A0A096N6G8_PAPAN Loading...

G protein subunit beta 1

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 (P62872), UniProt , Accession A0A096N6G8, Species PAPAN (Papio anubis, Olive baboon), Gene GNB1, Length 340 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	73.7	Confident	95.1	Very high	151 Å²	151	103.1 Å²	103.1	74%	0.744	51%	0.513	S	S	*	.				0	123	0	-162.1	176.9	-63.7	0	0	105.7	D5 Q6 Q9	M1-D5 HydrophobicContact CG-CB 3.59Å; M1-Q6 HydrophobicContact CG-CG 4.17Å; M1-Q6 HydrophobicContact SD-CG 4.01Å; M1-Q9 PolarHBondContact SD-OE1 3.4Å; M1-Q9 VanDerWaalsContact SD-OE1 3.41Å
2	S	91.9	Very high	95.4	Very high	56 Å²	56	101.6 Å²	101.6	39%	0.392	50%	0.504	S	S	.	.			trans	-69	159.9	-179	69.7	0	0	0	0	110.4	L4 D5 Q6	S2-L4 PolarHBondContact O-N 3.1Å; S2-D5 WeakPolarHBondContact CB-OD2 3.37Å; S2-D5 PolarHBondContact N-OD2 3.03Å; S2-D5 WeakPolarHBondContact O-CB 3.23Å; S2-D5 PolarHBondContact O-N 3.39Å; S2-D5 PolarHBondContact OG-N 2.95Å; S2-D5 VanDerWaalsContact OG-N 3.16Å; S2-D5 PolarHBondContact OG-OD2 2.85Å; S2-Q6 PolarHBondContact O-N 2.82Å; S2-Q6 VanDerWaalsContact O-N 3.1Å
3	E	96.6	Very high	95.7	Very high	156 Å²	156	102.5 Å²	102.5	73%	0.729	51%	0.506	S	S	*	.	H	α-helix	trans	-54.5	-39.6	173.3	-177.3	174.8	-173.7	0	0	111.4	D5 Q6 L7	E3-D5 PolarHBondContact O-N 3.25Å; E3-Q6 PolarHBondContact O-N 3.44Å; E3-L7 WeakPolarHBondContact O-CG 3.31Å; E3-L7 PolarHBondContact O-N 2.86Å; E3-L7 VanDerWaalsContact O-N 3.1Å
4	L	97.4	Very high	95.9	Very high	93 Å²	93	101.2 Å²	101.2	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-40	175.3	-178.5	61.8	0	0	0	112.7	S2 Q6 L7 R8	S2-L4 PolarHBondContact O-N 3.1Å; L4-Q6 VanDerWaalsContact C-N 3.33Å; L4-L7 PolarHBondContact O-N 3.04Å; L4-R8 WeakPolarHBondContact O-CB 3.41Å; L4-R8 VanDerWaalsContact O-CG 3.31Å; L4-R8 WeakPolarHBondContact O-CG 3.29Å; L4-R8 PolarHBondContact O-N 2.72Å
5	D	97.8	Very high	96	Very high	64 Å²	64	100.4 Å²	100.4	34%	0.342	49%	0.494	S	S	.	.	H	α-helix	trans	-67.2	-36.4	178.3	-62.2	-41.3	0	0	0	111.4	M1 S2 E3 R8 Q9	M1-D5 HydrophobicContact CG-CB 3.59Å; S2-D5 WeakPolarHBondContact CB-OD2 3.37Å; S2-D5 PolarHBondContact N-OD2 3.03Å; S2-D5 WeakPolarHBondContact O-CB 3.23Å; S2-D5 PolarHBondContact O-N 3.39Å; S2-D5 PolarHBondContact OG-N 2.95Å; S2-D5 VanDerWaalsContact OG-N 3.16Å; S2-D5 PolarHBondContact OG-OD2 2.85Å; E3-D5 PolarHBondContact O-N 3.25Å; D5-R8 PolarHBondContact O-N 2.97Å; D5-Q9 WeakPolarHBondContact O-CG 3.32Å; D5-Q9 PolarHBondContact O-N 3.39Å
6	Q	97.8	Very high	96.2	Very high	111 Å²	111	98.5 Å²	98.5	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-48.4	175.8	-68.8	177.4	-16.1	0	0	111	M1 S2 E3 L4 R8 Q9 E10	M1-Q6 HydrophobicContact CG-CG 4.17Å; M1-Q6 HydrophobicContact SD-CG 4.01Å; S2-Q6 PolarHBondContact O-N 2.82Å; S2-Q6 VanDerWaalsContact O-N 3.1Å; E3-Q6 PolarHBondContact O-N 3.44Å; L4-Q6 VanDerWaalsContact C-N 3.33Å; Q6-R8 VanDerWaalsContact C-N 3.32Å; Q6-R8 PolarHBondContact O-N 3.12Å; Q6-Q9 PolarHBondContact O-N 3.3Å; Q6-E10 PolarHBondContact O-N 3.11Å
7	L	98.4	Very high	96.3	Very high	99 Å²	99	99.9 Å²	99.9	52%	0.518	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-38.4	177.1	-67.1	174.3	0	0	0	112.3	E3 L4 E10 A11	E3-L7 WeakPolarHBondContact O-CG 3.31Å; E3-L7 PolarHBondContact O-N 2.86Å; E3-L7 VanDerWaalsContact O-N 3.1Å; L4-L7 PolarHBondContact O-N 3.04Å; L7-E10 PolarHBondContact O-N 3.25Å; L7-A11 WeakPolarHBondContact O-CB 3.49Å; L7-A11 PolarHBondContact O-N 3.29Å
8	R	98.2	Very high	96.4	Very high	151 Å²	151	99.1 Å²	99.1	57%	0.57	49%	0.488	S	S	*	.	H	α-helix	trans	-64.2	-43.3	174.7	-76.9	173.9	177.1	175.3	-2.3	111.9	L4 D5 Q6 A11 E12	L4-R8 WeakPolarHBondContact O-CB 3.41Å; L4-R8 VanDerWaalsContact O-CG 3.31Å; L4-R8 WeakPolarHBondContact O-CG 3.29Å; L4-R8 PolarHBondContact O-N 2.72Å; D5-R8 PolarHBondContact O-N 2.97Å; Q6-R8 VanDerWaalsContact C-N 3.32Å; Q6-R8 PolarHBondContact O-N 3.12Å; R8-A11 PolarHBondContact O-N 3.05Å; R8-E12 PolarHBondContact O-N 3.18Å
9	Q	98.1	Very high	96.5	Very high	98 Å²	98	100.6 Å²	100.6	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-63.4	-43.6	176.7	-77	-172.7	-1.5	0	0	111.6	M1 D5 Q6 E12 Q13	M1-Q9 PolarHBondContact SD-OE1 3.4Å; M1-Q9 VanDerWaalsContact SD-OE1 3.41Å; D5-Q9 WeakPolarHBondContact O-CG 3.32Å; D5-Q9 PolarHBondContact O-N 3.39Å; Q6-Q9 PolarHBondContact O-N 3.3Å; Q9-E12 PolarHBondContact O-N 3.32Å; Q9-Q13 VanDerWaalsContact O-CG 3.31Å; Q9-Q13 WeakPolarHBondContact O-CG 3.19Å; Q9-Q13 PolarHBondContact O-N 3.25Å
10	E	98.4	Very high	96.6	Very high	109 Å²	109	100.6 Å²	100.6	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-61.5	-44.6	176.1	-171.3	177.1	-177.7	0	0	111.5	Q6 L7 E12 Q13 L14	Q6-E10 PolarHBondContact O-N 3.11Å; L7-E10 PolarHBondContact O-N 3.25Å; E10-E12 PolarHBondContact O-N 3.18Å; E10-Q13 WeakPolarHBondContact O-CB 3.47Å; E10-Q13 PolarHBondContact O-N 3.38Å; E10-Q13 VanDerWaalsContact O-N 3.15Å; E10-L14 WeakPolarHBondContact O-CG 3.33Å; E10-L14 PolarHBondContact O-N 3Å
11	A	98.2	Very high	96.7	Very high	46 Å²	46	98.4 Å²	98.4	38%	0.38	49%	0.489	S	S	.	.	H	α-helix	trans	-61.6	-39.8	175.9	0	0	0	0	0	112.8	L7 R8 L14 K15	L7-A11 WeakPolarHBondContact O-CB 3.49Å; L7-A11 PolarHBondContact O-N 3.29Å; R8-A11 PolarHBondContact O-N 3.05Å; A11-L14 PolarHBondContact O-N 3.5Å; A11-K15 WeakPolarHBondContact O-CE 3.37Å; A11-K15 WeakPolarHBondContact O-CG 3.48Å; A11-K15 PolarHBondContact O-N 3.45Å
12	E	98.5	Very high	97.8	Very high	85 Å²	85	93.5 Å²	93.5	40%	0.397	46%	0.462	S	S	.	.	H	α-helix	trans	-65.8	-38.3	173.1	-73.4	-56.9	154.8	0	0	112.5	R8 Q9 E10 K15 N16	R8-E12 PolarHBondContact O-N 3.18Å; Q9-E12 PolarHBondContact O-N 3.32Å; E10-E12 PolarHBondContact O-N 3.18Å; E12-K15 PolarHBondContact O-N 3.44Å; E12-K15 VanDerWaalsContact OE1-CE 3.31Å; E12-K15 WeakPolarHBondContact OE1-CE 3.48Å; E12-K15 IonicContact OE1-NZ 3.45Å; E12-K15 PolarHBondContact OE1-NZ 2.94Å; E12-K15 WeakPolarHBondContact OE2-CE 3.37Å; E12-K15 IonicContact OE2-NZ 3.59Å; E12-K15 PolarHBondContact OE2-NZ 2.87Å; E12-N16 VanDerWaalsContact O-CG 3.29Å; E12-N16 PolarHBondContact O-N 3.33Å; E12-N16 PolarHBondContact O-ND2 2.78Å
13	Q	98.6	Very high	98.1	Very high	113 Å²	113	98 Å²	98	53%	0.528	47%	0.474	S	S	.	.	H	α-helix	trans	-61.6	-47	175.1	-72.7	172.6	11	0	0	111.1	Q9 E10 K15 N16 Q17	Q9-Q13 VanDerWaalsContact O-CG 3.31Å; Q9-Q13 WeakPolarHBondContact O-CG 3.19Å; Q9-Q13 PolarHBondContact O-N 3.25Å; E10-Q13 WeakPolarHBondContact O-CB 3.47Å; E10-Q13 PolarHBondContact O-N 3.38Å; E10-Q13 VanDerWaalsContact O-N 3.15Å; Q13-K15 PolarHBondContact O-N 3.43Å; Q13-N16 PolarHBondContact O-N 3.19Å; Q13-Q17 WeakPolarHBondContact O-CG 3.38Å; Q13-Q17 PolarHBondContact O-N 2.77Å
14	L	98.7	Very high	98.2	Very high	85 Å²	85	94.7 Å²	94.7	45%	0.445	47%	0.474	S	S	.	.	H	α-helix	trans	-61.6	-42.1	176.3	-68.5	172.7	0	0	0	111.9	E10 A11 N16 Q17 I18	E10-L14 WeakPolarHBondContact O-CG 3.33Å; E10-L14 PolarHBondContact O-N 3Å; A11-L14 PolarHBondContact O-N 3.5Å; L14-N16 VanDerWaalsContact C-N 3.31Å; L14-N16 PolarHBondContact O-N 3.07Å; L14-Q17 PolarHBondContact O-N 3.45Å; L14-I18 WeakPolarHBondContact O-CG1 3.43Å; L14-I18 PolarHBondContact O-N 2.79Å
15	K	98	Very high	98.2	Very high	89 Å²	89	94.3 Å²	94.3	39%	0.387	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-39.9	174.4	-77.4	-175.7	-67.9	179.6	0	112.4	A11 E12 Q13 I18 R19	A11-K15 WeakPolarHBondContact O-CE 3.37Å; A11-K15 WeakPolarHBondContact O-CG 3.48Å; A11-K15 PolarHBondContact O-N 3.45Å; E12-K15 PolarHBondContact O-N 3.44Å; E12-K15 VanDerWaalsContact OE1-CE 3.31Å; E12-K15 WeakPolarHBondContact OE1-CE 3.48Å; E12-K15 IonicContact OE1-NZ 3.45Å; E12-K15 PolarHBondContact OE1-NZ 2.94Å; E12-K15 WeakPolarHBondContact OE2-CE 3.37Å; E12-K15 IonicContact OE2-NZ 3.59Å; E12-K15 PolarHBondContact OE2-NZ 2.87Å; Q13-K15 PolarHBondContact O-N 3.43Å; K15-I18 PolarHBondContact O-N 3.11Å; K15-R19 WeakPolarHBondContact O-CG 3.39Å; K15-R19 PolarHBondContact O-N 3.07Å
16	N	98.4	Very high	98.2	Very high	70 Å²	70	93.7 Å²	93.7	37%	0.374	48%	0.482	S	S	.	.	H	α-helix	trans	-68.2	-41.5	176.4	-70.1	-29.7	0	0	0	111.8	E12 Q13 L14 I18 R19 D20	E12-N16 VanDerWaalsContact O-CG 3.29Å; E12-N16 PolarHBondContact O-N 3.33Å; E12-N16 PolarHBondContact O-ND2 2.78Å; Q13-N16 PolarHBondContact O-N 3.19Å; L14-N16 VanDerWaalsContact C-N 3.31Å; L14-N16 PolarHBondContact O-N 3.07Å; N16-I18 VanDerWaalsContact C-N 3.31Å; N16-I18 PolarHBondContact O-N 3.22Å; N16-R19 PolarHBondContact O-N 3.13Å; N16-R19 VanDerWaalsContact O-N 3.17Å; N16-R19 PolarHBondContact OD1-NH1 3.49Å; N16-D20 WeakPolarHBondContact O-CB 3.31Å; N16-D20 VanDerWaalsContact O-CG 3.31Å; N16-D20 PolarHBondContact O-N 2.87Å
17	Q	98.7	Very high	98.2	Very high	122 Å²	122	95.8 Å²	95.8	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-57.4	-43.3	173.5	-71	174.2	6.7	0	0	112	Q13 L14 D20 A21	Q13-Q17 WeakPolarHBondContact O-CG 3.38Å; Q13-Q17 PolarHBondContact O-N 2.77Å; L14-Q17 PolarHBondContact O-N 3.45Å; Q17-D20 PolarHBondContact O-N 3.41Å; Q17-A21 WeakPolarHBondContact O-CB 3.35Å; Q17-A21 PolarHBondContact O-N 3.17Å
18	I	98.1	Very high	98.1	Very high	86 Å²	86	93.3 Å²	93.3	44%	0.441	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-46.2	175.8	-67.7	164.8	0	0	0	111	L14 K15 N16 D20 A21 R22	L14-I18 WeakPolarHBondContact O-CG1 3.43Å; L14-I18 PolarHBondContact O-N 2.79Å; K15-I18 PolarHBondContact O-N 3.11Å; N16-I18 VanDerWaalsContact C-N 3.31Å; N16-I18 PolarHBondContact O-N 3.22Å; I18-D20 VanDerWaalsContact C-N 3.32Å; I18-D20 PolarHBondContact O-N 3.43Å; I18-A21 PolarHBondContact O-N 3.02Å; I18-R22 WeakPolarHBondContact O-CG 3.38Å; I18-R22 PolarHBondContact O-N 3.37Å
19	R	98	Very high	98.1	Very high	128 Å²	128	89 Å²	89	48%	0.483	48%	0.481	S	S	.	.	H	α-helix	trans	-59.8	-43.3	177.8	-74.1	171.4	-177.1	153	-2.4	111.9	K15 N16 R22 K23	K15-R19 WeakPolarHBondContact O-CG 3.39Å; K15-R19 PolarHBondContact O-N 3.07Å; N16-R19 PolarHBondContact O-N 3.13Å; N16-R19 VanDerWaalsContact O-N 3.17Å; N16-R19 PolarHBondContact OD1-NH1 3.49Å; R19-R22 PolarHBondContact O-N 3.07Å; R19-K23 WeakPolarHBondContact O-CB 3.47Å; R19-K23 VanDerWaalsContact O-CG 3.32Å; R19-K23 WeakPolarHBondContact O-CG 3.43Å; R19-K23 PolarHBondContact O-N 3.01Å
20	D	98.5	Very high	98.1	Very high	99 Å²	99	85.6 Å²	85.6	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-68.8	-39	-179.7	-68.1	-21.2	0	0	0	111.1	N16 Q17 I18 K23 A24	N16-D20 WeakPolarHBondContact O-CB 3.31Å; N16-D20 VanDerWaalsContact O-CG 3.31Å; N16-D20 PolarHBondContact O-N 2.87Å; Q17-D20 PolarHBondContact O-N 3.41Å; I18-D20 VanDerWaalsContact C-N 3.32Å; I18-D20 PolarHBondContact O-N 3.43Å; D20-K23 PolarHBondContact O-N 2.94Å; D20-A24 WeakPolarHBondContact O-CB 3.32Å; D20-A24 PolarHBondContact O-N 3.28Å
21	A	98.6	Very high	98	Very high	56 Å²	56	83.4 Å²	83.4	46%	0.463	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-45.6	174	0	0	0	0	0	112.3	Q17 I18 K23 A24 C25	Q17-A21 WeakPolarHBondContact O-CB 3.35Å; Q17-A21 PolarHBondContact O-N 3.17Å; I18-A21 PolarHBondContact O-N 3.02Å; A21-K23 PolarHBondContact O-N 3Å; A21-A24 PolarHBondContact O-N 3.47Å; A21-C25 PolarHBondContact O-N 3.38Å; A21-C25 VanDerWaalsContact O-N 3.11Å; A21-C25 PolarHBondContact O-SG 3.48Å
22	R	97.9	Very high	97.9	Very high	48 Å²	48	86.4 Å²	86.4	18%	0.181	47%	0.469	C	S	.	.	H	α-helix	trans	-60.3	-46	175.6	-73.7	177.1	-179.4	-178	-7.1	111.6	I18 R19 A24 C25 A26 T221 D258 Q259	I18-R22 WeakPolarHBondContact O-CG 3.38Å; I18-R22 PolarHBondContact O-N 3.37Å; R19-R22 PolarHBondContact O-N 3.07Å; R22-A24 VanDerWaalsContact C-N 3.34Å; R22-A24 PolarHBondContact O-N 3.2Å; R22-C25 CarbonylContact O-C 3.57Å; R22-C25 PolarHBondContact O-N 2.76Å; R22-A26 PolarHBondContact O-N 3.29Å; R22-T221 PolarHBondContact NH2-O 3.49Å; R22-D258 WeakPolarHBondContact CD-O 3.4Å; R22-D258 IonicContact CZ-OD2 3.9Å; R22-D258 VanDerWaalsContact CZ-OD2 3.26Å; R22-D258 PolarHBondContact NE-O 2.86Å; R22-D258 IonicContact NE-OD2 3.43Å; R22-D258 PolarHBondContact NE-OD2 3.12Å; R22-D258 PolarHBondContact NH2-O 2.82Å; R22-D258 IonicContact NH2-OD1 3.53Å; R22-D258 IonicContact NH2-OD2 2.85Å; R22-D258 PolarHBondContact NH2-OD2 2.99Å; R22-Q259 PolarHBondContact O-OE1 3.3Å
23	K	97.6	Very high	97.9	Very high	150 Å²	150	88.2 Å²	88.2	65%	0.652	48%	0.479	S	S	*	.	H	α-helix	trans	-61.4	-40	175.3	-75.1	175.3	-177.9	175.2	0	112.7	R19 D20 A21 C25 A26	R19-K23 WeakPolarHBondContact O-CB 3.47Å; R19-K23 VanDerWaalsContact O-CG 3.32Å; R19-K23 WeakPolarHBondContact O-CG 3.43Å; R19-K23 PolarHBondContact O-N 3.01Å; D20-K23 PolarHBondContact O-N 2.94Å; A21-K23 PolarHBondContact O-N 3Å; K23-C25 PolarHBondContact O-N 2.92Å; K23-A26 PolarHBondContact O-N 3.14Å
24	A	98.4	Very high	97.8	Very high	87 Å²	87	83.2 Å²	83.2	72%	0.719	46%	0.457	S	S	*	.	H	α-helix	trans	-64.4	-30.7	178	0	0	0	0	0	112.4	D20 A21 R22	D20-A24 WeakPolarHBondContact O-CB 3.32Å; D20-A24 PolarHBondContact O-N 3.28Å; A21-A24 PolarHBondContact O-N 3.47Å; R22-A24 VanDerWaalsContact C-N 3.34Å; R22-A24 PolarHBondContact O-N 3.2Å
25	C	97.9	Very high	97.7	Very high	84 Å²	84	84.5 Å²	84.5	57%	0.568	46%	0.464	S	S	*	.	H	α-helix	trans	-89	-5.5	175.5	-64.1	0	0	0	0	114.1	A21 R22 K23 D27	A21-C25 PolarHBondContact O-N 3.38Å; A21-C25 VanDerWaalsContact O-N 3.11Å; A21-C25 PolarHBondContact O-SG 3.48Å; R22-C25 CarbonylContact O-C 3.57Å; R22-C25 PolarHBondContact O-N 2.76Å; K23-C25 PolarHBondContact O-N 2.92Å; C25-D27 VanDerWaalsContact C-N 3.26Å; C25-D27 PolarHBondContact O-N 2.88Å
26	A	97	Very high	97.6	Very high	52 Å²	52	87.9 Å²	87.9	43%	0.43	49%	0.487	S	S	.	.			trans	-83.6	67.2	180	0	0	0	0	0	111.2	R22 K23	R22-A26 PolarHBondContact O-N 3.29Å; K23-A26 PolarHBondContact O-N 3.14Å
27	D	97.3	Very high	97.6	Very high	155 Å²	155	87.9 Å²	87.9	83%	0.829	49%	0.486	S	S	*	.			trans	-76.7	-29.3	-174.8	62.1	-21.9	0	0	0	114.2	C25	C25-D27 VanDerWaalsContact C-N 3.26Å; C25-D27 PolarHBondContact O-N 2.88Å
28	A	97.5	Very high	97.5	Very high	46 Å²	46	88.5 Å²	88.5	38%	0.38	49%	0.493	S	S	.	.	S	Bend	trans	-152.4	175.3	173.9	0	0	0	0	0	111.5	I33	A28-I33 HydrophobicContact CB-CG2 4.26Å
