-175.3	0	0	0	114.6	W99 M101 N119 Y145	W99-L117 HydrophobicContact CB-CB 3.83Å; W99-L117 HydrophobicContact CB-CD1 3.69Å; W99-L117 HydrophobicContact CB-CG 3.78Å; W99-L117 HydrophobicContact CD2-CD1 3.98Å; W99-L117 HydrophobicContact CE3-CD1 4.09Å; W99-L117 HydrophobicContact CG-CD1 3.82Å; W99-L117 HydrophobicContact CG-CG 4.45Å; W99-L117 PolarHBondContact O-N 3.23Å; M101-L117 HydrophobicContact SD-CD2 3.87Å; M101-L117 HydrophobicContact SD-CG 4.41Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-OD1 3.11Å; L117-Y145 HydrophobicContact CD2-CD1 4.44Å; L117-Y145 HydrophobicContact CD2-CG 4.13Å
118	D	95.9	Very high	94	Very high	51 Å²	51	30.7 Å²	30.7	27%	0.273	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-3.3	172.4	55.4	-2.5	0	0	0	113.2	S97 G116 I120	S97-D118 WeakPolarHBondContact CB-OD2 3.5Å; G116-D118 PolarHBondContact N-OD1 2.86Å; G116-D118 VanDerWaalsContact N-OD1 3.09Å; G116-D118 PolarHBondContact O-N 3.06Å; G116-D118 VanDerWaalsContact O-N 3.12Å; D118-I120 WeakPolarHBondContact O-CG1 3.33Å; D118-I120 PolarHBondContact O-N 2.61Å; D118-I120 VanDerWaalsContact O-N 3.08Å
119	N	97	Very high	92.4	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.251	20%	0.195	S	C	.	.			trans	60.4	13.9	179.8	-52.1	-6.4	0	0	0	113.9	G116 L117 T143 G144 Y145	G116-N119 PolarHBondContact O-N 3.13Å; G116-N119 VanDerWaalsContact O-N 3.14Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-OD1 3.11Å; N119-T143 PolarHBondContact ND2-O 3.01Å; N119-G144 VanDerWaalsContact CB-O 3.31Å; N119-G144 WeakPolarHBondContact CB-O 3.31Å; N119-G144 PolarHBondContact OD1-O 3.02Å; N119-G144 VanDerWaalsContact OD1-O 3.06Å; N119-Y145 VanDerWaalsContact OD1-CA 3.27Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.29Å; N119-Y145 PolarHBondContact OD1-N 3.26Å; N119-Y145 VanDerWaalsContact OD1-N 3.15Å
120	I	97.1	Very high	90.8	Very high	46 Å²	46	46.4 Å²	46.4	24%	0.236	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.5	-175.4	-67.4	166.4	0	0	0	108.9	G115 D118 E138 P140	G115-I120 VanDerWaalsContact CA-O 3.3Å; G115-I120 WeakPolarHBondContact CA-O 3.1Å; D118-I120 WeakPolarHBondContact O-CG1 3.33Å; D118-I120 PolarHBondContact O-N 2.61Å; D118-I120 VanDerWaalsContact O-N 3.08Å; I120-E138 HydrophobicContact CG2-CB 3.85Å; I120-E138 HydrophobicContact CG2-CG 4.24Å; I120-P140 HydrophobicContact CG1-CB 4.39Å
121	C	97.8	Very high	89.6	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.014	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	109.5	165	-175.7	0	0	0	0	109.4	L139 L146 T159	C121-L139 HydrophobicContact CB-CB 4.17Å; C121-L139 HydrophobicContact CB-CD1 4.31Å; C121-L139 PolarHBondContact N-O 3.37Å; C121-L139 PolarHBondContact O-N 2.97Å; C121-L146 HydrophobicContact CB-CD2 3.69Å; C121-T159 HydrophobicContact CB-CG2 4.04Å
122	S	97.6	Very high	88.7	Confident	8 Å²	8	50.1 Å²	50.1	6%	0.056	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	130.6	175.9	-60.6	0	0	0	0	110.6	A113 C114	A113-S122 CarbonylContact C-O 3.56Å; A113-S122 WeakPolarHBondContact CA-O 3.49Å; C114-S122 PolarHBondContact N-O 3.46Å; C114-S122 PolarHBondContact O-N 3.03Å
123	I	97.4	Very high	88	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132	179.3	-60.9	171.2	0	0	0	109.1	Y111 A113 V135 T136 R137 L139 F151 I157 I171	Y111-I123 HydrophobicContact CD1-CG2 3.84Å; Y111-I123 HydrophobicContact CG-CG2 4.32Å; A113-I123 HydrophobicContact CB-CG1 4.25Å; I123-V135 CarbonylContact O-C 3.57Å; I123-T136 PolarHBondContact O-N 2.87Å; I123-R137 HydrophobicContact CB-CB 4.39Å; I123-R137 PolarHBondContact N-O 3.41Å; I123-R137 PolarHBondContact O-N 3.03Å; I123-L139 HydrophobicContact CD1-CD1 3.73Å; I123-L139 HydrophobicContact CD1-CG 4.25Å; I123-F151 HydrophobicContact CG2-CE1 4.43Å; I123-F151 HydrophobicContact CG2-CZ 4.3Å; I123-I157 HydrophobicContact CD1-CG2 4.26Å; I123-I171 HydrophobicContact CD1-CB 4.12Å; I123-I171 HydrophobicContact CD1-CD1 3.85Å; I123-I171 HydrophobicContact CD1-CG1 3.57Å; I123-I171 HydrophobicContact CD1-CG2 3.59Å; I123-I171 HydrophobicContact CG2-CG2 4.48Å
124	Y	96	Very high	87.3	Confident	7 Å²	7	58.4 Å²	58.4	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.2	-177	-58.6	-97.7	0	0	0	110.1	L79 I93 L95 Y111 V112 C114 V133 V135	L79-Y124 HydrophobicContact CD2-CD2 4.41Å; I93-Y124 HydrophobicContact CD1-CG 4.42Å; I93-Y124 HydrophobicContact CG2-CD1 3.61Å; I93-Y124 HydrophobicContact CG2-CE1 3.47Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.47Å; I93-Y124 HydrophobicContact CG2-CG 4.36Å; L95-Y124 HydrophobicContact CD2-CE2 4.22Å; L95-Y124 VanDerWaalsContact CD2-OH 3.27Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.37Å; Y111-Y124 VanDerWaalsContact CA-O 3.24Å; Y111-Y124 WeakPolarHBondContact CA-O 3.39Å; V112-Y124 HydrophobicContact CG2-CD2 4.38Å; V112-Y124 HydrophobicContact CG2-CG 4.45Å; V112-Y124 PolarHBondContact N-O 2.81Å; V112-Y124 PolarHBondContact O-N 3.16Å; C114-Y124 VanDerWaalsContact SG-CE2 3.59Å; Y124-V133 HydrophobicContact CD1-CG1 4.3Å; Y124-V135 HydrophobicContact CD1-CG2 3.95Å; Y124-V135 HydrophobicContact CE1-CB 4.36Å; Y124-V135 HydrophobicContact CE1-CG2 3.36Å
125	S	93.7	Very high	86.8	Confident	17 Å²	17	60.7 Å²	60.7	12%	0.119	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.7	171.4	178	0	0	0	0	110.4	R134 T136	S125-R134 PolarHBondContact N-O 2.99Å; S125-T136 WeakPolarHBondContact CB-OG1 3.49Å; S125-T136 PolarHBondContact N-OG1 2.59Å; S125-T136 VanDerWaalsContact N-OG1 3.15Å
126	L	89.8	Confident	86.4	Confident	19 Å²	19	63.5 Å²	63.5	10%	0.099	32%	0.319	C	S	.	.	S	Bend	trans	-84.4	-26.5	177.2	-56.7	-176.2	0	0	0	112.6	I81 I93 Y105 N110 V112 T128 V133	I81-L126 HydrophobicContact CD1-CD1 3.44Å; I81-L126 VanDerWaalsContact CD1-CD1 3.44Å; I81-L126 HydrophobicContact CD1-CD2 3.3Å; I81-L126 HydrophobicContact CD1-CG 4Å; I93-L126 HydrophobicContact CD1-CD2 4.29Å; Y105-L126 HydrophobicContact CE1-CD1 4.39Å; Y105-L126 HydrophobicContact CE2-CD1 4.47Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.36Å; N110-L126 WeakPolarHBondContact O-CB 3.36Å; N110-L126 PolarHBondContact O-N 3.41Å; V112-L126 HydrophobicContact CG1-CD1 4.02Å; V112-L126 HydrophobicContact CG1-CD2 4.48Å; V112-L126 HydrophobicContact CG1-CG 4.49Å; V112-L126 HydrophobicContact CG2-CD2 3.94Å; L126-T128 PolarHBondContact O-N 3.04Å; L126-V133 HydrophobicContact CD2-CG1 4.26Å; L126-V133 HydrophobicContact CD2-CG2 4.31Å
127	K	79.8	Confident	86.2	Confident	150 Å²	150	68 Å²	68	65%	0.652	34%	0.336	S	S	*	.			trans	-97.1	77.7	178.4	-68.7	-174.3	-176	159.7	0	110	N110	N110-K127 VanDerWaalsContact OD1-CD 3.27Å; N110-K127 WeakPolarHBondContact OD1-CD 3.39Å; N110-K127 WeakPolarHBondContact OD1-CE 3.18Å; N110-K127 PolarHBondContact OD1-NZ 3.48Å
128	T	66.3	Low	86.2	Confident	45 Å²	45	66.6 Å²	66.6	28%	0.276	33%	0.328	S	S	.	.			trans	-102	135.9	171.2	56.7	0	0	0	0	110.8	L126 E130 G131 N132	L126-T128 PolarHBondContact O-N 3.04Å; T128-E130 PolarHBondContact O-N 3.28Å; T128-E130 VanDerWaalsContact O-N 3.12Å; T128-G131 PolarHBondContact O-N 2.86Å; T128-N132 PolarHBondContact OG1-O 3.09Å
129	R	61.6	Low	86.2	Confident	265 Å²	265	64.2 Å²	64.2	100%	1	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.5	176.1	-68.4	-176.6	178.7	-176.4	-0.5	113
130	E	62	Low	86	Confident	133 Å²	133	66.1 Å²	66.1	62%	0.621	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	2.2	-175.8	-62.3	179.9	-172.1	0	0	113.5	T128 N132 R134	T128-E130 PolarHBondContact O-N 3.28Å; T128-E130 VanDerWaalsContact O-N 3.12Å; E130-N132 PolarHBondContact O-N 2.78Å; E130-R134 IonicContact OE2-CZ 3.22Å; E130-R134 IonicContact OE2-NH1 3.11Å; E130-R134 PolarHBondContact OE2-NH1 3.11Å; E130-R134 VanDerWaalsContact OE2-NH1 3.11Å; E130-R134 IonicContact OE2-NH2 2.75Å; E130-R134 PolarHBondContact OE2-NH2 3.24Å
131	G	67.8	Low	85.6	Confident	60 Å²	60	66.2 Å²	66.2	62%	0.619	34%	0.342	S	S	*	.	S	Bend	trans	73.1	-17.4	177.5	0	0	0	0	0	116	T128	T128-G131 PolarHBondContact O-N 2.86Å
132	N	76.8	Confident	85.6	Confident	108 Å²	108	67 Å²	67	58%	0.578	35%	0.346	S	S	*	.	S	Bend	trans	-91.5	125	175.1	-74.5	-15.8	0	0	0	111.1	T128 E130 R134	T128-N132 PolarHBondContact OG1-O 3.09Å; E130-N132 PolarHBondContact O-N 2.78Å; N132-R134 PolarHBondContact O-N 3Å
133	V	84.1	Confident	85.5	Confident	34 Å²	34	72.3 Å²	72.3	21%	0.206	38%	0.378	C	S	.	.			trans	-70.1	122.7	172.4	179.2	0	0	0	0	108.6	I93 Y124 L126	I93-V133 HydrophobicContact CD1-CB 4.43Å; I93-V133 HydrophobicContact CD1-CG1 3.58Å; I93-V133 HydrophobicContact CG1-CB 4.11Å; I93-V133 HydrophobicContact CG1-CG1 3.73Å; Y124-V133 HydrophobicContact CD1-CG1 4.3Å; L126-V133 HydrophobicContact CD2-CG1 4.26Å; L126-V133 HydrophobicContact CD2-CG2 4.31Å
134	R	82.9	Confident	85.5	Confident	140 Å²	140	73 Å²	73	53%	0.528	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	154.8	177.9	-67.1	-171.3	-175.9	147.7	13.8	110.2	S125 E130 N132 T136	S125-R134 PolarHBondContact N-O 2.99Å; E130-R134 IonicContact OE2-CZ 3.22Å; E130-R134 IonicContact OE2-NH1 3.11Å; E130-R134 PolarHBondContact OE2-NH1 3.11Å; E130-R134 VanDerWaalsContact OE2-NH1 3.11Å; E130-R134 IonicContact OE2-NH2 2.75Å; E130-R134 PolarHBondContact OE2-NH2 3.24Å; N132-R134 PolarHBondContact O-N 3Å; R134-T136 PolarHBondContact O-N 3.42Å
135	V	87.8	Confident	85.6	Confident	51 Å²	51	75 Å²	75	31%	0.309	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	121	167.8	-176.9	0	0	0	0	107.8	I123 Y124 E138	I123-V135 CarbonylContact O-C 3.57Å; Y124-V135 HydrophobicContact CD1-CG2 3.95Å; Y124-V135 HydrophobicContact CE1-CB 4.36Å; Y124-V135 HydrophobicContact CE1-CG2 3.36Å; V135-E138 HydrophobicContact CG1-CG 3.73Å
136	T	89.1	Confident	85.8	Confident	61 Å²	61	74.2 Å²	74.2	37%	0.374	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-43.3	174.4	-57	0	0	0	0	110.5	Y111 I123 S125 R134	Y111-T136 HydrophobicContact CE1-CG2 4.28Å; I123-T136 PolarHBondContact O-N 2.87Å; S125-T136 WeakPolarHBondContact CB-OG1 3.49Å; S125-T136 PolarHBondContact N-OG1 2.59Å; S125-T136 VanDerWaalsContact N-OG1 3.15Å; R134-T136 PolarHBondContact O-N 3.42Å
137	R	93.9	Very high	86.2	Confident	95 Å²	95	73.9 Å²	73.9	36%	0.358	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	146.2	-177.6	-166.5	67.2	67.2	-163	-1	110.6	I123 L139 I171 E172	I123-R137 HydrophobicContact CB-CB 4.39Å; I123-R137 PolarHBondContact N-O 3.41Å; I123-R137 PolarHBondContact O-N 3.03Å; R137-L139 HydrophobicContact CG-CD2 3.69Å; R137-L139 HydrophobicContact CG-CG 4.39Å; R137-I171 HydrophobicContact CB-CG2 4.49Å; R137-I171 PolarHBondContact NE-O 3.36Å; R137-E172 PolarHBondContact NH2-O 3Å
138	E	95.9	Very high	87.1	Confident	60 Å²	60	67 Å²	67	28%	0.28	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.9	165.1	-69.4	177.1	172.4	0	0	106.6	R96 I120 V135 P140	R96-E138 IonicContact CZ-OE1 3.1Å; R96-E138 IonicContact NE-OE1 3.73Å; R96-E138 VanDerWaalsContact NH1-CD 3.32Å; R96-E138 IonicContact NH1-OE1 2.73Å; R96-E138 PolarHBondContact NH1-OE1 3.46Å; R96-E138 IonicContact NH1-OE2 3.09Å; R96-E138 PolarHBondContact NH1-OE2 3.32Å; R96-E138 VanDerWaalsContact NH1-OE2 3.09Å; R96-E138 IonicContact NH2-OE1 3.56Å; I120-E138 HydrophobicContact CG2-CB 3.85Å; I120-E138 HydrophobicContact CG2-CG 4.24Å; V135-E138 HydrophobicContact CG1-CG 3.73Å; E138-P140 VanDerWaalsContact C-CD 3.44Å; E138-P140 WeakPolarHBondContact O-CD 3.3Å
139	L	96.6	Very high	88.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	87.5	-179.4	-57.1	176.5	0	0	0	108.7	C121 I123 R137 I157 W169	C121-L139 HydrophobicContact CB-CB 4.17Å; C121-L139 HydrophobicContact CB-CD1 4.31Å; C121-L139 PolarHBondContact N-O 3.37Å; C121-L139 PolarHBondContact O-N 2.97Å; I123-L139 HydrophobicContact CD1-CD1 3.73Å; I123-L139 HydrophobicContact CD1-CG 4.25Å; R137-L139 HydrophobicContact CG-CD2 3.69Å; R137-L139 HydrophobicContact CG-CG 4.39Å; L139-I157 HydrophobicContact CD1-CG2 3.61Å; L139-W169 HydrophobicContact CB-CD2 4.13Å; L139-W169 HydrophobicContact CB-CE3 3.94Å; L139-W169 HydrophobicContact CB-CZ3 4.19Å; L139-W169 HydrophobicContact CD1-CB 3.75Å; L139-W169 HydrophobicContact CD1-CD2 4.09Å; L139-W169 HydrophobicContact CD1-CE3 4.42Å; L139-W169 HydrophobicContact CD1-CG 3.79Å; L139-W169 HydrophobicContact CD2-CE3 4.14Å; L139-W169 HydrophobicContact CG-CE3 4.39Å
140	P	93	Very high	90.4	Very high	86 Å²	86	55 Å²	55	56%	0.558	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.9	173	33.6	-33.3	0	0	0	109.9	I120 E138	I120-P140 HydrophobicContact CG1-CB 4.39Å; E138-P140 VanDerWaalsContact C-CD 3.44Å; E138-P140 WeakPolarHBondContact O-CD 3.3Å
141	G	87.8	Confident	92.1	Very high	49 Å²	49	49 Å²	49	51%	0.505	28%	0.279	S	S	.	.			trans	166.9	-15.5	167.1	0	0	0	0	0	114.9
142	H	96.7	Very high	93.6	Very high	18 Å²	18	47 Å²	47	8%	0.083	25%	0.254	C	S	.	.			trans	-68.7	143.6	163.8	-78.2	-60.2	0	0	0	111.2	T159 S161 D163 T165	H142-T159 PolarHBondContact NE2-OG1 2.85Å; H142-S161 VanDerWaalsContact CG-CB 3.48Å; H142-S161 WeakPolarHBondContact ND1-CB 3.15Å; H142-D163 VanDerWaalsContact CA-OD2 3.29Å; H142-D163 WeakPolarHBondContact CA-OD2 3.47Å; H142-D163 WeakPolarHBondContact CB-OD2 3.11Å; H142-D163 IonicContact CE1-OD2 3.43Å; H142-D163 IonicContact CG-OD2 3.32Å; H142-D163 IonicContact ND1-OD1 3.98Å; H142-D163 PolarHBondContact ND1-OD1 3.49Å; H142-D163 IonicContact ND1-OD2 3.5Å; H142-D163 PolarHBondContact ND1-OD2 3.41Å; H142-T165 PolarHBondContact CE1-OG1 3.24Å; H142-T165 PolarHBondContact ND1-OG1 3.2Å
143	T	97.1	Very high	94.5	Very high	120 Å²	120	45.1 Å²	45.1	74%	0.736	24%	0.244	S	C	*	.	S	Bend	trans	-97.9	-4.2	176.2	60.1	0	0	0	0	112.6	N119 D163	N119-T143 PolarHBondContact ND2-O 3.01Å; T143-D163 PolarHBondContact N-OD2 3.26Å; T143-D163 VanDerWaalsContact OG1-CB 3.28Å; T143-D163 WeakPolarHBondContact OG1-CB 3.24Å
144	G	97.1	Very high	95.1	Very high	13 Å²	13	45.5 Å²	45.5	13%	0.134	25%	0.245	C	C	.	.	S	Bend	trans	-128.4	175.2	175.7	0	0	0	0	0	111.9	N119 S161	N119-G144 VanDerWaalsContact CB-O 3.31Å; N119-G144 WeakPolarHBondContact CB-O 3.31Å; N119-G144 PolarHBondContact OD1-O 3.02Å; N119-G144 VanDerWaalsContact OD1-O 3.06Å; G144-S161 VanDerWaalsContact C-OG 3.25Å; G144-S161 PolarHBondContact O-OG 2.89Å
145	Y	97.7	Very high	95.8	Very high	49 Å²	49	42 Å²	42	19%	0.192	24%	0.238	C	C	.	.			trans	-61.3	148.9	-177	60.5	-94.6	0	0	0	111.7	M101 G116 L117 N119 S161 G162 D186	M101-Y145 HydrophobicContact CE-CD2 3.59Å; M101-Y145 HydrophobicContact CE-CE2 3.68Å; M101-Y145 HydrophobicContact CE-CG 4.49Å; M101-Y145 HydrophobicContact SD-CD2 3.57Å; M101-Y145 VanDerWaalsContact SD-CD2 3.57Å; M101-Y145 HydrophobicContact SD-CE2 4.28Å; M101-Y145 HydrophobicContact SD-CG 4.05Å; G116-Y145 CarbonylContact O-C 3.56Å; G116-Y145 WeakPolarHBondContact O-CA 3.49Å; L117-Y145 HydrophobicContact CD2-CD1 4.44Å; L117-Y145 HydrophobicContact CD2-CG 4.13Å; N119-Y145 VanDerWaalsContact OD1-CA 3.27Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.29Å; N119-Y145 PolarHBondContact OD1-N 3.26Å; N119-Y145 VanDerWaalsContact OD1-N 3.15Å; Y145-S161 CarbonylContact O-C 3.55Å; Y145-S161 WeakPolarHBondContact O-CA 3.28Å; Y145-S161 WeakPolarHBondContact O-CB 3.26Å; Y145-S161 PolarHBondContact O-OG 3.49Å; Y145-G162 PolarHBondContact O-N 2.94Å; Y145-D186 WeakPolarHBondContact CE1-OD2 3.28Å; Y145-D186 VanDerWaalsContact OH-CB 3.29Å; Y145-D186 WeakPolarHBondContact OH-CB 3.45Å; Y145-D186 PolarHBondContact OH-OD2 2.96Å
146	L	98.3	Very high	96.3	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116.6	175.8	-170.6	75.8	0	0	0	109.9	M101 T102 G116 C121 T159 S160	M101-L146 WeakPolarHBondContact CB-O 3.27Å; T102-L146 HydrophobicContact CG2-CD2 3.58Å; T102-L146 HydrophobicContact CG2-CG 3.86Å; G116-L146 PolarHBondContact O-N 2.94Å; C121-L146 HydrophobicContact CB-CD2 3.69Å; L146-T159 HydrophobicContact CD1-CG2 3.67Å; L146-S160 WeakPolarHBondContact CD1-O 3.4Å
147	S	98.1	Very high	96.7	Very high	12 Å²	12	39.5 Å²	39.5	8%	0.084	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-39.4	-174.8	61.2	0	0	0	0	113.4	T102 S160 V187 M188	T102-S147 WeakPolarHBondContact CB-O 3.46Å; S147-S160 PolarHBondContact N-O 2.81Å; S147-S160 VanDerWaalsContact OG-C 3.32Å; S147-S160 WeakPolarHBondContact OG-CB 3.18Å; S147-S160 PolarHBondContact OG-O 2.84Å; S147-S160 VanDerWaalsContact OG-O 3.06Å; S147-S160 PolarHBondContact OG-OG 2.84Å; S147-V187 WeakPolarHBondContact CB-O 3.49Å; S147-V187 PolarHBondContact OG-O 3.44Å; S147-M188 WeakPolarHBondContact CB-O 3.43Å
148	C	98.5	Very high	96.9	Very high	7 Å²	7	35 Å²	35	5%	0.047	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	155.4	178.7	-167	0	0	0	0	110.8	T102 T159 S160 L190	T102-C148 WeakPolarHBondContact OG1-CA 3.13Å; C148-T159 WeakPolarHBondContact O-CA 3.29Å; C148-S160 VanDerWaalsContact CB-OG 3.25Å; C148-S160 WeakPolarHBondContact CB-OG 3.32Å; C148-S160 PolarHBondContact N-OG 3.36Å; C148-S160 PolarHBondContact O-N 2.92Å; C148-L190 HydrophobicContact CB-CG 4.2Å
149	C	98.4	Very high	97.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	148.2	170.9	63	0	0	0	0	111.5	T102 A104 I157 L158 T159	T102-C149 HydrophobicContact CG2-CB 4.36Å; T102-C149 PolarHBondContact OG1-N 2.75Å; T102-C149 VanDerWaalsContact OG1-N 3.13Å; T102-C149 PolarHBondContact OG1-SG 2.92Å; A104-C149 WeakPolarHBondContact CB-O 3.49Å; C149-I157 HydrophobicContact CB-CD1 4.1Å; C149-I157 HydrophobicContact CB-CG1 4.46Å; C149-L158 CarbonylContact C-O 3.54Å; C149-L158 WeakPolarHBondContact CA-O 3.41Å; C149-L158 WeakPolarHBondContact CB-O 3.31Å; C149-T159 HydrophobicContact CB-CG2 4.14Å
150	R	98.6	Very high	97.2	Very high	56 Å²	56	32 Å²	32	21%	0.211	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	132.1	176.3	-68.7	-65.2	179	-97	1.8	110.9	C103 I157 L158 L190 L192	C103-R150 PolarHBondContact O-NH1 2.89Å; R150-I157 WeakPolarHBondContact O-CG1 3.39Å; R150-L158 PolarHBondContact N-O 3.09Å; R150-L158 PolarHBondContact O-N 2.62Å; R150-L190 HydrophobicContact CB-CD1 3.78Å; R150-L190 HydrophobicContact CG-CD1 3.47Å; R150-L190 VanDerWaalsContact CG-CD1 3.47Å; R150-L192 HydrophobicContact CB-CD1 3.62Å; R150-L192 HydrophobicContact CB-CG 4.15Å