29	T	97.9	Very high	97.4	Very high	62 Å²	62	88.9 Å²	88.9	38%	0.38	50%	0.501	S	S	.	.			trans	-108.5	154	170.8	71.4	0	0	0	0	111.9	S31 Q32 I33	T29-S31 PolarHBondContact O-N 2.84Å; T29-S31 PolarHBondContact OG1-OG 2.78Å; T29-Q32 VanDerWaalsContact N-OE1 3.15Å; T29-Q32 PolarHBondContact O-N 2.61Å; T29-Q32 VanDerWaalsContact O-N 3.11Å; T29-Q32 VanDerWaalsContact OG1-CG 3.23Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.45Å; T29-Q32 PolarHBondContact OG1-N 2.96Å; T29-I33 PolarHBondContact O-N 2.91Å
30	L	97.8	Very high	97.4	Very high	26 Å²	26	85.3 Å²	85.3	14%	0.136	49%	0.493	C	S	.	.	H	α-helix	trans	-57.9	-38.9	175.3	-179.4	61.7	0	0	0	111.5	Q32 I33 T34 L252 L261 M262 L300	L30-Q32 VanDerWaalsContact C-N 3.32Å; L30-Q32 PolarHBondContact O-N 3.28Å; L30-I33 HydrophobicContact CD1-CD1 4.03Å; L30-I33 HydrophobicContact CD1-CG1 4.17Å; L30-I33 VanDerWaalsContact O-CG1 3.29Å; L30-I33 WeakPolarHBondContact O-CG1 3.45Å; L30-I33 PolarHBondContact O-N 2.67Å; L30-T34 HydrophobicContact CD1-CG2 3.78Å; L30-T34 HydrophobicContact CG-CG2 4.27Å; L30-T34 VanDerWaalsContact O-CG2 3.31Å; L30-T34 WeakPolarHBondContact O-CG2 3.42Å; L30-T34 PolarHBondContact O-N 2.84Å; L30-T34 VanDerWaalsContact O-N 3.12Å; L30-T34 PolarHBondContact O-OG1 3.41Å; L30-L252 HydrophobicContact CD2-CD2 3.96Å; L30-L261 HydrophobicContact CB-CB 4.4Å; L30-L261 HydrophobicContact CD2-CB 4.34Å; L30-L261 HydrophobicContact CD2-CD1 4.45Å; L30-M262 HydrophobicContact CB-CE 3.88Å; L30-M262 HydrophobicContact CD2-CB 4.31Å; L30-M262 HydrophobicContact CD2-CE 3.78Å; L30-M262 HydrophobicContact CD2-SD 4.13Å; L30-M262 HydrophobicContact CG-CE 3.7Å; L30-L300 HydrophobicContact CD1-CD2 4.41Å; L30-L300 HydrophobicContact CD2-CD2 4.49Å
31	S	96.4	Very high	97.3	Very high	62 Å²	62	82.6 Å²	82.6	43%	0.434	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-33.8	177	54.2	0	0	0	0	113.9	T29 N35	T29-S31 PolarHBondContact O-N 2.84Å; T29-S31 PolarHBondContact OG1-OG 2.78Å; S31-N35 PolarHBondContact O-OD1 2.98Å
32	Q	97.1	Very high	97.2	Very high	110 Å²	110	89.3 Å²	89.3	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-70.5	-44.1	177.8	-74.7	166.7	-7.2	0	0	111.6	T29 L30 T34 N35	T29-Q32 VanDerWaalsContact N-OE1 3.15Å; T29-Q32 PolarHBondContact O-N 2.61Å; T29-Q32 VanDerWaalsContact O-N 3.11Å; T29-Q32 VanDerWaalsContact OG1-CG 3.23Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.45Å; T29-Q32 PolarHBondContact OG1-N 2.96Å; L30-Q32 VanDerWaalsContact C-N 3.32Å; L30-Q32 PolarHBondContact O-N 3.28Å; Q32-T34 VanDerWaalsContact C-N 3.34Å; Q32-N35 PolarHBondContact O-ND2 3.44Å
33	I	97.1	Very high	97.2	Very high	122 Å²	122	88.9 Å²	88.9	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-77.1	-21.2	-175.9	66.2	172.5	0	0	0	112.8	A28 T29 L30	A28-I33 HydrophobicContact CB-CG2 4.26Å; T29-I33 PolarHBondContact O-N 2.91Å; L30-I33 HydrophobicContact CD1-CD1 4.03Å; L30-I33 HydrophobicContact CD1-CG1 4.17Å; L30-I33 VanDerWaalsContact O-CG1 3.29Å; L30-I33 WeakPolarHBondContact O-CG1 3.45Å; L30-I33 PolarHBondContact O-N 2.67Å
34	T	97.2	Very high	97.1	Very high	9 Å²	9	88.2 Å²	88.2	6%	0.055	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	11	178	62.3	0	0	0	0	113.7	L30 Q32 N36 I37 L300 K301	L30-T34 HydrophobicContact CD1-CG2 3.78Å; L30-T34 HydrophobicContact CG-CG2 4.27Å; L30-T34 VanDerWaalsContact O-CG2 3.31Å; L30-T34 WeakPolarHBondContact O-CG2 3.42Å; L30-T34 PolarHBondContact O-N 2.84Å; L30-T34 VanDerWaalsContact O-N 3.12Å; L30-T34 PolarHBondContact O-OG1 3.41Å; Q32-T34 VanDerWaalsContact C-N 3.34Å; T34-N36 VanDerWaalsContact C-N 3.28Å; T34-N36 PolarHBondContact O-N 3.47Å; T34-I37 HydrophobicContact CG2-CG1 4.35Å; T34-I37 WeakPolarHBondContact O-CB 3.31Å; T34-I37 PolarHBondContact O-N 3.39Å; T34-L300 WeakPolarHBondContact CB-O 3.47Å; T34-L300 HydrophobicContact CG2-CB 4.11Å; T34-L300 HydrophobicContact CG2-CD2 4.37Å; T34-L300 PolarHBondContact OG1-O 3.29Å; T34-K301 PolarHBondContact O-NZ 3.48Å
35	N	95.7	Very high	97.1	Very high	111 Å²	111	86.3 Å²	86.3	59%	0.594	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-42.9	180	-86.4	-36.2	0	0	0	113	S31 Q32 I37 K301	S31-N35 PolarHBondContact O-OD1 2.98Å; Q32-N35 PolarHBondContact O-ND2 3.44Å; N35-I37 VanDerWaalsContact C-N 3.28Å; N35-I37 PolarHBondContact O-N 2.72Å; N35-K301 PolarHBondContact O-NZ 3.28Å; N35-K301 VanDerWaalsContact O-NZ 3.1Å
36	N	97	Very high	97.1	Very high	161 Å²	161	90.1 Å²	90.1	86%	0.861	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	6.5	-179	-63.4	-29.4	0	0	0	114.2	T34	T34-N36 VanDerWaalsContact C-N 3.28Å; T34-N36 PolarHBondContact O-N 3.47Å
37	I	97.5	Very high	97.1	Very high	70 Å²	70	90 Å²	90	36%	0.359	48%	0.475	S	S	.	.	S	Bend	trans	-83.6	125.6	174.8	-58.4	-61.1	0	0	0	108.8	T34 N35 K301	T34-I37 HydrophobicContact CG2-CG1 4.35Å; T34-I37 WeakPolarHBondContact O-CB 3.31Å; T34-I37 PolarHBondContact O-N 3.39Å; N35-I37 VanDerWaalsContact C-N 3.28Å; N35-I37 PolarHBondContact O-N 2.72Å; I37-K301 HydrophobicContact CB-CD 4.39Å; I37-K301 PolarHBondContact O-NZ 3.43Å
38	D	97.6	Very high	97.2	Very high	135 Å²	135	88.9 Å²	88.9	72%	0.722	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-57.5	134	175.2	-76.8	-26.8	0	0	0	110.8	R283	D38-R283 PolarHBondContact O-NH2 2.78Å
39	P	96.4	Very high	97.2	Very high	94 Å²	94	92.1 Å²	92.1	61%	0.61	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-64.5	148.5	175.6	29.1	-34.4	0	0	0	110.1	G41	P39-G41 PolarHBondContact O-N 3.06Å
40	V	97.5	Very high	97.2	Very high	53 Å²	53	90.7 Å²	90.7	32%	0.321	45%	0.453	S	S	.	.			trans	-64.6	-22	177.1	-175.8	0	0	0	0	112.1	I43 R283 L284 D298	V40-I43 HydrophobicContact CG1-CD1 3.59Å; V40-I43 HydrophobicContact CG1-CG1 4.13Å; V40-R283 HydrophobicContact CG2-CG 3.76Å; V40-L284 HydrophobicContact CB-CD2 4.49Å; V40-L284 HydrophobicContact CG1-CD2 4.2Å; V40-L284 HydrophobicContact CG2-CD2 4.2Å; V40-D298 WeakPolarHBondContact CG2-OD2 3.25Å
41	G	96.3	Very high	97.2	Very high	41 Å²	41	89.6 Å²	89.6	42%	0.423	45%	0.447	S	S	.	.			trans	77.7	-171.8	-171.9	0	0	0	0	0	111.8	P39 I43	P39-G41 PolarHBondContact O-N 3.06Å; G41-I43 PolarHBondContact O-N 2.85Å
42	R	96.6	Very high	97.3	Very high	198 Å²	198	94.3 Å²	94.3	75%	0.747	46%	0.455	S	S	*	.			trans	-78.1	112.8	-173.7	-171.3	167.6	177.1	172	1.3	111.5	Q44 A305	R42-Q44 HydrophobicContact CG-CG 4.1Å; R42-Q44 PolarHBondContact O-N 2.97Å; R42-A305 CarbonylContact C-O 3.57Å; R42-A305 WeakPolarHBondContact CA-O 3.5Å
43	I	97.6	Very high	97.2	Very high	38 Å²	38	90.9 Å²	90.9	20%	0.195	45%	0.449	C	S	.	.			trans	-79.2	118	174.5	-61.7	-57.7	0	0	0	109.7	V40 G41 M45 L284 A305	V40-I43 HydrophobicContact CG1-CD1 3.59Å; V40-I43 HydrophobicContact CG1-CG1 4.13Å; G41-I43 PolarHBondContact O-N 2.85Å; I43-M45 HydrophobicContact CG2-CE 3.96Å; I43-M45 HydrophobicContact CG2-CG 3.89Å; I43-M45 HydrophobicContact CG2-SD 4.23Å; I43-L284 HydrophobicContact CD1-CD1 4.26Å; I43-L284 HydrophobicContact CG1-CD1 4.11Å; I43-L284 HydrophobicContact CG1-CD2 4.34Å; I43-A305 HydrophobicContact CG1-CB 4.01Å; I43-A305 PolarHBondContact N-O 2.83Å
44	Q	96.1	Very high	97.3	Very high	136 Å²	136	85.6 Å²	85.6	64%	0.636	42%	0.422	S	S	*	.			trans	-119.4	73.7	-178.9	-62.3	-174.5	-4.8	0	0	110.8	R42	R42-Q44 HydrophobicContact CG-CG 4.1Å; R42-Q44 PolarHBondContact O-N 2.97Å
45	M	97.5	Very high	97.3	Very high	47 Å²	47	92.5 Å²	92.5	23%	0.232	46%	0.457	C	S	.	.			trans	-76.1	152.5	173.4	-65.1	168.7	173.6	0	0	110.8	I43 L308 V327 W339	I43-M45 HydrophobicContact CG2-CE 3.96Å; I43-M45 HydrophobicContact CG2-CG 3.89Å; I43-M45 HydrophobicContact CG2-SD 4.23Å; M45-L308 HydrophobicContact CB-CD2 3.7Å; M45-L308 HydrophobicContact CG-CD2 4.36Å; M45-L308 HydrophobicContact SD-CD1 4.3Å; M45-L308 HydrophobicContact SD-CD2 4.12Å; M45-V327 HydrophobicContact CE-CG2 4.49Å; M45-W339 HydrophobicContact CB-CB 4.36Å
46	R	97.7	Very high	97.4	Very high	164 Å²	164	88.5 Å²	88.5	62%	0.619	44%	0.44	S	S	*	.			trans	-121.6	147.6	175.3	-61	-177.5	-161.7	-124	0.9	110.6	R48 W339 N340	R46-R48 PolarHBondContact O-N 3.45Å; R46-W339 WeakPolarHBondContact O-CA 3.17Å; R46-N340 PolarHBondContact O-N 3.44Å; R46-N340 VanDerWaalsContact O-N 3.13Å
47	T	98.1	Very high	97.4	Very high	49 Å²	49	84.3 Å²	84.3	30%	0.301	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	115.7	168.6	-50.1	0	0	0	0	109.3	R49 K337 I338 W339	T47-R49 VanDerWaalsContact CG2-O 3.22Å; T47-R49 WeakPolarHBondContact CG2-O 3.37Å; T47-K337 HydrophobicContact CG2-CB 3.96Å; T47-K337 HydrophobicContact CG2-CD 4.07Å; T47-K337 HydrophobicContact CG2-CG 4.08Å; T47-I338 CarbonylContact C-O 3.54Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.33Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.18Å
48	R	97.9	Very high	97.5	Very high	133 Å²	133	81 Å²	81	50%	0.502	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-31.9	176.4	-60.2	-54.1	177.3	165.3	1.2	113	R46 I338 N340	R46-R48 PolarHBondContact O-N 3.45Å; R48-I338 PolarHBondContact N-O 2.82Å; R48-N340 HydrophobicContact CG-CB 3.93Å; R48-N340 VanDerWaalsContact CZ-O 3.27Å; R48-N340 PolarHBondContact NE-O 3.15Å; R48-N340 PolarHBondContact NH2-O 2.62Å
49	R	97.9	Very high	97.5	Very high	114 Å²	114	77.7 Å²	77.7	43%	0.43	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.2	179	-57.4	-67	-176.2	-90.5	-1.2	110.3	T47 Y85 T87 I338	T47-R49 VanDerWaalsContact CG2-O 3.22Å; T47-R49 WeakPolarHBondContact CG2-O 3.37Å; R49-Y85 PolarHBondContact NE-O 2.88Å; R49-T87 HydrophobicContact CB-CG2 4.04Å; R49-T87 HydrophobicContact CG-CG2 4.04Å; R49-I338 HydrophobicContact CB-CB 4.07Å; R49-I338 HydrophobicContact CB-CD1 4.15Å; R49-I338 HydrophobicContact CB-CG1 4.17Å; R49-I338 PolarHBondContact N-O 3.44Å; R49-I338 PolarHBondContact O-N 3.26Å
50	T	98.2	Very high	97.6	Very high	31 Å²	31	73.8 Å²	73.8	19%	0.19	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	110.6	170.4	-55.5	0	0	0	0	107.6	R52 F335 L336	T50-R52 HydrophobicContact CG2-CG 4.24Å; T50-F335 HydrophobicContact CG2-CB 4.05Å; T50-F335 HydrophobicContact CG2-CD1 4.17Å; T50-F335 HydrophobicContact CG2-CG 4.05Å; T50-L336 CarbonylContact C-O 3.56Å; T50-L336 WeakPolarHBondContact CA-O 3.39Å
51	L	98.4	Very high	97.6	Very high	3 Å²	3	71.8 Å²	71.8	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.8	179.1	-48.1	179.9	0	0	0	108.6	L70 W82 T87 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.17Å; L51-L70 HydrophobicContact CD1-CD2 4.1Å; L51-W82 HydrophobicContact CB-CD2 4.22Å; L51-W82 HydrophobicContact CB-CE3 4.07Å; L51-W82 HydrophobicContact CB-CH2 3.84Å; L51-W82 HydrophobicContact CB-CZ2 4.13Å; L51-W82 HydrophobicContact CB-CZ3 3.88Å; L51-W82 HydrophobicContact CD1-CB 3.99Å; L51-W82 HydrophobicContact CD1-CD2 3.94Å; L51-W82 HydrophobicContact CD1-CE3 4.3Å; L51-W82 HydrophobicContact CD1-CG 3.82Å; L51-W82 HydrophobicContact CD2-CE3 4.25Å; L51-W82 HydrophobicContact CG-CE3 4.45Å; L51-T87 HydrophobicContact CD2-CG2 3.71Å; L51-L336 HydrophobicContact CB-CB 4.05Å; L51-L336 HydrophobicContact CD1-CB 3.98Å; L51-L336 HydrophobicContact CD1-CD1 4Å; L51-L336 HydrophobicContact CG-CB 4.16Å; L51-L336 PolarHBondContact N-O 3.15Å; L51-L336 PolarHBondContact O-N 2.85Å; L51-I338 HydrophobicContact CD1-CD1 4.36Å; L51-I338 HydrophobicContact CD2-CD1 4.42Å; L51-I338 HydrophobicContact CG-CD1 4.47Å
52	R	97.5	Very high	97.7	Very high	162 Å²	162	72.5 Å²	72.5	61%	0.611	33%	0.33	S	S	*	.			trans	-119.7	138.7	-174.8	-60.7	-172.6	175.9	85.1	-3	112	T50 W82 K89 F335	T50-R52 HydrophobicContact CG2-CG 4.24Å; R52-W82 VanDerWaalsContact O-CH2 3.24Å; R52-W82 WeakPolarHBondContact O-CH2 3.35Å; R52-K89 PolarHBondContact O-NZ 2.88Å; R52-F335 HydrophobicContact CB-CE1 4.33Å; R52-F335 HydrophobicContact CG-CD1 3.88Å; R52-F335 HydrophobicContact CG-CE1 3.72Å
53	G	95.8	Very high	97.8	Very high	37 Å²	37	63.8 Å²	63.8	38%	0.381	30%	0.297	S	S	.	.			trans	126	18.2	169.1	0	0	0	0	0	115.4
54	H	98.1	Very high	97.9	Very high	12 Å²	12	62.1 Å²	62.1	6%	0.056	29%	0.289	C	S	.	.			trans	-76.9	150.5	144.1	-78.9	-61.8	0	0	0	109	I58 S72 S74 D76 K78 I80	H54-I58 HydrophobicContact CB-CG1 4.24Å; H54-S72 PolarHBondContact NE2-OG 3.31Å; H54-S74 VanDerWaalsContact CE1-CB 3.43Å; H54-S74 WeakPolarHBondContact CE1-CB 3.14Å; H54-S74 WeakPolarHBondContact ND1-CB 3.38Å; H54-S74 PolarHBondContact ND1-OG 2.93Å; H54-D76 VanDerWaalsContact CA-OD2 3.28Å; H54-D76 WeakPolarHBondContact CA-OD2 3.45Å; H54-D76 IonicContact CG-OD2 3.24Å; H54-D76 IonicContact ND1-OD1 3.43Å; H54-D76 PolarHBondContact ND1-OD1 2.94Å; H54-D76 IonicContact ND1-OD2 2.67Å; H54-D76 PolarHBondContact ND1-OD2 3.19Å; H54-K78 PolarHBondContact CE1-O 3.41Å; H54-I80 VanDerWaalsContact CE1-CD1 3.44Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.49Å
55	L	97.1	Very high	97.9	Very high	153 Å²	153	59.4 Å²	59.4	80%	0.801	28%	0.282	S	S	*	.	S	Bend	trans	-106.4	-3.2	-178.5	-58.2	178.9	0	0	0	113	D76	L55-D76 HydrophobicContact CB-CB 4.03Å; L55-D76 PolarHBondContact N-OD2 3.36Å
56	A	97.7	Very high	97.9	Very high	27 Å²	27	61.1 Å²	61.1	22%	0.223	29%	0.292	C	S	.	.	S	Bend	trans	-147.1	-177.1	178.6	0	0	0	0	0	110	I58 S74 Q75 D76 S334	A56-I58 PolarHBondContact O-N 2.97Å; A56-S74 PolarHBondContact O-OG 3.13Å; A56-Q75 HydrophobicContact CB-CB 3.98Å; A56-D76 HydrophobicContact CB-CB 3.99Å; A56-S334 VanDerWaalsContact O-CB 3.25Å; A56-S334 WeakPolarHBondContact O-CB 3.43Å; A56-S334 PolarHBondContact O-OG 3.21Å
57	K	98.2	Very high	97.9	Very high	74 Å²	74	53.9 Å²	53.9	32%	0.322	27%	0.267	S	S	.	.			trans	-52.5	126.3	-178	-55.9	-179.6	-176.3	-179.3	0	111	S74 Q75 W332	K57-S74 VanDerWaalsContact O-CA 3.28Å; K57-S74 WeakPolarHBondContact O-CA 3.33Å; K57-S74 WeakPolarHBondContact O-CB 3.22Å; K57-S74 PolarHBondContact O-OG 2.82Å; K57-Q75 HydrophobicContact CB-CG 4.4Å; K57-Q75 PolarHBondContact O-N 2.97Å; K57-W332 HydrophobicContact CB-CB 4.16Å; K57-W332 HydrophobicContact CB-CG 3.95Å; K57-W332 HydrophobicContact CD-CB 4.09Å; K57-W332 HydrophobicContact CD-CD2 3.75Å; K57-W332 HydrophobicContact CD-CE3 4.21Å; K57-W332 HydrophobicContact CD-CG 3.71Å; K57-W332 HydrophobicContact CG-CB 3.85Å; K57-W332 HydrophobicContact CG-CD2 4.45Å; K57-W332 HydrophobicContact CG-CG 3.88Å
58	I	98.6	Very high	97.9	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	140.2	165	-65.5	149.9	0	0	0	107.2	H54 A56 S316 S331 F335 L336	H54-I58 HydrophobicContact CB-CG1 4.24Å; A56-I58 PolarHBondContact O-N 2.97Å; I58-S316 PolarHBondContact O-OG 2.99Å; I58-S331 PolarHBondContact N-O 2.85Å; I58-F335 WeakPolarHBondContact CD1-O 3.45Å; I58-L336 HydrophobicContact CD1-CD1 4.48Å; I58-L336 HydrophobicContact CD1-CG 3.9Å; I58-L336 HydrophobicContact CG2-CD2 4.37Å
59	Y	97.8	Very high	97.9	Very high	65 Å²	65	51.9 Å²	51.9	26%	0.255	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-48.9	179.1	-153	-79.1	0	0	0	111.2	A73 V100 M101 S316 C317	Y59-A73 PolarHBondContact N-O 3.41Å; Y59-V100 WeakPolarHBondContact CB-O 3.21Å; Y59-M101 VanDerWaalsContact CD1-CA 3.44Å; Y59-M101 HydrophobicContact CD1-CB 4.01Å; Y59-M101 HydrophobicContact CD1-CG 4.41Å; Y59-M101 WeakPolarHBondContact CD1-O 3.17Å; Y59-M101 HydrophobicContact CE1-CB 3.8Å; Y59-M101 HydrophobicContact CE1-CE 4.25Å; Y59-M101 HydrophobicContact CE1-CG 4.04Å; Y59-M101 HydrophobicContact CE2-CG 4.48Å; Y59-M101 WeakPolarHBondContact OH-CE 3.36Å; Y59-S316 PolarHBondContact O-OG 3.4Å; Y59-C317 WeakPolarHBondContact O-CB 3.38Å
60	A	98.4	Very high	98	Very high	12 Å²	12	46.5 Å²	46.5	10%	0.099	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	154.5	-176.1	0	0	0	0	0	111.9	S72 A73 C103	A60-S72 WeakPolarHBondContact O-CA 3.39Å; A60-A73 PolarHBondContact O-N 3.45Å; A60-C103 VanDerWaalsContact C-SG 3.58Å
61	M	98.7	Very high	98	Very high	10 Å²	10	45 Å²	45	5%	0.049	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	156.2	170	71.8	80.2	55.8	0	0	110.1	W63 L70 V71 C317 A328 L336	M61-W63 HydrophobicContact CE-CD2 4.39Å; M61-W63 HydrophobicContact CE-CG 4.24Å; M61-L70 HydrophobicContact CE-CB 3.92Å; M61-L70 HydrophobicContact CE-CD1 3.97Å; M61-L70 HydrophobicContact CE-CD2 4.15Å; M61-L70 HydrophobicContact CE-CG 4.23Å; M61-V71 CarbonylContact C-O 3.58Å; M61-V71 WeakPolarHBondContact CA-O 3.45Å; M61-V71 WeakPolarHBondContact CB-O 3.42Å; M61-C317 HydrophobicContact CG-CB 4.07Å; M61-C317 VanDerWaalsContact CG-SG 3.54Å; M61-A328 HydrophobicContact CE-CB 3.58Å; M61-A328 HydrophobicContact SD-CB 4.35Å; M61-L336 HydrophobicContact CB-CD2 4.11Å; M61-L336 HydrophobicContact CG-CD2 4.17Å
62	H	98.9	Very high	98	Very high	56 Å²	56	44.9 Å²	44.9	26%	0.259	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	133	171.6	-164.5	-131.2	0	0	0	109.9	L70 V71 Y105	H62-L70 CarbonylContact O-C 3.54Å; H62-L70 WeakPolarHBondContact O-CA 3.47Å; H62-V71 HydrophobicContact CB-CG1 3.87Å; H62-V71 PolarHBondContact N-O 2.77Å; H62-V71 PolarHBondContact O-N 2.9Å; H62-Y105 PolarHBondContact ND1-N 2.82Å; H62-Y105 PolarHBondContact ND1-O 3.29Å
63	W	98.7	Very high	98	Very high	15 Å²	15	37.1 Å²	37.1	6%	0.057	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	148.5	169.9	-74.7	105.3	0	0	0	110.6	M61 L70 G319 T321 A328 I338	M61-W63 HydrophobicContact CE-CD2 4.39Å; M61-W63 HydrophobicContact CE-CG 4.24Å; W63-L70 HydrophobicContact CD2-CB 3.99Å; W63-L70 HydrophobicContact CD2-CD2 4.27Å; W63-L70 HydrophobicContact CE3-CB 3.76Å; W63-L70 HydrophobicContact CE3-CD2 4.02Å; W63-L70 HydrophobicContact CE3-CG 4.5Å; W63-L70 HydrophobicContact CG-CB 4.5Å; W63-L70 HydrophobicContact CH2-CD2 3.59Å; W63-L70 HydrophobicContact CZ2-CD2 3.84Å; W63-L70 HydrophobicContact CZ3-CB 4.21Å; W63-L70 HydrophobicContact CZ3-CD2 3.69Å; W63-L70 HydrophobicContact CZ3-CG 4.49Å; W63-G319 PolarHBondContact NE1-O 3.22Å; W63-T321 HydrophobicContact CD2-CG2 3.62Å; W63-T321 HydrophobicContact CE3-CG2 3.8Å; W63-T321 HydrophobicContact CG-CG2 4.18Å; W63-T321 HydrophobicContact CH2-CG2 3.87Å; W63-T321 HydrophobicContact CZ2-CG2 3.7Å; W63-T321 HydrophobicContact CZ3-CG2 3.91Å; W63-A328 HydrophobicContact CZ2-CB 3.6Å; W63-I338 HydrophobicContact CH2-CD1 4.26Å
64	G	97.9	Very high	98.1	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.031	18%	0.178	C	C	.	.			trans	-78.7	160.1	161.7	0	0	0	0	0	110.9	D66 S67 L69	G64-D66 PolarHBondContact O-N 2.78Å; G64-D66 VanDerWaalsContact O-N 3.15Å; G64-S67 PolarHBondContact O-N 3.49Å; G64-S67 VanDerWaalsContact O-N 3.15Å; G64-L69 PolarHBondContact N-O 3.45Å
65	T	97.4	Very high	98.1	Very high	79 Å²	79	37 Å²	37	49%	0.485	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-11.6	178.9	50.6	0	0	0	0	113.5	S67 P107 D322	T65-S67 PolarHBondContact O-N 2.94Å; T65-P107 HydrophobicContact CG2-CB 4.16Å; T65-P107 PolarHBondContact OG1-O 3.06Å; T65-D322 WeakPolarHBondContact CA-OD2 3.43Å
66	D	97.4	Very high	98.1	Very high	84 Å²	84	31.3 Å²	31.3	45%	0.449	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-2	174.7	71.2	-6.3	0	0	0	113.7	G64 R68 L69	G64-D66 PolarHBondContact O-N 2.78Å; G64-D66 VanDerWaalsContact O-N 3.15Å; D66-R68 PolarHBondContact O-N 2.94Å; D66-R68 VanDerWaalsContact O-N 3.08Å; D66-R68 PolarHBondContact OD1-N 3.41Å; D66-L69 PolarHBondContact OD1-N 3Å; D66-L69 WeakPolarHBondContact OD2-CG 3.41Å
67	S	98.1	Very high	97.9	Very high	11 Å²	11	30.3 Å²	30.3	8%	0.077	15%	0.148	C	C	.	.	S	Bend	trans	54.5	23.3	-176.6	-60.2	0	0	0	0	114	G64 T65 D323	G64-S67 PolarHBondContact O-N 3.49Å; G64-S67 VanDerWaalsContact O-N 3.15Å; T65-S67 PolarHBondContact O-N 2.94Å; S67-D323 PolarHBondContact OG-N 3.15Å; S67-D323 PolarHBondContact OG-OD1 3.31Å
68	R	97.5	Very high	97.9	Very high	108 Å²	108	30.9 Å²	30.9	41%	0.408	15%	0.151	S	C	.	.	S	Bend	trans	-130.9	-50.2	-177.3	179	179.3	177.9	-177.2	-3.1	112.1	D66 D83 S84 Y85	D66-R68 PolarHBondContact O-N 2.94Å; D66-R68 VanDerWaalsContact O-N 3.08Å; D66-R68 PolarHBondContact OD1-N 3.41Å; R68-D83 WeakPolarHBondContact CG-OD1 3.31Å; R68-D83 IonicContact CZ-OD1 2.88Å; R68-D83 IonicContact CZ-OD2 3.51Å; R68-D83 VanDerWaalsContact NE-CG 3.3Å; R68-D83 IonicContact NE-OD1 3.48Å; R68-D83 PolarHBondContact NE-OD1 3.42Å; R68-D83 IonicContact NE-OD2 2.97Å; R68-D83 PolarHBondContact NE-OD2 2.99Å; R68-D83 IonicContact NH2-OD1 3.42Å; R68-D83 IonicContact NH2-OD2 2.61Å; R68-D83 PolarHBondContact NH2-OD2 3.31Å; R68-S84 VanDerWaalsContact O-CB 3.25Å; R68-S84 WeakPolarHBondContact O-CB 3.5Å; R68-S84 PolarHBondContact O-N 3.48Å; R68-S84 PolarHBondContact O-OG 3.38Å; R68-Y85 HydrophobicContact CG-CG 4.49Å
69	L	98.4	Very high	97.9	Very high	33 Å²	33	30.8 Å²	30.8	17%	0.173	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	143.6	178.1	-64.5	179.1	0	0	0	109.8	G64 D66 W82 D83 V90 Y105	G64-L69 PolarHBondContact N-O 3.45Å; D66-L69 PolarHBondContact OD1-N 3Å; D66-L69 WeakPolarHBondContact OD2-CG 3.41Å; L69-W82 VanDerWaalsContact CA-O 3.26Å; L69-W82 WeakPolarHBondContact CA-O 3.17Å; L69-W82 WeakPolarHBondContact CD2-O 3.38Å; L69-D83 HydrophobicContact CD2-CB 4.16Å; L69-V90 HydrophobicContact CD2-CG2 3.95Å; L69-Y105 HydrophobicContact CB-CE2 4.17Å
70	L	98.7	Very high	97.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.8	169.3	68.4	93	0	0	0	110.2	L51 M61 H62 W63 I81 W82 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.17Å; L51-L70 HydrophobicContact CD1-CD2 4.1Å; M61-L70 HydrophobicContact CE-CB 3.92Å; M61-L70 HydrophobicContact CE-CD1 3.97Å; M61-L70 HydrophobicContact CE-CD2 4.15Å; M61-L70 HydrophobicContact CE-CG 4.23Å; H62-L70 CarbonylContact O-C 3.54Å; H62-L70 WeakPolarHBondContact O-CA 3.47Å; W63-L70 HydrophobicContact CD2-CB 3.99Å; W63-L70 HydrophobicContact CD2-CD2 4.27Å; W63-L70 HydrophobicContact CE3-CB 3.76Å; W63-L70 HydrophobicContact CE3-CD2 4.02Å; W63-L70 HydrophobicContact CE3-CG 4.5Å; W63-L70 HydrophobicContact CG-CB 4.5Å; W63-L70 HydrophobicContact CH2-CD2 3.59Å; W63-L70 HydrophobicContact CZ2-CD2 3.84Å; W63-L70 HydrophobicContact CZ3-CB 4.21Å; W63-L70 HydrophobicContact CZ3-CD2 3.69Å; W63-L70 HydrophobicContact CZ3-CG 4.49Å; L70-I81 WeakPolarHBondContact O-CA 3.42Å; L70-W82 HydrophobicContact CD1-CB 4.28Å; L70-W82 HydrophobicContact CD1-CG 4.28Å; L70-W82 HydrophobicContact CG-CB 4.18Å; L70-W82 PolarHBondContact N-O 2.6Å; L70-W82 VanDerWaalsContact N-O 3.09Å; L70-W82 PolarHBondContact O-N 3.05Å; L70-L336 HydrophobicContact CD1-CD1 3.97Å; L70-I338 HydrophobicContact CD2-CD1 4.4Å
71	V	98.8	Very high	97.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	142.2	172.1	64	0	0	0	0	109.6	M61 H62 L79 I80 I81 C103 Y105 V112	M61-V71 CarbonylContact C-O 3.58Å; M61-V71 WeakPolarHBondContact CA-O 3.45Å; M61-V71 WeakPolarHBondContact CB-O 3.42Å; H62-V71 HydrophobicContact CB-CG1 3.87Å; H62-V71 PolarHBondContact N-O 2.77Å; H62-V71 PolarHBondContact O-N 2.9Å; V71-L79 HydrophobicContact CG2-CD1 3.39Å; V71-L79 HydrophobicContact CG2-CD2 4.3Å; V71-L79 HydrophobicContact CG2-CG 3.69Å; V71-I80 CarbonylContact C-O 3.57Å; V71-I80 WeakPolarHBondContact CA-O 3.45Å; V71-I81 HydrophobicContact CB-CG1 4.37Å; V71-I81 HydrophobicContact CG2-CG1 4.24Å; V71-C103 HydrophobicContact CG1-CB 4.33Å; V71-C103 HydrophobicContact CG2-CB 4.39Å; V71-Y105 HydrophobicContact CB-CD2 4.08Å; V71-Y105 HydrophobicContact CG1-CD2 4.16Å; V71-V112 HydrophobicContact CB-CG1 4.33Å; V71-V112 HydrophobicContact CG2-CG1 4.29Å
72	S	98.8	Very high	97.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.9	172.7	64.5	0	0	0	0	111.8	H54 A60 L79 I80 W82 L336	H54-S72 PolarHBondContact NE2-OG 3.31Å; A60-S72 WeakPolarHBondContact O-CA 3.39Å; S72-L79 WeakPolarHBondContact O-CA 3.48Å; S72-I80 PolarHBondContact N-O 2.83Å; S72-I80 PolarHBondContact O-N 2.93Å; S72-W82 PolarHBondContact OG-NE1 3.36Å; S72-L336 VanDerWaalsContact CB-CD1 3.48Å
73	A	98.3	Very high	97.8	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.6	-178.6	0	0	0	0	0	110.7	Y59 A60 L79 V100 C103	Y59-A73 PolarHBondContact N-O 3.41Å; A60-A73 PolarHBondContact O-N 3.45Å; A73-L79 HydrophobicContact CB-CD1 3.79Å; A73-V100 HydrophobicContact CB-CB 4.32Å; A73-V100 HydrophobicContact CB-CG1 3.67Å; A73-V100 HydrophobicContact CB-CG2 3.66Å; A73-C103 HydrophobicContact CB-CB 3.87Å
74	S	97.8	Very high	97.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.9	-171.4	151	0	0	0	0	112.5	H54 A56 K57 D76 G77 K78 V100	H54-S74 VanDerWaalsContact CE1-CB 3.43Å; H54-S74 WeakPolarHBondContact CE1-CB 3.14Å; H54-S74 WeakPolarHBondContact ND1-CB 3.38Å; H54-S74 PolarHBondContact ND1-OG 2.93Å; A56-S74 PolarHBondContact O-OG 3.13Å; K57-S74 VanDerWaalsContact O-CA 3.28Å; K57-S74 WeakPolarHBondContact O-CA 3.33Å; K57-S74 WeakPolarHBondContact O-CB 3.22Å; K57-S74 PolarHBondContact O-OG 2.82Å; S74-D76 WeakPolarHBondContact CB-OD1 3.4Å; S74-D76 PolarHBondContact O-N 2.9Å; S74-D76 VanDerWaalsContact O-N 3.13Å; S74-D76 PolarHBondContact OG-N 2.89Å; S74-D76 PolarHBondContact OG-OD1 2.91Å; S74-G77 PolarHBondContact O-N 3.38Å; S74-G77 VanDerWaalsContact O-N 3.11Å; S74-K78 PolarHBondContact N-O 2.9Å; S74-V100 VanDerWaalsContact O-CG1 3.3Å; S74-V100 WeakPolarHBondContact O-CG1 3.43Å
75	Q	96.8	Very high	97.7	Very high	46 Å²	46	30.3 Å²	30.3	22%	0.215	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-5.1	179	-70	-172.3	-13.4	0	0	114.8	A56 K57 G77 S98	A56-Q75 HydrophobicContact CB-CB 3.98Å; K57-Q75 HydrophobicContact CB-CG 4.4Å; K57-Q75 PolarHBondContact O-N 2.97Å; Q75-G77 PolarHBondContact O-N 3.5Å; Q75-S98 VanDerWaalsContact CA-O 3.28Å; Q75-S98 WeakPolarHBondContact CA-O 3.34Å; Q75-S98 WeakPolarHBondContact O-CB 3.48Å
76	D	96.5	Very high	97.7	Very high	34 Å²	34	29.5 Å²	29.5	18%	0.182	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	4.1	168.9	64.8	-6.2	0	0	0	112.7	H54 L55 A56 S74 K78	H54-D76 VanDerWaalsContact CA-OD2 3.28Å; H54-D76 WeakPolarHBondContact CA-OD2 3.45Å; H54-D76 IonicContact CG-OD2 3.24Å; H54-D76 IonicContact ND1-OD1 3.43Å; H54-D76 PolarHBondContact ND1-OD1 2.94Å; H54-D76 IonicContact ND1-OD2 2.67Å; H54-D76 PolarHBondContact ND1-OD2 3.19Å; L55-D76 HydrophobicContact CB-CB 4.03Å; L55-D76 PolarHBondContact N-OD2 3.36Å; A56-D76 HydrophobicContact CB-CB 3.99Å; S74-D76 WeakPolarHBondContact CB-OD1 3.4Å; S74-D76 PolarHBondContact O-N 2.9Å; S74-D76 VanDerWaalsContact O-N 3.13Å; S74-D76 PolarHBondContact OG-N 2.89Å; S74-D76 PolarHBondContact OG-OD1 2.91Å; D76-K78 VanDerWaalsContact C-N 3.31Å; D76-K78 WeakPolarHBondContact OD1-CB 3.48Å; D76-K78 PolarHBondContact OD1-N 3.26Å; D76-K78 VanDerWaalsContact OD1-N 3.15Å
77	G	95.4	Very high	97.8	Very high	5 Å²	5	28 Å²	28	5%	0.052	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	27.1	-178.8	0	0	0	0	0	112.8	S74 Q75 L95	S74-G77 PolarHBondContact O-N 3.38Å; S74-G77 VanDerWaalsContact O-N 3.11Å; Q75-G77 PolarHBondContact O-N 3.5Å; G77-L95 WeakPolarHBondContact O-CB 3.4Å; G77-L95 PolarHBondContact O-N 3Å
78	K	97	Very high	97.7	Very high	86 Å²	86	32.3 Å²	32.3	37%	0.374	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137	175.8	-58.6	-56.7	-178	91.2	0	111.6	H54 S74 D76 I80	H54-K78 PolarHBondContact CE1-O 3.41Å; S74-K78 PolarHBondContact N-O 2.9Å; D76-K78 VanDerWaalsContact C-N 3.31Å; D76-K78 WeakPolarHBondContact OD1-CB 3.48Å; D76-K78 PolarHBondContact OD1-N 3.26Å; D76-K78 VanDerWaalsContact OD1-N 3.15Å; K78-I80 HydrophobicContact CB-CD1 4.49Å; K78-I80 HydrophobicContact CB-CG1 4.17Å
79	L	97.8	Very high	97.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	111.8	164.1	-174.2	72.4	0	0	0	107.8	V71 S72 A73 I93 L95 C103 V112 C114 Y124	V71-L79 HydrophobicContact CG2-CD1 3.39Å; V71-L79 HydrophobicContact CG2-CD2 4.3Å; V71-L79 HydrophobicContact CG2-CG 3.69Å; S72-L79 WeakPolarHBondContact O-CA 3.48Å; A73-L79 HydrophobicContact CB-CD1 3.79Å; L79-I93 HydrophobicContact CB-CB 4.23Å; L79-I93 HydrophobicContact CD2-CD1 4.12Å; L79-I93 PolarHBondContact N-O 3.42Å; L79-I93 PolarHBondContact O-N 2.87Å; L79-L95 HydrophobicContact CB-CD1 4.26Å; L79-L95 HydrophobicContact CB-CD2 3.79Å; L79-L95 HydrophobicContact CB-CG 4.13Å; L79-L95 HydrophobicContact CD2-CD2 4.46Å; L79-C103 HydrophobicContact CD1-CB 3.65Å; L79-V112 HydrophobicContact CD2-CB 4.38Å; L79-V112 HydrophobicContact CD2-CG2 3.86Å; L79-C114 HydrophobicContact CD1-CB 4.17Å; L79-C114 HydrophobicContact CD2-CB 4.15Å; L79-Y124 HydrophobicContact CD2-CD2 4.19Å; L79-Y124 HydrophobicContact CD2-CE2 4.33Å
80	I	98.2	Very high	97.6	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.8	-175.5	-57.5	179.8	0	0	0	109.5	H54 V71 S72 K78 W82 K89 H91 A92	H54-I80 VanDerWaalsContact CE1-CD1 3.44Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.49Å; V71-I80 CarbonylContact C-O 3.57Å; V71-I80 WeakPolarHBondContact CA-O 3.45Å; S72-I80 PolarHBondContact N-O 2.83Å; S72-I80 PolarHBondContact O-N 2.93Å; K78-I80 HydrophobicContact CB-CD1 4.49Å; K78-I80 HydrophobicContact CB-CG1 4.17Å; I80-W82 HydrophobicContact CB-CZ2 4.36Å; I80-W82 HydrophobicContact CD1-CZ2 4.08Å; I80-W82 HydrophobicContact CG2-CD2 3.78Å; I80-W82 HydrophobicContact CG2-CE3 4.5Å; I80-W82 HydrophobicContact CG2-CG 4.09Å; I80-W82 HydrophobicContact CG2-CZ2 3.84Å; I80-W82 VanDerWaalsContact CG2-NE1 3.32Å; I80-K89 HydrophobicContact CG2-CB 4.17Å; I80-K89 HydrophobicContact CG2-CD 4.4Å; I80-K89 HydrophobicContact CG2-CG 3.95Å; I80-H91 WeakPolarHBondContact CA-O 3.13Å; I80-H91 WeakPolarHBondContact CG2-O 3.44Å; I80-A92 HydrophobicContact CG1-CB 4.39Å