151	F	98.5	Very high	97.4	Very high	8 Å²	8	28 Å²	28	4%	0.035	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	137.9	173.5	-71.1	-84.8	0	0	0	110.4	A104 A106 A113 I123 D153 I157 I171 L192	A104-F151 HydrophobicContact CB-CD2 3.79Å; A104-F151 HydrophobicContact CB-CE2 3.91Å; A106-F151 HydrophobicContact CB-CB 4.31Å; A106-F151 HydrophobicContact CB-CD1 4.16Å; A106-F151 HydrophobicContact CB-CD2 3.85Å; A106-F151 HydrophobicContact CB-CE1 4.41Å; A106-F151 HydrophobicContact CB-CE2 4.12Å; A106-F151 HydrophobicContact CB-CG 3.86Å; A106-F151 HydrophobicContact CB-CZ 4.38Å; A113-F151 HydrophobicContact CB-CE2 3.57Å; A113-F151 HydrophobicContact CB-CZ 3.55Å; I123-F151 HydrophobicContact CG2-CE1 4.43Å; I123-F151 HydrophobicContact CG2-CZ 4.3Å; F151-D153 WeakPolarHBondContact CD1-O 3.12Å; F151-I157 HydrophobicContact CD1-CB 4.06Å; F151-I157 HydrophobicContact CD1-CD1 4.07Å; F151-I157 HydrophobicContact CD1-CG1 4.16Å; F151-I157 HydrophobicContact CD2-CD1 4.24Å; F151-I157 HydrophobicContact CE1-CB 4.36Å; F151-I157 HydrophobicContact CE1-CD1 3.88Å; F151-I157 HydrophobicContact CE1-CG1 4.43Å; F151-I157 HydrophobicContact CE2-CD1 4.06Å; F151-I157 HydrophobicContact CG-CD1 4.26Å; F151-I157 HydrophobicContact CG-CG1 4.31Å; F151-I157 HydrophobicContact CZ-CD1 3.89Å; F151-I171 HydrophobicContact CD1-CD1 3.9Å; F151-I171 HydrophobicContact CE1-CD1 3.7Å; F151-L192 VanDerWaalsContact O-CD1 3.28Å; F151-L192 WeakPolarHBondContact O-CD1 3.37Å
152	L	97.8	Very high	97.9	Very high	19 Å²	19	26.2 Å²	26.2	10%	0.099	14%	0.144	C	C	.	.	S	Bend	trans	-82.7	-47	162.8	-82.2	65.7	0	0	0	108.9	Q156 L158 L168 L192 F196 I213	L152-Q156 HydrophobicContact CB-CB 4.13Å; L152-Q156 HydrophobicContact CD2-CB 4.45Å; L152-Q156 PolarHBondContact N-O 2.71Å; L152-L158 HydrophobicContact CD1-CB 4.35Å; L152-L158 HydrophobicContact CD1-CD1 3.73Å; L152-L158 HydrophobicContact CD1-CG 3.62Å; L152-L168 HydrophobicContact CD1-CD1 4.21Å; L152-L168 HydrophobicContact CD2-CD1 4.08Å; L152-L192 HydrophobicContact CD1-CD1 4.13Å; L152-L192 HydrophobicContact CD1-CD2 3.89Å; L152-L192 HydrophobicContact CG-CD2 4.28Å; L152-F196 HydrophobicContact CB-CD1 4.44Å; L152-F196 HydrophobicContact CG-CD1 4.36Å; L152-I213 HydrophobicContact CD2-CD1 4.2Å; L152-I213 HydrophobicContact CD2-CG2 3.94Å
153	D	96.9	Very high	98	Very high	68 Å²	68	26.6 Å²	26.6	36%	0.364	15%	0.147	S	C	.	.	S	Bend	trans	-152.8	-159.8	177.1	58.1	26.6	0	0	0	109.4	F151 T155 Q156	F151-D153 WeakPolarHBondContact CD1-O 3.12Å; D153-T155 VanDerWaalsContact C-N 3.3Å; D153-T155 WeakPolarHBondContact OD1-CA 3.33Å; D153-T155 PolarHBondContact OD1-N 2.88Å; D153-T155 PolarHBondContact OD1-OG1 2.95Å; D153-Q156 PolarHBondContact OD1-N 2.87Å
154	D	96.4	Very high	98.1	Very high	42 Å²	42	23.1 Å²	23.1	23%	0.225	13%	0.125	C	C	.	.	S	Bend	trans	-79.1	-10.1	179.6	-79.2	-1.1	0	0	0	113.8	S108 N110 Y111	S108-D154 WeakPolarHBondContact CB-OD1 3.15Å; S108-D154 VanDerWaalsContact CB-OD2 3.29Å; S108-D154 WeakPolarHBondContact CB-OD2 3.48Å; S108-D154 PolarHBondContact OG-OD1 3.16Å; S108-D154 PolarHBondContact OG-OD2 3.34Å; S108-D154 VanDerWaalsContact OG-OD2 3.06Å; N110-D154 PolarHBondContact ND2-OD2 3.39Å; Y111-D154 HydrophobicContact CD2-CB 4.08Å; Y111-D154 HydrophobicContact CE2-CB 3.82Å
155	T	97.1	Very high	98.1	Very high	65 Å²	65	23.6 Å²	23.6	40%	0.399	13%	0.125	S	C	.	.	S	Bend	trans	-112.2	-18.8	-176.9	65.6	0	0	0	0	112.6	D153 I171	D153-T155 VanDerWaalsContact C-N 3.3Å; D153-T155 WeakPolarHBondContact OD1-CA 3.33Å; D153-T155 PolarHBondContact OD1-N 2.88Å; D153-T155 PolarHBondContact OD1-OG1 2.95Å; T155-I171 WeakPolarHBondContact O-CB 3.34Å; T155-I171 VanDerWaalsContact O-CG1 3.31Å; T155-I171 WeakPolarHBondContact O-CG1 3.18Å; T155-I171 PolarHBondContact O-N 3.07Å
156	Q	98	Very high	98.2	Very high	60 Å²	60	21.3 Å²	21.3	28%	0.28	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.1	-177.3	-66.4	-172.2	-22.7	0	0	113.5	L152 D153 L168 W169	L152-Q156 HydrophobicContact CB-CB 4.13Å; L152-Q156 HydrophobicContact CD2-CB 4.45Å; L152-Q156 PolarHBondContact N-O 2.71Å; D153-Q156 PolarHBondContact OD1-N 2.87Å; Q156-L168 HydrophobicContact CB-CD1 4.23Å; Q156-W169 WeakPolarHBondContact CA-O 3.34Å
157	I	98.6	Very high	98.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.8	175.3	-168.5	171.9	0	0	0	110.6	A113 I123 L139 C149 R150 F151 W169 I171	A113-I157 HydrophobicContact CB-CD1 3.57Å; I123-I157 HydrophobicContact CD1-CG2 4.26Å; L139-I157 HydrophobicContact CD1-CG2 3.61Å; C149-I157 HydrophobicContact CB-CD1 4.1Å; C149-I157 HydrophobicContact CB-CG1 4.46Å; R150-I157 WeakPolarHBondContact O-CG1 3.39Å; F151-I157 HydrophobicContact CD1-CB 4.06Å; F151-I157 HydrophobicContact CD1-CD1 4.07Å; F151-I157 HydrophobicContact CD1-CG1 4.16Å; F151-I157 HydrophobicContact CD2-CD1 4.24Å; F151-I157 HydrophobicContact CE1-CB 4.36Å; F151-I157 HydrophobicContact CE1-CD1 3.88Å; F151-I157 HydrophobicContact CE1-CG1 4.43Å; F151-I157 HydrophobicContact CE2-CD1 4.06Å; F151-I157 HydrophobicContact CG-CD1 4.26Å; F151-I157 HydrophobicContact CG-CG1 4.31Å; F151-I157 HydrophobicContact CZ-CD1 3.89Å; I157-W169 HydrophobicContact CG2-CB 3.83Å; I157-W169 HydrophobicContact CG2-CG 4.33Å; I157-W169 PolarHBondContact N-O 2.94Å; I157-W169 PolarHBondContact O-N 3.45Å; I157-I171 HydrophobicContact CB-CD1 4.17Å; I157-I171 HydrophobicContact CB-CG1 4.44Å; I157-I171 HydrophobicContact CG2-CD1 4.22Å; I157-I171 HydrophobicContact CG2-CG1 3.97Å
158	L	98.6	Very high	98.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	143.3	168.5	-76	170.7	0	0	0	110.7	C149 R150 L152 A167 L168 F180 L190 L192 F199 I213	C149-L158 CarbonylContact C-O 3.54Å; C149-L158 WeakPolarHBondContact CA-O 3.41Å; C149-L158 WeakPolarHBondContact CB-O 3.31Å; R150-L158 PolarHBondContact N-O 3.09Å; R150-L158 PolarHBondContact O-N 2.62Å; L152-L158 HydrophobicContact CD1-CB 4.35Å; L152-L158 HydrophobicContact CD1-CD1 3.73Å; L152-L158 HydrophobicContact CD1-CG 3.62Å; L158-A167 CarbonylContact C-O 3.54Å; L158-A167 VanDerWaalsContact CA-O 3.3Å; L158-A167 WeakPolarHBondContact CA-O 3.5Å; L158-L168 HydrophobicContact CD2-CB 3.85Å; L158-L168 HydrophobicContact CD2-CD1 3.8Å; L158-L168 HydrophobicContact CD2-CG 4.44Å; L158-L168 HydrophobicContact CG-CD1 4.02Å; L158-F180 HydrophobicContact CD2-CD2 4.48Å; L158-F180 HydrophobicContact CD2-CE2 3.68Å; L158-F180 HydrophobicContact CD2-CZ 4.31Å; L158-L190 HydrophobicContact CB-CD2 4.11Å; L158-L192 HydrophobicContact CD1-CD2 3.52Å; L158-L192 HydrophobicContact CD1-CG 4.32Å; L158-F199 HydrophobicContact CD1-CB 4.06Å; L158-F199 HydrophobicContact CD1-CD1 3.66Å; L158-F199 HydrophobicContact CD1-CE1 4.17Å; L158-F199 HydrophobicContact CD1-CG 3.84Å; L158-F199 HydrophobicContact CD2-CD1 4.36Å; L158-F199 HydrophobicContact CD2-CE1 4.05Å; L158-F199 HydrophobicContact CD2-CZ 4.48Å; L158-I213 HydrophobicContact CD1-CD1 4.04Å; L158-I213 HydrophobicContact CD1-CG1 4.39Å
159	T	98.8	Very high	98.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.6	173.8	55.5	0	0	0	0	111.1	C121 H142 L146 C148 C149 C166 A167 W169	C121-T159 HydrophobicContact CB-CG2 4.04Å; H142-T159 PolarHBondContact NE2-OG1 2.85Å; L146-T159 HydrophobicContact CD1-CG2 3.67Å; C148-T159 WeakPolarHBondContact O-CA 3.29Å; C149-T159 HydrophobicContact CB-CG2 4.14Å; T159-C166 CarbonylContact O-C 3.55Å; T159-C166 WeakPolarHBondContact O-CA 3.22Å; T159-C166 VanDerWaalsContact O-CB 3.24Å; T159-C166 WeakPolarHBondContact O-CB 3.17Å; T159-A167 PolarHBondContact N-O 3.34Å; T159-A167 PolarHBondContact O-N 3Å; T159-A167 PolarHBondContact OG1-O 3.16Å; T159-W169 PolarHBondContact OG1-NE1 2.87Å
160	S	98.6	Very high	98.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	148.4	164.1	55	0	0	0	0	110.1	L146 S147 C148	L146-S160 WeakPolarHBondContact CD1-O 3.4Å; S147-S160 PolarHBondContact N-O 2.81Å; S147-S160 VanDerWaalsContact OG-C 3.32Å; S147-S160 WeakPolarHBondContact OG-CB 3.18Å; S147-S160 PolarHBondContact OG-O 2.84Å; S147-S160 VanDerWaalsContact OG-O 3.06Å; S147-S160 PolarHBondContact OG-OG 2.84Å; C148-S160 VanDerWaalsContact CB-OG 3.25Å; C148-S160 WeakPolarHBondContact CB-OG 3.32Å; C148-S160 PolarHBondContact N-OG 3.36Å; C148-S160 PolarHBondContact O-N 2.92Å
161	S	98.6	Very high	98.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	157.5	-175.9	178.4	0	0	0	0	113.5	H142 G144 Y145 D163 T164 T165 V187	H142-S161 VanDerWaalsContact CG-CB 3.48Å; H142-S161 WeakPolarHBondContact ND1-CB 3.15Å; G144-S161 VanDerWaalsContact C-OG 3.25Å; G144-S161 PolarHBondContact O-OG 2.89Å; Y145-S161 CarbonylContact O-C 3.55Å; Y145-S161 WeakPolarHBondContact O-CA 3.28Å; Y145-S161 WeakPolarHBondContact O-CB 3.26Å; Y145-S161 PolarHBondContact O-OG 3.49Å; S161-D163 WeakPolarHBondContact CB-OD1 3.42Å; S161-D163 PolarHBondContact O-N 2.8Å; S161-D163 PolarHBondContact OG-N 2.76Å; S161-D163 VanDerWaalsContact OG-N 3.15Å; S161-D163 PolarHBondContact OG-OD1 2.93Å; S161-T164 PolarHBondContact O-N 3.18Å; S161-T165 PolarHBondContact N-O 3.02Å; S161-V187 PolarHBondContact O-N 3.32Å; S161-V187 VanDerWaalsContact O-N 3.12Å
162	G	98.3	Very high	97.9	Very high	12 Å²	12	27.6 Å²	27.6	12%	0.124	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-5.5	166.3	0	0	0	0	0	114.2	Y145 T164	Y145-G162 PolarHBondContact O-N 2.94Å; G162-T164 PolarHBondContact O-N 3.08Å
163	D	98.2	Very high	97.8	Very high	27 Å²	27	30.5 Å²	30.5	14%	0.144	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	12.3	169.5	67.2	19.2	0	0	0	114.2	H142 T143 S161 T165	H142-D163 VanDerWaalsContact CA-OD2 3.29Å; H142-D163 WeakPolarHBondContact CA-OD2 3.47Å; H142-D163 WeakPolarHBondContact CB-OD2 3.11Å; H142-D163 IonicContact CE1-OD2 3.43Å; H142-D163 IonicContact CG-OD2 3.32Å; H142-D163 IonicContact ND1-OD1 3.98Å; H142-D163 PolarHBondContact ND1-OD1 3.49Å; H142-D163 IonicContact ND1-OD2 3.5Å; H142-D163 PolarHBondContact ND1-OD2 3.41Å; T143-D163 PolarHBondContact N-OD2 3.26Å; T143-D163 VanDerWaalsContact OG1-CB 3.28Å; T143-D163 WeakPolarHBondContact OG1-CB 3.24Å; S161-D163 WeakPolarHBondContact CB-OD1 3.42Å; S161-D163 PolarHBondContact O-N 2.8Å; S161-D163 PolarHBondContact OG-N 2.76Å; S161-D163 VanDerWaalsContact OG-N 3.15Å; S161-D163 PolarHBondContact OG-OD1 2.93Å; D163-T165 VanDerWaalsContact C-N 3.27Å; D163-T165 PolarHBondContact O-N 2.81Å; D163-T165 WeakPolarHBondContact OD1-CB 3.26Å; D163-T165 PolarHBondContact OD1-N 2.83Å; D163-T165 PolarHBondContact OD1-OG1 2.84Å
164	T	98.4	Very high	97.8	Very high	46 Å²	46	27.9 Å²	27.9	28%	0.282	16%	0.156	S	C	.	.	S	Bend	trans	72.2	8.2	-178.4	77.5	0	0	0	0	115.3	S161 G162	S161-T164 PolarHBondContact O-N 3.18Å; G162-T164 PolarHBondContact O-N 3.08Å
165	T	98.4	Very high	97.8	Very high	23 Å²	23	32.2 Å²	32.2	14%	0.141	18%	0.175	C	C	.	.			trans	-115.8	157.4	-178.2	76	0	0	0	0	113.2	H142 S161 D163 T181	H142-T165 PolarHBondContact CE1-OG1 3.24Å; H142-T165 PolarHBondContact ND1-OG1 3.2Å; S161-T165 PolarHBondContact N-O 3.02Å; D163-T165 VanDerWaalsContact C-N 3.27Å; D163-T165 PolarHBondContact O-N 2.81Å; D163-T165 WeakPolarHBondContact OD1-CB 3.26Å; D163-T165 PolarHBondContact OD1-N 2.83Å; D163-T165 PolarHBondContact OD1-OG1 2.84Å; T165-T181 HydrophobicContact CG2-CG2 3.95Å
166	C	98.7	Very high	97.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	157.4	158.3	-58.5	0	0	0	0	109.5	T159 F180 F199	T159-C166 CarbonylContact O-C 3.55Å; T159-C166 WeakPolarHBondContact O-CA 3.22Å; T159-C166 VanDerWaalsContact O-CB 3.24Å; T159-C166 WeakPolarHBondContact O-CB 3.17Å; C166-F180 HydrophobicContact CB-CB 4Å; C166-F180 HydrophobicContact CB-CD2 4.11Å; C166-F180 HydrophobicContact CB-CG 4.45Å; C166-F180 PolarHBondContact N-O 3.33Å; C166-F180 VanDerWaalsContact N-O 3.08Å; C166-F180 PolarHBondContact O-N 2.88Å; C166-F199 HydrophobicContact CB-CE2 4.01Å; C166-F199 HydrophobicContact CB-CZ 3.93Å
167	A	98.5	Very high	97.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.2	-179.7	0	0	0	0	0	111.8	L158 T159 W169 Q176 T178	L158-A167 CarbonylContact C-O 3.54Å; L158-A167 VanDerWaalsContact CA-O 3.3Å; L158-A167 WeakPolarHBondContact CA-O 3.5Å; T159-A167 PolarHBondContact N-O 3.34Å; T159-A167 PolarHBondContact O-N 3Å; T159-A167 PolarHBondContact OG1-O 3.16Å; A167-W169 HydrophobicContact CB-CZ2 4.07Å; A167-Q176 HydrophobicContact CB-CG 4.08Å; A167-T178 WeakPolarHBondContact CA-O 3.45Å
168	L	98.7	Very high	97.7	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130.8	165.6	-178.6	68.8	0	0	0	108.4	L152 Q156 L158 A177 T178 F180 I213	L152-L168 HydrophobicContact CD1-CD1 4.21Å; L152-L168 HydrophobicContact CD2-CD1 4.08Å; Q156-L168 HydrophobicContact CB-CD1 4.23Å; L158-L168 HydrophobicContact CD2-CB 3.85Å; L158-L168 HydrophobicContact CD2-CD1 3.8Å; L158-L168 HydrophobicContact CD2-CG 4.44Å; L158-L168 HydrophobicContact CG-CD1 4.02Å; L168-A177 HydrophobicContact CD2-CB 4.42Å; L168-A177 HydrophobicContact CG-CB 4.41Å; L168-A177 PolarHBondContact O-N 2.88Å; L168-T178 PolarHBondContact N-O 3.19Å; L168-T178 PolarHBondContact O-N 3.04Å; L168-F180 HydrophobicContact CB-CE2 3.91Å; L168-F180 HydrophobicContact CB-CZ 4.39Å; L168-I213 HydrophobicContact CD1-CG2 4.5Å; L168-I213 HydrophobicContact CD2-CG2 3.98Å
169	W	98.5	Very high	97.7	Very high	5 Å²	5	37 Å²	37	2%	0.019	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.9	-177.9	-59.1	83.6	0	0	0	111.2	L139 Q156 I157 T159 A167 Q176	L139-W169 HydrophobicContact CB-CD2 4.13Å; L139-W169 HydrophobicContact CB-CE3 3.94Å; L139-W169 HydrophobicContact CB-CZ3 4.19Å; L139-W169 HydrophobicContact CD1-CB 3.75Å; L139-W169 HydrophobicContact CD1-CD2 4.09Å; L139-W169 HydrophobicContact CD1-CE3 4.42Å; L139-W169 HydrophobicContact CD1-CG 3.79Å; L139-W169 HydrophobicContact CD2-CE3 4.14Å; L139-W169 HydrophobicContact CG-CE3 4.39Å; Q156-W169 WeakPolarHBondContact CA-O 3.34Å; I157-W169 HydrophobicContact CG2-CB 3.83Å; I157-W169 HydrophobicContact CG2-CG 4.33Å; I157-W169 PolarHBondContact N-O 2.94Å; I157-W169 PolarHBondContact O-N 3.45Å; T159-W169 PolarHBondContact OG1-NE1 2.87Å; A167-W169 HydrophobicContact CB-CZ2 4.07Å; W169-Q176 HydrophobicContact CD2-CB 4.47Å; W169-Q176 HydrophobicContact CE3-CB 4.07Å; W169-Q176 HydrophobicContact CH2-CB 4.17Å; W169-Q176 HydrophobicContact CZ3-CB 3.91Å
170	D	97.8	Very high	97.6	Very high	47 Å²	47	37 Å²	37	25%	0.251	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.3	162	179	-62.1	0	0	0	108.2	E172 T173 G174 Q175	D170-E172 VanDerWaalsContact C-N 3.32Å; D170-E172 PolarHBondContact O-N 3.22Å; D170-E172 PolarHBondContact OD1-N 3.35Å; D170-T173 WeakPolarHBondContact CB-OG1 3.3Å; D170-T173 VanDerWaalsContact CG-OG1 3.26Å; D170-T173 PolarHBondContact O-OG1 2.7Å; D170-T173 WeakPolarHBondContact OD1-CB 3.4Å; D170-T173 WeakPolarHBondContact OD1-CG2 3.22Å; D170-T173 PolarHBondContact OD1-N 3.11Å; D170-T173 PolarHBondContact OD1-OG1 3.22Å; D170-G174 VanDerWaalsContact O-CA 3.26Å; D170-G174 WeakPolarHBondContact O-CA 3.3Å; D170-G174 PolarHBondContact O-N 3.32Å; D170-Q175 PolarHBondContact N-O 3Å; D170-Q175 PolarHBondContact O-N 2.88Å
171	I	96.8	Very high	97.6	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.046	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-31.8	-173.9	-61.9	171.8	0	0	0	111.3	I123 R137 F151 T155 I157	I123-I171 HydrophobicContact CD1-CB 4.12Å; I123-I171 HydrophobicContact CD1-CD1 3.85Å; I123-I171 HydrophobicContact CD1-CG1 3.57Å; I123-I171 HydrophobicContact CD1-CG2 3.59Å; I123-I171 HydrophobicContact CG2-CG2 4.48Å; R137-I171 HydrophobicContact CB-CG2 4.49Å; R137-I171 PolarHBondContact NE-O 3.36Å; F151-I171 HydrophobicContact CD1-CD1 3.9Å; F151-I171 HydrophobicContact CE1-CD1 3.7Å; T155-I171 WeakPolarHBondContact O-CB 3.34Å; T155-I171 VanDerWaalsContact O-CG1 3.31Å; T155-I171 WeakPolarHBondContact O-CG1 3.18Å; T155-I171 PolarHBondContact O-N 3.07Å; I157-I171 HydrophobicContact CB-CD1 4.17Å; I157-I171 HydrophobicContact CB-CG1 4.44Å; I157-I171 HydrophobicContact CG2-CD1 4.22Å; I157-I171 HydrophobicContact CG2-CG1 3.97Å
172	E	94.9	Very high	97.5	Very high	147 Å²	147	43.5 Å²	43.5	69%	0.687	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-50.2	-177.6	-175.6	174.6	179	0	0	110.5	R137 D170	R137-E172 PolarHBondContact NH2-O 3Å; D170-E172 VanDerWaalsContact C-N 3.32Å; D170-E172 PolarHBondContact O-N 3.22Å; D170-E172 PolarHBondContact OD1-N 3.35Å
173	T	96	Very high	97.5	Very high	81 Å²	81	43.4 Å²	43.4	50%	0.497	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-24.1	179	62.6	0	0	0	0	112.8	D170 Q175	D170-T173 WeakPolarHBondContact CB-OG1 3.3Å; D170-T173 VanDerWaalsContact CG-OG1 3.26Å; D170-T173 PolarHBondContact O-OG1 2.7Å; D170-T173 WeakPolarHBondContact OD1-CB 3.4Å; D170-T173 WeakPolarHBondContact OD1-CG2 3.22Å; D170-T173 PolarHBondContact OD1-N 3.11Å; D170-T173 PolarHBondContact OD1-OG1 3.22Å; T173-Q175 PolarHBondContact O-N 2.9Å; T173-Q175 PolarHBondContact OG1-N 2.95Å
174	G	95.3	Very high	97.5	Very high	12 Å²	12	48.1 Å²	48.1	12%	0.124	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	15.2	-173.1	0	0	0	0	0	113.7	D170	D170-G174 VanDerWaalsContact O-CA 3.26Å; D170-G174 WeakPolarHBondContact O-CA 3.3Å; D170-G174 PolarHBondContact O-N 3.32Å
175	Q	96.3	Very high	97.5	Very high	133 Å²	133	46.5 Å²	46.5	62%	0.621	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	150.8	-177.1	-63.4	-62.5	-39.7	0	0	111.3	D170 T173 A177	D170-Q175 PolarHBondContact N-O 3Å; D170-Q175 PolarHBondContact O-N 2.88Å; T173-Q175 PolarHBondContact O-N 2.9Å; T173-Q175 PolarHBondContact OG1-N 2.95Å; Q175-A177 PolarHBondContact O-N 3.22Å
176	Q	97.5	Very high	97.5	Very high	78 Å²	78	48 Å²	48	36%	0.364	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	115.9	169.9	-176.6	175.5	12.7	0	0	109.2	A167 W169 T178 S179	A167-Q176 HydrophobicContact CB-CG 4.08Å; W169-Q176 HydrophobicContact CD2-CB 4.47Å; W169-Q176 HydrophobicContact CE3-CB 4.07Å; W169-Q176 HydrophobicContact CH2-CB 4.17Å; W169-Q176 HydrophobicContact CZ3-CB 3.91Å; Q176-T178 WeakPolarHBondContact CG-O 3.46Å; Q176-T178 PolarHBondContact NE2-O 3.25Å; Q176-T178 VanDerWaalsContact NE2-O 3.15Å; Q176-S179 VanDerWaalsContact NE2-CA 3.27Å; Q176-S179 PolarHBondContact NE2-OG 2.86Å
177	A	97	Very high	97.5	Very high	58 Å²	58	48 Å²	48	48%	0.479	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-36.4	177	0	0	0	0	0	111.8	L168 Q175	L168-A177 HydrophobicContact CD2-CB 4.42Å; L168-A177 HydrophobicContact CG-CB 4.41Å; L168-A177 PolarHBondContact O-N 2.88Å; Q175-A177 PolarHBondContact O-N 3.22Å