81	I	98.1	Very high	97.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.5	169.2	-59	176.5	0	0	0	108	L70 V71 V90 H91 Y105 V112 L126	L70-I81 WeakPolarHBondContact O-CA 3.42Å; V71-I81 HydrophobicContact CB-CG1 4.37Å; V71-I81 HydrophobicContact CG2-CG1 4.24Å; I81-V90 HydrophobicContact CG2-CB 4.32Å; I81-V90 PolarHBondContact O-N 3.09Å; I81-H91 HydrophobicContact CB-CB 4.15Å; I81-H91 HydrophobicContact CD1-CB 4.14Å; I81-H91 HydrophobicContact CG1-CB 4.32Å; I81-H91 PolarHBondContact N-O 2.88Å; I81-H91 PolarHBondContact O-N 3.08Å; I81-Y105 HydrophobicContact CD1-CE2 4.4Å; I81-Y105 HydrophobicContact CG2-CE2 4.06Å; I81-V112 HydrophobicContact CD1-CG1 3.89Å; I81-V112 HydrophobicContact CD1-CG2 4.34Å; I81-V112 HydrophobicContact CG1-CG1 4.48Å; I81-L126 HydrophobicContact CD1-CD1 3.43Å; I81-L126 VanDerWaalsContact CD1-CD1 3.43Å; I81-L126 HydrophobicContact CD1-CD2 3.38Å; I81-L126 HydrophobicContact CD1-CG 4.04Å
82	W	98.6	Very high	97.2	Very high	5 Å²	5	38.5 Å²	38.5	2%	0.019	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.5	-175.4	-58	88.8	0	0	0	111.1	L51 R52 L69 L70 S72 I80 N88 K89	L51-W82 HydrophobicContact CB-CD2 4.22Å; L51-W82 HydrophobicContact CB-CE3 4.07Å; L51-W82 HydrophobicContact CB-CH2 3.84Å; L51-W82 HydrophobicContact CB-CZ2 4.13Å; L51-W82 HydrophobicContact CB-CZ3 3.88Å; L51-W82 HydrophobicContact CD1-CB 3.99Å; L51-W82 HydrophobicContact CD1-CD2 3.94Å; L51-W82 HydrophobicContact CD1-CE3 4.3Å; L51-W82 HydrophobicContact CD1-CG 3.82Å; L51-W82 HydrophobicContact CD2-CE3 4.25Å; L51-W82 HydrophobicContact CG-CE3 4.45Å; R52-W82 VanDerWaalsContact O-CH2 3.24Å; R52-W82 WeakPolarHBondContact O-CH2 3.35Å; L69-W82 VanDerWaalsContact CA-O 3.26Å; L69-W82 WeakPolarHBondContact CA-O 3.17Å; L69-W82 WeakPolarHBondContact CD2-O 3.38Å; L70-W82 HydrophobicContact CD1-CB 4.28Å; L70-W82 HydrophobicContact CD1-CG 4.28Å; L70-W82 HydrophobicContact CG-CB 4.18Å; L70-W82 PolarHBondContact N-O 2.6Å; L70-W82 VanDerWaalsContact N-O 3.09Å; L70-W82 PolarHBondContact O-N 3.05Å; S72-W82 PolarHBondContact OG-NE1 3.36Å; I80-W82 HydrophobicContact CB-CZ2 4.36Å; I80-W82 HydrophobicContact CD1-CZ2 4.08Å; I80-W82 HydrophobicContact CG2-CD2 3.78Å; I80-W82 HydrophobicContact CG2-CE3 4.5Å; I80-W82 HydrophobicContact CG2-CG 4.09Å; I80-W82 HydrophobicContact CG2-CZ2 3.84Å; I80-W82 VanDerWaalsContact CG2-NE1 3.32Å; W82-N88 WeakPolarHBondContact CA-O 3.37Å; W82-K89 HydrophobicContact CD2-CG 4.46Å; W82-K89 HydrophobicContact CE3-CG 3.84Å; W82-K89 HydrophobicContact CH2-CG 4.1Å; W82-K89 HydrophobicContact CZ3-CD 4.47Å; W82-K89 HydrophobicContact CZ3-CG 3.64Å
83	D	98.2	Very high	97.1	Very high	12 Å²	12	38.8 Å²	38.8	6%	0.064	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	108.8	157	174.2	4.5	0	0	0	108.6	R68 L69 Y85 T86 T87 N88 V90	R68-D83 WeakPolarHBondContact CG-OD1 3.31Å; R68-D83 IonicContact CZ-OD1 2.88Å; R68-D83 IonicContact CZ-OD2 3.51Å; R68-D83 VanDerWaalsContact NE-CG 3.3Å; R68-D83 IonicContact NE-OD1 3.48Å; R68-D83 PolarHBondContact NE-OD1 3.42Å; R68-D83 IonicContact NE-OD2 2.97Å; R68-D83 PolarHBondContact NE-OD2 2.99Å; R68-D83 IonicContact NH2-OD1 3.42Å; R68-D83 IonicContact NH2-OD2 2.61Å; R68-D83 PolarHBondContact NH2-OD2 3.31Å; L69-D83 HydrophobicContact CD2-CB 4.16Å; D83-Y85 PolarHBondContact O-N 3.04Å; D83-Y85 PolarHBondContact OD1-N 2.84Å; D83-Y85 VanDerWaalsContact OD1-N 3.16Å; D83-T86 WeakPolarHBondContact CB-OG1 3.43Å; D83-T86 VanDerWaalsContact OD2-CG2 3.29Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.39Å; D83-T86 PolarHBondContact OD2-OG1 3.43Å; D83-T87 WeakPolarHBondContact O-CA 3.32Å; D83-T87 PolarHBondContact O-N 2.72Å; D83-N88 PolarHBondContact N-O 3.01Å; D83-V90 HydrophobicContact CB-CG2 4.05Å
84	S	97.6	Very high	96.9	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.021	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.6	-175.6	58.3	0	0	0	0	114.1	R68 I338	R68-S84 VanDerWaalsContact O-CB 3.25Å; R68-S84 WeakPolarHBondContact O-CB 3.5Å; R68-S84 PolarHBondContact O-N 3.48Å; R68-S84 PolarHBondContact O-OG 3.38Å; S84-I338 VanDerWaalsContact CB-CD1 3.42Å
85	Y	96.6	Very high	96.7	Very high	126 Å²	126	44.4 Å²	44.4	49%	0.494	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-47.8	-175.1	-73.1	5.5	0	0	0	111.1	R49 R68 D83	R49-Y85 PolarHBondContact NE-O 2.88Å; R68-Y85 HydrophobicContact CG-CG 4.49Å; D83-Y85 PolarHBondContact O-N 3.04Å; D83-Y85 PolarHBondContact OD1-N 2.84Å; D83-Y85 VanDerWaalsContact OD1-N 3.16Å
86	T	97.6	Very high	96.2	Very high	62 Å²	62	51 Å²	51	38%	0.38	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-14.4	-178.4	65	0	0	0	0	113	D83 N88	D83-T86 WeakPolarHBondContact CB-OG1 3.43Å; D83-T86 VanDerWaalsContact OD2-CG2 3.29Å; D83-T86 WeakPolarHBondContact OD2-CG2 3.39Å; D83-T86 PolarHBondContact OD2-OG1 3.43Å; T86-N88 PolarHBondContact O-N 3Å; T86-N88 WeakPolarHBondContact OG1-CB 3.43Å; T86-N88 PolarHBondContact OG1-N 3.07Å; T86-N88 PolarHBondContact OG1-ND2 2.88Å
87	T	98.1	Very high	95.9	Very high	54 Å²	54	50.7 Å²	50.7	33%	0.331	26%	0.261	S	S	.	.			trans	63.2	11.6	-172.8	71.7	0	0	0	0	114.7	R49 L51 D83	R49-T87 HydrophobicContact CB-CG2 4.04Å; R49-T87 HydrophobicContact CG-CG2 4.04Å; L51-T87 HydrophobicContact CD2-CG2 3.71Å; D83-T87 WeakPolarHBondContact O-CA 3.32Å; D83-T87 PolarHBondContact O-N 2.72Å
88	N	97.8	Very high	95.8	Very high	101 Å²	101	53.3 Å²	53.3	54%	0.54	28%	0.279	S	S	.	.			trans	-74.7	145.9	179	-70.4	-31	0	0	0	111.3	W82 D83 T86	W82-N88 WeakPolarHBondContact CA-O 3.37Å; D83-N88 PolarHBondContact N-O 3.01Å; T86-N88 PolarHBondContact O-N 3Å; T86-N88 WeakPolarHBondContact OG1-CB 3.43Å; T86-N88 PolarHBondContact OG1-N 3.07Å; T86-N88 PolarHBondContact OG1-ND2 2.88Å
89	K	96.9	Very high	95.6	Very high	90 Å²	90	56 Å²	56	39%	0.391	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	113.7	169.2	-56.9	173.7	-164.9	-71.9	0	107.7	R52 I80 W82	R52-K89 PolarHBondContact O-NZ 2.88Å; I80-K89 HydrophobicContact CG2-CB 4.17Å; I80-K89 HydrophobicContact CG2-CD 4.4Å; I80-K89 HydrophobicContact CG2-CG 3.95Å; W82-K89 HydrophobicContact CD2-CG 4.46Å; W82-K89 HydrophobicContact CE3-CG 3.84Å; W82-K89 HydrophobicContact CH2-CG 4.1Å; W82-K89 HydrophobicContact CZ3-CD 4.47Å; W82-K89 HydrophobicContact CZ3-CG 3.64Å
90	V	95.1	Very high	95.5	Very high	71 Å²	71	56.2 Å²	56.2	43%	0.43	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-45.8	177.4	-175.8	0	0	0	0	109.8	L69 I81 D83	L69-V90 HydrophobicContact CD2-CG2 3.95Å; I81-V90 HydrophobicContact CG2-CB 4.32Å; I81-V90 PolarHBondContact O-N 3.09Å; D83-V90 HydrophobicContact CB-CG2 4.05Å
91	H	95	Very high	95.4	Very high	53 Å²	53	57.2 Å²	57.2	25%	0.245	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	149	173.3	-62.9	-72.8	0	0	0	110.5	I80 I81 V133	I80-H91 WeakPolarHBondContact CA-O 3.13Å; I80-H91 WeakPolarHBondContact CG2-O 3.44Å; I81-H91 HydrophobicContact CB-CB 4.15Å; I81-H91 HydrophobicContact CD1-CB 4.14Å; I81-H91 HydrophobicContact CG1-CB 4.32Å; I81-H91 PolarHBondContact N-O 2.88Å; I81-H91 PolarHBondContact O-N 3.08Å; H91-V133 HydrophobicContact CB-CG2 4.44Å
92	A	95.3	Very high	95.4	Very high	57 Å²	57	57.3 Å²	57.3	47%	0.471	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	101.4	170.1	0	0	0	0	0	108.6	I80	I80-A92 HydrophobicContact CG1-CB 4.39Å
93	I	95.7	Very high	95.4	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	120.5	-173.7	-57.2	162.3	0	0	0	107.9	L79 V112 Y124 L126 V133	L79-I93 HydrophobicContact CB-CB 4.23Å; L79-I93 HydrophobicContact CD2-CD1 4.12Å; L79-I93 PolarHBondContact N-O 3.42Å; L79-I93 PolarHBondContact O-N 2.87Å; I93-V112 HydrophobicContact CD1-CG2 3.91Å; I93-Y124 HydrophobicContact CD1-CG 4.27Å; I93-Y124 HydrophobicContact CG2-CD1 3.72Å; I93-Y124 HydrophobicContact CG2-CE1 3.49Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.49Å; I93-Y124 HydrophobicContact CG2-CE2 4.42Å; I93-Y124 HydrophobicContact CG2-CG 4.25Å; I93-L126 HydrophobicContact CD1-CD2 4.34Å; I93-V133 HydrophobicContact CD1-CB 4.35Å; I93-V133 HydrophobicContact CD1-CG1 3.63Å; I93-V133 HydrophobicContact CG1-CB 4.01Å; I93-V133 HydrophobicContact CG1-CG1 3.78Å; I93-V133 HydrophobicContact CG1-CG2 4.28Å
94	P	94.8	Very high	95.5	Very high	93 Å²	93	56.5 Å²	56.5	60%	0.604	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	128	170.1	29.6	-31.7	0	0	0	109.7
95	L	93.7	Very high	95.5	Very high	25 Å²	25	57.2 Å²	57.2	13%	0.131	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-87.5	151.1	176.6	-60.2	-178.4	0	0	0	110.5	G77 L79 S97 V100 C114 Y124	G77-L95 WeakPolarHBondContact O-CB 3.4Å; G77-L95 PolarHBondContact O-N 3Å; L79-L95 HydrophobicContact CB-CD1 4.26Å; L79-L95 HydrophobicContact CB-CD2 3.79Å; L79-L95 HydrophobicContact CB-CG 4.13Å; L79-L95 HydrophobicContact CD2-CD2 4.46Å; L95-S97 WeakPolarHBondContact CB-O 3.22Å; L95-V100 HydrophobicContact CD1-CB 3.9Å; L95-V100 HydrophobicContact CD1-CG1 4.1Å; L95-V100 HydrophobicContact CD1-CG2 4.06Å; L95-C114 WeakPolarHBondContact CD2-SG 3.03Å; L95-Y124 HydrophobicContact CD2-CE2 4.12Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.47Å
96	R	86.5	Confident	95.6	Very high	184 Å²	184	51.3 Å²	51.3	69%	0.694	27%	0.269	S	S	*	.	S	Bend	trans	-69.4	-36.8	174	178	179.2	165.3	-171.8	-6.1	111.8	E138	R96-E138 IonicContact NH1-OE1 3.08Å; R96-E138 IonicContact NH1-OE2 3.97Å
97	S	91.1	Very high	95.6	Very high	28 Å²	28	51 Å²	51	20%	0.196	27%	0.268	C	S	.	.			trans	-114	136.6	176.3	-178.1	0	0	0	0	110.3	L95 W99 D118	L95-S97 WeakPolarHBondContact CB-O 3.22Å; S97-W99 VanDerWaalsContact C-N 3.29Å; S97-W99 PolarHBondContact OG-N 2.83Å; S97-D118 WeakPolarHBondContact CB-OD2 3.49Å
98	S	91.6	Very high	95.6	Very high	60 Å²	60	50.8 Å²	50.8	42%	0.42	27%	0.269	S	S	.	.	S	Bend	trans	-73.6	-23.4	172.4	-61.7	0	0	0	0	112.5	Q75 V100	Q75-S98 VanDerWaalsContact CA-O 3.28Å; Q75-S98 WeakPolarHBondContact CA-O 3.34Å; Q75-S98 WeakPolarHBondContact O-CB 3.48Å; S98-V100 VanDerWaalsContact C-N 3.29Å; S98-V100 PolarHBondContact O-N 3.43Å
99	W	92.6	Very high	95.5	Very high	143 Å²	143	47.4 Å²	47.4	54%	0.542	26%	0.257	S	S	.	.			trans	-87.8	66.6	-174.2	-67.7	104.6	0	0	0	111.9	S97 G116 L117	S97-W99 VanDerWaalsContact C-N 3.29Å; S97-W99 PolarHBondContact OG-N 2.83Å; W99-G116 CarbonylContact O-C 3.6Å; W99-G116 VanDerWaalsContact O-CA 3.28Å; W99-G116 WeakPolarHBondContact O-CA 3.49Å; W99-L117 HydrophobicContact CB-CB 3.72Å; W99-L117 HydrophobicContact CB-CD1 3.61Å; W99-L117 HydrophobicContact CB-CG 3.65Å; W99-L117 HydrophobicContact CD2-CD1 3.74Å; W99-L117 HydrophobicContact CE3-CD1 3.93Å; W99-L117 HydrophobicContact CG-CB 4.43Å; W99-L117 HydrophobicContact CG-CD1 3.62Å; W99-L117 HydrophobicContact CG-CG 4.24Å; W99-L117 PolarHBondContact O-N 2.9Å
100	V	96.1	Very high	95.4	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.024	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	136.2	175.8	67.3	0	0	0	0	110.9	Y59 A73 S74 L95 S98 T102 C114 G115	Y59-V100 WeakPolarHBondContact CB-O 3.21Å; A73-V100 HydrophobicContact CB-CB 4.32Å; A73-V100 HydrophobicContact CB-CG1 3.67Å; A73-V100 HydrophobicContact CB-CG2 3.66Å; S74-V100 VanDerWaalsContact O-CG1 3.3Å; S74-V100 WeakPolarHBondContact O-CG1 3.43Å; L95-V100 HydrophobicContact CD1-CB 3.9Å; L95-V100 HydrophobicContact CD1-CG1 4.1Å; L95-V100 HydrophobicContact CD1-CG2 4.06Å; S98-V100 VanDerWaalsContact C-N 3.29Å; S98-V100 PolarHBondContact O-N 3.43Å; V100-T102 WeakPolarHBondContact CG2-O 3.37Å; V100-C114 HydrophobicContact CG2-CB 3.98Å; V100-G115 WeakPolarHBondContact CG2-O 3.36Å
101	M	97	Very high	95.5	Very high	25 Å²	25	43.2 Å²	43.2	12%	0.123	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	-19.9	-179.9	-65.2	176.3	72.3	0	0	112.5	Y59 G115 L117 Y145 L146	Y59-M101 VanDerWaalsContact CD1-CA 3.44Å; Y59-M101 HydrophobicContact CD1-CB 4.01Å; Y59-M101 HydrophobicContact CD1-CG 4.41Å; Y59-M101 WeakPolarHBondContact CD1-O 3.17Å; Y59-M101 HydrophobicContact CE1-CB 3.8Å; Y59-M101 HydrophobicContact CE1-CE 4.25Å; Y59-M101 HydrophobicContact CE1-CG 4.04Å; Y59-M101 HydrophobicContact CE2-CG 4.48Å; Y59-M101 WeakPolarHBondContact OH-CE 3.36Å; M101-G115 PolarHBondContact N-O 2.8Å; M101-L117 HydrophobicContact SD-CD2 3.87Å; M101-L117 HydrophobicContact SD-CG 4.43Å; M101-Y145 HydrophobicContact CE-CD2 3.68Å; M101-Y145 HydrophobicContact CE-CE2 3.69Å; M101-Y145 HydrophobicContact SD-CD2 3.61Å; M101-Y145 HydrophobicContact SD-CE2 4.26Å; M101-Y145 HydrophobicContact SD-CG 4.22Å; M101-L146 WeakPolarHBondContact CB-O 3.22Å
102	T	98.3	Very high	95.7	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.5	178.1	-177.5	0	0	0	0	112	V100 C114 G115 L146 C148 C149	V100-T102 WeakPolarHBondContact CG2-O 3.37Å; T102-C114 WeakPolarHBondContact O-CA 3.48Å; T102-C114 WeakPolarHBondContact O-CB 3.48Å; T102-G115 PolarHBondContact N-O 3.13Å; T102-G115 PolarHBondContact O-N 2.61Å; T102-L146 HydrophobicContact CG2-CD2 3.61Å; T102-L146 HydrophobicContact CG2-CG 3.92Å; T102-C148 WeakPolarHBondContact OG1-CA 3.22Å; T102-C149 HydrophobicContact CG2-CB 4.2Å; T102-C149 PolarHBondContact OG1-N 3.41Å; T102-C149 PolarHBondContact OG1-SG 2.8Å
103	C	98.4	Very high	95.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	153.2	160.8	59.9	0	0	0	0	110.6	A60 V71 A73 L79 A113 C114 R150	A60-C103 VanDerWaalsContact C-SG 3.58Å; V71-C103 HydrophobicContact CG1-CB 4.33Å; V71-C103 HydrophobicContact CG2-CB 4.39Å; A73-C103 HydrophobicContact CB-CB 3.87Å; L79-C103 HydrophobicContact CD1-CB 3.65Å; C103-A113 CarbonylContact C-O 3.53Å; C103-A113 WeakPolarHBondContact CA-O 3.44Å; C103-A113 WeakPolarHBondContact CB-O 3.2Å; C103-C114 HydrophobicContact CB-CB 4.32Å; C103-R150 PolarHBondContact O-NH1 3.17Å
104	A	98.8	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	139	176.1	0	0	0	0	0	110.9	V112 A113 C149 F151	A104-V112 CarbonylContact O-C 3.53Å; A104-V112 VanDerWaalsContact O-CA 3.25Å; A104-V112 WeakPolarHBondContact O-CA 3.5Å; A104-A113 HydrophobicContact CB-CB 4.47Å; A104-A113 PolarHBondContact N-O 2.74Å; A104-A113 PolarHBondContact O-N 3.21Å; A104-C149 WeakPolarHBondContact CB-O 3.27Å; A104-F151 HydrophobicContact CB-CD2 3.86Å; A104-F151 HydrophobicContact CB-CE2 4.04Å
105	Y	98.5	Very high	96.1	Very high	18 Å²	18	33.6 Å²	33.6	7%	0.071	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	126.5	168.9	-149.9	-58.3	0	0	0	109	H62 L69 V71 I81 G109 V112 L126	H62-Y105 PolarHBondContact ND1-N 2.82Å; H62-Y105 PolarHBondContact ND1-O 3.29Å; L69-Y105 HydrophobicContact CB-CE2 4.17Å; V71-Y105 HydrophobicContact CB-CD2 4.08Å; V71-Y105 HydrophobicContact CG1-CD2 4.16Å; I81-Y105 HydrophobicContact CD1-CE2 4.4Å; I81-Y105 HydrophobicContact CG2-CE2 4.06Å; Y105-G109 PolarHBondContact OH-O 2.98Å; Y105-V112 HydrophobicContact CD2-CG1 3.96Å; Y105-V112 HydrophobicContact CE2-CG1 4.17Å; Y105-V112 HydrophobicContact CG-CG1 4.14Å; Y105-L126 HydrophobicContact CE1-CD1 4.29Å; Y105-L126 HydrophobicContact CE2-CD1 4.42Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.43Å
106	A	98.5	Very high	96.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	17%	0.166	C	C	.	.			trans	-71.4	144.4	178.3	0	0	0	0	0	112.2	S108 G109 Y111 F151	A106-S108 PolarHBondContact O-N 2.92Å; A106-G109 PolarHBondContact O-N 3.2Å; A106-Y111 VanDerWaalsContact CB-O 3.27Å; A106-Y111 WeakPolarHBondContact CB-O 3.46Å; A106-Y111 PolarHBondContact N-O 3.41Å; A106-F151 HydrophobicContact CB-CB 4.39Å; A106-F151 HydrophobicContact CB-CD1 4.09Å; A106-F151 HydrophobicContact CB-CD2 3.77Å; A106-F151 HydrophobicContact CB-CE1 4.25Å; A106-F151 HydrophobicContact CB-CE2 3.96Å; A106-F151 HydrophobicContact CB-CG 3.83Å; A106-F151 HydrophobicContact CB-CZ 4.18Å
107	P	98	Very high	96.7	Very high	55 Å²	55	27.7 Å²	27.7	36%	0.357	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.9	-172.4	23.3	-34.1	0	0	0	114.1	T65 G109	T65-P107 HydrophobicContact CG2-CB 4.16Å; T65-P107 PolarHBondContact OG1-O 3.06Å; P107-G109 VanDerWaalsContact C-N 3.35Å
108	S	97.3	Very high	96.9	Very high	51 Å²	51	28.5 Å²	28.5	36%	0.357	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.7	179.2	67.5	0	0	0	0	115.2	A106 N110 D154	A106-S108 PolarHBondContact O-N 2.92Å; S108-N110 VanDerWaalsContact C-N 3.35Å; S108-N110 WeakPolarHBondContact CB-ND2 3.27Å; S108-N110 VanDerWaalsContact OG-CB 3.29Å; S108-N110 WeakPolarHBondContact OG-CB 2.95Å; S108-N110 VanDerWaalsContact OG-CG 3.27Å; S108-N110 PolarHBondContact OG-N 3.41Å; S108-N110 PolarHBondContact OG-ND2 3.1Å; S108-N110 VanDerWaalsContact OG-ND2 3.12Å; S108-D154 VanDerWaalsContact CB-CG 3.46Å; S108-D154 WeakPolarHBondContact CB-OD1 3.34Å; S108-D154 WeakPolarHBondContact CB-OD2 3.48Å; S108-D154 PolarHBondContact OG-OD1 3.43Å; S108-D154 PolarHBondContact OG-OD2 2.95Å
109	G	96	Very high	97.2	Very high	29 Å²	29	28 Å²	28	30%	0.299	15%	0.149	S	C	.	.	S	Bend	trans	91.3	-13.8	-167.3	0	0	0	0	0	114.9	Y105 A106 P107	Y105-G109 PolarHBondContact OH-O 2.98Å; A106-G109 PolarHBondContact O-N 3.2Å; P107-G109 VanDerWaalsContact C-N 3.35Å
110	N	95	Very high	97.4	Very high	28 Å²	28	22.4 Å²	22.4	15%	0.15	13%	0.129	C	C	.	.	S	Bend	trans	-88.8	-31.6	-162.5	-60.3	-35.3	0	0	0	114.9	S108 N125 L126 K127 D154	S108-N110 VanDerWaalsContact C-N 3.35Å; S108-N110 WeakPolarHBondContact CB-ND2 3.27Å; S108-N110 VanDerWaalsContact OG-CB 3.29Å; S108-N110 WeakPolarHBondContact OG-CB 2.95Å; S108-N110 VanDerWaalsContact OG-CG 3.27Å; S108-N110 PolarHBondContact OG-N 3.41Å; S108-N110 PolarHBondContact OG-ND2 3.1Å; S108-N110 VanDerWaalsContact OG-ND2 3.12Å; N110-N125 PolarHBondContact O-OD1 3.44Å; N110-L126 WeakPolarHBondContact O-CB 3.15Å; N110-L126 PolarHBondContact O-N 3.48Å; N110-K127 VanDerWaalsContact OD1-CD 3.25Å; N110-K127 WeakPolarHBondContact OD1-CD 3.23Å; N110-K127 WeakPolarHBondContact OD1-CE 3.26Å; N110-K127 PolarHBondContact OD1-NZ 3.1Å; N110-D154 PolarHBondContact ND2-OD2 3.27Å
111	Y	97.6	Very high	97.5	Very high	46 Å²	46	22.4 Å²	22.4	18%	0.18	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.7	-173.8	-60.9	-65.1	0	0	0	112	A106 I123 Y124 N125 D154	A106-Y111 VanDerWaalsContact CB-O 3.27Å; A106-Y111 WeakPolarHBondContact CB-O 3.46Å; A106-Y111 PolarHBondContact N-O 3.41Å; Y111-I123 HydrophobicContact CD1-CG2 3.96Å; Y111-I123 HydrophobicContact CG-CG2 4.14Å; Y111-Y124 VanDerWaalsContact CA-O 3.31Å; Y111-Y124 WeakPolarHBondContact CA-O 3.34Å; Y111-N125 HydrophobicContact CD1-CB 4.03Å; Y111-N125 HydrophobicContact CE1-CB 3.78Å; Y111-D154 HydrophobicContact CD2-CB 4.16Å; Y111-D154 HydrophobicContact CE2-CB 3.93Å
112	V	98.3	Very high	97.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	140.6	161.1	-70.3	0	0	0	0	109.3	V71 L79 I81 I93 A104 Y105 I123 Y124 L126	V71-V112 HydrophobicContact CB-CG1 4.33Å; V71-V112 HydrophobicContact CG2-CG1 4.29Å; L79-V112 HydrophobicContact CD2-CB 4.38Å; L79-V112 HydrophobicContact CD2-CG2 3.86Å; I81-V112 HydrophobicContact CD1-CG1 3.89Å; I81-V112 HydrophobicContact CD1-CG2 4.34Å; I81-V112 HydrophobicContact CG1-CG1 4.48Å; I93-V112 HydrophobicContact CD1-CG2 3.91Å; A104-V112 CarbonylContact O-C 3.53Å; A104-V112 VanDerWaalsContact O-CA 3.25Å; A104-V112 WeakPolarHBondContact O-CA 3.5Å; Y105-V112 HydrophobicContact CD2-CG1 3.96Å; Y105-V112 HydrophobicContact CE2-CG1 4.17Å; Y105-V112 HydrophobicContact CG-CG1 4.14Å; V112-I123 WeakPolarHBondContact O-CA 3.21Å; V112-Y124 HydrophobicContact CG2-CD2 4.42Å; V112-Y124 PolarHBondContact N-O 3.05Å; V112-Y124 PolarHBondContact O-N 3.3Å; V112-L126 HydrophobicContact CG1-CD1 3.97Å; V112-L126 HydrophobicContact CG2-CD2 3.96Å; V112-L126 HydrophobicContact CG2-CG 4.44Å
113	A	98.4	Very high	97.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	152.2	173.7	0	0	0	0	0	110.5	C103 A104 S122 I123 F151 I157	C103-A113 CarbonylContact C-O 3.53Å; C103-A113 WeakPolarHBondContact CA-O 3.44Å; C103-A113 WeakPolarHBondContact CB-O 3.2Å; A104-A113 HydrophobicContact CB-CB 4.47Å; A104-A113 PolarHBondContact N-O 2.74Å; A104-A113 PolarHBondContact O-N 3.21Å; A113-S122 CarbonylContact C-O 3.59Å; A113-S122 VanDerWaalsContact CA-O 3.24Å; A113-S122 WeakPolarHBondContact CA-O 3.12Å; A113-I123 HydrophobicContact CB-CG1 4.17Å; A113-F151 HydrophobicContact CB-CE2 3.52Å; A113-F151 HydrophobicContact CB-CZ 3.57Å; A113-I157 HydrophobicContact CB-CD1 3.55Å
114	C	98.2	Very high	97.4	Very high	4 Å²	4	21.7 Å²	21.7	3%	0.027	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	164.3	165.4	70.2	0	0	0	0	111.5	L79 L95 V100 T102 C103 C121 S122	L79-C114 HydrophobicContact CD1-CB 4.17Å; L79-C114 HydrophobicContact CD2-CB 4.15Å; L95-C114 WeakPolarHBondContact CD2-SG 3.03Å; V100-C114 HydrophobicContact CG2-CB 3.98Å; T102-C114 WeakPolarHBondContact O-CA 3.48Å; T102-C114 WeakPolarHBondContact O-CB 3.48Å; C103-C114 HydrophobicContact CB-CB 4.32Å; C114-C121 CarbonylContact O-C 3.56Å; C114-C121 WeakPolarHBondContact O-CA 3.46Å; C114-S122 PolarHBondContact N-O 2.96Å; C114-S122 PolarHBondContact O-N 3.23Å
115	G	97.4	Very high	97.2	Very high	2 Å²	2	23.7 Å²	23.7	2%	0.021	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	175.9	167.6	0	0	0	0	0	111.9	V100 M101 T102 I120	V100-G115 WeakPolarHBondContact CG2-O 3.36Å; M101-G115 PolarHBondContact N-O 2.8Å; T102-G115 PolarHBondContact N-O 3.13Å; T102-G115 PolarHBondContact O-N 2.61Å; G115-I120 WeakPolarHBondContact CA-O 3.27Å
116	G	97.2	Very high	97	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	-123.8	177.5	0	0	0	0	0	112.6	W99 D118 N119 L146	W99-G116 CarbonylContact O-C 3.6Å; W99-G116 VanDerWaalsContact O-CA 3.28Å; W99-G116 WeakPolarHBondContact O-CA 3.49Å; G116-D118 PolarHBondContact N-OD1 3.03Å; G116-D118 VanDerWaalsContact N-OD1 3.17Å; G116-D118 PolarHBondContact O-N 2.67Å; G116-D118 VanDerWaalsContact O-N 3.12Å; G116-N119 PolarHBondContact O-N 3.1Å; G116-L146 WeakPolarHBondContact CA-O 3.47Å; G116-L146 PolarHBondContact O-N 2.7Å
117	L	96.5	Very high	96.3	Very high	84 Å²	84	30.7 Å²	30.7	44%	0.44	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-3.4	-175.8	-59.9	-174.2	0	0	0	114.5	W99 M101 N119 Y145	W99-L117 HydrophobicContact CB-CB 3.72Å; W99-L117 HydrophobicContact CB-CD1 3.61Å; W99-L117 HydrophobicContact CB-CG 3.65Å; W99-L117 HydrophobicContact CD2-CD1 3.74Å; W99-L117 HydrophobicContact CE3-CD1 3.93Å; W99-L117 HydrophobicContact CG-CB 4.43Å; W99-L117 HydrophobicContact CG-CD1 3.62Å; W99-L117 HydrophobicContact CG-CG 4.24Å; W99-L117 PolarHBondContact O-N 2.9Å; M101-L117 HydrophobicContact SD-CD2 3.87Å; M101-L117 HydrophobicContact SD-CG 4.43Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-OD1 3.43Å; L117-Y145 HydrophobicContact CD2-CD1 4.47Å; L117-Y145 HydrophobicContact CD2-CG 4.03Å
118	D	95.5	Very high	95.1	Very high	45 Å²	45	30 Å²	30	24%	0.241	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-2.9	173.2	55.7	-1.9	0	0	0	113.3	S97 G116 I120	S97-D118 WeakPolarHBondContact CB-OD2 3.49Å; G116-D118 PolarHBondContact N-OD1 3.03Å; G116-D118 VanDerWaalsContact N-OD1 3.17Å; G116-D118 PolarHBondContact O-N 2.67Å; G116-D118 VanDerWaalsContact O-N 3.12Å; D118-I120 WeakPolarHBondContact O-CG1 3.45Å; D118-I120 PolarHBondContact O-N 2.93Å; D118-I120 VanDerWaalsContact O-N 3.09Å
119	N	97.1	Very high	93.9	Very high	51 Å²	51	40 Å²	40	27%	0.273	19%	0.192	S	C	.	.	S	Bend	trans	59.2	15.9	-179.6	-53.4	-5.5	0	0	0	113.6	G116 L117 G144 Y145	G116-N119 PolarHBondContact O-N 3.1Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-OD1 3.43Å; N119-G144 WeakPolarHBondContact CB-O 3.25Å; N119-G144 PolarHBondContact OD1-O 2.83Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.2Å; N119-Y145 PolarHBondContact OD1-N 2.89Å
120	I	97.3	Very high	92.7	Very high	25 Å²	25	44.6 Å²	44.6	13%	0.128	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.8	-176.2	-65.3	168.1	0	0	0	108.8	G115 D118 E138 L139 A140	G115-I120 WeakPolarHBondContact CA-O 3.27Å; D118-I120 WeakPolarHBondContact O-CG1 3.45Å; D118-I120 PolarHBondContact O-N 2.93Å; D118-I120 VanDerWaalsContact O-N 3.09Å; I120-E138 HydrophobicContact CG2-CB 3.83Å; I120-E138 HydrophobicContact CG2-CG 4.28Å; I120-L139 WeakPolarHBondContact CA-O 3.36Å; I120-A140 HydrophobicContact CG1-CB 4.1Å
121	C	98	Very high	91.7	Very high	3 Å²	3	46 Å²	46	2%	0.02	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.1	166.6	-175.4	0	0	0	0	109.1	C114 L139 L146 T159	C114-C121 CarbonylContact O-C 3.56Å; C114-C121 WeakPolarHBondContact O-CA 3.46Å; C121-L139 HydrophobicContact CB-CB 4.13Å; C121-L139 HydrophobicContact CB-CD1 4.34Å; C121-L139 PolarHBondContact N-O 2.73Å; C121-L139 PolarHBondContact O-N 3.13Å; C121-L146 HydrophobicContact CB-CD2 3.65Å; C121-T159 HydrophobicContact CB-CG2 4.14Å
122	S	97.6	Very high	91	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.028	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.4	178.6	-62.2	0	0	0	0	110.5	A113 C114	A113-S122 CarbonylContact C-O 3.59Å; A113-S122 VanDerWaalsContact CA-O 3.24Å; A113-S122 WeakPolarHBondContact CA-O 3.12Å; C114-S122 PolarHBondContact N-O 2.96Å; C114-S122 PolarHBondContact O-N 3.23Å
123	I	97.8	Very high	90.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.1	178	-61	172.7	0	0	0	108.8	Y111 V112 A113 S136 R137 L139 F151 I157 I171	Y111-I123 HydrophobicContact CD1-CG2 3.96Å; Y111-I123 HydrophobicContact CG-CG2 4.14Å; V112-I123 WeakPolarHBondContact O-CA 3.21Å; A113-I123 HydrophobicContact CB-CG1 4.17Å; I123-S136 WeakPolarHBondContact O-CA 3.44Å; I123-S136 WeakPolarHBondContact O-CB 3.18Å; I123-S136 PolarHBondContact O-N 2.99Å; I123-R137 HydrophobicContact CB-CB 4.36Å; I123-R137 PolarHBondContact N-O 2.99Å; I123-R137 PolarHBondContact O-N 2.77Å; I123-L139 HydrophobicContact CD1-CD1 3.85Å; I123-L139 HydrophobicContact CD1-CG 4.36Å; I123-F151 HydrophobicContact CD1-CE1 4.34Å; I123-F151 HydrophobicContact CG1-CZ 4.41Å; I123-F151 HydrophobicContact CG2-CE1 4.47Å; I123-F151 HydrophobicContact CG2-CZ 4.24Å; I123-I157 HydrophobicContact CD1-CG2 4.24Å; I123-I171 HydrophobicContact CD1-CB 4.25Å; I123-I171 HydrophobicContact CD1-CD1 3.89Å; I123-I171 HydrophobicContact CD1-CG1 3.65Å; I123-I171 HydrophobicContact CD1-CG2 3.74Å
124	Y	96.8	Very high	90.1	Very high	9 Å²	9	58.1 Å²	58.1	4%	0.035	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.8	179.7	-60.2	-92	0	0	0	110.5	L79 I93 L95 Y111 V112 V133 V135	L79-Y124 HydrophobicContact CD2-CD2 4.19Å; L79-Y124 HydrophobicContact CD2-CE2 4.33Å; I93-Y124 HydrophobicContact CD1-CG 4.27Å; I93-Y124 HydrophobicContact CG2-CD1 3.72Å; I93-Y124 HydrophobicContact CG2-CE1 3.49Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.49Å; I93-Y124 HydrophobicContact CG2-CE2 4.42Å; I93-Y124 HydrophobicContact CG2-CG 4.25Å; L95-Y124 HydrophobicContact CD2-CE2 4.12Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.47Å; Y111-Y124 VanDerWaalsContact CA-O 3.31Å; Y111-Y124 WeakPolarHBondContact CA-O 3.34Å; V112-Y124 HydrophobicContact CG2-CD2 4.42Å; V112-Y124 PolarHBondContact N-O 3.05Å; V112-Y124 PolarHBondContact O-N 3.3Å; Y124-V133 HydrophobicContact CD1-CG1 4.19Å; Y124-V133 HydrophobicContact CG-CG1 4.41Å; Y124-V135 HydrophobicContact CD1-CB 4.47Å; Y124-V135 HydrophobicContact CD1-CG2 3.98Å; Y124-V135 HydrophobicContact CE1-CB 4.31Å; Y124-V135 HydrophobicContact CE1-CG2 3.39Å
125	N	95	Very high	89.8	Confident	42 Å²	42	61 Å²	61	23%	0.225	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.5	174.4	-168.7	-17.2	0	0	0	110.2	N110 Y111 K127 T128 R134	N110-N125 PolarHBondContact O-OD1 3.44Å; Y111-N125 HydrophobicContact CD1-CB 4.03Å; Y111-N125 HydrophobicContact CE1-CB 3.78Å; N125-K127 WeakPolarHBondContact OD1-CA 3.47Å; N125-K127 WeakPolarHBondContact OD1-CB 3.44Å; N125-K127 PolarHBondContact OD1-N 2.85Å; N125-K127 PolarHBondContact OD1-O 2.91Å; N125-T128 WeakPolarHBondContact O-CG2 3.22Å; N125-R134 PolarHBondContact N-O 2.97Å
126	L	93.2	Very high	89.6	Confident	21 Å²	21	63.5 Å²	63.5	11%	0.11	32%	0.32	C	S	.	.	S	Bend	trans	-84.3	-21.6	177.9	-57.9	-177.2	0	0	0	112.8	I81 I93 Y105 N110 V112 T128 V133	I81-L126 HydrophobicContact CD1-CD1 3.43Å; I81-L126 VanDerWaalsContact CD1-CD1 3.43Å; I81-L126 HydrophobicContact CD1-CD2 3.38Å; I81-L126 HydrophobicContact CD1-CG 4.04Å; I93-L126 HydrophobicContact CD1-CD2 4.34Å; Y105-L126 HydrophobicContact CE1-CD1 4.29Å; Y105-L126 HydrophobicContact CE2-CD1 4.42Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.43Å; N110-L126 WeakPolarHBondContact O-CB 3.15Å; N110-L126 PolarHBondContact O-N 3.48Å; V112-L126 HydrophobicContact CG1-CD1 3.97Å; V112-L126 HydrophobicContact CG2-CD2 3.96Å; V112-L126 HydrophobicContact CG2-CG 4.44Å; L126-T128 VanDerWaalsContact C-N 3.35Å; L126-T128 PolarHBondContact O-N 3.18Å; L126-T128 VanDerWaalsContact O-N 3.09Å; L126-V133 HydrophobicContact CD2-CG1 4.33Å; L126-V133 HydrophobicContact CD2-CG2 4.35Å