178	T	97.9	Very high	97.5	Very high	36 Å²	36	50.2 Å²	50.2	22%	0.221	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	143.6	-179.1	-51.5	0	0	0	0	110.7	A167 L168 Q176 F180	A167-T178 WeakPolarHBondContact CA-O 3.45Å; L168-T178 PolarHBondContact N-O 3.19Å; L168-T178 PolarHBondContact O-N 3.04Å; Q176-T178 WeakPolarHBondContact CG-O 3.46Å; Q176-T178 PolarHBondContact NE2-O 3.25Å; Q176-T178 VanDerWaalsContact NE2-O 3.15Å; T178-F180 HydrophobicContact CG2-CE1 4.13Å; T178-F180 HydrophobicContact CG2-CE2 4.21Å; T178-F180 HydrophobicContact CG2-CZ 3.9Å
179	S	97.6	Very high	97.5	Very high	53 Å²	53	50.6 Å²	50.6	37%	0.371	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.1	172.7	-166.3	0	0	0	0	109.6	Q176	Q176-S179 VanDerWaalsContact NE2-CA 3.27Å; Q176-S179 PolarHBondContact NE2-OG 2.86Å
180	F	98.6	Very high	97.5	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	99.9	178.4	-56.3	-86.6	0	0	0	108.2	L158 C166 L168 T178 F199 W211	L158-F180 HydrophobicContact CD2-CD2 4.48Å; L158-F180 HydrophobicContact CD2-CE2 3.68Å; L158-F180 HydrophobicContact CD2-CZ 4.31Å; C166-F180 HydrophobicContact CB-CB 4Å; C166-F180 HydrophobicContact CB-CD2 4.11Å; C166-F180 HydrophobicContact CB-CG 4.45Å; C166-F180 PolarHBondContact N-O 3.33Å; C166-F180 VanDerWaalsContact N-O 3.08Å; C166-F180 PolarHBondContact O-N 2.88Å; L168-F180 HydrophobicContact CB-CE2 3.91Å; L168-F180 HydrophobicContact CB-CZ 4.39Å; T178-F180 HydrophobicContact CG2-CE1 4.13Å; T178-F180 HydrophobicContact CG2-CE2 4.21Å; T178-F180 HydrophobicContact CG2-CZ 3.9Å; F180-F199 HydrophobicContact CB-CZ 4.23Å; F180-F199 AromaticContact CD1-CE1 3.89Å; F180-F199 HydrophobicContact CD1-CE1 3.89Å; F180-F199 HydrophobicContact CD1-CZ 4.01Å; F180-F199 AromaticContact CD2-CE1 3.93Å; F180-F199 HydrophobicContact CD2-CE1 3.93Å; F180-F199 AromaticContact CD2-CZ 3.73Å; F180-F199 HydrophobicContact CD2-CZ 3.73Å; F180-F199 AromaticContact CE1-CE1 3.7Å; F180-F199 HydrophobicContact CE1-CE1 3.7Å; F180-F199 HydrophobicContact CE1-CZ 4.27Å; F180-F199 AromaticContact CE2-CE1 3.76Å; F180-F199 HydrophobicContact CE2-CE1 3.76Å; F180-F199 HydrophobicContact CE2-CZ 4.04Å; F180-F199 HydrophobicContact CG-CE1 4.01Å; F180-F199 AromaticContact CG-CZ 3.73Å; F180-F199 HydrophobicContact CG-CZ 3.73Å; F180-F199 AromaticContact CZ-CE1 3.66Å; F180-F199 HydrophobicContact CZ-CE1 3.66Å; F180-F199 HydrophobicContact CZ-CZ 4.31Å; F180-W211 HydrophobicContact CB-CD2 4.03Å; F180-W211 HydrophobicContact CB-CE3 3.75Å; F180-W211 HydrophobicContact CB-CH2 4.32Å; F180-W211 HydrophobicContact CB-CZ3 3.89Å; F180-W211 HydrophobicContact CD1-CB 4Å; F180-W211 HydrophobicContact CD1-CD2 4.16Å; F180-W211 AromaticContact CD1-CE3 3.8Å; F180-W211 HydrophobicContact CD1-CE3 3.8Å; F180-W211 HydrophobicContact CD1-CG 4.27Å; F180-W211 HydrophobicContact CE1-CB 4.26Å; F180-W211 HydrophobicContact CG-CD2 4.44Å; F180-W211 HydrophobicContact CG-CE3 4.23Å
181	T	97.8	Very high	97.6	Very high	96 Å²	96	49 Å²	49	59%	0.589	29%	0.292	S	S	*	.			trans	-109.5	139.9	-178.1	59	0	0	0	0	110.2	T165 W211	T165-T181 HydrophobicContact CG2-CG2 3.95Å; T181-W211 WeakPolarHBondContact O-CH2 3.36Å
182	G	97.2	Very high	97.7	Very high	41 Å²	41	49.8 Å²	49.8	42%	0.423	30%	0.296	S	S	.	.			trans	154.9	-14.3	177.9	0	0	0	0	0	115.4	K209	G182-K209 WeakPolarHBondContact O-CE 3.29Å; G182-K209 PolarHBondContact O-NZ 3.04Å
183	H	98.4	Very high	97.8	Very high	10 Å²	10	43 Å²	43	5%	0.046	27%	0.265	C	S	.	.			trans	-72.1	153.5	164.7	-81.4	-66.6	0	0	0	110.7	V187 S201 A203 D205 W211	H183-V187 HydrophobicContact CB-CG2 4.01Å; H183-S201 PolarHBondContact CD2-OG 2.76Å; H183-S201 PolarHBondContact NE2-OG 2.9Å; H183-A203 HydrophobicContact CB-CB 4.35Å; H183-A203 VanDerWaalsContact ND1-CB 3.34Å; H183-A203 WeakPolarHBondContact ND1-CB 3.12Å; H183-D205 WeakPolarHBondContact CA-OD2 3.24Å; H183-D205 WeakPolarHBondContact CB-OD2 3.11Å; H183-D205 IonicContact CE1-OD1 2.91Å; H183-D205 IonicContact CE1-OD2 3.53Å; H183-D205 IonicContact CG-OD2 3.34Å; H183-D205 IonicContact ND1-OD1 3.48Å; H183-D205 PolarHBondContact ND1-OD1 3.14Å; H183-D205 IonicContact ND1-OD2 2.79Å; H183-D205 PolarHBondContact ND1-OD2 3.06Å; H183-W211 AromaticContact CD2-CZ2 3.97Å
184	T	98.1	Very high	97.8	Very high	125 Å²	125	42.4 Å²	42.4	77%	0.767	26%	0.263	S	S	*	.	S	Bend	trans	-113.8	5.6	178	57.5	0	0	0	0	113.1	D205	T184-D205 PolarHBondContact N-OD2 3.19Å; T184-D205 VanDerWaalsContact OG1-CB 3.31Å; T184-D205 WeakPolarHBondContact OG1-CB 3.49Å
185	G	98.2	Very high	97.8	Very high	12 Å²	12	46.1 Å²	46.1	12%	0.124	28%	0.28	C	S	.	.	S	Bend	trans	-145.6	172.9	175.3	0	0	0	0	0	110.3	V187	G185-V187 PolarHBondContact O-N 3.49Å
186	D	98.6	Very high	97.8	Very high	56 Å²	56	44.1 Å²	44.1	30%	0.299	27%	0.269	S	S	.	.			trans	-53.5	127.8	-177.6	-61.4	17.6	0	0	0	110.8	Y145 M188 A203 C204	Y145-D186 WeakPolarHBondContact CE1-OD2 3.28Å; Y145-D186 VanDerWaalsContact OH-CB 3.29Å; Y145-D186 WeakPolarHBondContact OH-CB 3.45Å; Y145-D186 PolarHBondContact OH-OD2 2.96Å; D186-M188 HydrophobicContact CB-SD 4.38Å; D186-M188 PolarHBondContact O-N 2.9Å; D186-A203 CarbonylContact O-C 3.57Å; D186-A203 WeakPolarHBondContact O-CA 3.42Å; D186-A203 VanDerWaalsContact O-CB 3.27Å; D186-A203 WeakPolarHBondContact O-CB 3.19Å; D186-C204 HydrophobicContact CB-CB 4.38Å; D186-C204 PolarHBondContact O-N 3.24Å
187	V	98.8	Very high	97.8	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	120.8	176	-171.8	0	0	0	0	107.5	S147 S161 H183 G185 G202 A203	S147-V187 WeakPolarHBondContact CB-O 3.49Å; S147-V187 PolarHBondContact OG-O 3.44Å; S161-V187 PolarHBondContact O-N 3.32Å; S161-V187 VanDerWaalsContact O-N 3.12Å; H183-V187 HydrophobicContact CB-CG2 4.01Å; G185-V187 PolarHBondContact O-N 3.49Å; V187-G202 WeakPolarHBondContact CG1-O 3.44Å; V187-A203 HydrophobicContact CG2-CB 4.36Å
188	M	98.6	Very high	97.9	Very high	46 Å²	46	47.5 Å²	47.5	23%	0.227	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-31.6	-171.7	-65.1	-58.2	-71.8	0	0	113.1	S147 D186 G202 I229	S147-M188 WeakPolarHBondContact CB-O 3.43Å; D186-M188 HydrophobicContact CB-SD 4.38Å; D186-M188 PolarHBondContact O-N 2.9Å; M188-G202 PolarHBondContact N-O 2.6Å; M188-I229 WeakPolarHBondContact CB-O 3.42Å
189	S	98.3	Very high	97.9	Very high	17 Å²	17	45.8 Å²	45.8	12%	0.119	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	154.1	-175.4	-166.7	0	0	0	0	112	S201 G202 N230	S189-S201 CarbonylContact O-C 3.56Å; S189-S201 VanDerWaalsContact O-CA 3.29Å; S189-S201 WeakPolarHBondContact O-CA 3.23Å; S189-G202 PolarHBondContact N-O 3.4Å; S189-G202 PolarHBondContact O-N 2.95Å; S189-N230 WeakPolarHBondContact CB-O 3.48Å
190	L	98.6	Very high	98	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	154.1	170.2	65.1	77.2	0	0	0	111	C148 R150 L158 F199 V200	C148-L190 HydrophobicContact CB-CG 4.2Å; R150-L190 HydrophobicContact CB-CD1 3.78Å; R150-L190 HydrophobicContact CG-CD1 3.47Å; R150-L190 VanDerWaalsContact CG-CD1 3.47Å; L158-L190 HydrophobicContact CB-CD2 4.11Å; L190-F199 HydrophobicContact CB-CD2 4.19Å; L190-V200 CarbonylContact C-O 3.48Å; L190-V200 WeakPolarHBondContact CA-O 3.46Å
191	S	98.7	Very high	98	Very high	18 Å²	18	43.2 Å²	43.2	13%	0.126	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	133	174.2	-170.3	0	0	0	0	109.6	F199 V200 F234	S191-F199 VanDerWaalsContact O-CA 3.3Å; S191-F199 WeakPolarHBondContact O-CA 3.25Å; S191-F199 VanDerWaalsContact O-CB 3.32Å; S191-F199 WeakPolarHBondContact O-CB 3.34Å; S191-V200 PolarHBondContact N-O 3.04Å; S191-V200 PolarHBondContact O-N 3.05Å; S191-F234 VanDerWaalsContact O-CD2 3.32Å; S191-F234 WeakPolarHBondContact O-CD2 3.35Å; S191-F234 WeakPolarHBondContact O-CE2 3.19Å; S191-F234 PolarHBondContact OG-N 2.76Å
192	L	98.5	Very high	98	Very high	24 Å²	24	38.7 Å²	38.7	13%	0.126	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	140.7	175.3	-80.6	166.4	0	0	0	110.6	R150 F151 L152 L158 F196 F199 I213 F234	R150-L192 HydrophobicContact CB-CD1 3.62Å; R150-L192 HydrophobicContact CB-CG 4.15Å; F151-L192 VanDerWaalsContact O-CD1 3.28Å; F151-L192 WeakPolarHBondContact O-CD1 3.37Å; L152-L192 HydrophobicContact CD1-CD1 4.13Å; L152-L192 HydrophobicContact CD1-CD2 3.89Å; L152-L192 HydrophobicContact CG-CD2 4.28Å; L158-L192 HydrophobicContact CD1-CD2 3.52Å; L158-L192 HydrophobicContact CD1-CG 4.32Å; L192-F196 HydrophobicContact CD1-CD1 3.85Å; L192-F196 HydrophobicContact CD1-CE1 3.79Å; L192-F196 HydrophobicContact CD2-CD1 4.36Å; L192-F196 HydrophobicContact CG-CD1 4.49Å; L192-F199 HydrophobicContact CD2-CB 4.19Å; L192-I213 HydrophobicContact CD2-CD1 3.83Å; L192-F234 WeakPolarHBondContact O-CD2 3.49Å
193	S	97.7	Very high	98.1	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.028	19%	0.193	C	C	.	.			trans	-65.3	152.5	168.2	54.9	0	0	0	0	110.7	D195 F196 R197 T198 F234	S193-D195 PolarHBondContact O-N 3.27Å; S193-D195 VanDerWaalsContact O-N 3.11Å; S193-D195 PolarHBondContact OG-OD1 2.85Å; S193-F196 PolarHBondContact O-N 3.1Å; S193-R197 PolarHBondContact OG-N 2.85Å; S193-T198 VanDerWaalsContact CB-O 3.31Å; S193-T198 WeakPolarHBondContact CB-O 3.27Å; S193-T198 VanDerWaalsContact CB-OG1 3.29Å; S193-T198 WeakPolarHBondContact CB-OG1 3.16Å; S193-T198 PolarHBondContact N-O 2.98Å; S193-T198 PolarHBondContact OG-N 3.21Å; S193-T198 PolarHBondContact OG-O 2.75Å; S193-T198 PolarHBondContact OG-OG1 3.12Å; S193-T198 VanDerWaalsContact OG-OG1 3.13Å; S193-F234 VanDerWaalsContact N-CE2 3.26Å
194	P	95.8	Very high	98.1	Very high	70 Å²	70	38 Å²	38	46%	0.455	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-23	179.1	-25.7	34.8	0	0	0	114.9
195	D	95.9	Very high	98.1	Very high	90 Å²	90	33.6 Å²	33.6	48%	0.481	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	0.2	178.5	73.7	-3.1	0	0	0	113.7	S193 R197	S193-D195 PolarHBondContact O-N 3.27Å; S193-D195 VanDerWaalsContact O-N 3.11Å; S193-D195 PolarHBondContact OG-OD1 2.85Å; D195-R197 HydrophobicContact CB-CG 4.38Å; D195-R197 PolarHBondContact O-N 3.42Å; D195-R197 VanDerWaalsContact O-N 3.16Å; D195-R197 WeakPolarHBondContact OD1-CB 3.5Å; D195-R197 PolarHBondContact OD1-N 2.99Å; D195-R197 WeakPolarHBondContact OD2-CD 3.39Å; D195-R197 IonicContact OD2-NE 3.6Å
196	F	96.4	Very high	98.1	Very high	91 Å²	91	34 Å²	34	40%	0.399	18%	0.176	S	C	.	.	S	Bend	trans	56.7	21.7	-178.2	-63.3	-94.3	0	0	0	114.7	L152 L192 S193 I213	L152-F196 HydrophobicContact CB-CD1 4.44Å; L152-F196 HydrophobicContact CG-CD1 4.36Å; L192-F196 HydrophobicContact CD1-CD1 3.85Å; L192-F196 HydrophobicContact CD1-CE1 3.79Å; L192-F196 HydrophobicContact CD2-CD1 4.36Å; L192-F196 HydrophobicContact CG-CD1 4.49Å; S193-F196 PolarHBondContact O-N 3.1Å; F196-I213 WeakPolarHBondContact O-CD1 3.29Å
197	R	97.1	Very high	98.1	Very high	179 Å²	179	32.2 Å²	32.2	68%	0.675	17%	0.167	S	C	*	.	S	Bend	trans	-94.7	-30.2	178.1	-62	-175.3	-179.7	-165.3	-1.1	113	S193 D195 I213	S193-R197 PolarHBondContact OG-N 2.85Å; D195-R197 HydrophobicContact CB-CG 4.38Å; D195-R197 PolarHBondContact O-N 3.42Å; D195-R197 VanDerWaalsContact O-N 3.16Å; D195-R197 WeakPolarHBondContact OD1-CB 3.5Å; D195-R197 PolarHBondContact OD1-N 2.99Å; D195-R197 WeakPolarHBondContact OD2-CD 3.39Å; D195-R197 IonicContact OD2-NE 3.6Å; R197-I213 WeakPolarHBondContact O-CB 3.47Å; R197-I213 WeakPolarHBondContact O-CG1 3.42Å; R197-I213 PolarHBondContact O-N 2.58Å
198	T	98.3	Very high	98.1	Very high	28 Å²	28	32.2 Å²	32.2	17%	0.172	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	162.3	-179	62	0	0	0	0	111	S193 W211	S193-T198 VanDerWaalsContact CB-O 3.31Å; S193-T198 WeakPolarHBondContact CB-O 3.27Å; S193-T198 VanDerWaalsContact CB-OG1 3.29Å; S193-T198 WeakPolarHBondContact CB-OG1 3.16Å; S193-T198 PolarHBondContact N-O 2.98Å; S193-T198 PolarHBondContact OG-N 3.21Å; S193-T198 PolarHBondContact OG-O 2.75Å; S193-T198 PolarHBondContact OG-OG1 3.12Å; S193-T198 VanDerWaalsContact OG-OG1 3.13Å; T198-W211 CarbonylContact C-O 3.53Å; T198-W211 WeakPolarHBondContact CA-O 3.34Å; T198-W211 WeakPolarHBondContact CB-O 3.47Å
199	F	98.8	Very high	98.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	157.1	167.3	73.6	-84.3	0	0	0	110.6	L158 C166 F180 L190 S191 L192 W211 I213	L158-F199 HydrophobicContact CD1-CB 4.06Å; L158-F199 HydrophobicContact CD1-CD1 3.66Å; L158-F199 HydrophobicContact CD1-CE1 4.17Å; L158-F199 HydrophobicContact CD1-CG 3.84Å; L158-F199 HydrophobicContact CD2-CD1 4.36Å; L158-F199 HydrophobicContact CD2-CE1 4.05Å; L158-F199 HydrophobicContact CD2-CZ 4.48Å; C166-F199 HydrophobicContact CB-CE2 4.01Å; C166-F199 HydrophobicContact CB-CZ 3.93Å; F180-F199 HydrophobicContact CB-CZ 4.23Å; F180-F199 AromaticContact CD1-CE1 3.89Å; F180-F199 HydrophobicContact CD1-CE1 3.89Å; F180-F199 HydrophobicContact CD1-CZ 4.01Å; F180-F199 AromaticContact CD2-CE1 3.93Å; F180-F199 HydrophobicContact CD2-CE1 3.93Å; F180-F199 AromaticContact CD2-CZ 3.73Å; F180-F199 HydrophobicContact CD2-CZ 3.73Å; F180-F199 AromaticContact CE1-CE1 3.7Å; F180-F199 HydrophobicContact CE1-CE1 3.7Å; F180-F199 HydrophobicContact CE1-CZ 4.27Å; F180-F199 AromaticContact CE2-CE1 3.76Å; F180-F199 HydrophobicContact CE2-CE1 3.76Å; F180-F199 HydrophobicContact CE2-CZ 4.04Å; F180-F199 HydrophobicContact CG-CE1 4.01Å; F180-F199 AromaticContact CG-CZ 3.73Å; F180-F199 HydrophobicContact CG-CZ 3.73Å; F180-F199 AromaticContact CZ-CE1 3.66Å; F180-F199 HydrophobicContact CZ-CE1 3.66Å; F180-F199 HydrophobicContact CZ-CZ 4.31Å; L190-F199 HydrophobicContact CB-CD2 4.19Å; S191-F199 VanDerWaalsContact O-CA 3.3Å; S191-F199 WeakPolarHBondContact O-CA 3.25Å; S191-F199 VanDerWaalsContact O-CB 3.32Å; S191-F199 WeakPolarHBondContact O-CB 3.34Å; L192-F199 HydrophobicContact CD2-CB 4.19Å; F199-W211 HydrophobicContact CD1-CB 3.75Å; F199-W211 HydrophobicContact CD1-CG 4.43Å; F199-W211 AromaticContact CD2-CD1 3.79Å; F199-W211 HydrophobicContact CD2-CG 4.46Å; F199-W211 HydrophobicContact CE1-CB 3.33Å; F199-W211 AromaticContact CE1-CG 3.82Å; F199-W211 HydrophobicContact CE1-CG 3.82Å; F199-W211 HydrophobicContact CE2-CB 4.19Å; F199-W211 AromaticContact CE2-CD1 3.28Å; F199-W211 AromaticContact CE2-CG 3.84Å; F199-W211 HydrophobicContact CE2-CG 3.84Å; F199-W211 AromaticContact CE2-NE1 3.89Å; F199-W211 HydrophobicContact CG-CB 4.34Å; F199-W211 HydrophobicContact CZ-CB 3.57Å; F199-W211 AromaticContact CZ-CD1 3.43Å; F199-W211 VanDerWaalsContact CZ-CD1 3.43Å; F199-W211 HydrophobicContact CZ-CD2 4.27Å; 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 2.97Å; F199-W211 PolarHBondContact O-N 3.41Å; F199-I213 HydrophobicContact CD1-CD1 4.23Å; F199-I213 HydrophobicContact CD1-CG1 3.69Å; F199-I213 HydrophobicContact CE1-CG1 4.29Å
200	V	98.9	Very high	98.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	142.6	169.4	-66.5	0	0	0	0	109.7	L190 S191 K209 L210 V232 F234 F241	L190-V200 CarbonylContact C-O 3.48Å; L190-V200 WeakPolarHBondContact CA-O 3.46Å; S191-V200 PolarHBondContact N-O 3.04Å; S191-V200 PolarHBondContact O-N 3.05Å; V200-K209 CarbonylContact C-O 3.53Å; V200-K209 VanDerWaalsContact CA-O 3.23Å; V200-K209 WeakPolarHBondContact CA-O 3.33Å; V200-L210 HydrophobicContact CG1-CB 4.4Å; V200-L210 HydrophobicContact CG1-CD1 3.73Å; V200-V232 HydrophobicContact CG2-CB 4.21Å; V200-V232 HydrophobicContact CG2-CG2 4.08Å; V200-F234 HydrophobicContact CB-CE2 4.14Å; V200-F234 HydrophobicContact CB-CZ 4.42Å; V200-F234 HydrophobicContact CG1-CE1 4.31Å; V200-F234 HydrophobicContact CG1-CE2 3.85Å; V200-F234 HydrophobicContact CG1-CZ 3.63Å; V200-F234 HydrophobicContact CG2-CD2 3.87Å; V200-F234 HydrophobicContact CG2-CE2 3.66Å; V200-F234 HydrophobicContact CG2-CZ 4.27Å; V200-F241 HydrophobicContact CG1-CD1 4Å; V200-F241 HydrophobicContact CG1-CE1 4.26Å; V200-F241 HydrophobicContact CG1-CG 4.18Å; V200-F241 HydrophobicContact CG2-CB 4.29Å; V200-F241 HydrophobicContact CG2-CD2 4.37Å; V200-F241 HydrophobicContact CG2-CG 4.3Å
201	S	98.8	Very high	98.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.1	170.6	58	0	0	0	0	110.7	H183 S189 S208 K209 W211	H183-S201 PolarHBondContact CD2-OG 2.76Å; H183-S201 PolarHBondContact NE2-OG 2.9Å; S189-S201 CarbonylContact O-C 3.56Å; S189-S201 VanDerWaalsContact O-CA 3.29Å; S189-S201 WeakPolarHBondContact O-CA 3.23Å; S201-S208 CarbonylContact O-C 3.57Å; S201-S208 WeakPolarHBondContact O-CA 3.41Å; S201-S208 WeakPolarHBondContact O-CB 3.38Å; S201-K209 PolarHBondContact N-O 2.73Å; S201-K209 PolarHBondContact O-N 3.15Å; S201-W211 PolarHBondContact OG-NE1 3.27Å
202	G	98.7	Very high	98.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.3	171.4	0	0	0	0	0	110.5	V187 M188 S189 I229	V187-G202 WeakPolarHBondContact CG1-O 3.44Å; M188-G202 PolarHBondContact N-O 2.6Å; S189-G202 PolarHBondContact N-O 3.4Å; S189-G202 PolarHBondContact O-N 2.95Å; G202-I229 CarbonylContact C-O 3.57Å
203	A	98.8	Very high	98.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	170.9	-171.5	0	0	0	0	0	113.3	H183 D186 V187 D205 A206 T207 I229	H183-A203 HydrophobicContact CB-CB 4.35Å; H183-A203 VanDerWaalsContact ND1-CB 3.34Å; H183-A203 WeakPolarHBondContact ND1-CB 3.12Å; D186-A203 CarbonylContact O-C 3.57Å; D186-A203 WeakPolarHBondContact O-CA 3.42Å; D186-A203 VanDerWaalsContact O-CB 3.27Å; D186-A203 WeakPolarHBondContact O-CB 3.19Å; V187-A203 HydrophobicContact CG2-CB 4.36Å; A203-D205 PolarHBondContact O-N 3.49Å; A203-A206 PolarHBondContact O-N 2.9Å; A203-T207 PolarHBondContact N-O 2.92Å; A203-I229 PolarHBondContact O-N 3.13Å
204	C	98.7	Very high	98	Very high	36 Å²	36	42.5 Å²	42.5	24%	0.243	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-1.7	173.4	-63.6	0	0	0	0	113.8	D186 A206 D228	D186-C204 HydrophobicContact CB-CB 4.38Å; D186-C204 PolarHBondContact O-N 3.24Å; C204-A206 PolarHBondContact O-N 2.89Å; C204-D228 HydrophobicContact CB-CB 4.29Å; C204-D228 VanDerWaalsContact SG-CG 3.59Å; C204-D228 PolarHBondContact SG-OD2 3.13Å
205	D	98.3	Very high	97.9	Very high	34 Å²	34	42.3 Å²	42.3	18%	0.182	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	10.4	169.5	64.1	19.8	0	0	0	113.3	H183 T184 A203 T207	H183-D205 WeakPolarHBondContact CA-OD2 3.24Å; H183-D205 WeakPolarHBondContact CB-OD2 3.11Å; H183-D205 IonicContact CE1-OD1 2.91Å; H183-D205 IonicContact CE1-OD2 3.53Å; H183-D205 IonicContact CG-OD2 3.34Å; H183-D205 IonicContact ND1-OD1 3.48Å; H183-D205 PolarHBondContact ND1-OD1 3.14Å; H183-D205 IonicContact ND1-OD2 2.79Å; H183-D205 PolarHBondContact ND1-OD2 3.06Å; T184-D205 PolarHBondContact N-OD2 3.19Å; T184-D205 VanDerWaalsContact OG1-CB 3.31Å; T184-D205 WeakPolarHBondContact OG1-CB 3.49Å; A203-D205 PolarHBondContact O-N 3.49Å; D205-T207 VanDerWaalsContact CG-OG1 3.27Å; D205-T207 WeakPolarHBondContact O-CG2 3.36Å; D205-T207 PolarHBondContact O-N 2.82Å; D205-T207 VanDerWaalsContact O-N 3.16Å; D205-T207 WeakPolarHBondContact OD1-CA 3.3Å; D205-T207 WeakPolarHBondContact OD1-CB 3.37Å; D205-T207 PolarHBondContact OD1-N 2.89Å; D205-T207 PolarHBondContact OD1-OG1 3.37Å; D205-T207 PolarHBondContact OD2-OG1 3.3Å
206	A	98.3	Very high	97.9	Very high	19 Å²	19	38.6 Å²	38.6	16%	0.157	18%	0.179	C	C	.	.	S	Bend	trans	58.3	19.1	-175.5	0	0	0	0	0	114.2	A203 C204 H225 S227	A203-A206 PolarHBondContact O-N 2.9Å; C204-A206 PolarHBondContact O-N 2.89Å; A206-H225 HydrophobicContact CB-CB 4.38Å; A206-S227 WeakPolarHBondContact CA-O 3.44Å; A206-S227 VanDerWaalsContact CB-O 3.27Å; A206-S227 WeakPolarHBondContact CB-O 3.35Å
207	T	98.4	Very high	97.9	Very high	20 Å²	20	39.8 Å²	39.8	12%	0.123	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	149.5	177	78.8	0	0	0	0	112.1	A203 D205 F222 T223	A203-T207 PolarHBondContact N-O 2.92Å; D205-T207 VanDerWaalsContact CG-OG1 3.27Å; D205-T207 WeakPolarHBondContact O-CG2 3.36Å; D205-T207 PolarHBondContact O-N 2.82Å; D205-T207 VanDerWaalsContact O-N 3.16Å; D205-T207 WeakPolarHBondContact OD1-CA 3.3Å; D205-T207 WeakPolarHBondContact OD1-CB 3.37Å; D205-T207 PolarHBondContact OD1-N 2.89Å; D205-T207 PolarHBondContact OD1-OG1 3.37Å; D205-T207 PolarHBondContact OD2-OG1 3.3Å; T207-F222 WeakPolarHBondContact CA-O 3.27Å; T207-T223 HydrophobicContact CG2-CG2 3.99Å
208	S	98.7	Very high	98	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.2	163.9	-61.1	0	0	0	0	109.9	S201 S221 F222 I229	S201-S208 CarbonylContact O-C 3.57Å; S201-S208 WeakPolarHBondContact O-CA 3.41Å; S201-S208 WeakPolarHBondContact O-CB 3.38Å; S208-S221 CarbonylContact O-C 3.54Å; S208-S221 WeakPolarHBondContact O-CA 3.31Å; S208-F222 PolarHBondContact N-O 3.37Å; S208-F222 PolarHBondContact O-N 3.07Å; S208-I229 VanDerWaalsContact OG-CD1 3.26Å; S208-I229 WeakPolarHBondContact OG-CD1 3.38Å
209	K	98.8	Very high	98	Very high	27 Å²	27	38.6 Å²	38.6	12%	0.117	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.1	179.9	-70	177.5	-170.2	-73.1	0	110.9	G182 V200 S201 W211 Q220 S221	G182-K209 WeakPolarHBondContact O-CE 3.29Å; G182-K209 PolarHBondContact O-NZ 3.04Å; V200-K209 CarbonylContact C-O 3.53Å; V200-K209 VanDerWaalsContact CA-O 3.23Å; V200-K209 WeakPolarHBondContact CA-O 3.33Å; S201-K209 PolarHBondContact N-O 2.73Å; S201-K209 PolarHBondContact O-N 3.15Å; K209-W211 HydrophobicContact CB-CZ2 3.77Å; K209-W211 HydrophobicContact CD-CH2 4.05Å; K209-W211 HydrophobicContact CD-CZ2 3.55Å; K209-W211 HydrophobicContact CG-CZ2 4.3Å; K209-W211 PolarHBondContact O-NE1 3.47Å; K209-Q220 WeakPolarHBondContact CA-O 3.3Å; K209-S221 PolarHBondContact NZ-OG 2.8Å
210	L	98.8	Very high	97.9	Very high	11 Å²	11	40.9 Å²	40.9	6%	0.058	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.2	171.3	179	74.1	0	0	0	108.9	V200 C218 R219 Q220 F222 F234 L255	V200-L210 HydrophobicContact CG1-CB 4.4Å; V200-L210 HydrophobicContact CG1-CD1 3.73Å; L210-C218 CarbonylContact O-C 3.48Å; L210-C218 WeakPolarHBondContact O-CA 3.15Å; L210-R219 HydrophobicContact CD2-CB 4.1Å; L210-R219 HydrophobicContact CG-CB 4.4Å; L210-R219 PolarHBondContact O-N 3.05Å; L210-Q220 HydrophobicContact CB-CB 4.23Å; L210-Q220 PolarHBondContact N-O 2.87Å; L210-F222 HydrophobicContact CB-CE2 4.1Å; L210-F234 HydrophobicContact CD1-CZ 4.05Å; L210-L255 HydrophobicContact CD1-CD1 4.28Å; L210-L255 HydrophobicContact CD1-CD2 4.29Å; L210-L255 HydrophobicContact CD2-CD1 4.13Å; L210-L255 HydrophobicContact CD2-CD2 4.09Å
211	W	98.8	Very high	97.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.7	-178.3	-52.5	90.6	0	0	0	110.5	F180 T181 H183 T198 F199 S201 K209 M217 C218	F180-W211 HydrophobicContact CB-CD2 4.03Å; F180-W211 HydrophobicContact CB-CE3 3.75Å; F180-W211 HydrophobicContact CB-CH2 4.32Å; F180-W211 HydrophobicContact CB-CZ3 3.89Å; F180-W211 HydrophobicContact CD1-CB 4Å; F180-W211 HydrophobicContact CD1-CD2 4.16Å; F180-W211 AromaticContact CD1-CE3 3.8Å; F180-W211 HydrophobicContact CD1-CE3 3.8Å; F180-W211 HydrophobicContact CD1-CG 4.27Å; F180-W211 HydrophobicContact CE1-CB 4.26Å; F180-W211 HydrophobicContact CG-CD2 4.44Å; F180-W211 HydrophobicContact CG-CE3 4.23Å; T181-W211 WeakPolarHBondContact O-CH2 3.36Å; H183-W211 AromaticContact CD2-CZ2 3.97Å; T198-W211 CarbonylContact C-O 3.53Å; T198-W211 WeakPolarHBondContact CA-O 3.34Å; T198-W211 WeakPolarHBondContact CB-O 3.47Å; F199-W211 HydrophobicContact CD1-CB 3.75Å; F199-W211 HydrophobicContact CD1-CG 4.43Å; F199-W211 AromaticContact CD2-CD1 3.79Å; F199-W211 HydrophobicContact CD2-CG 4.46Å; F199-W211 HydrophobicContact CE1-CB 3.33Å; F199-W211 AromaticContact CE1-CG 3.82Å; F199-W211 HydrophobicContact CE1-CG 3.82Å; F199-W211 HydrophobicContact CE2-CB 4.19Å; F199-W211 AromaticContact CE2-CD1 3.28Å; F199-W211 AromaticContact CE2-CG 3.84Å; F199-W211 HydrophobicContact CE2-CG 3.84Å; F199-W211 AromaticContact CE2-NE1 3.89Å; F199-W211 HydrophobicContact CG-CB 4.34Å; F199-W211 HydrophobicContact CZ-CB 3.57Å; F199-W211 AromaticContact CZ-CD1 3.43Å; F199-W211 VanDerWaalsContact CZ-CD1 3.43Å; F199-W211 HydrophobicContact CZ-CD2 4.27Å; 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 2.97Å; F199-W211 PolarHBondContact O-N 3.41Å; S201-W211 PolarHBondContact OG-NE1 3.27Å; K209-W211 HydrophobicContact CB-CZ2 3.77Å; K209-W211 HydrophobicContact CD-CH2 4.05Å; K209-W211 HydrophobicContact CD-CZ2 3.55Å; K209-W211 HydrophobicContact CG-CZ2 4.3Å; K209-W211 PolarHBondContact O-NE1 3.47Å; W211-M217 WeakPolarHBondContact CA-O 3.22Å; W211-C218 HydrophobicContact CD2-CB 4.32Å; W211-C218 HydrophobicContact CE3-CB 3.65Å; W211-C218 HydrophobicContact CH2-CB 4.01Å; W211-C218 HydrophobicContact CZ3-CB 3.49Å; W211-C218 VanDerWaalsContact CZ3-CB 3.49Å
212	D	98.3	Very high	97.9	Very high	34 Å²	34	42.8 Å²	42.8	18%	0.182	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.2	168.5	179.4	-36.6	0	0	0	109	R214 D215 G216 M217 R219	D212-R214 VanDerWaalsContact C-N 3.28Å; D212-R214 PolarHBondContact O-N 2.78Å; D212-R214 WeakPolarHBondContact OD1-CB 3.49Å; D212-R214 PolarHBondContact OD1-N 3Å; D212-D215 WeakPolarHBondContact CB-OD1 3.13Å; D212-D215 PolarHBondContact OD1-N 3.32Å; D212-G216 WeakPolarHBondContact O-CA 3.35Å; D212-G216 PolarHBondContact O-N 2.76Å; D212-M217 PolarHBondContact N-O 2.5Å; D212-R219 HydrophobicContact CB-CG 4.08Å; D212-R219 IonicContact OD2-CZ 3.65Å; D212-R219 IonicContact OD2-NE 3.22Å; D212-R219 IonicContact OD2-NH2 3.97Å; D212-R219 PolarHBondContact OD2-NH2 2.98Å
213	I	97.8	Very high	97.8	Very high	13 Å²	13	46.6 Å²	46.6	7%	0.067	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-31.6	-171.8	-67.7	169.5	0	0	0	110.9	L152 L158 L168 L192 F196 R197 F199	L152-I213 HydrophobicContact CD2-CD1 4.2Å; L152-I213 HydrophobicContact CD2-CG2 3.94Å; L158-I213 HydrophobicContact CD1-CD1 4.04Å; L158-I213 HydrophobicContact CD1-CG1 4.39Å; L168-I213 HydrophobicContact CD1-CG2 4.5Å; L168-I213 HydrophobicContact CD2-CG2 3.98Å; L192-I213 HydrophobicContact CD2-CD1 3.83Å; F196-I213 WeakPolarHBondContact O-CD1 3.29Å; R197-I213 WeakPolarHBondContact O-CB 3.47Å; R197-I213 WeakPolarHBondContact O-CG1 3.42Å; R197-I213 PolarHBondContact O-N 2.58Å; F199-I213 HydrophobicContact CD1-CD1 4.23Å; F199-I213 HydrophobicContact CD1-CG1 3.69Å; F199-I213 HydrophobicContact CE1-CG1 4.29Å
214	R	95.6	Very high	97.7	Very high	238 Å²	238	48 Å²	48	90%	0.898	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-41	-171.9	-179	179.5	175.9	-175.1	-0.7	112.1	D212	D212-R214 VanDerWaalsContact C-N 3.28Å; D212-R214 PolarHBondContact O-N 2.78Å; D212-R214 WeakPolarHBondContact OD1-CB 3.49Å; D212-R214 PolarHBondContact OD1-N 3Å
215	D	94.3	Very high	97.7	Very high	67 Å²	67	47 Å²	47	36%	0.358	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-9.7	-178.6	75.6	-6.8	0	0	0	113.8	D212 M217 R219	D212-D215 WeakPolarHBondContact CB-OD1 3.13Å; D212-D215 PolarHBondContact OD1-N 3.32Å; D215-M217 VanDerWaalsContact C-N 3.29Å; D215-M217 PolarHBondContact O-N 2.84Å; D215-M217 WeakPolarHBondContact OD1-CB 3.22Å; D215-M217 PolarHBondContact OD1-N 3.06Å; D215-R219 VanDerWaalsContact CG-NH2 3.34Å; D215-R219 IonicContact OD1-CZ 3.68Å; D215-R219 IonicContact OD1-NH2 3.49Å; D215-R219 IonicContact OD2-CZ 2.81Å; D215-R219 IonicContact OD2-NH1 2.82Å; D215-R219 PolarHBondContact OD2-NH1 2.84Å; D215-R219 IonicContact OD2-NH2 3.57Å; D215-R219 PolarHBondContact OD2-NH2 2.8Å
216	G	95.4	Very high	97.7	Very high	11 Å²	11	51.2 Å²	51.2	11%	0.113	27%	0.267	C	S	.	.			trans	79.9	8.4	176.3	0	0	0	0	0	114.2	D212	D212-G216 WeakPolarHBondContact O-CA 3.35Å; D212-G216 PolarHBondContact O-N 2.76Å
217	M	96.6	Very high	97.7	Very high	117 Å²	117	52.3 Å²	52.3	58%	0.576	27%	0.273	S	S	*	.			trans	-105	144.9	-167.8	-64.7	-67.7	174.1	0	0	113.1	W211 D212 D215 R219	W211-M217 WeakPolarHBondContact CA-O 3.22Å; D212-M217 PolarHBondContact N-O 2.5Å; D215-M217 VanDerWaalsContact C-N 3.29Å; D215-M217 PolarHBondContact O-N 2.84Å; D215-M217 WeakPolarHBondContact OD1-CB 3.22Å; D215-M217 PolarHBondContact OD1-N 3.06Å; M217-R219 PolarHBondContact O-N 3.35Å
218	C	98.3	Very high	97.7	Very high	51 Å²	51	53.8 Å²	53.8	35%	0.345	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	123	167.4	-174.9	0	0	0	0	109.2	L210 W211 Q220	L210-C218 CarbonylContact O-C 3.48Å; L210-C218 WeakPolarHBondContact O-CA 3.15Å; W211-C218 HydrophobicContact CD2-CB 4.32Å; W211-C218 HydrophobicContact CE3-CB 3.65Å; W211-C218 HydrophobicContact CH2-CB 4.01Å; W211-C218 HydrophobicContact CZ3-CB 3.49Å; W211-C218 VanDerWaalsContact CZ3-CB 3.49Å; C218-Q220 PolarHBondContact SG-O 3.31Å; C218-Q220 VanDerWaalsContact SG-O 3.38Å
219	R	98.3	Very high	97.7	Very high	131 Å²	131	53.9 Å²	53.9	49%	0.494	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-43	176.1	-62.5	-58	-163.7	-161.1	-2.4	112.2	L210 D212 D215 M217	L210-R219 HydrophobicContact CD2-CB 4.1Å; L210-R219 HydrophobicContact CG-CB 4.4Å; L210-R219 PolarHBondContact O-N 3.05Å; D212-R219 HydrophobicContact CB-CG 4.08Å; D212-R219 IonicContact OD2-CZ 3.65Å; D212-R219 IonicContact OD2-NE 3.22Å; D212-R219 IonicContact OD2-NH2 3.97Å; D212-R219 PolarHBondContact OD2-NH2 2.98Å; D215-R219 VanDerWaalsContact CG-NH2 3.34Å; D215-R219 IonicContact OD1-CZ 3.68Å; D215-R219 IonicContact OD1-NH2 3.49Å; D215-R219 IonicContact OD2-CZ 2.81Å; D215-R219 IonicContact OD2-NH1 2.82Å; D215-R219 PolarHBondContact OD2-NH1 2.84Å; D215-R219 IonicContact OD2-NH2 3.57Å; D215-R219 PolarHBondContact OD2-NH2 2.8Å; M217-R219 PolarHBondContact O-N 3.35Å
220	Q	98.4	Very high	97.7	Very high	48 Å²	48	54 Å²	54	22%	0.224	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.5	-173.9	-69.5	176	-52.6	0	0	111.1	K209 L210 C218 F222 L255 D258	K209-Q220 WeakPolarHBondContact CA-O 3.3Å; L210-Q220 HydrophobicContact CB-CB 4.23Å; L210-Q220 PolarHBondContact N-O 2.87Å; C218-Q220 PolarHBondContact SG-O 3.31Å; C218-Q220 VanDerWaalsContact SG-O 3.38Å; Q220-F222 HydrophobicContact CB-CD2 4.47Å; Q220-F222 HydrophobicContact CB-CE2 3.67Å; Q220-F222 HydrophobicContact CB-CZ 3.84Å; Q220-L255 PolarHBondContact NE2-O 2.89Å; Q220-L255 PolarHBondContact OE1-O 3.43Å; Q220-D258 PolarHBondContact NE2-OD1 2.92Å
221	S	98.3	Very high	97.7	Very high	37 Å²	37	53.7 Å²	53.7	26%	0.259	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	114.8	175.1	-161.9	0	0	0	0	109.3	R22 S208 K209	R22-S221 PolarHBondContact NH2-O 3.49Å; S208-S221 CarbonylContact O-C 3.54Å; S208-S221 WeakPolarHBondContact O-CA 3.31Å; K209-S221 PolarHBondContact NZ-OG 2.8Å
222	F	98.6	Very high	97.6	Very high	2 Å²	2	54 Å²	54	1%	0.009	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.6	-178	-58.1	-91.3	0	0	0	109.4	T207 S208 L210 Q220 F241 F253 L255	T207-F222 WeakPolarHBondContact CA-O 3.27Å; S208-F222 PolarHBondContact N-O 3.37Å; S208-F222 PolarHBondContact O-N 3.07Å; L210-F222 HydrophobicContact CB-CE2 4.1Å; Q220-F222 HydrophobicContact CB-CD2 4.47Å; Q220-F222 HydrophobicContact CB-CE2 3.67Å; Q220-F222 HydrophobicContact CB-CZ 3.84Å; F222-F241 HydrophobicContact CB-CZ 4.09Å; F222-F241 HydrophobicContact CD1-CE1 4.21Å; F222-F241 HydrophobicContact CD1-CZ 4.1Å; F222-F241 AromaticContact CD2-CE1 3.75Å; F222-F241 HydrophobicContact CD2-CE1 3.75Å; F222-F241 AromaticContact CD2-CZ 3.48Å; F222-F241 HydrophobicContact CD2-CZ 3.48Å; F222-F241 VanDerWaalsContact CD2-CZ 3.48Å; F222-F241 HydrophobicContact CE1-CE1 4.08Å; F222-F241 HydrophobicContact CE1-CZ 4.43Å; F222-F241 AromaticContact CE2-CE1 3.63Å; F222-F241 HydrophobicContact CE2-CE1 3.63Å; F222-F241 AromaticContact CE2-CZ 3.88Å; F222-F241 HydrophobicContact CE2-CZ 3.88Å; F222-F241 HydrophobicContact CG-CE1 4.06Å; F222-F241 AromaticContact CG-CZ 3.61Å; F222-F241 HydrophobicContact CG-CZ 3.61Å; F222-F241 AromaticContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CZ 4.35Å; F222-F253 HydrophobicContact CB-CD1 3.93Å; F222-F253 HydrophobicContact CB-CE1 4.02Å; F222-F253 HydrophobicContact CB-CG 4.41Å; F222-F253 HydrophobicContact CD1-CB 4.12Å; F222-F253 AromaticContact CD1-CD1 3.81Å; F222-F253 HydrophobicContact CD1-CD1 3.81Å; F222-F253 HydrophobicContact CD1-CG 4.22Å; F222-F253 HydrophobicContact CE1-CB 4.45Å; F222-F253 HydrophobicContact CG-CD1 4.21Å; F222-F253 HydrophobicContact CG-CG 4.5Å; F222-L255 HydrophobicContact CE1-CD2 4.47Å; F222-L255 HydrophobicContact CE2-CD2 4.03Å; F222-L255 HydrophobicContact CZ-CD2 3.57Å
223	T	97.6	Very high	97.7	Very high	81 Å²	81	53.6 Å²	53.6	50%	0.497	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	151.7	177.4	57.5	0	0	0	0	108.8	R22 T207	R22-T223 PolarHBondContact NH1-OG1 2.96Å; T207-T223 HydrophobicContact CG2-CG2 3.99Å
224	G	96.4	Very high	97.7	Very high	29 Å²	29	53.6 Å²	53.6	30%	0.299	28%	0.283	S	S	.	.			trans	164.7	-42.9	176	0	0	0	0	0	111.9	R251	G224-R251 VanDerWaalsContact CA-NH1 3.35Å; G224-R251 PolarHBondContact O-NH1 3.15Å; G224-R251 PolarHBondContact O-NH2 2.65Å
225	H	98.3	Very high	97.8	Very high	14 Å²	14	44.1 Å²	44.1	7%	0.065	25%	0.248	C	C	.	.			trans	-59.9	152.3	174.9	-79.2	-65.8	0	0	0	112.3	A206 I229 T243 S245 D247 T249 R251	A206-H225 HydrophobicContact CB-CB 4.38Å; H225-I229 HydrophobicContact CB-CD1 4.32Å; H225-I229 HydrophobicContact CB-CG1 4.16Å; H225-T243 WeakPolarHBondContact NE2-CB 3.21Å; H225-T243 PolarHBondContact NE2-OG1 3.12Å; H225-S245 WeakPolarHBondContact CE1-CB 3.01Å; H225-S245 WeakPolarHBondContact ND1-CB 3.41Å; H225-D247 WeakPolarHBondContact CA-OD2 3.37Å; H225-D247 IonicContact CE1-OD1 3.51Å; H225-D247 IonicContact CE1-OD2 3.36Å; H225-D247 IonicContact CG-OD2 2.84Å; H225-D247 IonicContact ND1-OD1 3.46Å; H225-D247 PolarHBondContact ND1-OD1 2.78Å; H225-D247 IonicContact ND1-OD2 3.99Å; H225-D247 PolarHBondContact ND1-OD2 2.82Å; H225-T249 PolarHBondContact CE1-O 3.49Å; H225-T249 PolarHBondContact CE1-OG1 2.52Å; H225-T249 PolarHBondContact ND1-OG1 2.63Å; H225-R251 VanDerWaalsContact CE1-CD 3.45Å; H225-R251 WeakPolarHBondContact CE1-CD 3.34Å; H225-R251 PolarHBondContact ND1-NE 3.36Å
226	V	97.4	Very high	98	Very high	124 Å²	124	43.6 Å²	43.6	75%	0.752	25%	0.249	S	C	*	.	S	Bend	trans	-101.9	-13.6	-178.9	-174.2	0	0	0	0	111.6	D247	V226-D247 HydrophobicContact CB-CB 4.22Å; V226-D247 PolarHBondContact N-OD2 2.81Å
227	S	98.2	Very high	98.1	Very high	42 Å²	42	47.4 Å²	47.4	29%	0.294	27%	0.266	S	S	.	.	S	Bend	trans	-144.4	-169.1	-179.5	-164.8	0	0	0	0	110.7	A206 S245	A206-S227 WeakPolarHBondContact CA-O 3.44Å; A206-S227 VanDerWaalsContact CB-O 3.27Å; A206-S227 WeakPolarHBondContact CB-O 3.35Å; S227-S245 PolarHBondContact O-OG 2.75Å
228	D	98.5	Very high	98.1	Very high	51 Å²	51	42.6 Å²	42.6	27%	0.273	25%	0.246	S	C	.	.			trans	-62	139.1	-169	-61.6	6.9	0	0	0	110.9	C204 S245 D246	C204-D228 HydrophobicContact CB-CB 4.29Å; C204-D228 VanDerWaalsContact SG-CG 3.59Å; C204-D228 PolarHBondContact SG-OD2 3.13Å; D228-S245 CarbonylContact O-C 3.58Å; D228-S245 WeakPolarHBondContact O-CA 3.5Å; D228-S245 WeakPolarHBondContact O-CB 3.32Å; D228-S245 PolarHBondContact O-OG 3.26Å; D228-D246 PolarHBondContact O-N 3.4Å
229	I	98.8	Very high	98.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	101.4	175.9	-57.1	-179.9	0	0	0	108.3	M188 G202 A203 S208 H225 V232 T243	M188-I229 WeakPolarHBondContact CB-O 3.42Å; G202-I229 CarbonylContact C-O 3.57Å; A203-I229 PolarHBondContact O-N 3.13Å; S208-I229 VanDerWaalsContact OG-CD1 3.26Å; S208-I229 WeakPolarHBondContact OG-CD1 3.38Å; H225-I229 HydrophobicContact CB-CD1 4.32Å; H225-I229 HydrophobicContact CB-CG1 4.16Å; I229-V232 HydrophobicContact CG2-CG1 3.82Å; I229-T243 HydrophobicContact CG2-CG2 4.31Å
230	N	98.7	Very high	98.1	Very high	30 Å²	30	37.4 Å²	37.4	16%	0.16	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-28.7	-177.2	-65.4	-41.6	0	0	0	113.5	S189 G244 D246 I273	S189-N230 WeakPolarHBondContact CB-O 3.48Å; N230-G244 PolarHBondContact N-O 2.87Å; N230-D246 VanDerWaalsContact ND2-CG 3.34Å; N230-D246 PolarHBondContact ND2-OD1 3.31Å; N230-I273 VanDerWaalsContact CB-O 3.27Å; N230-I273 WeakPolarHBondContact CB-O 3.44Å; N230-I273 PolarHBondContact ND2-O 2.79Å
231	A	98.5	Very high	98.2	Very high	5 Å²	5	35.1 Å²	35.1	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	139.7	-172.3	0	0	0	0	0	112.3	T243 G244 V276	A231-T243 CarbonylContact O-C 3.48Å; A231-T243 VanDerWaalsContact O-CA 3.29Å; A231-T243 WeakPolarHBondContact O-CA 3.28Å; A231-G244 PolarHBondContact N-O 2.55Å; A231-G244 PolarHBondContact O-N 3.17Å; A231-V276 HydrophobicContact CB-CG1 4.45Å; A231-V276 HydrophobicContact CB-CG2 3.9Å