127	K	85.4	Confident	89.5	Confident	145 Å²	145	68.2 Å²	68.2	63%	0.63	34%	0.337	S	S	*	.			trans	-81.9	81.8	171.3	-75.9	-178.9	168.8	160.4	0	109.5	N110 N125	N110-K127 VanDerWaalsContact OD1-CD 3.25Å; N110-K127 WeakPolarHBondContact OD1-CD 3.23Å; N110-K127 WeakPolarHBondContact OD1-CE 3.26Å; N110-K127 PolarHBondContact OD1-NZ 3.1Å; N125-K127 WeakPolarHBondContact OD1-CA 3.47Å; N125-K127 WeakPolarHBondContact OD1-CB 3.44Å; N125-K127 PolarHBondContact OD1-N 2.85Å; N125-K127 PolarHBondContact OD1-O 2.91Å
128	T	72	Confident	89.5	Confident	40 Å²	40	68.2 Å²	68.2	25%	0.245	34%	0.335	C	S	.	.			trans	-106.8	123.3	173.7	72.5	0	0	0	0	110.9	N125 L126 E130 G131 N132	N125-T128 WeakPolarHBondContact O-CG2 3.22Å; L126-T128 VanDerWaalsContact C-N 3.35Å; L126-T128 PolarHBondContact O-N 3.18Å; L126-T128 VanDerWaalsContact O-N 3.09Å; T128-E130 PolarHBondContact O-N 3.34Å; T128-G131 PolarHBondContact O-N 3.33Å; T128-G131 PolarHBondContact OG1-N 3.28Å; T128-N132 WeakPolarHBondContact CB-O 3.24Å; T128-N132 WeakPolarHBondContact CG2-O 3.36Å; T128-N132 PolarHBondContact OG1-N 2.95Å; T128-N132 PolarHBondContact OG1-O 2.81Å
129	R	71.2	Confident	89.7	Confident	262 Å²	262	66.1 Å²	66.1	99%	0.989	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.2	173.8	-65.2	-177.1	179.9	-177.9	0.3	112
130	E	70.7	Confident	89.6	Confident	126 Å²	126	67.1 Å²	67.1	59%	0.589	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-2.2	-174.6	-59.1	-179.5	175.2	0	0	113.5	T128 N132 R134	T128-E130 PolarHBondContact O-N 3.34Å; E130-N132 PolarHBondContact O-N 3.05Å; E130-N132 VanDerWaalsContact O-N 3.15Å; E130-R134 IonicContact OE1-NH2 2.73Å; E130-R134 IonicContact OE2-CZ 2.62Å; E130-R134 IonicContact OE2-NE 3.86Å; E130-R134 PolarHBondContact OE2-NE 3.15Å; E130-R134 IonicContact OE2-NH1 3.3Å; E130-R134 IonicContact OE2-NH2 3.96Å; E130-R134 PolarHBondContact OE2-NH2 3.34Å
131	G	75.2	Confident	89.5	Confident	57 Å²	57	68 Å²	68	59%	0.588	35%	0.354	S	S	*	.	S	Bend	trans	78.8	-19.1	179.6	0	0	0	0	0	115.7	T128	T128-G131 PolarHBondContact O-N 3.33Å; T128-G131 PolarHBondContact OG1-N 3.28Å
132	N	83.3	Confident	89.5	Confident	115 Å²	115	68.6 Å²	68.6	62%	0.615	36%	0.357	S	S	*	.	S	Bend	trans	-94.2	130.4	174.9	-70.1	-31.4	0	0	0	110.9	T128 E130	T128-N132 WeakPolarHBondContact CB-O 3.24Å; T128-N132 WeakPolarHBondContact CG2-O 3.36Å; T128-N132 PolarHBondContact OG1-N 2.95Å; T128-N132 PolarHBondContact OG1-O 2.81Å; E130-N132 PolarHBondContact O-N 3.05Å; E130-N132 VanDerWaalsContact O-N 3.15Å
133	V	89.3	Confident	89.5	Confident	35 Å²	35	74.3 Å²	74.3	21%	0.212	39%	0.392	C	S	.	.			trans	-71.6	130.4	174.3	-179.2	0	0	0	0	109.3	H91 I93 Y124 L126	H91-V133 HydrophobicContact CB-CG2 4.44Å; I93-V133 HydrophobicContact CD1-CB 4.35Å; I93-V133 HydrophobicContact CD1-CG1 3.63Å; I93-V133 HydrophobicContact CG1-CB 4.01Å; I93-V133 HydrophobicContact CG1-CG1 3.78Å; I93-V133 HydrophobicContact CG1-CG2 4.28Å; Y124-V133 HydrophobicContact CD1-CG1 4.19Å; Y124-V133 HydrophobicContact CG-CG1 4.41Å; L126-V133 HydrophobicContact CD2-CG1 4.33Å; L126-V133 HydrophobicContact CD2-CG2 4.35Å
134	R	88	Confident	89.4	Confident	150 Å²	150	75 Å²	75	57%	0.566	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	152.8	179	-65.7	-174.1	-179.2	-161.4	1.3	110.7	N125 E130 S136	N125-R134 PolarHBondContact N-O 2.97Å; E130-R134 IonicContact OE1-NH2 2.73Å; E130-R134 IonicContact OE2-CZ 2.62Å; E130-R134 IonicContact OE2-NE 3.86Å; E130-R134 PolarHBondContact OE2-NE 3.15Å; E130-R134 IonicContact OE2-NH1 3.3Å; E130-R134 IonicContact OE2-NH2 3.96Å; E130-R134 PolarHBondContact OE2-NH2 3.34Å; R134-S136 PolarHBondContact O-N 2.89Å
135	V	92.3	Very high	89.5	Confident	65 Å²	65	76.9 Å²	76.9	39%	0.394	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	120.3	167.9	-175.2	0	0	0	0	107.4	Y124 E138	Y124-V135 HydrophobicContact CD1-CB 4.47Å; Y124-V135 HydrophobicContact CD1-CG2 3.98Å; Y124-V135 HydrophobicContact CE1-CB 4.31Å; Y124-V135 HydrophobicContact CE1-CG2 3.39Å; V135-E138 HydrophobicContact CG1-CG 3.7Å
136	S	92.8	Very high	89.6	Confident	55 Å²	55	75 Å²	75	39%	0.385	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-45.6	174.7	-162.2	0	0	0	0	110.1	I123 R134	I123-S136 WeakPolarHBondContact O-CA 3.44Å; I123-S136 WeakPolarHBondContact O-CB 3.18Å; I123-S136 PolarHBondContact O-N 2.99Å; R134-S136 PolarHBondContact O-N 2.89Å
137	R	95.5	Very high	89.9	Confident	98 Å²	98	74.5 Å²	74.5	37%	0.37	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	146.4	-176.3	-87	-75.4	-171.7	-162.6	0	111.1	I123 I171 E172 T173	I123-R137 HydrophobicContact CB-CB 4.36Å; I123-R137 PolarHBondContact N-O 2.99Å; I123-R137 PolarHBondContact O-N 2.77Å; R137-I171 WeakPolarHBondContact CD-O 3.41Å; R137-I171 HydrophobicContact CG-CG2 4.42Å; R137-I171 VanDerWaalsContact CG-O 3.28Å; R137-I171 WeakPolarHBondContact CG-O 3.31Å; R137-I171 PolarHBondContact NE-O 2.95Å; R137-E172 VanDerWaalsContact CZ-O 3.28Å; R137-E172 PolarHBondContact NE-O 3.18Å; R137-E172 PolarHBondContact NH2-O 3.26Å; R137-T173 PolarHBondContact NH2-O 2.74Å
138	E	96.6	Very high	90.5	Very high	84 Å²	84	68 Å²	68	39%	0.393	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.1	167.7	-66	-170.6	164.5	0	0	108	R96 I120 V135	R96-E138 IonicContact NH1-OE1 3.08Å; R96-E138 IonicContact NH1-OE2 3.97Å; I120-E138 HydrophobicContact CG2-CB 3.83Å; I120-E138 HydrophobicContact CG2-CG 4.28Å; V135-E138 HydrophobicContact CG1-CG 3.7Å
139	L	97.8	Very high	91.8	Very high	2 Å²	2	66.1 Å²	66.1	1%	0.01	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	104.4	-179.8	-52	177.8	0	0	0	108.4	I120 C121 I123 I157 W169	I120-L139 WeakPolarHBondContact CA-O 3.36Å; C121-L139 HydrophobicContact CB-CB 4.13Å; C121-L139 HydrophobicContact CB-CD1 4.34Å; C121-L139 PolarHBondContact N-O 2.73Å; C121-L139 PolarHBondContact O-N 3.13Å; I123-L139 HydrophobicContact CD1-CD1 3.85Å; I123-L139 HydrophobicContact CD1-CG 4.36Å; L139-I157 HydrophobicContact CD1-CG2 3.55Å; L139-W169 HydrophobicContact CB-CD2 4.06Å; L139-W169 HydrophobicContact CB-CE3 3.89Å; L139-W169 HydrophobicContact CB-CH2 4.27Å; L139-W169 HydrophobicContact CB-CZ2 4.46Å; L139-W169 HydrophobicContact CB-CZ3 3.99Å; L139-W169 HydrophobicContact CD1-CB 3.79Å; L139-W169 HydrophobicContact CD1-CD2 4.02Å; L139-W169 HydrophobicContact CD1-CE3 4.35Å; L139-W169 HydrophobicContact CD1-CG 3.78Å; L139-W169 HydrophobicContact CD2-CE3 4.08Å; L139-W169 HydrophobicContact CG-CD2 4.45Å; L139-W169 HydrophobicContact CG-CE3 4.33Å
140	A	95.7	Very high	93.1	Very high	72 Å²	72	56.5 Å²	56.5	60%	0.595	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	121	-179.5	0	0	0	0	0	109.6	I120	I120-A140 HydrophobicContact CG1-CB 4.1Å
141	G	94.8	Very high	94.4	Very high	43 Å²	43	51.1 Å²	51.1	44%	0.443	29%	0.294	S	S	.	.			trans	177.4	-6.6	178	0	0	0	0	0	115.3
142	H	97.7	Very high	95.6	Very high	16 Å²	16	49.4 Å²	49.4	7%	0.074	27%	0.271	C	S	.	.			trans	-77.8	146.3	164.6	-76.9	-59.5	0	0	0	111.1	T159 S161 D163 T165	H142-T159 PolarHBondContact NE2-OG1 2.92Å; H142-S161 VanDerWaalsContact CE1-CB 3.43Å; H142-S161 WeakPolarHBondContact CE1-CB 3.47Å; H142-S161 VanDerWaalsContact CG-CB 3.47Å; H142-S161 WeakPolarHBondContact ND1-CB 3.32Å; H142-S161 PolarHBondContact ND1-OG 2.58Å; H142-D163 WeakPolarHBondContact CA-OD2 3.07Å; H142-D163 VanDerWaalsContact CB-OD2 3.24Å; H142-D163 WeakPolarHBondContact CB-OD2 3.19Å; H142-D163 IonicContact CG-OD2 3.83Å; H142-D163 IonicContact ND1-OD1 3.63Å; H142-D163 PolarHBondContact ND1-OD1 3.25Å; H142-D163 IonicContact ND1-OD2 3.31Å; H142-D163 PolarHBondContact ND1-OD2 2.96Å; H142-T165 PolarHBondContact CE1-OG1 3.16Å; H142-T165 PolarHBondContact ND1-OG1 3.45Å
143	T	97.9	Very high	96.3	Very high	123 Å²	123	47 Å²	47	76%	0.755	26%	0.258	S	S	*	.	S	Bend	trans	-101.1	-8.4	175.9	57.8	0	0	0	0	112.6	D163	T143-D163 PolarHBondContact N-OD2 2.99Å; T143-D163 VanDerWaalsContact OG1-CB 3.24Å; T143-D163 WeakPolarHBondContact OG1-CB 3.49Å
144	G	97.2	Very high	96.7	Very high	14 Å²	14	47.1 Å²	47.1	14%	0.144	26%	0.258	C	S	.	.	S	Bend	trans	-118.8	179.8	171.8	0	0	0	0	0	111.5	N119 S161	N119-G144 WeakPolarHBondContact CB-O 3.25Å; N119-G144 PolarHBondContact OD1-O 2.83Å; G144-S161 PolarHBondContact O-OG 3.42Å
145	Y	97.5	Very high	97.1	Very high	50 Å²	50	44.1 Å²	44.1	20%	0.196	25%	0.253	C	S	.	.			trans	-68	147.5	-178.8	60.4	-92.5	0	0	0	112.1	M101 L117 N119 S147 S161 G162 D186	M101-Y145 HydrophobicContact CE-CD2 3.68Å; M101-Y145 HydrophobicContact CE-CE2 3.69Å; M101-Y145 HydrophobicContact SD-CD2 3.61Å; M101-Y145 HydrophobicContact SD-CE2 4.26Å; M101-Y145 HydrophobicContact SD-CG 4.22Å; L117-Y145 HydrophobicContact CD2-CD1 4.47Å; L117-Y145 HydrophobicContact CD2-CG 4.03Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.2Å; N119-Y145 PolarHBondContact OD1-N 2.89Å; Y145-S147 PolarHBondContact O-N 3.3Å; Y145-S161 CarbonylContact O-C 3.55Å; Y145-S161 VanDerWaalsContact O-CA 3.23Å; Y145-S161 WeakPolarHBondContact O-CA 3.41Å; Y145-S161 PolarHBondContact O-OG 3.29Å; Y145-G162 PolarHBondContact O-N 3.32Å; Y145-D186 WeakPolarHBondContact CE1-OD2 3.35Å; Y145-D186 VanDerWaalsContact OH-CB 3.3Å; Y145-D186 WeakPolarHBondContact OH-CB 3.17Å; Y145-D186 VanDerWaalsContact OH-CG 3.3Å; Y145-D186 PolarHBondContact OH-OD2 3.19Å
146	L	98.4	Very high	97.4	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.3	175.5	-167.1	71.7	0	0	0	110.6	M101 T102 G116 C121 T159 S160	M101-L146 WeakPolarHBondContact CB-O 3.22Å; T102-L146 HydrophobicContact CG2-CD2 3.61Å; T102-L146 HydrophobicContact CG2-CG 3.92Å; G116-L146 WeakPolarHBondContact CA-O 3.47Å; G116-L146 PolarHBondContact O-N 2.7Å; C121-L146 HydrophobicContact CB-CD2 3.65Å; L146-T159 HydrophobicContact CD1-CG2 3.97Å; L146-S160 WeakPolarHBondContact CD1-O 3.37Å
147	S	98.4	Very high	97.7	Very high	11 Å²	11	41.1 Å²	41.1	8%	0.077	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-38.7	-175.3	59.9	0	0	0	0	113.6	Y145 S160 V187 M188	Y145-S147 PolarHBondContact O-N 3.3Å; S147-S160 PolarHBondContact N-O 3.03Å; S147-S160 PolarHBondContact OG-O 3.19Å; S147-S160 VanDerWaalsContact OG-O 3.09Å; S147-S160 PolarHBondContact OG-OG 2.95Å; S147-V187 WeakPolarHBondContact CB-O 3.17Å; S147-V187 PolarHBondContact OG-O 2.9Å; S147-M188 WeakPolarHBondContact CB-O 3.25Å
148	C	98.7	Very high	97.9	Very high	10 Å²	10	36.5 Å²	36.5	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	154.9	178.8	-166.1	0	0	0	0	111	T102 T159 S160 L190	T102-C148 WeakPolarHBondContact OG1-CA 3.22Å; C148-T159 WeakPolarHBondContact O-CA 3.47Å; C148-S160 WeakPolarHBondContact CB-OG 3.28Å; C148-S160 PolarHBondContact N-OG 3.45Å; C148-S160 VanDerWaalsContact N-OG 3.17Å; C148-S160 PolarHBondContact O-N 3.04Å; C148-L190 HydrophobicContact CB-CD2 4.44Å; C148-L190 HydrophobicContact CB-CG 4.19Å
149	C	98.7	Very high	98	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	146	170.3	65.4	0	0	0	0	111.1	T102 A104 I157 V158 T159	T102-C149 HydrophobicContact CG2-CB 4.2Å; T102-C149 PolarHBondContact OG1-N 3.41Å; T102-C149 PolarHBondContact OG1-SG 2.8Å; A104-C149 WeakPolarHBondContact CB-O 3.27Å; C149-I157 HydrophobicContact CB-CD1 4.04Å; C149-I157 HydrophobicContact CB-CG1 4.44Å; C149-V158 CarbonylContact C-O 3.54Å; C149-V158 WeakPolarHBondContact CA-O 3.09Å; C149-T159 HydrophobicContact CB-CG2 4.02Å
150	R	98.8	Very high	98.1	Very high	59 Å²	59	32.4 Å²	32.4	22%	0.223	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	133.2	176.1	-66.5	-65.7	177.5	-104.6	6	111	C103 I157 V158 L190 L192	C103-R150 PolarHBondContact O-NH1 3.17Å; R150-I157 WeakPolarHBondContact O-CG1 3.21Å; R150-V158 PolarHBondContact N-O 3Å; R150-V158 PolarHBondContact O-N 3.4Å; R150-L190 HydrophobicContact CB-CD1 3.79Å; R150-L190 HydrophobicContact CG-CD1 3.53Å; R150-L192 HydrophobicContact CB-CD1 3.68Å; R150-L192 HydrophobicContact CB-CG 3.89Å
151	F	98.8	Very high	98.2	Very high	14 Å²	14	29 Å²	29	6%	0.061	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	134.2	173.3	-72.1	-84.2	0	0	0	110.3	A104 A106 A113 I123 D153 I157 I171 L192	A104-F151 HydrophobicContact CB-CD2 3.86Å; A104-F151 HydrophobicContact CB-CE2 4.04Å; A106-F151 HydrophobicContact CB-CB 4.39Å; A106-F151 HydrophobicContact CB-CD1 4.09Å; A106-F151 HydrophobicContact CB-CD2 3.77Å; A106-F151 HydrophobicContact CB-CE1 4.25Å; A106-F151 HydrophobicContact CB-CE2 3.96Å; A106-F151 HydrophobicContact CB-CG 3.83Å; A106-F151 HydrophobicContact CB-CZ 4.18Å; A113-F151 HydrophobicContact CB-CE2 3.52Å; A113-F151 HydrophobicContact CB-CZ 3.57Å; I123-F151 HydrophobicContact CD1-CE1 4.34Å; I123-F151 HydrophobicContact CG1-CZ 4.41Å; I123-F151 HydrophobicContact CG2-CE1 4.47Å; I123-F151 HydrophobicContact CG2-CZ 4.24Å; F151-D153 WeakPolarHBondContact CD1-O 3.46Å; F151-I157 HydrophobicContact CD1-CB 4.11Å; F151-I157 HydrophobicContact CD1-CD1 4.21Å; F151-I157 HydrophobicContact CD1-CG1 4.26Å; F151-I157 HydrophobicContact CD2-CD1 4.33Å; F151-I157 HydrophobicContact CE1-CB 4.39Å; F151-I157 HydrophobicContact CE1-CD1 4.04Å; F151-I157 HydrophobicContact CE2-CD1 4.15Å; F151-I157 HydrophobicContact CG-CD1 4.37Å; F151-I157 HydrophobicContact CG-CG1 4.4Å; F151-I157 HydrophobicContact CZ-CD1 4.01Å; F151-I171 HydrophobicContact CD1-CD1 3.81Å; F151-I171 HydrophobicContact CE1-CD1 3.58Å; F151-L192 WeakPolarHBondContact O-CD1 3.31Å
152	L	98.5	Very high	98.4	Very high	20 Å²	20	27.6 Å²	27.6	11%	0.105	15%	0.149	C	C	.	.	S	Bend	trans	-79.9	-46	162.2	-64.1	173.1	0	0	0	109	Q156 V158 L168 L192 V213	L152-Q156 HydrophobicContact CB-CB 4.18Å; L152-Q156 HydrophobicContact CD1-CB 4.08Å; L152-Q156 PolarHBondContact N-O 3.38Å; L152-V158 HydrophobicContact CD1-CG2 4.09Å; L152-V158 HydrophobicContact CD2-CG2 4.27Å; L152-V158 HydrophobicContact CG-CG2 4.06Å; L152-L168 HydrophobicContact CD1-CD1 3.53Å; L152-L192 HydrophobicContact CD2-CD1 3.78Å; L152-L192 HydrophobicContact CD2-CD2 3.57Å; L152-L192 HydrophobicContact CD2-CG 4.27Å; L152-V213 HydrophobicContact CD1-CG1 3.79Å