232	V	98.6	Very high	98.2	Very high	9 Å²	9	33.4 Å²	33.4	6%	0.055	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	143	174.2	-56.2	0	0	0	0	110.1	V200 I229 G242 T243	V200-V232 HydrophobicContact CG2-CB 4.21Å; V200-V232 HydrophobicContact CG2-CG2 4.08Å; I229-V232 HydrophobicContact CG2-CG1 3.82Å; V232-G242 CarbonylContact C-O 3.58Å; V232-G242 WeakPolarHBondContact CA-O 3.18Å; V232-T243 HydrophobicContact CG1-CG2 4.11Å
233	C	98.6	Very high	98.2	Very high	24 Å²	24	33.3 Å²	33.3	16%	0.162	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	126.4	177.7	-177	0	0	0	0	110.7	F241 G242 V276	C233-F241 CarbonylContact O-C 3.56Å; C233-F241 VanDerWaalsContact O-CA 3.32Å; C233-F241 WeakPolarHBondContact O-CA 3.49Å; C233-F241 WeakPolarHBondContact O-CB 3.12Å; C233-G242 PolarHBondContact N-O 2.71Å; C233-G242 PolarHBondContact O-N 3.35Å; C233-V276 HydrophobicContact CB-CG2 3.9Å
234	F	98.6	Very high	98.2	Very high	13 Å²	13	29.4 Å²	29.4	6%	0.057	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	141.1	171	-94.6	-80.2	0	0	0	112.2	S191 L192 S193 V200 L210 F241 L255 F278	S191-F234 VanDerWaalsContact O-CD2 3.32Å; S191-F234 WeakPolarHBondContact O-CD2 3.35Å; S191-F234 WeakPolarHBondContact O-CE2 3.19Å; S191-F234 PolarHBondContact OG-N 2.76Å; L192-F234 WeakPolarHBondContact O-CD2 3.49Å; S193-F234 VanDerWaalsContact N-CE2 3.26Å; V200-F234 HydrophobicContact CB-CE2 4.14Å; V200-F234 HydrophobicContact CB-CZ 4.42Å; V200-F234 HydrophobicContact CG1-CE1 4.31Å; V200-F234 HydrophobicContact CG1-CE2 3.85Å; V200-F234 HydrophobicContact CG1-CZ 3.63Å; V200-F234 HydrophobicContact CG2-CD2 3.87Å; V200-F234 HydrophobicContact CG2-CE2 3.66Å; V200-F234 HydrophobicContact CG2-CZ 4.27Å; L210-F234 HydrophobicContact CD1-CZ 4.05Å; F234-F241 HydrophobicContact CD1-CB 4.44Å; F234-L255 HydrophobicContact CE1-CD1 4.36Å; F234-F278 WeakPolarHBondContact O-CD2 3.28Å
235	F	98.6	Very high	98.4	Very high	39 Å²	39	28 Å²	28	17%	0.171	17%	0.165	C	C	.	.			trans	-69.6	147.9	165.9	-169.8	-93.8	0	0	0	109.7	N237 G238 A240 F278 G282 T299	F235-N237 HydrophobicContact CD1-CB 4.16Å; F235-N237 VanDerWaalsContact CD1-CG 3.49Å; F235-N237 VanDerWaalsContact CD1-OD1 3.29Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.29Å; F235-N237 HydrophobicContact CE1-CB 4.36Å; F235-N237 PolarHBondContact O-N 3.06Å; F235-G238 PolarHBondContact O-N 3.39Å; F235-A240 HydrophobicContact CB-CB 3.81Å; F235-A240 WeakPolarHBondContact CB-O 3.43Å; F235-A240 HydrophobicContact CG-CB 4.27Å; F235-A240 PolarHBondContact N-O 2.96Å; F235-F278 HydrophobicContact CB-CD2 4.43Å; F235-F278 HydrophobicContact CB-CE2 4.25Å; F235-F278 AromaticContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD2 4.25Å; F235-F278 AromaticContact CD2-CE1 3.77Å; F235-F278 HydrophobicContact CD2-CE1 3.77Å; F235-F278 HydrophobicContact CD2-CE2 4.17Å; F235-F278 HydrophobicContact CD2-CG 4.09Å; F235-F278 AromaticContact CD2-CZ 3.95Å; F235-F278 HydrophobicContact CD2-CZ 3.95Å; F235-F278 HydrophobicContact CE2-CD1 4.18Å; F235-F278 HydrophobicContact CE2-CE1 4.25Å; F235-G282 VanDerWaalsContact CE2-CA 3.41Å; F235-G282 WeakPolarHBondContact CE2-O 3.47Å; F235-T299 HydrophobicContact CE2-CG2 4.39Å
236	P	97.5	Very high	98.4	Very high	57 Å²	57	30.4 Å²	30.4	37%	0.37	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-24.9	-171.8	-30.4	36.4	0	0	0	116.5	F278	P236-F278 HydrophobicContact CG-CB 4.32Å
237	N	97.2	Very high	98.4	Very high	91 Å²	91	26.1 Å²	26.1	49%	0.487	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.1	178.8	75.1	5.1	0	0	0	114.4	F235 N239	F235-N237 HydrophobicContact CD1-CB 4.16Å; F235-N237 VanDerWaalsContact CD1-CG 3.49Å; F235-N237 VanDerWaalsContact CD1-OD1 3.29Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.29Å; F235-N237 HydrophobicContact CE1-CB 4.36Å; F235-N237 PolarHBondContact O-N 3.06Å; N237-N239 VanDerWaalsContact C-N 3.29Å; N237-N239 PolarHBondContact O-N 3.37Å; N237-N239 WeakPolarHBondContact OD1-CB 3.38Å; N237-N239 PolarHBondContact OD1-N 3.03Å
238	G	97.5	Very high	98.4	Very high	15 Å²	15	24.6 Å²	24.6	16%	0.155	14%	0.14	C	C	.	.	S	Bend	trans	78	-3.9	-179.2	0	0	0	0	0	116.6	F235 L255	F235-G238 PolarHBondContact O-N 3.39Å; G238-L255 WeakPolarHBondContact O-CD1 3.27Å
239	N	98.2	Very high	98.4	Very high	68 Å²	68	23.1 Å²	23.1	36%	0.364	13%	0.133	S	C	.	.	S	Bend	trans	-94.9	-7.4	-178	-66.1	-40.6	0	0	0	113.9	N237 L255	N237-N239 VanDerWaalsContact C-N 3.29Å; N237-N239 PolarHBondContact O-N 3.37Å; N237-N239 WeakPolarHBondContact OD1-CB 3.38Å; N237-N239 PolarHBondContact OD1-N 3.03Å; N239-L255 WeakPolarHBondContact O-CG 3.21Å; N239-L255 PolarHBondContact O-N 3.46Å
240	A	98.6	Very high	98.3	Very high	6 Å²	6	23 Å²	23	5%	0.05	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	165.4	-179.2	0	0	0	0	0	110	F235 L252 F253	F235-A240 HydrophobicContact CB-CB 3.81Å; F235-A240 WeakPolarHBondContact CB-O 3.43Å; F235-A240 HydrophobicContact CG-CB 4.27Å; F235-A240 PolarHBondContact N-O 2.96Å; A240-L252 HydrophobicContact CB-CD1 4.12Å; A240-F253 CarbonylContact C-O 3.55Å; A240-F253 WeakPolarHBondContact CA-O 3.23Å; A240-F253 WeakPolarHBondContact CB-O 3.42Å
241	F	98.8	Very high	98.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	152.9	173.3	65.8	-85.1	0	0	0	111.2	V200 F222 C233 F234 T243 L252 F253 L255	V200-F241 HydrophobicContact CG1-CD1 4Å; V200-F241 HydrophobicContact CG1-CE1 4.26Å; V200-F241 HydrophobicContact CG1-CG 4.18Å; V200-F241 HydrophobicContact CG2-CB 4.29Å; V200-F241 HydrophobicContact CG2-CD2 4.37Å; V200-F241 HydrophobicContact CG2-CG 4.3Å; F222-F241 HydrophobicContact CB-CZ 4.09Å; F222-F241 HydrophobicContact CD1-CE1 4.21Å; F222-F241 HydrophobicContact CD1-CZ 4.1Å; F222-F241 AromaticContact CD2-CE1 3.75Å; F222-F241 HydrophobicContact CD2-CE1 3.75Å; F222-F241 AromaticContact CD2-CZ 3.48Å; F222-F241 HydrophobicContact CD2-CZ 3.48Å; F222-F241 VanDerWaalsContact CD2-CZ 3.48Å; F222-F241 HydrophobicContact CE1-CE1 4.08Å; F222-F241 HydrophobicContact CE1-CZ 4.43Å; F222-F241 AromaticContact CE2-CE1 3.63Å; F222-F241 HydrophobicContact CE2-CE1 3.63Å; F222-F241 AromaticContact CE2-CZ 3.88Å; F222-F241 HydrophobicContact CE2-CZ 3.88Å; F222-F241 HydrophobicContact CG-CE1 4.06Å; F222-F241 AromaticContact CG-CZ 3.61Å; F222-F241 HydrophobicContact CG-CZ 3.61Å; F222-F241 AromaticContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CE1 3.82Å; F222-F241 HydrophobicContact CZ-CZ 4.35Å; C233-F241 CarbonylContact O-C 3.56Å; C233-F241 VanDerWaalsContact O-CA 3.32Å; C233-F241 WeakPolarHBondContact O-CA 3.49Å; C233-F241 WeakPolarHBondContact O-CB 3.12Å; F234-F241 HydrophobicContact CD1-CB 4.44Å; F241-T243 HydrophobicContact CD2-CG2 3.77Å; F241-T243 HydrophobicContact CE2-CG2 3.56Å; F241-L252 WeakPolarHBondContact O-CA 3.3Å; F241-F253 HydrophobicContact CD1-CB 4.02Å; F241-F253 HydrophobicContact CD2-CB 4.41Å; F241-F253 HydrophobicContact CD2-CD2 4.31Å; F241-F253 HydrophobicContact CE1-CB 3.48Å; F241-F253 VanDerWaalsContact CE1-CB 3.48Å; F241-F253 HydrophobicContact CE1-CG 4.3Å; F241-F253 HydrophobicContact CE2-CB 3.93Å; F241-F253 AromaticContact CE2-CD2 3.62Å; F241-F253 HydrophobicContact CE2-CD2 3.62Å; F241-F253 HydrophobicContact CE2-CE2 4.45Å; F241-F253 HydrophobicContact CE2-CG 4.01Å; F241-F253 HydrophobicContact CG-CB 4.45Å; F241-F253 HydrophobicContact CZ-CB 3.43Å; F241-F253 VanDerWaalsContact CZ-CB 3.43Å; F241-F253 AromaticContact CZ-CD2 3.84Å; F241-F253 HydrophobicContact CZ-CD2 3.84Å; F241-F253 AromaticContact CZ-CG 3.73Å; F241-F253 HydrophobicContact CZ-CG 3.73Å; F241-F253 PolarHBondContact N-O 2.92Å; F241-F253 PolarHBondContact O-N 3.06Å; F241-L255 HydrophobicContact CD1-CD2 3.8Å; F241-L255 HydrophobicContact CE1-CD2 3.75Å
242	G	98.7	Very high	98.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	144	176.4	0	0	0	0	0	110.8	V232 C233 R251	V232-G242 CarbonylContact C-O 3.58Å; V232-G242 WeakPolarHBondContact CA-O 3.18Å; C233-G242 PolarHBondContact N-O 2.71Å; C233-G242 PolarHBondContact O-N 3.35Å; G242-R251 CarbonylContact C-O 3.53Å; G242-R251 VanDerWaalsContact CA-O 3.25Å; G242-R251 WeakPolarHBondContact CA-O 3.29Å
243	T	98.8	Very high	98.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	153	176.4	56.3	0	0	0	0	110.4	H225 I229 A231 V232 F241 C250 R251 F253	H225-T243 WeakPolarHBondContact NE2-CB 3.21Å; H225-T243 PolarHBondContact NE2-OG1 3.12Å; I229-T243 HydrophobicContact CG2-CG2 4.31Å; A231-T243 CarbonylContact O-C 3.48Å; A231-T243 VanDerWaalsContact O-CA 3.29Å; A231-T243 WeakPolarHBondContact O-CA 3.28Å; V232-T243 HydrophobicContact CG1-CG2 4.11Å; F241-T243 HydrophobicContact CD2-CG2 3.77Å; F241-T243 HydrophobicContact CE2-CG2 3.56Å; T243-C250 CarbonylContact O-C 3.58Å; T243-C250 WeakPolarHBondContact O-CA 3.47Å; T243-C250 VanDerWaalsContact O-CB 3.31Å; T243-C250 WeakPolarHBondContact O-CB 3.43Å; T243-R251 PolarHBondContact N-O 2.94Å; T243-R251 PolarHBondContact O-N 3.06Å; T243-R251 VanDerWaalsContact O-N 3.09Å; T243-R251 PolarHBondContact OG1-O 3.27Å; T243-F253 HydrophobicContact CG2-CD2 4Å; T243-F253 HydrophobicContact CG2-CE2 3.92Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.34Å
244	G	98.7	Very high	98.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.4	170.3	0	0	0	0	0	110.2	N230 A231	N230-G244 PolarHBondContact N-O 2.87Å; A231-G244 PolarHBondContact N-O 2.55Å; A231-G244 PolarHBondContact O-N 3.17Å
245	S	98.7	Very high	98.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	163	-171	176.6	0	0	0	0	113	H225 S227 D228 D247 A248 T249 I273	H225-S245 WeakPolarHBondContact CE1-CB 3.01Å; H225-S245 WeakPolarHBondContact ND1-CB 3.41Å; S227-S245 PolarHBondContact O-OG 2.75Å; D228-S245 CarbonylContact O-C 3.58Å; D228-S245 WeakPolarHBondContact O-CA 3.5Å; D228-S245 WeakPolarHBondContact O-CB 3.32Å; D228-S245 PolarHBondContact O-OG 3.26Å; S245-D247 WeakPolarHBondContact CB-OD1 3.46Å; S245-D247 PolarHBondContact O-N 2.9Å; S245-D247 PolarHBondContact OG-N 3.03Å; S245-D247 PolarHBondContact OG-OD1 3.15Å; S245-A248 PolarHBondContact O-N 2.9Å; S245-T249 PolarHBondContact N-O 2.85Å; S245-I273 PolarHBondContact O-N 3.15Å
246	D	98.4	Very high	98.3	Very high	63 Å²	63	30.1 Å²	30.1	34%	0.337	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-11.3	167.9	-80.3	-14.7	0	0	0	113.7	D228 N230 A248	D228-D246 PolarHBondContact O-N 3.4Å; N230-D246 VanDerWaalsContact ND2-CG 3.34Å; N230-D246 PolarHBondContact ND2-OD1 3.31Å; D246-A248 PolarHBondContact O-N 2.95Å; D246-A248 VanDerWaalsContact O-N 3.11Å
247	D	97.8	Very high	98.3	Very high	35 Å²	35	29 Å²	29	19%	0.187	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	10.2	169.9	73.9	10.4	0	0	0	114.1	H225 V226 S245 T249 R251	H225-D247 WeakPolarHBondContact CA-OD2 3.37Å; H225-D247 IonicContact CE1-OD1 3.51Å; H225-D247 IonicContact CE1-OD2 3.36Å; H225-D247 IonicContact CG-OD2 2.84Å; H225-D247 IonicContact ND1-OD1 3.46Å; H225-D247 PolarHBondContact ND1-OD1 2.78Å; H225-D247 IonicContact ND1-OD2 3.99Å; H225-D247 PolarHBondContact ND1-OD2 2.82Å; V226-D247 HydrophobicContact CB-CB 4.22Å; V226-D247 PolarHBondContact N-OD2 2.81Å; S245-D247 WeakPolarHBondContact CB-OD1 3.46Å; S245-D247 PolarHBondContact O-N 2.9Å; S245-D247 PolarHBondContact OG-N 3.03Å; S245-D247 PolarHBondContact OG-OD1 3.15Å; D247-T249 VanDerWaalsContact CG-OG1 3.32Å; D247-T249 PolarHBondContact O-N 3.44Å; D247-T249 WeakPolarHBondContact OD1-CA 3.14Å; D247-T249 WeakPolarHBondContact OD1-CB 3.34Å; D247-T249 PolarHBondContact OD1-N 3.44Å; D247-T249 PolarHBondContact OD1-OG1 2.89Å; D247-T249 PolarHBondContact OD2-OG1 3.04Å; D247-R251 IonicContact OD2-NH2 2.98Å
248	A	97.9	Very high	98.4	Very high	9 Å²	9	26.4 Å²	26.4	7%	0.074	14%	0.136	C	C	.	.	S	Bend	trans	62.4	12.4	-177.9	0	0	0	0	0	115	S245 D246 I269 C271	S245-A248 PolarHBondContact O-N 2.9Å; D246-A248 PolarHBondContact O-N 2.95Å; D246-A248 VanDerWaalsContact O-N 3.11Å; A248-I269 WeakPolarHBondContact CB-O 3.14Å; A248-C271 WeakPolarHBondContact CA-O 3.42Å; A248-C271 VanDerWaalsContact CB-O 3.24Å; A248-C271 WeakPolarHBondContact CB-O 3.46Å
249	T	98.3	Very high	98.3	Very high	20 Å²	20	27.4 Å²	27.4	12%	0.123	14%	0.136	C	C	.	.			trans	-110.5	141.7	177.5	76.1	0	0	0	0	112.4	H225 S245 D247 R251 T263 I273	H225-T249 PolarHBondContact CE1-O 3.49Å; H225-T249 PolarHBondContact CE1-OG1 2.52Å; H225-T249 PolarHBondContact ND1-OG1 2.63Å; S245-T249 PolarHBondContact N-O 2.85Å; D247-T249 VanDerWaalsContact CG-OG1 3.32Å; D247-T249 PolarHBondContact O-N 3.44Å; D247-T249 WeakPolarHBondContact OD1-CA 3.14Å; D247-T249 WeakPolarHBondContact OD1-CB 3.34Å; D247-T249 PolarHBondContact OD1-N 3.44Å; D247-T249 PolarHBondContact OD1-OG1 2.89Å; D247-T249 PolarHBondContact OD2-OG1 3.04Å; T249-R251 PolarHBondContact OG1-NE 3.26Å; T249-T263 HydrophobicContact CG2-CG2 4.09Å; T249-I273 WeakPolarHBondContact O-CD1 3.21Å
250	C	98.6	Very high	98.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	148.3	157.5	-58.8	0	0	0	0	108.7	T243 Y264 I273 L285 A287	T243-C250 CarbonylContact O-C 3.58Å; T243-C250 WeakPolarHBondContact O-CA 3.47Å; T243-C250 VanDerWaalsContact O-CB 3.31Å; T243-C250 WeakPolarHBondContact O-CB 3.43Å; C250-Y264 HydrophobicContact CB-CD2 3.84Å; C250-Y264 HydrophobicContact CB-CG 4.41Å; C250-Y264 PolarHBondContact N-O 2.85Å; C250-Y264 WeakPolarHBondContact O-CD2 3.39Å; C250-Y264 PolarHBondContact O-N 3.43Å; C250-I273 HydrophobicContact CB-CD1 4.47Å; C250-I273 WeakPolarHBondContact SG-CD1 3.16Å; C250-L285 HydrophobicContact CB-CD2 3.94Å; C250-A287 VanDerWaalsContact SG-CB 3.52Å
251	R	98.7	Very high	98.3	Very high	25 Å²	25	30 Å²	30	9%	0.094	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	148.3	173.5	-65.7	172	-173.3	-135.2	14.3	110.8	G224 H225 G242 T243 D247 T249 F253 E260 M262 T263	G224-R251 VanDerWaalsContact CA-NH1 3.35Å; G224-R251 PolarHBondContact O-NH1 3.15Å; G224-R251 PolarHBondContact O-NH2 2.65Å; H225-R251 VanDerWaalsContact CE1-CD 3.45Å; H225-R251 WeakPolarHBondContact CE1-CD 3.34Å; H225-R251 PolarHBondContact ND1-NE 3.36Å; G242-R251 CarbonylContact C-O 3.53Å; G242-R251 VanDerWaalsContact CA-O 3.25Å; G242-R251 WeakPolarHBondContact CA-O 3.29Å; T243-R251 PolarHBondContact N-O 2.94Å; T243-R251 PolarHBondContact O-N 3.06Å; T243-R251 VanDerWaalsContact O-N 3.09Å; T243-R251 PolarHBondContact OG1-O 3.27Å; D247-R251 IonicContact OD2-NH2 2.98Å; T249-R251 PolarHBondContact OG1-NE 3.26Å; R251-F253 HydrophobicContact CB-CD2 4.23Å; R251-F253 HydrophobicContact CB-CE2 3.58Å; R251-F253 HydrophobicContact CB-CZ 4.05Å; R251-E260 WeakPolarHBondContact CD-OE2 3.38Å; R251-E260 IonicContact CZ-OE2 3.92Å; R251-E260 IonicContact NE-OE2 3.54Å; R251-E260 VanDerWaalsContact NH1-CD 3.31Å; R251-E260 IonicContact NH1-OE1 3.72Å; R251-E260 PolarHBondContact NH1-OE1 3.01Å; R251-E260 IonicContact NH1-OE2 2.84Å; R251-E260 PolarHBondContact NH1-OE2 2.77Å; R251-M262 WeakPolarHBondContact CA-O 3.44Å; R251-T263 HydrophobicContact CG-CG2 4.2Å
252	L	98.8	Very high	98.2	Very high	8 Å²	8	30.8 Å²	30.8	4%	0.042	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125	170.8	177.8	70.7	0	0	0	108.3	L30 A240 F241 E260 L261 M262 Y264 F278 T299	L30-L252 HydrophobicContact CD2-CD2 3.9Å; A240-L252 HydrophobicContact CB-CD1 4.12Å; F241-L252 WeakPolarHBondContact O-CA 3.3Å; L252-E260 CarbonylContact O-C 3.56Å; L252-E260 WeakPolarHBondContact O-CA 3.5Å; L252-L261 HydrophobicContact CD2-CB 4.26Å; L252-L261 HydrophobicContact CD2-CD1 4.24Å; L252-L261 HydrophobicContact CG-CB 4.41Å; L252-L261 PolarHBondContact O-N 3.5Å; L252-M262 HydrophobicContact CB-CB 4.45Å; L252-M262 PolarHBondContact N-O 3.04Å; L252-Y264 HydrophobicContact CB-CE2 3.96Å; L252-F278 HydrophobicContact CD1-CE1 4.39Å; L252-F278 HydrophobicContact CD1-CZ 3.79Å; L252-T299 HydrophobicContact CD2-CG2 3.94Å
253	F	98.7	Very high	98.2	Very high	3 Å²	3	33.5 Å²	33.5	1%	0.013	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	143.8	176.5	-67.2	-87.8	0	0	0	110.4	F222 A240 F241 T243 R251 E260	F222-F253 HydrophobicContact CB-CD1 3.93Å; F222-F253 HydrophobicContact CB-CE1 4.02Å; F222-F253 HydrophobicContact CB-CG 4.41Å; F222-F253 HydrophobicContact CD1-CB 4.12Å; F222-F253 AromaticContact CD1-CD1 3.81Å; F222-F253 HydrophobicContact CD1-CD1 3.81Å; F222-F253 HydrophobicContact CD1-CG 4.22Å; F222-F253 HydrophobicContact CE1-CB 4.45Å; F222-F253 HydrophobicContact CG-CD1 4.21Å; F222-F253 HydrophobicContact CG-CG 4.5Å; A240-F253 CarbonylContact C-O 3.55Å; A240-F253 WeakPolarHBondContact CA-O 3.23Å; A240-F253 WeakPolarHBondContact CB-O 3.42Å; F241-F253 HydrophobicContact CD1-CB 4.02Å; F241-F253 HydrophobicContact CD2-CB 4.41Å; F241-F253 HydrophobicContact CD2-CD2 4.31Å; F241-F253 HydrophobicContact CE1-CB 3.48Å; F241-F253 VanDerWaalsContact CE1-CB 3.48Å; F241-F253 HydrophobicContact CE1-CG 4.3Å; F241-F253 HydrophobicContact CE2-CB 3.93Å; F241-F253 AromaticContact CE2-CD2 3.62Å; F241-F253 HydrophobicContact CE2-CD2 3.62Å; F241-F253 HydrophobicContact CE2-CE2 4.45Å; F241-F253 HydrophobicContact CE2-CG 4.01Å; F241-F253 HydrophobicContact CG-CB 4.45Å; F241-F253 HydrophobicContact CZ-CB 3.43Å; F241-F253 VanDerWaalsContact CZ-CB 3.43Å; F241-F253 AromaticContact CZ-CD2 3.84Å; F241-F253 HydrophobicContact CZ-CD2 3.84Å; F241-F253 AromaticContact CZ-CG 3.73Å; F241-F253 HydrophobicContact CZ-CG 3.73Å; F241-F253 PolarHBondContact N-O 2.92Å; F241-F253 PolarHBondContact O-N 3.06Å; T243-F253 HydrophobicContact CG2-CD2 4Å; T243-F253 HydrophobicContact CG2-CE2 3.92Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.34Å; R251-F253 HydrophobicContact CB-CD2 4.23Å; R251-F253 HydrophobicContact CB-CE2 3.58Å; R251-F253 HydrophobicContact CB-CZ 4.05Å; F253-E260 HydrophobicContact CD1-CB 3.83Å; F253-E260 HydrophobicContact CE1-CB 3.64Å; F253-E260 HydrophobicContact CZ-CB 4.21Å
254	D	98.6	Very high	98.1	Very high	17 Å²	17	33.5 Å²	33.5	9%	0.091	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.5	171.2	178.3	-69.1	0	0	0	110.3	R256 A257 D258 Q259 L261	D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 3.13Å; D254-R256 WeakPolarHBondContact OD1-CA 3.24Å; D254-R256 WeakPolarHBondContact OD1-CB 3.31Å; D254-R256 PolarHBondContact OD1-N 3.07Å; D254-R256 IonicContact OD1-NE 2.71Å; D254-R256 IonicContact OD2-NE 3.5Å; D254-R256 IonicContact OD2-NH2 3.3Å; D254-R256 PolarHBondContact OD2-NH2 2.79Å; D254-A257 HydrophobicContact CB-CB 4.01Å; D254-A257 PolarHBondContact O-N 2.84Å; D254-A257 PolarHBondContact OD1-N 2.91Å; D254-D258 PolarHBondContact O-N 3.48Å; D254-Q259 PolarHBondContact N-O 2.78Å; D254-L261 HydrophobicContact CB-CD1 3.64Å; D254-L261 HydrophobicContact CB-CD2 4.07Å; D254-L261 HydrophobicContact CB-CG 3.82Å
255	L	98.3	Very high	98	Very high	23 Å²	23	36.5 Å²	36.5	12%	0.12	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-32	-174.8	-59.1	-174.6	0	0	0	112.5	L210 Q220 F222 F234 G238 N239 F241	L210-L255 HydrophobicContact CD1-CD1 4.28Å; L210-L255 HydrophobicContact CD1-CD2 4.29Å; L210-L255 HydrophobicContact CD2-CD1 4.13Å; L210-L255 HydrophobicContact CD2-CD2 4.09Å; Q220-L255 PolarHBondContact NE2-O 2.89Å; Q220-L255 PolarHBondContact OE1-O 3.43Å; F222-L255 HydrophobicContact CE1-CD2 4.47Å; F222-L255 HydrophobicContact CE2-CD2 4.03Å; F222-L255 HydrophobicContact CZ-CD2 3.57Å; F234-L255 HydrophobicContact CE1-CD1 4.36Å; G238-L255 WeakPolarHBondContact O-CD1 3.27Å; N239-L255 WeakPolarHBondContact O-CG 3.21Å; N239-L255 PolarHBondContact O-N 3.46Å; F241-L255 HydrophobicContact CD1-CD2 3.8Å; F241-L255 HydrophobicContact CE1-CD2 3.75Å
256	R	98.1	Very high	97.7	Very high	193 Å²	193	40 Å²	40	73%	0.728	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-32.3	-178.4	-57.4	169.4	-63.4	161.7	4.7	111.3	D254 D258	D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 3.13Å; D254-R256 WeakPolarHBondContact OD1-CA 3.24Å; D254-R256 WeakPolarHBondContact OD1-CB 3.31Å; D254-R256 PolarHBondContact OD1-N 3.07Å; D254-R256 IonicContact OD1-NE 2.71Å; D254-R256 IonicContact OD2-NE 3.5Å; D254-R256 IonicContact OD2-NH2 3.3Å; D254-R256 PolarHBondContact OD2-NH2 2.79Å; R256-D258 VanDerWaalsContact C-N 3.29Å
257	A	97.4	Very high	97.2	Very high	33 Å²	33	44.2 Å²	44.2	27%	0.273	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-22.6	173.3	0	0	0	0	0	112.5	D254 Q259 L261	D254-A257 HydrophobicContact CB-CB 4.01Å; D254-A257 PolarHBondContact O-N 2.84Å; D254-A257 PolarHBondContact OD1-N 2.91Å; A257-Q259 HydrophobicContact CB-CG 4.08Å; A257-Q259 WeakPolarHBondContact O-CG 3.26Å; A257-Q259 PolarHBondContact O-N 2.98Å; A257-Q259 VanDerWaalsContact O-N 3.17Å; A257-L261 HydrophobicContact CB-CD2 4.31Å
258	D	98.3	Very high	96.8	Very high	37 Å²	37	48.9 Å²	48.9	20%	0.198	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	24.9	-175.7	-167.3	58.2	0	0	0	113.3	R22 Q220 D254 R256	R22-D258 WeakPolarHBondContact CD-O 3.41Å; R22-D258 VanDerWaalsContact CZ-O 3.27Å; R22-D258 IonicContact CZ-OD2 3.21Å; R22-D258 PolarHBondContact NE-O 3.46Å; R22-D258 IonicContact NE-OD2 3.13Å; R22-D258 PolarHBondContact NE-OD2 3.4Å; R22-D258 PolarHBondContact NH2-O 3.02Å; R22-D258 IonicContact NH2-OD1 2.85Å; R22-D258 PolarHBondContact NH2-OD1 2.8Å; R22-D258 IonicContact NH2-OD2 3.6Å; R22-D258 PolarHBondContact NH2-OD2 2.91Å; Q220-D258 PolarHBondContact NE2-OD1 2.92Å; D254-D258 PolarHBondContact O-N 3.48Å; R256-D258 VanDerWaalsContact C-N 3.29Å
259	Q	97.1	Very high	96.5	Very high	36 Å²	36	49.1 Å²	49.1	17%	0.168	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	171.8	-177.2	66	-171.7	-21.6	0	0	111.8	R22 D254 A257	R22-Q259 PolarHBondContact O-NE2 2.91Å; R22-Q259 PolarHBondContact O-OE1 2.93Å; D254-Q259 PolarHBondContact N-O 2.78Å; A257-Q259 HydrophobicContact CB-CG 4.08Å; A257-Q259 WeakPolarHBondContact O-CG 3.26Å; A257-Q259 PolarHBondContact O-N 2.98Å; A257-Q259 VanDerWaalsContact O-N 3.17Å
260	E	97.4	Very high	96.3	Very high	72 Å²	72	55.6 Å²	55.6	34%	0.336	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	141.8	175	68.2	-176.4	165.3	0	0	111.4	R251 L252 F253	R251-E260 WeakPolarHBondContact CD-OE2 3.38Å; R251-E260 IonicContact CZ-OE2 3.92Å; R251-E260 IonicContact NE-OE2 3.54Å; R251-E260 VanDerWaalsContact NH1-CD 3.31Å; R251-E260 IonicContact NH1-OE1 3.72Å; R251-E260 PolarHBondContact NH1-OE1 3.01Å; R251-E260 IonicContact NH1-OE2 2.84Å; R251-E260 PolarHBondContact NH1-OE2 2.77Å; L252-E260 CarbonylContact O-C 3.56Å; L252-E260 WeakPolarHBondContact O-CA 3.5Å; F253-E260 HydrophobicContact CD1-CB 3.83Å; F253-E260 HydrophobicContact CE1-CB 3.64Å; F253-E260 HydrophobicContact CZ-CB 4.21Å
261	L	97.7	Very high	96.2	Very high	57 Å²	57	56.9 Å²	56.9	30%	0.298	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-34.5	174.4	-64.3	-171.6	0	0	0	112.4	L30 L252 D254 A257	L30-L261 HydrophobicContact CB-CB 4.44Å; L30-L261 HydrophobicContact CD2-CB 4.48Å; L252-L261 HydrophobicContact CD2-CB 4.26Å; L252-L261 HydrophobicContact CD2-CD1 4.24Å; L252-L261 HydrophobicContact CG-CB 4.41Å; L252-L261 PolarHBondContact O-N 3.5Å; D254-L261 HydrophobicContact CB-CD1 3.64Å; D254-L261 HydrophobicContact CB-CD2 4.07Å; D254-L261 HydrophobicContact CB-CG 3.82Å; A257-L261 HydrophobicContact CB-CD2 4.31Å
262	M	97.8	Very high	96.1	Very high	16 Å²	16	56 Å²	56	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	143	-174.3	-173.8	158.5	-83.9	0	0	111.4	L30 R251 L252 Y264 T299 G302	L30-M262 HydrophobicContact CB-CE 3.86Å; L30-M262 HydrophobicContact CD2-CB 4.14Å; L30-M262 HydrophobicContact CD2-CE 4.14Å; L30-M262 HydrophobicContact CD2-SD 4.11Å; L30-M262 HydrophobicContact CG-CE 3.97Å; R251-M262 WeakPolarHBondContact CA-O 3.44Å; L252-M262 HydrophobicContact CB-CB 4.45Å; L252-M262 PolarHBondContact N-O 3.04Å; M262-Y264 HydrophobicContact CB-CE2 4.4Å; M262-Y264 HydrophobicContact CG-CD1 4.33Å; M262-Y264 HydrophobicContact CG-CE1 3.79Å; M262-Y264 HydrophobicContact CG-CE2 4.29Å; M262-Y264 HydrophobicContact SD-CD1 4.42Å; M262-Y264 HydrophobicContact SD-CE1 3.6Å; M262-T299 VanDerWaalsContact SD-O 3.34Å; M262-G302 PolarHBondContact SD-N 3.47Å
263	T	97.9	Very high	96.1	Very high	56 Å²	56	55.7 Å²	55.7	34%	0.344	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.8	170.8	-47.4	0	0	0	0	108.7	T249 R251	T249-T263 HydrophobicContact CG2-CG2 4.09Å; R251-T263 HydrophobicContact CG-CG2 4.2Å
264	Y	97.8	Very high	96.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	110.2	174.7	-45.6	-89.6	0	0	0	108.2	C250 L252 M262 L285 W297 T299	C250-Y264 HydrophobicContact CB-CD2 3.84Å; C250-Y264 HydrophobicContact CB-CG 4.41Å; C250-Y264 PolarHBondContact N-O 2.85Å; C250-Y264 WeakPolarHBondContact O-CD2 3.39Å; C250-Y264 PolarHBondContact O-N 3.43Å; L252-Y264 HydrophobicContact CB-CE2 3.96Å; M262-Y264 HydrophobicContact CB-CE2 4.4Å; M262-Y264 HydrophobicContact CG-CD1 4.33Å; M262-Y264 HydrophobicContact CG-CE1 3.79Å; M262-Y264 HydrophobicContact CG-CE2 4.29Å; M262-Y264 HydrophobicContact SD-CD1 4.42Å; M262-Y264 HydrophobicContact SD-CE1 3.6Å; Y264-L285 HydrophobicContact CD2-CD2 3.61Å; Y264-L285 HydrophobicContact CE2-CD2 3.61Å; Y264-L285 HydrophobicContact CG-CD2 4.23Å; Y264-W297 HydrophobicContact CD1-CB 4Å; Y264-W297 HydrophobicContact CD1-CE3 4.45Å; Y264-W297 HydrophobicContact CD1-CG 4.38Å; Y264-W297 HydrophobicContact CG-CB 4.45Å; Y264-W297 HydrophobicContact CG-CG 4.46Å; Y264-T299 WeakPolarHBondContact OH-CA 3.33Å; Y264-T299 VanDerWaalsContact OH-CG2 3.25Å; Y264-T299 WeakPolarHBondContact OH-CG2 3.3Å; Y264-T299 PolarHBondContact OH-O 2.75Å
265	S	95.6	Very high	96	Very high	63 Å²	63	56 Å²	56	44%	0.441	29%	0.293	S	S	.	.			trans	-148.3	164.4	-179.9	62.4	0	0	0	0	109.7
266	H	92.6	Very high	96.1	Very high	73 Å²	73	55.5 Å²	55.5	34%	0.338	29%	0.291	S	S	.	.			trans	-149.6	139.7	173	-172.3	65.2	0	0	0	108.5	N268 I269 W297	H266-N268 PolarHBondContact NE2-ND2 3.25Å; H266-N268 PolarHBondContact O-N 2.75Å; H266-I269 HydrophobicContact CB-CD1 3.83Å; H266-I269 HydrophobicContact CB-CG1 4.04Å; H266-I269 PolarHBondContact O-N 3.2Å; H266-W297 HydrophobicContact CB-CH2 4.06Å
267	D	88.2	Confident	96.1	Very high	152 Å²	152	46.7 Å²	46.7	81%	0.813	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.4	-170.9	-58.4	-26.7	0	0	0	114.1
268	N	89.9	Confident	96.1	Very high	134 Å²	134	45.8 Å²	45.8	72%	0.717	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-7.2	178.3	-60.5	-48.8	0	0	0	113.7	H266	H266-N268 PolarHBondContact NE2-ND2 3.25Å; H266-N268 PolarHBondContact O-N 2.75Å
269	I	91.8	Very high	96.1	Very high	14 Å²	14	44.9 Å²	44.9	7%	0.072	25%	0.246	C	C	.	.			trans	-102.1	104.2	-179	-57	176.3	0	0	0	107.7	A248 H266 Y289 W297	A248-I269 WeakPolarHBondContact CB-O 3.14Å; H266-I269 HydrophobicContact CB-CD1 3.83Å; H266-I269 HydrophobicContact CB-CG1 4.04Å; H266-I269 PolarHBondContact O-N 3.2Å; I269-Y289 HydrophobicContact CG2-CD1 3.69Å; I269-Y289 HydrophobicContact CG2-CE1 3.46Å; I269-Y289 VanDerWaalsContact CG2-CE1 3.46Å; I269-W297 HydrophobicContact CD1-CH2 4.13Å; I269-W297 HydrophobicContact CD1-CZ2 3.9Å
270	I	93.5	Very high	96.2	Very high	155 Å²	155	49.3 Å²	49.3	80%	0.795	27%	0.265	S	S	*	.			trans	-116.1	5.7	179.9	60.4	169.5	0	0	0	112.7
271	C	95.7	Very high	96.2	Very high	28 Å²	28	50.2 Å²	50.2	19%	0.189	28%	0.279	C	S	.	.	S	Bend	trans	-98.7	153.2	-177.5	62.5	0	0	0	0	111.2	A248 D290 D291	A248-C271 WeakPolarHBondContact CA-O 3.42Å; A248-C271 VanDerWaalsContact CB-O 3.24Å; A248-C271 WeakPolarHBondContact CB-O 3.46Å; C271-D290 HydrophobicContact CB-CB 4.14Å; C271-D291 HydrophobicContact CB-CB 4.48Å; C271-D291 VanDerWaalsContact SG-CB 3.58Å
272	G	96.5	Very high	96.2	Very high	7 Å²	7	47.6 Å²	47.6	7%	0.072	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-66.1	152	-179.7	0	0	0	0	0	112.9	D290	G272-D290 PolarHBondContact O-N 2.91Å
273	I	98.6	Very high	96.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.5	173.8	-64.6	144	0	0	0	108.5	N230 S245 T249 C250 V276 A287 G288 Y289	N230-I273 VanDerWaalsContact CB-O 3.27Å; N230-I273 WeakPolarHBondContact CB-O 3.44Å; N230-I273 PolarHBondContact ND2-O 2.79Å; S245-I273 PolarHBondContact O-N 3.15Å; T249-I273 WeakPolarHBondContact O-CD1 3.21Å; C250-I273 HydrophobicContact CB-CD1 4.47Å; C250-I273 WeakPolarHBondContact SG-CD1 3.16Å; I273-V276 HydrophobicContact CG2-CG1 3.8Å; I273-A287 HydrophobicContact CG2-CB 4.25Å; I273-G288 WeakPolarHBondContact CA-O 3.33Å; I273-Y289 HydrophobicContact CD1-CE1 3.86Å; I273-Y289 HydrophobicContact CG1-CD1 3.64Å; I273-Y289 HydrophobicContact CG1-CE1 3.21Å; I273-Y289 HydrophobicContact CG1-CE2 4.37Å; I273-Y289 HydrophobicContact CG1-CG 4.38Å
274	T	98.5	Very high	96.2	Very high	16 Å²	16	48.3 Å²	48.3	10%	0.098	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-27.2	-176.7	63.4	0	0	0	0	113	G288 D290 V315	T274-G288 PolarHBondContact N-O 2.81Å; T274-G288 PolarHBondContact OG1-O 3.17Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.34Å; T274-V315 VanDerWaalsContact CB-O 3.31Å; T274-V315 WeakPolarHBondContact CB-O 3.29Å; T274-V315 VanDerWaalsContact CG2-O 3.3Å; T274-V315 WeakPolarHBondContact CG2-O 3.43Å; T274-V315 PolarHBondContact OG1-O 3.34Å
275	S	98.3	Very high	96.2	Very high	10 Å²	10	48.3 Å²	48.3	7%	0.07	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	145.5	-170.7	52.6	0	0	0	0	111.2	A287 G288 L318	S275-A287 CarbonylContact O-C 3.44Å; S275-A287 VanDerWaalsContact O-CA 3.3Å; S275-A287 WeakPolarHBondContact O-CA 3.16Å; S275-G288 PolarHBondContact O-N 2.87Å; S275-L318 WeakPolarHBondContact OG-CD2 3.42Å; S275-L318 PolarHBondContact OG-N 3.2Å
276	V	98.6	Very high	96.4	Very high	13 Å²	13	45.5 Å²	45.5	8%	0.079	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.4	178.8	-62.9	0	0	0	0	110.7	A231 C233 I273 L285 L286 A287	A231-V276 HydrophobicContact CB-CG1 4.45Å; A231-V276 HydrophobicContact CB-CG2 3.9Å; C233-V276 HydrophobicContact CB-CG2 3.9Å; I273-V276 HydrophobicContact CG2-CG1 3.8Å; V276-L285 HydrophobicContact CB-CD1 4.25Å; V276-L286 CarbonylContact C-O 3.58Å; V276-L286 VanDerWaalsContact CA-O 3.3Å; V276-L286 WeakPolarHBondContact CA-O 3.49Å; V276-A287 HydrophobicContact CG1-CB 4.16Å
277	A	98.6	Very high	96.7	Very high	9 Å²	9	42 Å²	42	7%	0.074	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	146.3	170.1	0	0	0	0	0	112	L286 L318 V320	A277-L286 PolarHBondContact N-O 3.21Å; A277-L286 PolarHBondContact O-N 3.31Å; A277-L318 HydrophobicContact CB-CD1 3.27Å; A277-V320 HydrophobicContact CB-CG2 4.05Å
278	F	98.7	Very high	97.2	Very high	14 Å²	14	34.8 Å²	34.8	6%	0.061	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	146.6	171.9	-70.1	-76.9	0	0	0	112	F234 F235 P236 L252 L284 L285 T299 V320	F234-F278 WeakPolarHBondContact O-CD2 3.28Å; F235-F278 HydrophobicContact CB-CD2 4.43Å; F235-F278 HydrophobicContact CB-CE2 4.25Å; F235-F278 AromaticContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD1 3.84Å; F235-F278 HydrophobicContact CD2-CD2 4.25Å; F235-F278 AromaticContact CD2-CE1 3.77Å; F235-F278 HydrophobicContact CD2-CE1 3.77Å; F235-F278 HydrophobicContact CD2-CE2 4.17Å; F235-F278 HydrophobicContact CD2-CG 4.09Å; F235-F278 AromaticContact CD2-CZ 3.95Å; F235-F278 HydrophobicContact CD2-CZ 3.95Å; F235-F278 HydrophobicContact CE2-CD1 4.18Å; F235-F278 HydrophobicContact CE2-CE1 4.25Å; P236-F278 HydrophobicContact CG-CB 4.32Å; L252-F278 HydrophobicContact CD1-CE1 4.39Å; L252-F278 HydrophobicContact CD1-CZ 3.79Å; F278-L284 WeakPolarHBondContact CA-O 3.34Å; F278-L285 HydrophobicContact CD1-CB 4.17Å; F278-L285 HydrophobicContact CD1-CD1 4.12Å; F278-L285 HydrophobicContact CE1-CB 3.94Å; F278-L285 HydrophobicContact CE1-CD1 3.82Å; F278-L285 HydrophobicContact CE1-CG 4.32Å; F278-L285 HydrophobicContact CE2-CD1 4.34Å; F278-L285 HydrophobicContact CG-CD1 4.5Å; F278-L285 HydrophobicContact CZ-CD1 3.93Å; F278-T299 HydrophobicContact CE1-CG2 3.95Å; F278-V320 WeakPolarHBondContact O-CG2 3.48Å
279	S	98.3	Very high	97.6	Very high	17 Å²	17	28.4 Å²	28.4	12%	0.119	15%	0.154	C	C	.	.			trans	-61.8	161.6	158.5	57.5	0	0	0	0	111.4	S281 G282 R283 L284	S279-S281 VanDerWaalsContact C-N 3.26Å; S279-S281 PolarHBondContact O-N 3.27Å; S279-S281 VanDerWaalsContact O-N 3.17Å; S279-G282 WeakPolarHBondContact O-CA 3.25Å; S279-G282 PolarHBondContact O-N 2.96Å; S279-R283 PolarHBondContact OG-N 3.37Å; S279-L284 PolarHBondContact N-O 3.31Å; S279-L284 WeakPolarHBondContact OG-CB 3.23Å; S279-L284 PolarHBondContact OG-N 2.77Å; S279-L284 PolarHBondContact OG-O 3.11Å; S279-L284 VanDerWaalsContact OG-O 3.05Å
280	K	97.7	Very high	97.8	Very high	130 Å²	130	30.1 Å²	30.1	57%	0.565	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-37.6	-178.5	-175.6	176.1	-172.3	67.1	0	114.3	G282 S322 D323	K280-G282 VanDerWaalsContact C-N 3.31Å; K280-S322 PolarHBondContact NZ-O 2.92Å; K280-D323 VanDerWaalsContact CD-O 3.32Å; K280-D323 WeakPolarHBondContact CD-O 3.31Å
281	S	97.6	Very high	98	Very high	90 Å²	90	25.5 Å²	25.5	63%	0.629	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.5	176.9	62.9	0	0	0	0	113.3	S279 R283	S279-S281 VanDerWaalsContact C-N 3.26Å; S279-S281 PolarHBondContact O-N 3.27Å; S279-S281 VanDerWaalsContact O-N 3.17Å; S281-R283 PolarHBondContact O-N 2.81Å; S281-R283 WeakPolarHBondContact OG-CB 3.25Å; S281-R283 PolarHBondContact OG-N 3.32Å
282	G	97.4	Very high	98.1	Very high	2 Å²	2	28.5 Å²	28.5	2%	0.021	15%	0.15	C	C	.	.	S	Bend	trans	76.6	-1.9	-170.2	0	0	0	0	0	114.5	F235 S279 K280 L284 T299	F235-G282 VanDerWaalsContact CE2-CA 3.41Å; F235-G282 WeakPolarHBondContact CE2-O 3.47Å; S279-G282 WeakPolarHBondContact O-CA 3.25Å; S279-G282 PolarHBondContact O-N 2.96Å; K280-G282 VanDerWaalsContact C-N 3.31Å; G282-L284 VanDerWaalsContact C-N 3.31Å; G282-L284 PolarHBondContact O-N 3.47Å; G282-T299 VanDerWaalsContact O-CB 3.25Å; G282-T299 WeakPolarHBondContact O-CB 3.24Å; G282-T299 PolarHBondContact O-OG1 2.85Å
283	R	97.7	Very high	98.1	Very high	63 Å²	63	30.2 Å²	30.2	24%	0.238	16%	0.158	C	C	.	.	S	Bend	trans	-67.4	-32	-178.5	-176.8	59.7	-174.6	-89.2	0.6	113	D38 V40 S279 S281 D298 T299	D38-R283 PolarHBondContact O-NH2 2.9Å; V40-R283 HydrophobicContact CG1-CG 3.57Å; S279-R283 PolarHBondContact OG-N 3.37Å; S281-R283 PolarHBondContact O-N 2.81Å; S281-R283 WeakPolarHBondContact OG-CB 3.25Å; S281-R283 PolarHBondContact OG-N 3.32Å; R283-D298 IonicContact CZ-OD1 3.89Å; R283-D298 IonicContact CZ-OD2 3.78Å; R283-D298 IonicContact NE-OD1 2.76Å; R283-D298 PolarHBondContact NE-OD1 2.89Å; R283-D298 IonicContact NE-OD2 3.99Å; R283-D298 PolarHBondContact NE-OD2 3.42Å; R283-D298 IonicContact NH2-OD1 3.73Å; R283-D298 IonicContact NH2-OD2 3.26Å; R283-D298 PolarHBondContact NH2-OD2 3.33Å; R283-T299 PolarHBondContact O-N 2.74Å; R283-T299 PolarHBondContact O-OG1 2.94Å
284	L	98.4	Very high	98.1	Very high	25 Å²	25	30.2 Å²	30.2	13%	0.131	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.3	174.8	-51.1	177.4	0	0	0	110.7	V40 I43 F278 S279 G282 L286 V296 W297	V40-L284 HydrophobicContact CG1-CD2 4.33Å; V40-L284 HydrophobicContact CG2-CD2 4.22Å; I43-L284 HydrophobicContact CG1-CD1 4.49Å; I43-L284 HydrophobicContact CG1-CD2 4.39Å; F278-L284 WeakPolarHBondContact CA-O 3.34Å; S279-L284 PolarHBondContact N-O 3.31Å; S279-L284 WeakPolarHBondContact OG-CB 3.23Å; S279-L284 PolarHBondContact OG-N 2.77Å; S279-L284 PolarHBondContact OG-O 3.11Å; S279-L284 VanDerWaalsContact OG-O 3.05Å; G282-L284 VanDerWaalsContact C-N 3.31Å; G282-L284 PolarHBondContact O-N 3.47Å; L284-L286 HydrophobicContact CB-CD1 4.33Å; L284-V296 HydrophobicContact CB-CG1 4.04Å; L284-V296 HydrophobicContact CD1-CG1 4.01Å; L284-V296 HydrophobicContact CD2-CG1 4.05Å; L284-V296 HydrophobicContact CG-CG1 4.26Å; L284-W297 VanDerWaalsContact CA-O 3.3Å; L284-W297 WeakPolarHBondContact CA-O 3.14Å
285	L	98.6	Very high	98.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.8	165.3	172	63.8	0	0	0	108.3	C250 Y264 V276 F278 W297 T299	C250-L285 HydrophobicContact CB-CD2 3.94Å; Y264-L285 HydrophobicContact CD2-CD2 3.61Å; Y264-L285 HydrophobicContact CE2-CD2 3.61Å; Y264-L285 HydrophobicContact CG-CD2 4.23Å; V276-L285 HydrophobicContact CB-CD1 4.25Å; F278-L285 HydrophobicContact CD1-CB 4.17Å; F278-L285 HydrophobicContact CD1-CD1 4.12Å; F278-L285 HydrophobicContact CE1-CB 3.94Å; F278-L285 HydrophobicContact CE1-CD1 3.82Å; F278-L285 HydrophobicContact CE1-CG 4.32Å; F278-L285 HydrophobicContact CE2-CD1 4.34Å; F278-L285 HydrophobicContact CG-CD1 4.5Å; F278-L285 HydrophobicContact CZ-CD1 3.93Å; L285-W297 HydrophobicContact CB-CB 4.26Å; L285-W297 PolarHBondContact N-O 2.87Å; L285-W297 PolarHBondContact O-N 3.09Å; L285-T299 PolarHBondContact N-OG1 2.97Å