153	D	98.3	Very high	98.4	Very high	65 Å²	65	28.1 Å²	28.1	35%	0.348	15%	0.153	S	C	.	.	S	Bend	trans	-153.9	-163.2	176.3	63	24.1	0	0	0	110.1	F151 N155 Q156	F151-D153 WeakPolarHBondContact CD1-O 3.46Å; D153-N155 VanDerWaalsContact C-N 3.25Å; D153-N155 PolarHBondContact O-N 2.89Å; D153-N155 WeakPolarHBondContact OD1-CA 3.34Å; D153-N155 PolarHBondContact OD1-N 3.26Å; D153-Q156 PolarHBondContact N-O 3.07Å; D153-Q156 PolarHBondContact OD1-N 3.37Å
154	D	97.6	Very high	98.5	Very high	38 Å²	38	24.7 Å²	24.7	20%	0.203	13%	0.132	C	C	.	.	S	Bend	trans	-74.4	-11.4	178.8	-85.2	1.1	0	0	0	114.3	S108 N110 Y111 I171	S108-D154 VanDerWaalsContact CB-CG 3.46Å; S108-D154 WeakPolarHBondContact CB-OD1 3.34Å; S108-D154 WeakPolarHBondContact CB-OD2 3.48Å; S108-D154 PolarHBondContact OG-OD1 3.43Å; S108-D154 PolarHBondContact OG-OD2 2.95Å; N110-D154 PolarHBondContact ND2-OD2 3.27Å; Y111-D154 HydrophobicContact CD2-CB 4.16Å; Y111-D154 HydrophobicContact CE2-CB 3.93Å; D154-I171 WeakPolarHBondContact O-CD1 3.49Å
155	N	98.2	Very high	98.5	Very high	87 Å²	87	25.1 Å²	25.1	47%	0.465	13%	0.132	S	C	.	.	S	Bend	trans	-112.5	-16.2	-177	-61.6	-43.2	0	0	0	112.9	D153 I171	D153-N155 VanDerWaalsContact C-N 3.25Å; D153-N155 PolarHBondContact O-N 2.89Å; D153-N155 WeakPolarHBondContact OD1-CA 3.34Å; D153-N155 PolarHBondContact OD1-N 3.26Å; N155-I171 WeakPolarHBondContact O-CB 3.32Å; N155-I171 WeakPolarHBondContact O-CG1 3.43Å; N155-I171 PolarHBondContact O-N 3.05Å
156	Q	98.6	Very high	98.6	Very high	57 Å²	57	22.8 Å²	22.8	27%	0.266	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.4	-176.3	-66.4	-173.6	-21.6	0	0	113.2	L152 D153 L168 W169	L152-Q156 HydrophobicContact CB-CB 4.18Å; L152-Q156 HydrophobicContact CD1-CB 4.08Å; L152-Q156 PolarHBondContact N-O 3.38Å; D153-Q156 PolarHBondContact N-O 3.07Å; D153-Q156 PolarHBondContact OD1-N 3.37Å; Q156-L168 HydrophobicContact CB-CD1 4.17Å; Q156-W169 VanDerWaalsContact CA-O 3.3Å; Q156-W169 WeakPolarHBondContact CA-O 3.24Å
157	I	98.9	Very high	98.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.7	176.1	-169.1	172.3	0	0	0	110.4	A113 I123 L139 C149 R150 F151 W169 I171	A113-I157 HydrophobicContact CB-CD1 3.55Å; I123-I157 HydrophobicContact CD1-CG2 4.24Å; L139-I157 HydrophobicContact CD1-CG2 3.55Å; C149-I157 HydrophobicContact CB-CD1 4.04Å; C149-I157 HydrophobicContact CB-CG1 4.44Å; R150-I157 WeakPolarHBondContact O-CG1 3.21Å; F151-I157 HydrophobicContact CD1-CB 4.11Å; F151-I157 HydrophobicContact CD1-CD1 4.21Å; F151-I157 HydrophobicContact CD1-CG1 4.26Å; F151-I157 HydrophobicContact CD2-CD1 4.33Å; F151-I157 HydrophobicContact CE1-CB 4.39Å; F151-I157 HydrophobicContact CE1-CD1 4.04Å; F151-I157 HydrophobicContact CE2-CD1 4.15Å; F151-I157 HydrophobicContact CG-CD1 4.37Å; F151-I157 HydrophobicContact CG-CG1 4.4Å; F151-I157 HydrophobicContact CZ-CD1 4.01Å; I157-W169 HydrophobicContact CG2-CB 3.85Å; I157-W169 HydrophobicContact CG2-CG 4.34Å; I157-W169 PolarHBondContact N-O 2.89Å; I157-W169 PolarHBondContact O-N 3.07Å; I157-I171 HydrophobicContact CB-CD1 4.26Å; I157-I171 HydrophobicContact CB-CG1 4.46Å; I157-I171 HydrophobicContact CG2-CD1 4.35Å; I157-I171 HydrophobicContact CG2-CG1 4.04Å
158	V	98.9	Very high	98.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.2	171.5	-175.1	0	0	0	0	109.1	C149 R150 L152 A167 L168 L190 L192 F199	C149-V158 CarbonylContact C-O 3.54Å; C149-V158 WeakPolarHBondContact CA-O 3.09Å; R150-V158 PolarHBondContact N-O 3Å; R150-V158 PolarHBondContact O-N 3.4Å; L152-V158 HydrophobicContact CD1-CG2 4.09Å; L152-V158 HydrophobicContact CD2-CG2 4.27Å; L152-V158 HydrophobicContact CG-CG2 4.06Å; V158-A167 CarbonylContact C-O 3.58Å; V158-A167 VanDerWaalsContact CA-O 3.29Å; V158-A167 WeakPolarHBondContact CA-O 3.41Å; V158-L168 HydrophobicContact CG2-CD1 3.93Å; V158-L190 HydrophobicContact CG1-CD1 4.46Å; V158-L190 HydrophobicContact CG1-CD2 3.87Å; V158-L192 HydrophobicContact CG2-CD2 4.17Å; V158-F199 HydrophobicContact CG1-CE1 4.42Å; V158-F199 HydrophobicContact CG1-CE2 4.32Å; V158-F199 HydrophobicContact CG1-CZ 4.27Å
159	T	98.9	Very high	98.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149	177.8	59.3	0	0	0	0	111.3	C121 H142 L146 C148 C149 C166 A167 W169	C121-T159 HydrophobicContact CB-CG2 4.14Å; H142-T159 PolarHBondContact NE2-OG1 2.92Å; L146-T159 HydrophobicContact CD1-CG2 3.97Å; C148-T159 WeakPolarHBondContact O-CA 3.47Å; C149-T159 HydrophobicContact CB-CG2 4.02Å; T159-C166 CarbonylContact O-C 3.55Å; T159-C166 WeakPolarHBondContact O-CA 3.43Å; T159-C166 VanDerWaalsContact O-CB 3.23Å; T159-C166 WeakPolarHBondContact O-CB 3.42Å; T159-A167 PolarHBondContact N-O 2.93Å; T159-A167 PolarHBondContact O-N 2.66Å; T159-A167 PolarHBondContact OG1-O 2.92Å; T159-W169 PolarHBondContact OG1-NE1 3.05Å
160	S	98.8	Very high	98.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	150.5	168	59	0	0	0	0	111.1	L146 S147 C148	L146-S160 WeakPolarHBondContact CD1-O 3.37Å; S147-S160 PolarHBondContact N-O 3.03Å; S147-S160 PolarHBondContact OG-O 3.19Å; S147-S160 VanDerWaalsContact OG-O 3.09Å; S147-S160 PolarHBondContact OG-OG 2.95Å; C148-S160 WeakPolarHBondContact CB-OG 3.28Å; C148-S160 PolarHBondContact N-OG 3.45Å; C148-S160 VanDerWaalsContact N-OG 3.17Å; C148-S160 PolarHBondContact O-N 3.04Å
161	S	98.7	Very high	98.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	156.8	-171.5	174.4	0	0	0	0	113.6	H142 G144 Y145 D163 T164 T165 V187	H142-S161 VanDerWaalsContact CE1-CB 3.43Å; H142-S161 WeakPolarHBondContact CE1-CB 3.47Å; H142-S161 VanDerWaalsContact CG-CB 3.47Å; H142-S161 WeakPolarHBondContact ND1-CB 3.32Å; H142-S161 PolarHBondContact ND1-OG 2.58Å; G144-S161 PolarHBondContact O-OG 3.42Å; Y145-S161 CarbonylContact O-C 3.55Å; Y145-S161 VanDerWaalsContact O-CA 3.23Å; Y145-S161 WeakPolarHBondContact O-CA 3.41Å; Y145-S161 PolarHBondContact O-OG 3.29Å; S161-D163 WeakPolarHBondContact CB-OD1 3.04Å; S161-D163 PolarHBondContact O-N 3.07Å; S161-D163 PolarHBondContact OG-N 2.87Å; S161-D163 VanDerWaalsContact OG-N 3.13Å; S161-D163 PolarHBondContact OG-OD1 2.91Å; S161-D163 VanDerWaalsContact OG-OD1 3.11Å; S161-D163 PolarHBondContact OG-OD2 3.02Å; S161-T164 PolarHBondContact O-N 3.5Å; S161-T165 PolarHBondContact N-O 3.43Å; S161-V187 PolarHBondContact O-N 2.81Å; S161-V187 VanDerWaalsContact O-N 3.13Å
162	G	98.6	Very high	98.5	Very high	14 Å²	14	27.5 Å²	27.5	14%	0.144	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	3.1	167.7	0	0	0	0	0	114.3	Y145 T164	Y145-G162 PolarHBondContact O-N 3.32Å; G162-T164 VanDerWaalsContact C-N 3.26Å
163	D	98.5	Very high	98.4	Very high	27 Å²	27	30 Å²	30	14%	0.144	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	17.9	169.6	59.9	27.6	0	0	0	113.7	H142 T143 S161 T165	H142-D163 WeakPolarHBondContact CA-OD2 3.07Å; H142-D163 VanDerWaalsContact CB-OD2 3.24Å; H142-D163 WeakPolarHBondContact CB-OD2 3.19Å; H142-D163 IonicContact CG-OD2 3.83Å; H142-D163 IonicContact ND1-OD1 3.63Å; H142-D163 PolarHBondContact ND1-OD1 3.25Å; H142-D163 IonicContact ND1-OD2 3.31Å; H142-D163 PolarHBondContact ND1-OD2 2.96Å; T143-D163 PolarHBondContact N-OD2 2.99Å; T143-D163 VanDerWaalsContact OG1-CB 3.24Å; T143-D163 WeakPolarHBondContact OG1-CB 3.49Å; S161-D163 WeakPolarHBondContact CB-OD1 3.04Å; S161-D163 PolarHBondContact O-N 3.07Å; S161-D163 PolarHBondContact OG-N 2.87Å; S161-D163 VanDerWaalsContact OG-N 3.13Å; S161-D163 PolarHBondContact OG-OD1 2.91Å; S161-D163 VanDerWaalsContact OG-OD1 3.11Å; S161-D163 PolarHBondContact OG-OD2 3.02Å; D163-T165 PolarHBondContact O-N 3.24Å; D163-T165 WeakPolarHBondContact OD1-CB 3.45Å; D163-T165 PolarHBondContact OD1-N 3.31Å; D163-T165 VanDerWaalsContact OD1-N 3.08Å; D163-T165 PolarHBondContact OD1-OG1 3.39Å
164	T	98.6	Very high	98.4	Very high	51 Å²	51	27.7 Å²	27.7	31%	0.313	15%	0.154	S	C	.	.	S	Bend	trans	69.9	7.6	-177.9	77.3	0	0	0	0	115.5	S161 G162	S161-T164 PolarHBondContact O-N 3.5Å; G162-T164 VanDerWaalsContact C-N 3.26Å
165	T	98.6	Very high	98.4	Very high	24 Å²	24	32.4 Å²	32.4	15%	0.147	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	156	-177.7	75	0	0	0	0	113.6	H142 S161 D163 T181	H142-T165 PolarHBondContact CE1-OG1 3.16Å; H142-T165 PolarHBondContact ND1-OG1 3.45Å; S161-T165 PolarHBondContact N-O 3.43Å; D163-T165 PolarHBondContact O-N 3.24Å; D163-T165 WeakPolarHBondContact OD1-CB 3.45Å; D163-T165 PolarHBondContact OD1-N 3.31Å; D163-T165 VanDerWaalsContact OD1-N 3.08Å; D163-T165 PolarHBondContact OD1-OG1 3.39Å; T165-T181 HydrophobicContact CG2-CG2 4.01Å
166	C	98.9	Very high	98.3	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	160.5	154.8	-60	0	0	0	0	109.5	T159 F180 F199	T159-C166 CarbonylContact O-C 3.55Å; T159-C166 WeakPolarHBondContact O-CA 3.43Å; T159-C166 VanDerWaalsContact O-CB 3.23Å; T159-C166 WeakPolarHBondContact O-CB 3.42Å; C166-F180 HydrophobicContact CB-CB 4Å; C166-F180 HydrophobicContact CB-CD2 3.89Å; C166-F180 HydrophobicContact CB-CG 4.39Å; C166-F180 PolarHBondContact N-O 2.85Å; C166-F180 VanDerWaalsContact N-O 3.11Å; C166-F180 PolarHBondContact O-N 2.89Å; C166-F199 HydrophobicContact CB-CE2 4.22Å; C166-F199 HydrophobicContact CB-CZ 4.21Å
167	A	98.8	Very high	98.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	144.7	176	0	0	0	0	0	111.6	V158 T159 W169 Q176 T178	V158-A167 CarbonylContact C-O 3.58Å; V158-A167 VanDerWaalsContact CA-O 3.29Å; V158-A167 WeakPolarHBondContact CA-O 3.41Å; T159-A167 PolarHBondContact N-O 2.93Å; T159-A167 PolarHBondContact O-N 2.66Å; T159-A167 PolarHBondContact OG1-O 2.92Å; A167-W169 HydrophobicContact CB-CZ2 4.37Å; A167-Q176 HydrophobicContact CB-CG 4.5Å; A167-T178 WeakPolarHBondContact CA-O 3.44Å
168	L	98.9	Very high	98.3	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.031	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.2	166	174.9	66	0	0	0	108.3	L152 Q156 V158 Q176 T177 T178 F180 V213	L152-L168 HydrophobicContact CD1-CD1 3.53Å; Q156-L168 HydrophobicContact CB-CD1 4.17Å; V158-L168 HydrophobicContact CG2-CD1 3.93Å; L168-Q176 CarbonylContact O-C 3.53Å; L168-T177 HydrophobicContact CD2-CG2 4.34Å; L168-T177 PolarHBondContact O-N 2.81Å; L168-T178 PolarHBondContact N-O 2.86Å; L168-T178 PolarHBondContact O-N 2.87Å; L168-F180 HydrophobicContact CB-CE2 3.93Å; L168-F180 HydrophobicContact CB-CZ 4.27Å; L168-V213 HydrophobicContact CD1-CG1 4.48Å; L168-V213 HydrophobicContact CD2-CG1 3.93Å
169	W	98.8	Very high	98.3	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	142.4	-178.3	-58.9	82.8	0	0	0	111.3	L139 Q156 I157 T159 A167 Q176	L139-W169 HydrophobicContact CB-CD2 4.06Å; L139-W169 HydrophobicContact CB-CE3 3.89Å; L139-W169 HydrophobicContact CB-CH2 4.27Å; L139-W169 HydrophobicContact CB-CZ2 4.46Å; L139-W169 HydrophobicContact CB-CZ3 3.99Å; L139-W169 HydrophobicContact CD1-CB 3.79Å; L139-W169 HydrophobicContact CD1-CD2 4.02Å; L139-W169 HydrophobicContact CD1-CE3 4.35Å; L139-W169 HydrophobicContact CD1-CG 3.78Å; L139-W169 HydrophobicContact CD2-CE3 4.08Å; L139-W169 HydrophobicContact CG-CD2 4.45Å; L139-W169 HydrophobicContact CG-CE3 4.33Å; Q156-W169 VanDerWaalsContact CA-O 3.3Å; Q156-W169 WeakPolarHBondContact CA-O 3.24Å; I157-W169 HydrophobicContact CG2-CB 3.85Å; I157-W169 HydrophobicContact CG2-CG 4.34Å; I157-W169 PolarHBondContact N-O 2.89Å; I157-W169 PolarHBondContact O-N 3.07Å; T159-W169 PolarHBondContact OG1-NE1 3.05Å; A167-W169 HydrophobicContact CB-CZ2 4.37Å; W169-Q176 HydrophobicContact CD2-CG 3.81Å; W169-Q176 HydrophobicContact CE3-CB 4.36Å; W169-Q176 HydrophobicContact CE3-CG 3.54Å; W169-Q176 HydrophobicContact CH2-CG 3.3Å; W169-Q176 VanDerWaalsContact CH2-NE2 3.26Å; W169-Q176 HydrophobicContact CZ2-CG 3.56Å; W169-Q176 HydrophobicContact CZ3-CB 4.41Å; W169-Q176 HydrophobicContact CZ3-CG 3.3Å
170	D	98.5	Very high	98.3	Very high	40 Å²	40	37.9 Å²	37.9	21%	0.214	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	116.4	161.8	177.8	-86	0	0	0	108.2	E172 T173 G174 Q175 T177	D170-E172 PolarHBondContact OD1-N 3.32Å; D170-T173 WeakPolarHBondContact CB-OG1 3.43Å; D170-T173 VanDerWaalsContact OD1-CB 3.29Å; D170-T173 WeakPolarHBondContact OD1-CB 3.36Å; D170-T173 VanDerWaalsContact OD1-CG2 3.29Å; D170-T173 WeakPolarHBondContact OD1-CG2 3.31Å; D170-T173 PolarHBondContact OD1-N 3.39Å; D170-T173 PolarHBondContact OD1-OG1 3.43Å; D170-G174 VanDerWaalsContact O-CA 3.28Å; D170-G174 WeakPolarHBondContact O-CA 3.3Å; D170-G174 PolarHBondContact O-N 3.35Å; D170-Q175 PolarHBondContact N-O 3.07Å; D170-Q175 PolarHBondContact O-N 3.04Å; D170-T177 PolarHBondContact N-OG1 3.1Å
171	I	98.1	Very high	98.2	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.031	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-40.7	-174.2	-63.5	172.2	0	0	0	110.1	I123 R137 F151 D154 N155 I157 T173 G174	I123-I171 HydrophobicContact CD1-CB 4.25Å; I123-I171 HydrophobicContact CD1-CD1 3.89Å; I123-I171 HydrophobicContact CD1-CG1 3.65Å; I123-I171 HydrophobicContact CD1-CG2 3.74Å; R137-I171 WeakPolarHBondContact CD-O 3.41Å; R137-I171 HydrophobicContact CG-CG2 4.42Å; R137-I171 VanDerWaalsContact CG-O 3.28Å; R137-I171 WeakPolarHBondContact CG-O 3.31Å; R137-I171 PolarHBondContact NE-O 2.95Å; F151-I171 HydrophobicContact CD1-CD1 3.81Å; F151-I171 HydrophobicContact CE1-CD1 3.58Å; D154-I171 WeakPolarHBondContact O-CD1 3.49Å; N155-I171 WeakPolarHBondContact O-CB 3.32Å; N155-I171 WeakPolarHBondContact O-CG1 3.43Å; N155-I171 PolarHBondContact O-N 3.05Å; I157-I171 HydrophobicContact CB-CD1 4.26Å; I157-I171 HydrophobicContact CB-CG1 4.46Å; I157-I171 HydrophobicContact CG2-CD1 4.35Å; I157-I171 HydrophobicContact CG2-CG1 4.04Å; I171-T173 PolarHBondContact O-N 3.14Å; I171-G174 PolarHBondContact O-N 3.02Å
172	E	96.3	Very high	98.2	Very high	137 Å²	137	44.3 Å²	44.3	64%	0.64	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-43.8	-176.1	-179.8	58.5	-161.1	0	0	111.4	R137 D170	R137-E172 VanDerWaalsContact CZ-O 3.28Å; R137-E172 PolarHBondContact NE-O 3.18Å; R137-E172 PolarHBondContact NH2-O 3.26Å; D170-E172 PolarHBondContact OD1-N 3.32Å
173	T	97.2	Very high	98.2	Very high	72 Å²	72	44.1 Å²	44.1	44%	0.442	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-26.2	178.4	61.4	0	0	0	0	113	R137 D170 I171 Q175	R137-T173 PolarHBondContact NH2-O 2.74Å; D170-T173 WeakPolarHBondContact CB-OG1 3.43Å; D170-T173 VanDerWaalsContact OD1-CB 3.29Å; D170-T173 WeakPolarHBondContact OD1-CB 3.36Å; D170-T173 VanDerWaalsContact OD1-CG2 3.29Å; D170-T173 WeakPolarHBondContact OD1-CG2 3.31Å; D170-T173 PolarHBondContact OD1-N 3.39Å; D170-T173 PolarHBondContact OD1-OG1 3.43Å; I171-T173 PolarHBondContact O-N 3.14Å; T173-Q175 VanDerWaalsContact C-N 3.26Å; T173-Q175 PolarHBondContact OG1-N 2.94Å