286	L	98.8	Very high	98.1	Very high	4 Å²	4	29 Å²	29	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.7	176.9	-60.9	92.9	0	0	0	108.6	V276 A277 L284 V296 L308 L318 V320 V327	V276-L286 CarbonylContact C-O 3.58Å; V276-L286 VanDerWaalsContact CA-O 3.3Å; V276-L286 WeakPolarHBondContact CA-O 3.49Å; A277-L286 PolarHBondContact N-O 3.21Å; A277-L286 PolarHBondContact O-N 3.31Å; L284-L286 HydrophobicContact CB-CD1 4.33Å; L286-V296 HydrophobicContact CD2-CG2 4.11Å; L286-V296 HydrophobicContact CG-CG1 4.46Å; L286-V296 HydrophobicContact CG-CG2 4.27Å; L286-L308 HydrophobicContact CD2-CD1 4.29Å; L286-L318 HydrophobicContact CB-CD1 4.29Å; L286-V320 HydrophobicContact CD1-CG2 3.95Å; L286-V327 HydrophobicContact CD2-CB 4.13Å; L286-V327 HydrophobicContact CD2-CG1 4.04Å; L286-V327 HydrophobicContact CD2-CG2 3.9Å
287	A	98.7	Very high	98.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	127.8	-178.7	0	0	0	0	0	110.6	C250 I273 S275 V276 Y289 C294 N295	C250-A287 VanDerWaalsContact SG-CB 3.52Å; I273-A287 HydrophobicContact CG2-CB 4.25Å; S275-A287 CarbonylContact O-C 3.44Å; S275-A287 VanDerWaalsContact O-CA 3.3Å; S275-A287 WeakPolarHBondContact O-CA 3.16Å; V276-A287 HydrophobicContact CG1-CB 4.16Å; A287-Y289 HydrophobicContact CB-CD2 4.4Å; A287-Y289 HydrophobicContact CB-CE2 3.56Å; A287-Y289 WeakPolarHBondContact O-CD2 3.46Å; A287-Y289 VanDerWaalsContact O-CE2 3.22Å; A287-Y289 WeakPolarHBondContact O-CE2 3.44Å; A287-C294 CarbonylContact O-C 3.51Å; A287-C294 WeakPolarHBondContact O-CA 3.39Å; A287-C294 PolarHBondContact O-SG 3.13Å; A287-N295 PolarHBondContact N-O 3.3Å; A287-N295 PolarHBondContact O-N 2.88Å
288	G	98.4	Very high	98	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.7	176.4	0	0	0	0	0	110.3	I273 T274 S275	I273-G288 WeakPolarHBondContact CA-O 3.33Å; T274-G288 PolarHBondContact N-O 2.81Å; T274-G288 PolarHBondContact OG1-O 3.17Å; S275-G288 PolarHBondContact O-N 2.87Å
289	Y	98.4	Very high	98	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	159.7	-172.3	-71.3	-99.4	0	0	0	111.6	I269 I273 A287 D291 F292 N293 N295 W297 V315	I269-Y289 HydrophobicContact CG2-CD1 3.69Å; I269-Y289 HydrophobicContact CG2-CE1 3.46Å; I269-Y289 VanDerWaalsContact CG2-CE1 3.46Å; I273-Y289 HydrophobicContact CD1-CE1 3.86Å; I273-Y289 HydrophobicContact CG1-CD1 3.64Å; I273-Y289 HydrophobicContact CG1-CE1 3.21Å; I273-Y289 HydrophobicContact CG1-CE2 4.37Å; I273-Y289 HydrophobicContact CG1-CG 4.38Å; A287-Y289 HydrophobicContact CB-CD2 4.4Å; A287-Y289 HydrophobicContact CB-CE2 3.56Å; A287-Y289 WeakPolarHBondContact O-CD2 3.46Å; A287-Y289 VanDerWaalsContact O-CE2 3.22Å; A287-Y289 WeakPolarHBondContact O-CE2 3.44Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.36Å; Y289-D291 PolarHBondContact O-N 2.9Å; Y289-F292 PolarHBondContact O-N 3.08Å; Y289-N293 PolarHBondContact N-O 3.22Å; Y289-N295 HydrophobicContact CD2-CB 4.35Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.26Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.36Å; Y289-N295 HydrophobicContact CE2-CB 3.72Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.47Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.35Å; Y289-W297 PolarHBondContact OH-NE1 3.14Å; Y289-W297 VanDerWaalsContact OH-NE1 3.09Å; Y289-V315 PolarHBondContact O-N 2.87Å
290	D	97.5	Very high	97.9	Very high	49 Å²	49	29.2 Å²	29.2	26%	0.262	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.3	174.4	-81.6	-25.3	0	0	0	113.5	C271 G272 T274 F292 R314	C271-D290 HydrophobicContact CB-CB 4.14Å; G272-D290 PolarHBondContact O-N 2.91Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.34Å; D290-F292 WeakPolarHBondContact O-CD1 3.45Å; D290-F292 WeakPolarHBondContact O-CE1 3.43Å; D290-F292 PolarHBondContact O-N 3.49Å; D290-R314 VanDerWaalsContact OD1-CD 3.31Å; D290-R314 WeakPolarHBondContact OD1-CD 3.32Å; D290-R314 IonicContact OD1-CZ 2.62Å; D290-R314 IonicContact OD1-NE 2.77Å; D290-R314 PolarHBondContact OD1-NE 2.81Å; D290-R314 IonicContact OD1-NH1 3.44Å
291	D	96.7	Very high	97.7	Very high	58 Å²	58	24.9 Å²	24.9	31%	0.31	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	13.3	173.1	77.7	-17.2	0	0	0	114.3	C271 Y289 N293	C271-D291 HydrophobicContact CB-CB 4.48Å; C271-D291 VanDerWaalsContact SG-CB 3.58Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.36Å; Y289-D291 PolarHBondContact O-N 2.9Å; D291-N293 PolarHBondContact O-N 3.07Å; D291-N293 PolarHBondContact O-ND2 2.83Å; D291-N293 WeakPolarHBondContact OD1-CB 3.38Å; D291-N293 PolarHBondContact OD1-N 3.15Å; D291-N293 PolarHBondContact OD2-ND2 2.85Å; D291-N293 VanDerWaalsContact OD2-ND2 3.13Å
292	F	97.7	Very high	97.5	Very high	91 Å²	91	21.4 Å²	21.4	40%	0.399	11%	0.108	S	C	.	.	S	Bend	trans	77	-3.2	176.6	-37.7	-23.5	0	0	0	114	Y289 D290 N313 R314 V315	Y289-F292 PolarHBondContact O-N 3.08Å; D290-F292 WeakPolarHBondContact O-CD1 3.45Å; D290-F292 WeakPolarHBondContact O-CE1 3.43Å; D290-F292 PolarHBondContact O-N 3.49Å; F292-N313 WeakPolarHBondContact CB-O 3.27Å; F292-N313 VanDerWaalsContact CD1-CA 3.5Å; F292-R314 HydrophobicContact CD1-CB 4.36Å; F292-V315 WeakPolarHBondContact O-CG2 3.26Å
293	N	97.4	Very high	97.4	Very high	43 Å²	43	25.9 Å²	25.9	23%	0.23	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	161.6	179.9	-59.3	-55.1	0	0	0	111.7	Y289 D291 V307 A309	Y289-N293 PolarHBondContact N-O 3.22Å; D291-N293 PolarHBondContact O-N 3.07Å; D291-N293 PolarHBondContact O-ND2 2.83Å; D291-N293 WeakPolarHBondContact OD1-CB 3.38Å; D291-N293 PolarHBondContact OD1-N 3.15Å; D291-N293 PolarHBondContact OD2-ND2 2.85Å; D291-N293 VanDerWaalsContact OD2-ND2 3.13Å; N293-V307 HydrophobicContact CB-CG1 4.1Å; N293-A309 WeakPolarHBondContact OD1-CB 3.38Å
294	C	98.1	Very high	97.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124	162.9	167.3	0	0	0	0	109	A287 V307 L308 T329	A287-C294 CarbonylContact O-C 3.51Å; A287-C294 WeakPolarHBondContact O-CA 3.39Å; A287-C294 PolarHBondContact O-SG 3.13Å; C294-V307 CarbonylContact O-C 3.55Å; C294-V307 WeakPolarHBondContact O-CA 3.21Å; C294-L308 HydrophobicContact CB-CB 4.07Å; C294-L308 HydrophobicContact CB-CD1 4.42Å; C294-L308 HydrophobicContact CB-CG 4.5Å; C294-L308 PolarHBondContact N-O 3.46Å; C294-L308 VanDerWaalsContact N-O 3.13Å; C294-L308 PolarHBondContact O-N 3.15Å; C294-T329 HydrophobicContact CB-CG2 4.48Å
295	N	98.3	Very high	97.2	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	141	177.4	-64.6	-66.3	0	0	0	109.8	A287 Y289 W297 R304	A287-N295 PolarHBondContact N-O 3.3Å; A287-N295 PolarHBondContact O-N 2.88Å; Y289-N295 HydrophobicContact CD2-CB 4.35Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.26Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.36Å; Y289-N295 HydrophobicContact CE2-CB 3.72Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.47Å; N295-W297 HydrophobicContact CB-CZ2 4.24Å; N295-R304 HydrophobicContact CB-CG 4.46Å; N295-R304 WeakPolarHBondContact OD1-CD 3.35Å; N295-R304 PolarHBondContact OD1-NH1 2.76Å; N295-R304 VanDerWaalsContact OD1-NH1 3.16Å
296	V	98.3	Very high	97.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	112.6	175	-176	0	0	0	0	107.7	L284 L286 A305 G306 L308	L284-V296 HydrophobicContact CB-CG1 4.04Å; L284-V296 HydrophobicContact CD1-CG1 4.01Å; L284-V296 HydrophobicContact CD2-CG1 4.05Å; L284-V296 HydrophobicContact CG-CG1 4.26Å; L286-V296 HydrophobicContact CD2-CG2 4.11Å; L286-V296 HydrophobicContact CG-CG1 4.46Å; L286-V296 HydrophobicContact CG-CG2 4.27Å; V296-A305 WeakPolarHBondContact O-CA 3.41Å; V296-A305 PolarHBondContact O-N 3.31Å; V296-G306 PolarHBondContact N-O 2.85Å; V296-G306 PolarHBondContact O-N 3.41Å; V296-G306 VanDerWaalsContact O-N 3.11Å; V296-L308 HydrophobicContact CG2-CD1 4.46Å; V296-L308 HydrophobicContact CG2-CD2 4.4Å; V296-L308 HydrophobicContact CG2-CG 4.12Å
297	W	98.3	Very high	97.1	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.015	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	141	-177.5	-59.4	97.2	0	0	0	110.9	Y264 H266 I269 L284 L285 Y289 N295 T299 D303 R304	Y264-W297 HydrophobicContact CD1-CB 4Å; Y264-W297 HydrophobicContact CD1-CE3 4.45Å; Y264-W297 HydrophobicContact CD1-CG 4.38Å; Y264-W297 HydrophobicContact CG-CB 4.45Å; Y264-W297 HydrophobicContact CG-CG 4.46Å; H266-W297 HydrophobicContact CB-CH2 4.06Å; I269-W297 HydrophobicContact CD1-CH2 4.13Å; I269-W297 HydrophobicContact CD1-CZ2 3.9Å; L284-W297 VanDerWaalsContact CA-O 3.3Å; L284-W297 WeakPolarHBondContact CA-O 3.14Å; L285-W297 HydrophobicContact CB-CB 4.26Å; L285-W297 PolarHBondContact N-O 2.87Å; L285-W297 PolarHBondContact O-N 3.09Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.35Å; Y289-W297 PolarHBondContact OH-NE1 3.14Å; Y289-W297 VanDerWaalsContact OH-NE1 3.09Å; N295-W297 HydrophobicContact CB-CZ2 4.24Å; W297-T299 PolarHBondContact O-N 3.41Å; W297-D303 WeakPolarHBondContact CA-O 3.31Å; W297-R304 HydrophobicContact CE3-CB 3.95Å; W297-R304 HydrophobicContact CH2-CB 4.32Å; W297-R304 HydrophobicContact CZ3-CB 3.84Å
298	D	97.8	Very high	97.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	108.8	165.4	-175	-22.8	0	0	0	108.7	V40 R283 L300 K301 G302 D303	V40-D298 HydrophobicContact CG2-CB 4.06Å; R283-D298 IonicContact CZ-OD1 3.89Å; R283-D298 IonicContact CZ-OD2 3.78Å; R283-D298 IonicContact NE-OD1 2.76Å; R283-D298 PolarHBondContact NE-OD1 2.89Å; R283-D298 IonicContact NE-OD2 3.99Å; R283-D298 PolarHBondContact NE-OD2 3.42Å; R283-D298 IonicContact NH2-OD1 3.73Å; R283-D298 IonicContact NH2-OD2 3.26Å; R283-D298 PolarHBondContact NH2-OD2 3.33Å; D298-L300 PolarHBondContact O-N 3.06Å; D298-L300 VanDerWaalsContact O-N 3.1Å; D298-L300 PolarHBondContact OD1-N 2.85Å; D298-K301 HydrophobicContact CB-CB 4.12Å; D298-K301 PolarHBondContact O-N 2.9Å; D298-K301 PolarHBondContact OD1-N 3.33Å; D298-G302 PolarHBondContact O-N 2.8Å; D298-D303 PolarHBondContact N-O 3.12Å
299	T	97.3	Very high	97	Very high	3 Å²	3	34 Å²	34	2%	0.018	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.5	-176.6	-48.8	0	0	0	0	112.8	L30 F235 L252 M262 Y264 F278 G282 R283 L285 W297	L30-T299 WeakPolarHBondContact CD2-O 3.5Å; F235-T299 HydrophobicContact CE2-CG2 4.39Å; L252-T299 HydrophobicContact CD2-CG2 3.94Å; M262-T299 VanDerWaalsContact SD-O 3.34Å; Y264-T299 WeakPolarHBondContact OH-CA 3.33Å; Y264-T299 VanDerWaalsContact OH-CG2 3.25Å; Y264-T299 WeakPolarHBondContact OH-CG2 3.3Å; Y264-T299 PolarHBondContact OH-O 2.75Å; F278-T299 HydrophobicContact CE1-CG2 3.95Å; G282-T299 VanDerWaalsContact O-CB 3.25Å; G282-T299 WeakPolarHBondContact O-CB 3.24Å; G282-T299 PolarHBondContact O-OG1 2.85Å; R283-T299 PolarHBondContact O-N 2.74Å; R283-T299 PolarHBondContact O-OG1 2.94Å; L285-T299 PolarHBondContact N-OG1 2.97Å; W297-T299 PolarHBondContact O-N 3.41Å
300	L	96.8	Very high	96.9	Very high	48 Å²	48	34.9 Å²	34.9	25%	0.251	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-30.6	-177.3	-63.2	-178.3	0	0	0	112.3	L30 T34 L37 D298	L30-L300 HydrophobicContact CD1-CD2 4.41Å; T34-L300 WeakPolarHBondContact CB-O 3.31Å; T34-L300 HydrophobicContact CG2-CB 3.83Å; T34-L300 HydrophobicContact CG2-CD2 4.02Å; T34-L300 HydrophobicContact CG2-CG 4.37Å; T34-L300 PolarHBondContact OG1-O 3.38Å; L37-L300 HydrophobicContact CD1-CD1 3.67Å; D298-L300 PolarHBondContact O-N 3.06Å; D298-L300 VanDerWaalsContact O-N 3.1Å; D298-L300 PolarHBondContact OD1-N 2.85Å
301	K	94.4	Very high	97	Very high	40 Å²	40	33.1 Å²	33.1	17%	0.174	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-25.8	-174.8	-66.8	-63.8	-167.5	176.5	0	113.5	T34 A35 L37 D298 D303	T34-K301 PolarHBondContact O-NZ 2.9Å; A35-K301 PolarHBondContact O-NZ 2.99Å; L37-K301 WeakPolarHBondContact O-CE 3.32Å; L37-K301 PolarHBondContact O-NZ 3.26Å; D298-K301 HydrophobicContact CB-CB 4.12Å; D298-K301 PolarHBondContact O-N 2.9Å; D298-K301 PolarHBondContact OD1-N 3.33Å; K301-D303 HydrophobicContact CB-CB 4.3Å; K301-D303 PolarHBondContact O-N 3.01Å
302	G	93.6	Very high	97	Very high	17 Å²	17	36.4 Å²	36.4	18%	0.175	20%	0.203	C	C	.	.			trans	81.6	-3.3	-170.7	0	0	0	0	0	113.4	M262 D298	M262-G302 PolarHBondContact SD-N 3.47Å; D298-G302 PolarHBondContact O-N 2.8Å
303	D	94.3	Very high	97	Very high	95 Å²	95	34.6 Å²	34.6	51%	0.508	20%	0.197	S	C	.	.			trans	-84.8	148.2	-175.9	-66.3	-36.4	0	0	0	112.4	W297 D298 K301 A305	W297-D303 WeakPolarHBondContact CA-O 3.31Å; D298-D303 PolarHBondContact N-O 3.12Å; K301-D303 HydrophobicContact CB-CB 4.3Å; K301-D303 PolarHBondContact O-N 3.01Å; D303-A305 PolarHBondContact O-N 2.82Å
304	R	95.9	Very high	97.1	Very high	112 Å²	112	35.6 Å²	35.6	42%	0.423	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	107.9	170.5	-174.4	171.4	62.3	172.9	-4.4	110.5	N295 W297	N295-R304 HydrophobicContact CB-CG 4.46Å; N295-R304 WeakPolarHBondContact OD1-CD 3.35Å; N295-R304 PolarHBondContact OD1-NH1 2.76Å; N295-R304 VanDerWaalsContact OD1-NH1 3.16Å; W297-R304 HydrophobicContact CE3-CB 3.95Å; W297-R304 HydrophobicContact CH2-CB 4.32Å; W297-R304 HydrophobicContact CZ3-CB 3.84Å
305	A	96.7	Very high	97.1	Very high	11 Å²	11	35.6 Å²	35.6	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-28.4	179.3	0	0	0	0	0	113.5	V40 R42 I43 V296 D303	V40-A305 HydrophobicContact CG2-CB 3.53Å; R42-A305 CarbonylContact C-O 3.49Å; R42-A305 WeakPolarHBondContact CA-O 3.36Å; I43-A305 HydrophobicContact CG1-CB 3.97Å; I43-A305 PolarHBondContact N-O 3.01Å; V296-A305 WeakPolarHBondContact O-CA 3.41Å; V296-A305 PolarHBondContact O-N 3.31Å; D303-A305 PolarHBondContact O-N 2.82Å
306	G	96.9	Very high	97.1	Very high	8 Å²	8	36 Å²	36	8%	0.082	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	171	-177.1	0	0	0	0	0	113.9	V296	V296-G306 PolarHBondContact N-O 2.85Å; V296-G306 PolarHBondContact O-N 3.41Å; V296-G306 VanDerWaalsContact O-N 3.11Å
307	V	97.6	Very high	97.1	Very high	62 Å²	62	36.5 Å²	36.5	38%	0.376	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	129.5	176.7	-175.8	0	0	0	0	108.9	N293 C294 A309	N293-V307 HydrophobicContact CB-CG1 4.1Å; C294-V307 CarbonylContact O-C 3.55Å; C294-V307 WeakPolarHBondContact O-CA 3.21Å; V307-A309 HydrophobicContact CG1-CB 4.34Å
308	L	98.1	Very high	97.1	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	89.4	171.2	-49	-176	0	0	0	108	M45 L286 C294 V296 V327 W339	M45-L308 HydrophobicContact CB-CD2 3.62Å; M45-L308 HydrophobicContact CG-CD2 4.14Å; M45-L308 HydrophobicContact SD-CD1 4.26Å; M45-L308 HydrophobicContact SD-CD2 3.95Å; L286-L308 HydrophobicContact CD2-CD1 4.29Å; C294-L308 HydrophobicContact CB-CB 4.07Å; C294-L308 HydrophobicContact CB-CD1 4.42Å; C294-L308 HydrophobicContact CB-CG 4.5Å; C294-L308 PolarHBondContact N-O 3.46Å; C294-L308 VanDerWaalsContact N-O 3.13Å; C294-L308 PolarHBondContact O-N 3.15Å; V296-L308 HydrophobicContact CG2-CD1 4.46Å; V296-L308 HydrophobicContact CG2-CD2 4.4Å; V296-L308 HydrophobicContact CG2-CG 4.12Å; L308-V327 HydrophobicContact CD1-CG1 4.07Å; L308-W339 HydrophobicContact CB-CD2 4.31Å; L308-W339 HydrophobicContact CB-CE3 4.27Å; L308-W339 HydrophobicContact CB-CH2 4.14Å; L308-W339 HydrophobicContact CB-CZ2 4.19Å; L308-W339 HydrophobicContact CB-CZ3 4.18Å; L308-W339 HydrophobicContact CD1-CD2 4.22Å; L308-W339 HydrophobicContact CD1-CG 4.14Å; L308-W339 HydrophobicContact CD2-CD2 4.39Å; L308-W339 HydrophobicContact CD2-CE3 4.09Å
309	A	97.3	Very high	97.1	Very high	66 Å²	66	37.6 Å²	37.6	55%	0.545	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.2	175.8	0	0	0	0	0	109.2	N293 V307	N293-A309 WeakPolarHBondContact OD1-CB 3.38Å; V307-A309 HydrophobicContact CG1-CB 4.34Å
310	G	96.6	Very high	97.2	Very high	20 Å²	20	39 Å²	39	21%	0.206	22%	0.221	C	C	.	.			trans	-175.8	-0.1	177.3	0	0	0	0	0	115.3	R337	G310-R337 PolarHBondContact O-NE 2.95Å; G310-R337 PolarHBondContact O-NH2 3.31Å
311	H	98.3	Very high	97.3	Very high	12 Å²	12	37 Å²	37	6%	0.056	21%	0.211	C	C	.	.			trans	-97	149.3	171.5	-73.3	-71.5	0	0	0	110.3	N313 V315 T329 S331 D333 F335	H311-N313 VanDerWaalsContact C-N 3.35Å; H311-N313 WeakPolarHBondContact CB-O 3.49Å; H311-V315 HydrophobicContact CB-CG2 4.47Å; H311-T329 PolarHBondContact NE2-OG1 2.78Å; H311-S331 VanDerWaalsContact CG-CB 3.44Å; H311-S331 WeakPolarHBondContact ND1-CB 3.47Å; H311-D333 VanDerWaalsContact CA-OD2 3.32Å; H311-D333 WeakPolarHBondContact CA-OD2 3.27Å; H311-D333 WeakPolarHBondContact CB-OD2 3.11Å; H311-D333 IonicContact CE1-OD1 3.25Å; H311-D333 IonicContact CE1-OD2 3.94Å; H311-D333 IonicContact CG-OD2 2.77Å; H311-D333 IonicContact ND1-OD1 3.69Å; H311-D333 PolarHBondContact ND1-OD1 2.79Å; H311-D333 IonicContact ND1-OD2 3.99Å; H311-D333 PolarHBondContact ND1-OD2 2.83Å; H311-F335 PolarHBondContact CE1-O 3.22Å
312	D	97.7	Very high	97.3	Very high	127 Å²	127	38.4 Å²	38.4	68%	0.679	23%	0.226	S	C	*	.	S	Bend	trans	-97.3	6.2	179.3	-60.7	-43.3	0	0	0	111.9	D333	D312-D333 HydrophobicContact CB-CB 4.39Å; D312-D333 PolarHBondContact N-OD2 3.12Å
313	N	98.3	Very high	97.5	Very high	53 Å²	53	40.2 Å²	40.2	28%	0.283	23%	0.232	S	C	.	.	S	Bend	trans	-156.4	173.2	178.7	-150.8	-38.5	0	0	0	109.7	F292 H311 V315 S331 W332 D333	F292-N313 WeakPolarHBondContact CB-O 3.27Å; F292-N313 VanDerWaalsContact CD1-CA 3.5Å; H311-N313 VanDerWaalsContact C-N 3.35Å; H311-N313 WeakPolarHBondContact CB-O 3.49Å; N313-V315 PolarHBondContact O-N 3.38Å; N313-S331 PolarHBondContact O-OG 3.15Å; N313-W332 HydrophobicContact CB-CB 3.91Å; N313-D333 HydrophobicContact CB-CB 4.09Å
314	R	97.9	Very high	97.6	Very high	63 Å²	63	37.4 Å²	37.4	24%	0.238	23%	0.225	C	C	.	.			trans	-51.6	134.5	-174.3	60.2	173.3	-97.8	-177.8	0.4	112.4	D290 F292 S316 S331 W332	D290-R314 VanDerWaalsContact OD1-CD 3.31Å; D290-R314 WeakPolarHBondContact OD1-CD 3.32Å; D290-R314 IonicContact OD1-CZ 2.62Å; D290-R314 IonicContact OD1-NE 2.77Å; D290-R314 PolarHBondContact OD1-NE 2.81Å; D290-R314 IonicContact OD1-NH1 3.44Å; F292-R314 HydrophobicContact CD1-CB 4.36Å; R314-S316 PolarHBondContact O-N 3.19Å; R314-S331 VanDerWaalsContact O-CA 3.28Å; R314-S331 WeakPolarHBondContact O-CA 3.21Å; R314-S331 WeakPolarHBondContact O-CB 3.22Å; R314-S331 PolarHBondContact O-OG 3.28Å; R314-W332 VanDerWaalsContact CD-CE2 3.41Å; R314-W332 VanDerWaalsContact CD-CE3 3.45Å; R314-W332 HydrophobicContact CG-CB 3.97Å; R314-W332 HydrophobicContact CG-CD2 3.29Å; R314-W332 HydrophobicContact CG-CE3 3.5Å; R314-W332 HydrophobicContact CG-CG 3.5Å; R314-W332 HydrophobicContact CG-CZ2 4.38Å; R314-W332 HydrophobicContact CG-CZ3 4.13Å; R314-W332 VanDerWaalsContact NE-CE2 3.33Å; R314-W332 PolarHBondContact O-N 3.43Å; R314-W332 VanDerWaalsContact O-N 3.11Å
315	V	98.6	Very high	97.7	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	117.3	168.9	179	0	0	0	0	105.6	T274 Y289 F292 H311 N313	T274-V315 VanDerWaalsContact CB-O 3.31Å; T274-V315 WeakPolarHBondContact CB-O 3.29Å; T274-V315 VanDerWaalsContact CG2-O 3.3Å; T274-V315 WeakPolarHBondContact CG2-O 3.43Å; T274-V315 PolarHBondContact OG1-O 3.34Å; Y289-V315 PolarHBondContact O-N 2.87Å; F292-V315 WeakPolarHBondContact O-CG2 3.26Å; H311-V315 HydrophobicContact CB-CG2 4.47Å; N313-V315 PolarHBondContact O-N 3.38Å
316	S	98.5	Very high	97.7	Very high	11 Å²	11	38.6 Å²	38.6	8%	0.077	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-28.2	-175.9	60.3	0	0	0	0	112.2	I58 R314 G330	I58-S316 WeakPolarHBondContact O-CB 3.41Å; I58-S316 PolarHBondContact O-OG 2.88Å; R314-S316 PolarHBondContact O-N 3.19Å; S316-G330 PolarHBondContact N-O 2.91Å; S316-G330 PolarHBondContact OG-O 3.42Å
317	C	98.4	Very high	97.8	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.068	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	153.7	-177.9	56.5	0	0	0	0	110.9	Y59 A60 M61 T329 G330	Y59-C317 WeakPolarHBondContact O-CB 3.42Å; A60-C317 VanDerWaalsContact C-SG 3.59Å; M61-C317 HydrophobicContact CG-CB 4.19Å; M61-C317 VanDerWaalsContact CG-SG 3.57Å; C317-T329 WeakPolarHBondContact O-CA 3.4Å; C317-G330 PolarHBondContact N-O 2.81Å; C317-G330 PolarHBondContact O-N 3.41Å
318	L	98.4	Very high	97.9	Very high	17 Å²	17	35.3 Å²	35.3	9%	0.089	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	158.7	172.3	69.3	87.2	0	0	0	110.3	S275 A277 L286 A328 T329	S275-L318 WeakPolarHBondContact OG-CD2 3.42Å; S275-L318 PolarHBondContact OG-N 3.2Å; A277-L318 HydrophobicContact CB-CD1 3.27Å; L286-L318 HydrophobicContact CB-CD1 4.29Å; L318-A328 CarbonylContact C-O 3.57Å; L318-A328 WeakPolarHBondContact CA-O 3.42Å; L318-T329 HydrophobicContact CB-CG2 4.12Å
319	G	98.2	Very high	97.9	Very high	11 Å²	11	35.2 Å²	35.2	11%	0.113	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	141.7	175.3	0	0	0	0	0	111.6	W63 V327 A328	W63-G319 PolarHBondContact NE1-O 3.33Å; G319-V327 CarbonylContact O-C 3.57Å; G319-V327 WeakPolarHBondContact O-CA 3.49Å; G319-V327 WeakPolarHBondContact O-CG2 3.48Å; G319-A328 PolarHBondContact N-O 3.08Å; G319-A328 PolarHBondContact O-N 3.4Å
320	V	98.6	Very high	98	Very high	31 Å²	31	32.1 Å²	32.1	19%	0.188	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	142.6	173.1	-177.3	0	0	0	0	108.8	A277 F278 L286 V327	A277-V320 HydrophobicContact CB-CG2 4.05Å; F278-V320 WeakPolarHBondContact O-CG2 3.48Å; L286-V320 HydrophobicContact CD1-CG2 3.95Å; V320-V327 HydrophobicContact CG2-CB 4.32Å; V320-V327 HydrophobicContact CG2-CG2 4.24Å
321	T	98.3	Very high	98.1	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.043	18%	0.18	C	C	.	.			trans	-66.3	153.5	176.2	55.8	0	0	0	0	111.9	W63 S67 D323 G324 M325 A326	W63-T321 HydrophobicContact CD2-CG2 3.7Å; W63-T321 HydrophobicContact CE3-CG2 3.87Å; W63-T321 HydrophobicContact CG-CG2 4.27Å; W63-T321 HydrophobicContact CH2-CG2 3.94Å; W63-T321 HydrophobicContact CZ2-CG2 3.74Å; W63-T321 HydrophobicContact CZ3-CG2 3.99Å; S67-T321 WeakPolarHBondContact OG-CB 3.44Å; T321-D323 WeakPolarHBondContact CB-OD1 3.48Å; T321-D323 PolarHBondContact O-N 2.93Å; T321-D323 PolarHBondContact OG1-OD1 3.21Å; T321-G324 PolarHBondContact O-N 3.01Å; T321-G324 PolarHBondContact OG1-N 3.05Å; T321-M325 PolarHBondContact OG1-N 3.25Å; T321-A326 HydrophobicContact CG2-CB 4.12Å; T321-A326 PolarHBondContact N-O 2.92Å; T321-A326 PolarHBondContact OG1-N 2.77Å; T321-A326 VanDerWaalsContact OG1-N 3.1Å; T321-A326 PolarHBondContact OG1-O 2.94Å
322	S	95.2	Very high	98.1	Very high	69 Å²	69	33.1 Å²	33.1	48%	0.483	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.3	-178.6	63.3	0	0	0	0	112.7	S65 S67 K280	S65-S322 PolarHBondContact O-OG 3.25Å; S67-S322 PolarHBondContact OG-N 2.97Å; S67-S322 PolarHBondContact OG-OG 2.85Å; K280-S322 PolarHBondContact NZ-O 2.92Å
323	D	96.9	Very high	98.1	Very high	56 Å²	56	28 Å²	28	30%	0.299	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.7	172.7	67.7	3.8	0	0	0	114.1	S67 K280 T321 M325	S67-D323 VanDerWaalsContact CB-CG 3.47Å; S67-D323 WeakPolarHBondContact CB-OD2 3.31Å; S67-D323 PolarHBondContact OG-N 3.06Å; S67-D323 PolarHBondContact OG-OD1 2.76Å; K280-D323 VanDerWaalsContact CD-O 3.32Å; K280-D323 WeakPolarHBondContact CD-O 3.31Å; T321-D323 WeakPolarHBondContact CB-OD1 3.48Å; T321-D323 PolarHBondContact O-N 2.93Å; T321-D323 PolarHBondContact OG1-OD1 3.21Å; D323-M325 VanDerWaalsContact C-N 3.27Å; D323-M325 HydrophobicContact CB-CG 4.19Å; D323-M325 PolarHBondContact O-N 3.43Å; D323-M325 VanDerWaalsContact OD1-CB 3.29Å; D323-M325 WeakPolarHBondContact OD1-CB 3.26Å; D323-M325 WeakPolarHBondContact OD1-CG 3.04Å; D323-M325 PolarHBondContact OD1-N 3.39Å; D323-M325 VanDerWaalsContact OD2-CG 3.23Å; D323-M325 WeakPolarHBondContact OD2-CG 3.37Å
324	G	96.9	Very high	98.1	Very high	35 Å²	35	26.7 Å²	26.7	36%	0.361	15%	0.154	S	C	.	.	S	Bend	trans	73	8.9	-178.1	0	0	0	0	0	115.4	T321	T321-G324 PolarHBondContact O-N 3.01Å; T321-G324 PolarHBondContact OG1-N 3.05Å
325	M	97.5	Very high	98.1	Very high	133 Å²	133	26.5 Å²	26.5	66%	0.655	16%	0.155	S	C	*	.	S	Bend	trans	-74.2	-24.9	-175.7	-69.9	-67.7	174.1	0	0	114.5	T321 D323 N340	T321-M325 PolarHBondContact OG1-N 3.25Å; D323-M325 VanDerWaalsContact C-N 3.27Å; D323-M325 HydrophobicContact CB-CG 4.19Å; D323-M325 PolarHBondContact O-N 3.43Å; D323-M325 VanDerWaalsContact OD1-CB 3.29Å; D323-M325 WeakPolarHBondContact OD1-CB 3.26Å; D323-M325 WeakPolarHBondContact OD1-CG 3.04Å; D323-M325 PolarHBondContact OD1-N 3.39Å; D323-M325 VanDerWaalsContact OD2-CG 3.23Å; D323-M325 WeakPolarHBondContact OD2-CG 3.37Å; M325-N340 VanDerWaalsContact O-CB 3.28Å; M325-N340 WeakPolarHBondContact O-CB 3.46Å
326	A	98	Very high	98.1	Very high	15 Å²	15	26.4 Å²	26.4	12%	0.124	16%	0.155	C	C	.	.			trans	-149.6	157.1	-178.2	0	0	0	0	0	112.6	T321 I338 W339	T321-A326 HydrophobicContact CG2-CB 4.12Å; T321-A326 PolarHBondContact N-O 2.92Å; T321-A326 PolarHBondContact OG1-N 2.77Å; T321-A326 VanDerWaalsContact OG1-N 3.1Å; T321-A326 PolarHBondContact OG1-O 2.94Å; A326-I338 HydrophobicContact CB-CG2 3.77Å; A326-W339 WeakPolarHBondContact CA-O 3.24Å
327	V	98.5	Very high	98.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.9	164.8	58.1	0	0	0	0	108.9	M45 L286 L308 G319 V320 I338 W339	M45-V327 HydrophobicContact CE-CG1 4.27Å; M45-V327 HydrophobicContact SD-CG1 3.84Å; L286-V327 HydrophobicContact CD2-CB 4.13Å; L286-V327 HydrophobicContact CD2-CG1 4.04Å; L286-V327 HydrophobicContact CD2-CG2 3.9Å; L308-V327 HydrophobicContact CD1-CG1 4.07Å; G319-V327 CarbonylContact O-C 3.57Å; G319-V327 WeakPolarHBondContact O-CA 3.49Å; G319-V327 WeakPolarHBondContact O-CG2 3.48Å; V320-V327 HydrophobicContact CG2-CB 4.32Å; V320-V327 HydrophobicContact CG2-CG2 4.24Å; V327-I338 CarbonylContact O-C 3.53Å; V327-I338 WeakPolarHBondContact O-CA 3.33Å; V327-W339 HydrophobicContact CG1-CB 3.63Å; V327-W339 HydrophobicContact CG1-CG 4.07Å; V327-W339 PolarHBondContact N-O 3.38Å; V327-W339 PolarHBondContact O-N 3.11Å
328	A	98.8	Very high	98.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.1	166.2	0	0	0	0	0	110.1	M61 W63 L318 G319 R337 I338	M61-A328 HydrophobicContact CE-CB 3.48Å; M61-A328 VanDerWaalsContact CE-CB 3.48Å; M61-A328 HydrophobicContact SD-CB 4.26Å; W63-A328 HydrophobicContact CH2-CB 4.43Å; W63-A328 HydrophobicContact CZ2-CB 3.41Å; W63-A328 VanDerWaalsContact CZ2-CB 3.41Å; L318-A328 CarbonylContact C-O 3.57Å; L318-A328 WeakPolarHBondContact CA-O 3.42Å; G319-A328 PolarHBondContact N-O 3.08Å; G319-A328 PolarHBondContact O-N 3.4Å; A328-R337 CarbonylContact C-O 3.49Å; A328-R337 VanDerWaalsContact CA-O 3.25Å; A328-R337 WeakPolarHBondContact CA-O 3.48Å; A328-I338 HydrophobicContact CB-CG1 4.42Å
329	T	98.8	Very high	98.1	Very high	1 Å²	1	28 Å²	28	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.9	169.8	57.4	0	0	0	0	108.8	C294 H311 C317 L318 L336 R337 W339	C294-T329 HydrophobicContact CB-CG2 4.48Å; H311-T329 PolarHBondContact NE2-OG1 2.78Å; C317-T329 WeakPolarHBondContact O-CA 3.4Å; L318-T329 HydrophobicContact CB-CG2 4.12Å; T329-L336 CarbonylContact O-C 3.56Å; T329-L336 VanDerWaalsContact O-CA 3.23Å; T329-L336 WeakPolarHBondContact O-CA 3.47Å; T329-R337 PolarHBondContact N-O 3.4Å; T329-R337 PolarHBondContact O-N 3.2Å; T329-W339 PolarHBondContact OG1-NE1 2.79Å
330	G	98.7	Very high	97.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	145.3	171.4	0	0	0	0	0	110.2	S316 C317	S316-G330 PolarHBondContact N-O 2.91Å; S316-G330 PolarHBondContact OG-O 3.42Å; C317-G330 PolarHBondContact N-O 2.81Å; C317-G330 PolarHBondContact O-N 3.41Å
331	S	98.8	Very high	97.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.1	-175.1	167.5	0	0	0	0	112.2	I58 H311 N313 R314 D333 S334 F335	I58-S331 WeakPolarHBondContact CB-O 3.47Å; I58-S331 PolarHBondContact N-O 2.73Å; H311-S331 VanDerWaalsContact CG-CB 3.44Å; H311-S331 WeakPolarHBondContact ND1-CB 3.47Å; N313-S331 PolarHBondContact O-OG 3.15Å; R314-S331 VanDerWaalsContact O-CA 3.28Å; R314-S331 WeakPolarHBondContact O-CA 3.21Å; R314-S331 WeakPolarHBondContact O-CB 3.22Å; R314-S331 PolarHBondContact O-OG 3.28Å; S331-D333 VanDerWaalsContact CB-OD1 3.29Å; S331-D333 WeakPolarHBondContact CB-OD1 3.42Å; S331-D333 PolarHBondContact O-N 3.25Å; S331-D333 PolarHBondContact OG-N 3.23Å; S331-D333 VanDerWaalsContact OG-N 3.15Å; S331-D333 PolarHBondContact OG-OD1 2.74Å; S331-S334 PolarHBondContact O-N 3.3Å; S331-F335 PolarHBondContact N-O 3.09Å
332	W	98.6	Very high	97.8	Very high	53 Å²	53	33.5 Å²	33.5	20%	0.201	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-9.5	169.7	-76	13.6	0	0	0	113.9	K57 I58 Y59 N313 R314 S334	K57-W332 HydrophobicContact CB-CB 4.21Å; K57-W332 HydrophobicContact CB-CG 3.93Å; K57-W332 HydrophobicContact CD-CB 4.3Å; K57-W332 HydrophobicContact CD-CD2 3.69Å; K57-W332 HydrophobicContact CD-CE3 3.95Å; K57-W332 HydrophobicContact CD-CG 3.87Å; K57-W332 HydrophobicContact CG-CB 3.89Å; K57-W332 HydrophobicContact CG-CD2 4.23Å; K57-W332 HydrophobicContact CG-CG 3.86Å; I58-W332 VanDerWaalsContact O-CD1 3.29Å; Y59-W332 HydrophobicContact CE2-CZ2 4.45Å; Y59-W332 AromaticContact CE2-NE1 3.72Å; Y59-W332 AromaticContact CZ-CZ2 3.98Å; Y59-W332 AromaticContact CZ-NE1 3.98Å; N313-W332 HydrophobicContact CB-CB 3.91Å; R314-W332 VanDerWaalsContact CD-CE2 3.41Å; R314-W332 VanDerWaalsContact CD-CE3 3.45Å; R314-W332 HydrophobicContact CG-CB 3.97Å; R314-W332 HydrophobicContact CG-CD2 3.29Å; R314-W332 HydrophobicContact CG-CE3 3.5Å; R314-W332 HydrophobicContact CG-CG 3.5Å; R314-W332 HydrophobicContact CG-CZ2 4.38Å; R314-W332 HydrophobicContact CG-CZ3 4.13Å; R314-W332 VanDerWaalsContact NE-CE2 3.33Å; R314-W332 PolarHBondContact O-N 3.43Å; R314-W332 VanDerWaalsContact O-N 3.11Å; W332-S334 PolarHBondContact O-N 3.39Å
333	D	98.2	Very high	98	Very high	21 Å²	21	31.5 Å²	31.5	11%	0.112	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	3.4	170.3	72	6.2	0	0	0	114.1	H311 D312 N313 S331 F335	H311-D333 VanDerWaalsContact CA-OD2 3.32Å; H311-D333 WeakPolarHBondContact CA-OD2 3.27Å; H311-D333 WeakPolarHBondContact CB-OD2 3.11Å; H311-D333 IonicContact CE1-OD1 3.25Å; H311-D333 IonicContact CE1-OD2 3.94Å; H311-D333 IonicContact CG-OD2 2.77Å; H311-D333 IonicContact ND1-OD1 3.69Å; H311-D333 PolarHBondContact ND1-OD1 2.79Å; H311-D333 IonicContact ND1-OD2 3.99Å; H311-D333 PolarHBondContact ND1-OD2 2.83Å; D312-D333 HydrophobicContact CB-CB 4.39Å; D312-D333 PolarHBondContact N-OD2 3.12Å; N313-D333 HydrophobicContact CB-CB 4.09Å; S331-D333 VanDerWaalsContact CB-OD1 3.29Å; S331-D333 WeakPolarHBondContact CB-OD1 3.42Å; S331-D333 PolarHBondContact O-N 3.25Å; S331-D333 PolarHBondContact OG-N 3.23Å; S331-D333 VanDerWaalsContact OG-N 3.15Å; S331-D333 PolarHBondContact OG-OD1 2.74Å; D333-F335 VanDerWaalsContact C-N 3.28Å; D333-F335 HydrophobicContact CB-CD2 4.22Å; D333-F335 VanDerWaalsContact O-CD2 3.22Å; D333-F335 WeakPolarHBondContact O-CD2 3.29Å; D333-F335 WeakPolarHBondContact O-CE2 3.48Å; D333-F335 PolarHBondContact O-N 2.81Å; D333-F335 WeakPolarHBondContact OD1-CB 3.42Å; D333-F335 PolarHBondContact OD1-N 3.14Å
334	S	98.3	Very high	98	Very high	24 Å²	24	30.1 Å²	30.1	17%	0.168	16%	0.159	C	C	.	.	S	Bend	trans	71.4	7.9	-179	76.1	0	0	0	0	116.1	A56 I58 S331 W332	A56-S334 WeakPolarHBondContact O-CA 3.42Å; A56-S334 WeakPolarHBondContact O-CB 3.38Å; I58-S334 VanDerWaalsContact CD1-C 3.41Å; I58-S334 WeakPolarHBondContact CD1-O 3.22Å; S331-S334 PolarHBondContact O-N 3.3Å; W332-S334 PolarHBondContact O-N 3.39Å
335	F	98.4	Very high	98.1	Very high	59 Å²	59	29.8 Å²	29.8	26%	0.259	15%	0.146	S	C	.	.			trans	-106.7	147.1	178.1	-59.3	-65.2	0	0	0	112.5	T50 R52 I58 H311 S331 D333	T50-F335 HydrophobicContact CG2-CB 4.33Å; T50-F335 HydrophobicContact CG2-CD1 4.16Å; T50-F335 HydrophobicContact CG2-CG 4.39Å; R52-F335 HydrophobicContact CB-CE1 4.36Å; R52-F335 HydrophobicContact CG-CD1 3.84Å; R52-F335 HydrophobicContact CG-CE1 3.74Å; I58-F335 VanDerWaalsContact CD1-C 3.49Å; I58-F335 WeakPolarHBondContact CD1-O 3.11Å; H311-F335 PolarHBondContact CE1-O 3.22Å; S331-F335 PolarHBondContact N-O 3.09Å; D333-F335 VanDerWaalsContact C-N 3.28Å; D333-F335 HydrophobicContact CB-CD2 4.22Å; D333-F335 VanDerWaalsContact O-CD2 3.22Å; D333-F335 WeakPolarHBondContact O-CD2 3.29Å; D333-F335 WeakPolarHBondContact O-CE2 3.48Å; D333-F335 PolarHBondContact O-N 2.81Å; D333-F335 WeakPolarHBondContact OD1-CB 3.42Å; D333-F335 PolarHBondContact OD1-N 3.14Å
336	L	98.7	Very high	98.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	138.3	157.5	-59.2	92.1	0	0	0	109.8	T50 L51 I58 M61 L70 W82 T329	T50-L336 CarbonylContact C-O 3.59Å; T50-L336 WeakPolarHBondContact CA-O 3.26Å; L51-L336 HydrophobicContact CB-CB 4.08Å; L51-L336 HydrophobicContact CB-CD1 4.48Å; L51-L336 HydrophobicContact CD1-CB 4.08Å; L51-L336 HydrophobicContact CG-CB 4.3Å; L51-L336 PolarHBondContact N-O 3.09Å; L51-L336 PolarHBondContact O-N 2.85Å; I58-L336 HydrophobicContact CD1-CD1 3.41Å; I58-L336 VanDerWaalsContact CD1-CD1 3.41Å; I58-L336 HydrophobicContact CD1-CG 3.87Å; I58-L336 HydrophobicContact CG1-CD1 4.39Å; M61-L336 HydrophobicContact CB-CD2 3.88Å; M61-L336 HydrophobicContact CG-CD2 4.31Å; L70-L336 HydrophobicContact CD1-CD2 3.77Å; W82-L336 HydrophobicContact CZ2-CD1 4.35Å; T329-L336 CarbonylContact O-C 3.56Å; T329-L336 VanDerWaalsContact O-CA 3.23Å; T329-L336 WeakPolarHBondContact O-CA 3.47Å
337	R	98.6	Very high	98.2	Very high	52 Å²	52	23.4 Å²	23.4	20%	0.196	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.4	175.4	-69.2	179.7	177.8	-109.1	3.6	109.6	T47 R49 G310 A328 T329 W339	T47-R337 HydrophobicContact CG2-CB 4.03Å; T47-R337 HydrophobicContact CG2-CG 4.08Å; R49-R337 WeakPolarHBondContact O-CA 3.08Å; G310-R337 PolarHBondContact O-NE 2.95Å; G310-R337 PolarHBondContact O-NH2 3.31Å; A328-R337 CarbonylContact C-O 3.49Å; A328-R337 VanDerWaalsContact CA-O 3.25Å; A328-R337 WeakPolarHBondContact CA-O 3.48Å; T329-R337 PolarHBondContact N-O 3.4Å; T329-R337 PolarHBondContact O-N 3.2Å; R337-W339 HydrophobicContact CB-CZ2 3.92Å; R337-W339 HydrophobicContact CG-CZ2 4.45Å; R337-W339 PolarHBondContact O-NE1 2.98Å
338	I	98.6	Very high	98.1	Very high	9 Å²	9	25.1 Å²	25.1	5%	0.046	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.1	173.5	-59.8	160.3	0	0	0	108.1	T47 R48 R49 L51 W63 S84 A326 V327 A328	T47-I338 CarbonylContact C-O 3.58Å; T47-I338 WeakPolarHBondContact CA-O 3.5Å; R48-I338 PolarHBondContact N-O 3.08Å; R49-I338 HydrophobicContact CB-CB 4.12Å; R49-I338 HydrophobicContact CB-CD1 3.88Å; R49-I338 HydrophobicContact CB-CG1 4.4Å; R49-I338 HydrophobicContact CG-CD1 4.32Å; R49-I338 PolarHBondContact N-O 3.32Å; R49-I338 PolarHBondContact O-N 2.87Å; L51-I338 HydrophobicContact CD1-CD1 4.16Å; L51-I338 HydrophobicContact CD2-CD1 4.26Å; L51-I338 HydrophobicContact CG-CD1 4.3Å; W63-I338 HydrophobicContact CH2-CD1 4.3Å; W63-I338 HydrophobicContact CH2-CG1 4.3Å; S84-I338 VanDerWaalsContact CB-CD1 3.43Å; A326-I338 HydrophobicContact CB-CG2 3.77Å; V327-I338 CarbonylContact O-C 3.53Å; V327-I338 WeakPolarHBondContact O-CA 3.33Å; A328-I338 HydrophobicContact CB-CG1 4.42Å
339	W	98.6	Very high	98.1	Very high	9 Å²	9	27.2 Å²	27.2	3%	0.034	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	143.3	-175.7	-40.2	73.8	0	0	0	110.7	M45 R46 T47 L308 A326 V327 T329 R337	M45-W339 HydrophobicContact CB-CB 4.09Å; M45-W339 HydrophobicContact SD-CB 4.37Å; R46-W339 WeakPolarHBondContact O-CA 3.21Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.42Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.2Å; L308-W339 HydrophobicContact CB-CD2 4.31Å; L308-W339 HydrophobicContact CB-CE3 4.27Å; L308-W339 HydrophobicContact CB-CH2 4.14Å; L308-W339 HydrophobicContact CB-CZ2 4.19Å; L308-W339 HydrophobicContact CB-CZ3 4.18Å; L308-W339 HydrophobicContact CD1-CD2 4.22Å; L308-W339 HydrophobicContact CD1-CG 4.14Å; L308-W339 HydrophobicContact CD2-CD2 4.39Å; L308-W339 HydrophobicContact CD2-CE3 4.09Å; A326-W339 WeakPolarHBondContact CA-O 3.24Å; V327-W339 HydrophobicContact CG1-CB 3.63Å; V327-W339 HydrophobicContact CG1-CG 4.07Å; V327-W339 PolarHBondContact N-O 3.38Å; V327-W339 PolarHBondContact O-N 3.11Å; T329-W339 PolarHBondContact OG1-NE1 2.79Å; R337-W339 HydrophobicContact CB-CZ2 3.92Å; R337-W339 HydrophobicContact CG-CZ2 4.45Å; R337-W339 PolarHBondContact O-NE1 2.98Å
340	N	92.9	Very high	98	Very high	98 Å²	98	29.5 Å²	29.5	52%	0.524	14%	0.14	S	C	.	.			trans	-159.1	0	162.9	72.2	11	0	0	0	112.5	R46 R48 M325	R46-N340 PolarHBondContact N-O 3.36Å; R46-N340 VanDerWaalsContact N-O 3.12Å; R46-N340 PolarHBondContact O-N 2.75Å; R48-N340 WeakPolarHBondContact CD-OD1 3.32Å; R48-N340 WeakPolarHBondContact CG-OD1 3.42Å; R48-N340 PolarHBondContact NE-O 3.47Å; R48-N340 PolarHBondContact NE-OD1 3.11Å; R48-N340 PolarHBondContact NH2-O 2.94Å; M325-N340 VanDerWaalsContact O-CB 3.28Å; M325-N340 WeakPolarHBondContact O-CB 3.46Å

Retrieved 340 of 340 residues in 162 ms (Link to these results)

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