174	G	97.2	Very high	98.2	Very high	17 Å²	17	48.7 Å²	48.7	18%	0.175	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	13.5	-171.8	0	0	0	0	0	113.9	D170 I171	D170-G174 VanDerWaalsContact O-CA 3.28Å; D170-G174 WeakPolarHBondContact O-CA 3.3Å; D170-G174 PolarHBondContact O-N 3.35Å; I171-G174 PolarHBondContact O-N 3.02Å
175	Q	97.7	Very high	98.1	Very high	137 Å²	137	46.9 Å²	46.9	64%	0.64	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	150.4	-178.1	-64.4	-169.6	-11.8	0	0	111.8	D170 T173 T177	D170-Q175 PolarHBondContact N-O 3.07Å; D170-Q175 PolarHBondContact O-N 3.04Å; T173-Q175 VanDerWaalsContact C-N 3.26Å; T173-Q175 PolarHBondContact OG1-N 2.94Å; Q175-T177 PolarHBondContact O-N 3.46Å
176	Q	98	Very high	98.2	Very high	82 Å²	82	48.3 Å²	48.3	38%	0.383	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	118.2	168.7	-67.6	-177.3	-21.1	0	0	109.2	A167 L168 W169	A167-Q176 HydrophobicContact CB-CG 4.5Å; L168-Q176 CarbonylContact O-C 3.53Å; W169-Q176 HydrophobicContact CD2-CG 3.81Å; W169-Q176 HydrophobicContact CE3-CB 4.36Å; W169-Q176 HydrophobicContact CE3-CG 3.54Å; W169-Q176 HydrophobicContact CH2-CG 3.3Å; W169-Q176 VanDerWaalsContact CH2-NE2 3.26Å; W169-Q176 HydrophobicContact CZ2-CG 3.56Å; W169-Q176 HydrophobicContact CZ3-CB 4.41Å; W169-Q176 HydrophobicContact CZ3-CG 3.3Å
177	T	97.9	Very high	98.2	Very high	72 Å²	72	48.3 Å²	48.3	44%	0.442	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-37.5	173.5	-45.4	0	0	0	0	110.8	L168 D170 Q175	L168-T177 HydrophobicContact CD2-CG2 4.34Å; L168-T177 PolarHBondContact O-N 2.81Å; D170-T177 PolarHBondContact N-OG1 3.1Å; Q175-T177 PolarHBondContact O-N 3.46Å
178	T	98.4	Very high	98.2	Very high	38 Å²	38	50.1 Å²	50.1	23%	0.233	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	145.4	-177.8	-60.3	0	0	0	0	109.9	A167 L168 F180	A167-T178 WeakPolarHBondContact CA-O 3.44Å; L168-T178 PolarHBondContact N-O 2.86Å; L168-T178 PolarHBondContact O-N 2.87Å; T178-F180 HydrophobicContact CG2-CD1 4.36Å; T178-F180 HydrophobicContact CG2-CE1 3.95Å; T178-F180 HydrophobicContact CG2-CZ 4.02Å
179	T	98.3	Very high	98.1	Very high	67 Å²	67	50.4 Å²	50.4	41%	0.411	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.4	171.3	-176.6	0	0	0	0	109.3	T181	T179-T181 HydrophobicContact CG2-CG2 4.46Å
180	F	98.8	Very high	98.1	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	101.6	-179.8	-56.5	-76.2	0	0	0	108.4	C166 L168 T178 F199 W211	C166-F180 HydrophobicContact CB-CB 4Å; C166-F180 HydrophobicContact CB-CD2 3.89Å; C166-F180 HydrophobicContact CB-CG 4.39Å; C166-F180 PolarHBondContact N-O 2.85Å; C166-F180 VanDerWaalsContact N-O 3.11Å; C166-F180 PolarHBondContact O-N 2.89Å; L168-F180 HydrophobicContact CB-CE2 3.93Å; L168-F180 HydrophobicContact CB-CZ 4.27Å; T178-F180 HydrophobicContact CG2-CD1 4.36Å; T178-F180 HydrophobicContact CG2-CE1 3.95Å; T178-F180 HydrophobicContact CG2-CZ 4.02Å; F180-F199 HydrophobicContact CB-CZ 4.42Å; F180-F199 HydrophobicContact CD1-CE1 4.19Å; F180-F199 HydrophobicContact CD1-CZ 4.16Å; F180-F199 AromaticContact CD2-CE1 3.91Å; F180-F199 HydrophobicContact CD2-CE1 3.91Å; F180-F199 AromaticContact CD2-CZ 3.55Å; F180-F199 HydrophobicContact CD2-CZ 3.55Å; F180-F199 AromaticContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CZ 4.27Å; F180-F199 AromaticContact CE2-CE1 3.58Å; F180-F199 HydrophobicContact CE2-CE1 3.58Å; F180-F199 AromaticContact CE2-CZ 3.71Å; F180-F199 HydrophobicContact CE2-CZ 3.71Å; F180-F199 HydrophobicContact CG-CE1 4.21Å; F180-F199 AromaticContact CG-CZ 3.8Å; F180-F199 HydrophobicContact CG-CZ 3.8Å; F180-F199 AromaticContact CZ-CE1 3.57Å; F180-F199 HydrophobicContact CZ-CE1 3.57Å; F180-F199 HydrophobicContact CZ-CZ 4.1Å; F180-W211 HydrophobicContact CB-CD2 4.02Å; F180-W211 HydrophobicContact CB-CE3 3.71Å; F180-W211 HydrophobicContact CB-CH2 4.17Å; F180-W211 HydrophobicContact CB-CZ2 4.43Å; F180-W211 HydrophobicContact CB-CZ3 3.79Å; F180-W211 HydrophobicContact CD1-CB 4.33Å; F180-W211 HydrophobicContact CD1-CD2 4.22Å; F180-W211 AromaticContact CD1-CE3 3.73Å; F180-W211 HydrophobicContact CD1-CE3 3.73Å; F180-W211 HydrophobicContact CD1-CG 4.49Å; F180-W211 HydrophobicContact CD1-CZ3 4.41Å; F180-W211 HydrophobicContact CG-CD2 4.37Å; F180-W211 HydrophobicContact CG-CE3 4.11Å
181	T	98	Very high	98.2	Very high	96 Å²	96	49.5 Å²	49.5	59%	0.589	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	132.8	-178.6	56.4	0	0	0	0	110.3	T165 T179 W211	T165-T181 HydrophobicContact CG2-CG2 4.01Å; T179-T181 HydrophobicContact CG2-CG2 4.46Å; T181-W211 WeakPolarHBondContact O-CH2 3.39Å
182	G	97.7	Very high	98.2	Very high	38 Å²	38	50.7 Å²	50.7	39%	0.392	30%	0.295	S	S	.	.			trans	160.3	-12.5	179.5	0	0	0	0	0	115.7	K209	G182-K209 WeakPolarHBondContact O-CE 3.34Å; G182-K209 PolarHBondContact O-NZ 3.44Å
183	H	98.6	Very high	98.3	Very high	10 Å²	10	44.4 Å²	44.4	5%	0.046	27%	0.266	C	S	.	.			trans	-76.3	154.1	163	-78	-71.6	0	0	0	111	V187 S201 A203 D205 S207 K209	H183-V187 HydrophobicContact CB-CG2 3.89Å; H183-S201 PolarHBondContact NE2-OG 2.76Å; H183-A203 HydrophobicContact CB-CB 4.27Å; H183-A203 WeakPolarHBondContact ND1-CB 2.99Å; H183-D205 WeakPolarHBondContact CA-OD2 3.39Å; H183-D205 IonicContact CE1-OD1 3.37Å; H183-D205 IonicContact CG-OD2 2.72Å; H183-D205 IonicContact ND1-OD1 2.71Å; H183-D205 PolarHBondContact ND1-OD1 2.59Å; H183-D205 IonicContact ND1-OD2 3.73Å; H183-D205 PolarHBondContact ND1-OD2 2.76Å; H183-S207 PolarHBondContact CE1-O 2.92Å; H183-S207 PolarHBondContact ND1-OG 2.97Å; H183-K209 PolarHBondContact ND1-NZ 3.15Å
184	T	98.4	Very high	98.3	Very high	123 Å²	123	44.8 Å²	44.8	76%	0.755	27%	0.27	S	S	*	.	S	Bend	trans	-114.8	6.7	178.1	53.7	0	0	0	0	113	D205	T184-D205 PolarHBondContact N-OD2 3.34Å; T184-D205 WeakPolarHBondContact OG1-CB 3.22Å
185	G	98.5	Very high	98.3	Very high	14 Å²	14	48.1 Å²	48.1	14%	0.144	28%	0.284	C	S	.	.	S	Bend	trans	-146.5	176.9	175	0	0	0	0	0	110.3	V187	G185-V187 PolarHBondContact O-N 2.76Å
186	D	98.7	Very high	98.3	Very high	54 Å²	54	44.6 Å²	44.6	29%	0.289	27%	0.272	S	S	.	.			trans	-55.6	128.1	-177.3	-63.1	6.1	0	0	0	110.8	Y145 M188 A203 C204	Y145-D186 WeakPolarHBondContact CE1-OD2 3.35Å; Y145-D186 VanDerWaalsContact OH-CB 3.3Å; Y145-D186 WeakPolarHBondContact OH-CB 3.17Å; Y145-D186 VanDerWaalsContact OH-CG 3.3Å; Y145-D186 PolarHBondContact OH-OD2 3.19Å; D186-M188 HydrophobicContact CB-SD 4.39Å; D186-M188 PolarHBondContact O-N 3.43Å; D186-A203 CarbonylContact O-C 3.53Å; D186-A203 WeakPolarHBondContact O-CA 3.26Å; D186-A203 VanDerWaalsContact O-CB 3.26Å; D186-A203 WeakPolarHBondContact O-CB 3.46Å; D186-C204 HydrophobicContact CB-CB 4.39Å; D186-C204 PolarHBondContact O-N 3.18Å
187	V	98.9	Very high	98.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.9	176.7	-170.9	0	0	0	0	107.4	S147 S161 H183 G185 A203	S147-V187 WeakPolarHBondContact CB-O 3.17Å; S147-V187 PolarHBondContact OG-O 2.9Å; S161-V187 PolarHBondContact O-N 2.81Å; S161-V187 VanDerWaalsContact O-N 3.13Å; H183-V187 HydrophobicContact CB-CG2 3.89Å; G185-V187 PolarHBondContact O-N 2.76Å; V187-A203 HydrophobicContact CG2-CB 4.41Å
188	M	98.7	Very high	98.3	Very high	38 Å²	38	47.3 Å²	47.3	19%	0.187	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-33.6	-169.7	-67.6	-60.1	-74	0	0	113.2	S147 D186 G202 C204 I229	S147-M188 WeakPolarHBondContact CB-O 3.25Å; D186-M188 HydrophobicContact CB-SD 4.39Å; D186-M188 PolarHBondContact O-N 3.43Å; M188-G202 PolarHBondContact N-O 3.03Å; M188-C204 VanDerWaalsContact CG-SG 3.6Å; M188-I229 WeakPolarHBondContact CB-O 3.47Å
189	S	98.4	Very high	98.4	Very high	13 Å²	13	45.5 Å²	45.5	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	157.9	-177.7	60.5	0	0	0	0	112.6	S201 G202 N230 A231 I232	S189-S201 CarbonylContact O-C 3.59Å; S189-S201 VanDerWaalsContact O-CA 3.28Å; S189-S201 WeakPolarHBondContact O-CA 3.17Å; S189-G202 PolarHBondContact N-O 3.13Å; S189-G202 PolarHBondContact O-N 2.91Å; S189-N230 VanDerWaalsContact CB-O 3.32Å; S189-N230 WeakPolarHBondContact CB-O 3.19Å; S189-N230 PolarHBondContact OG-O 3.36Å; S189-N230 VanDerWaalsContact OG-O 3.13Å; S189-A231 VanDerWaalsContact OG-CA 3.31Å; S189-A231 WeakPolarHBondContact OG-CA 3.23Å; S189-I232 WeakPolarHBondContact OG-CG2 3.33Å; S189-I232 PolarHBondContact OG-N 3.45Å
190	L	98.8	Very high	98.4	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	152.8	172	70.6	87.7	0	0	0	110.7	C148 R150 V158 F199 V200	C148-L190 HydrophobicContact CB-CD2 4.44Å; C148-L190 HydrophobicContact CB-CG 4.19Å; R150-L190 HydrophobicContact CB-CD1 3.79Å; R150-L190 HydrophobicContact CG-CD1 3.53Å; V158-L190 HydrophobicContact CG1-CD1 4.46Å; V158-L190 HydrophobicContact CG1-CD2 3.87Å; L190-F199 HydrophobicContact CB-CD2 4.36Å; L190-V200 CarbonylContact C-O 3.5Å; L190-V200 WeakPolarHBondContact CA-O 3.23Å
191	S	98.9	Very high	98.4	Very high	20 Å²	20	42.3 Å²	42.3	14%	0.14	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.2	173.6	-176.2	0	0	0	0	109.3	F199 V200 I232 F234	S191-F199 WeakPolarHBondContact O-CA 3.17Å; S191-F199 WeakPolarHBondContact O-CB 3.35Å; S191-V200 PolarHBondContact N-O 3.16Å; S191-V200 PolarHBondContact O-N 2.89Å; S191-I232 WeakPolarHBondContact CB-O 3.34Å; S191-F234 WeakPolarHBondContact O-CD2 3.44Å; S191-F234 WeakPolarHBondContact O-CE2 3.45Å; S191-F234 PolarHBondContact OG-N 3.4Å
192	L	98.8	Very high	98.4	Very high	31 Å²	31	37.7 Å²	37.7	16%	0.162	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142.5	176.4	-63.1	175.8	0	0	0	110.3	R150 F151 L152 V158 F199 F234	R150-L192 HydrophobicContact CB-CD1 3.68Å; R150-L192 HydrophobicContact CB-CG 3.89Å; F151-L192 WeakPolarHBondContact O-CD1 3.31Å; L152-L192 HydrophobicContact CD2-CD1 3.78Å; L152-L192 HydrophobicContact CD2-CD2 3.57Å; L152-L192 HydrophobicContact CD2-CG 4.27Å; V158-L192 HydrophobicContact CG2-CD2 4.17Å; L192-F199 HydrophobicContact CD2-CB 3.77Å; L192-F234 VanDerWaalsContact O-CD2 3.22Å; L192-F234 WeakPolarHBondContact O-CD2 3.21Å
193	A	98.4	Very high	98.5	Very high	5 Å²	5	35.9 Å²	35.9	4%	0.041	20%	0.195	C	C	.	.			trans	-65.7	153.4	169.3	0	0	0	0	0	110.3	D195 T196 L198 F234	A193-D195 WeakPolarHBondContact CB-OD1 3.1Å; A193-D195 PolarHBondContact O-N 2.84Å; A193-D195 VanDerWaalsContact O-N 3.13Å; A193-T196 WeakPolarHBondContact O-CA 3.26Å; A193-T196 PolarHBondContact O-N 3Å; A193-L198 HydrophobicContact CB-CB 4.12Å; A193-L198 WeakPolarHBondContact CB-O 3.43Å; A193-L198 PolarHBondContact N-O 3.11Å; A193-F234 HydrophobicContact CB-CD2 4.32Å; A193-F234 HydrophobicContact CB-CE1 4.13Å; A193-F234 HydrophobicContact CB-CE2 3.85Å; A193-F234 HydrophobicContact CB-CZ 3.74Å; A193-F234 VanDerWaalsContact N-CE2 3.25Å
194	P	97.3	Very high	98.5	Very high	79 Å²	79	37.2 Å²	37.2	51%	0.513	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.1	179.2	-26.1	34.4	0	0	0	114.7	T196 P236	P194-T196 VanDerWaalsContact C-N 3.34Å; P194-P236 WeakPolarHBondContact CG-O 3.39Å
195	D	97.1	Very high	98.5	Very high	87 Å²	87	33.1 Å²	33.1	47%	0.465	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-0.2	176.5	73.5	-7.5	0	0	0	113.5	A193 R197	A193-D195 WeakPolarHBondContact CB-OD1 3.1Å; A193-D195 PolarHBondContact O-N 2.84Å; A193-D195 VanDerWaalsContact O-N 3.13Å; D195-R197 HydrophobicContact CB-CG 4.46Å; D195-R197 PolarHBondContact O-N 2.55Å; D195-R197 VanDerWaalsContact O-N 3.1Å; D195-R197 PolarHBondContact OD1-N 2.96Å; D195-R197 WeakPolarHBondContact OD2-CD 3.12Å
196	T	97.8	Very high	98.5	Very high	64 Å²	64	33.5 Å²	33.5	39%	0.393	18%	0.181	S	C	.	.	S	Bend	trans	58.2	13	-178.8	65.8	0	0	0	0	115.7	A193 P194	A193-T196 WeakPolarHBondContact O-CA 3.26Å; A193-T196 PolarHBondContact O-N 3Å; P194-T196 VanDerWaalsContact C-N 3.34Å
197	R	98.2	Very high	98.5	Very high	177 Å²	177	31.2 Å²	31.2	67%	0.668	17%	0.169	S	C	*	.	S	Bend	trans	-87	-32.8	-179.5	-63.6	-173.7	178.2	-169.9	0.6	113	D195 V213	D195-R197 HydrophobicContact CB-CG 4.46Å; D195-R197 PolarHBondContact O-N 2.55Å; D195-R197 VanDerWaalsContact O-N 3.1Å; D195-R197 PolarHBondContact OD1-N 2.96Å; D195-R197 WeakPolarHBondContact OD2-CD 3.12Å; R197-V213 WeakPolarHBondContact O-CB 3.3Å; R197-V213 WeakPolarHBondContact O-CG2 3.36Å; R197-V213 PolarHBondContact O-N 3.42Å
198	L	98.7	Very high	98.5	Very high	34 Å²	34	31.2 Å²	31.2	18%	0.178	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	158.1	178.3	-56.4	176.9	0	0	0	109.5	A193 L210 W211 D212	A193-L198 HydrophobicContact CB-CB 4.12Å; A193-L198 WeakPolarHBondContact CB-O 3.43Å; A193-L198 PolarHBondContact N-O 3.11Å; L198-L210 HydrophobicContact CB-CD1 4.01Å; L198-L210 HydrophobicContact CD1-CD1 4.17Å; L198-L210 HydrophobicContact CD1-CD2 4.27Å; L198-W211 VanDerWaalsContact CA-O 3.27Å; L198-W211 WeakPolarHBondContact CA-O 3.13Å; L198-D212 HydrophobicContact CD2-CB 3.93Å
199	F	98.9	Very high	98.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157.4	163.9	74	-85.4	0	0	0	110.3	V158 C166 F180 L190 S191 L192 W211 V213	V158-F199 HydrophobicContact CG1-CE1 4.42Å; V158-F199 HydrophobicContact CG1-CE2 4.32Å; V158-F199 HydrophobicContact CG1-CZ 4.27Å; C166-F199 HydrophobicContact CB-CE2 4.22Å; C166-F199 HydrophobicContact CB-CZ 4.21Å; F180-F199 HydrophobicContact CB-CZ 4.42Å; F180-F199 HydrophobicContact CD1-CE1 4.19Å; F180-F199 HydrophobicContact CD1-CZ 4.16Å; F180-F199 AromaticContact CD2-CE1 3.91Å; F180-F199 HydrophobicContact CD2-CE1 3.91Å; F180-F199 AromaticContact CD2-CZ 3.55Å; F180-F199 HydrophobicContact CD2-CZ 3.55Å; F180-F199 AromaticContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CE1 3.85Å; F180-F199 HydrophobicContact CE1-CZ 4.27Å; F180-F199 AromaticContact CE2-CE1 3.58Å; F180-F199 HydrophobicContact CE2-CE1 3.58Å; F180-F199 AromaticContact CE2-CZ 3.71Å; F180-F199 HydrophobicContact CE2-CZ 3.71Å; F180-F199 HydrophobicContact CG-CE1 4.21Å; F180-F199 AromaticContact CG-CZ 3.8Å; F180-F199 HydrophobicContact CG-CZ 3.8Å; F180-F199 AromaticContact CZ-CE1 3.57Å; F180-F199 HydrophobicContact CZ-CE1 3.57Å; F180-F199 HydrophobicContact CZ-CZ 4.1Å; L190-F199 HydrophobicContact CB-CD2 4.36Å; S191-F199 WeakPolarHBondContact O-CA 3.17Å; S191-F199 WeakPolarHBondContact O-CB 3.35Å; L192-F199 HydrophobicContact CD2-CB 3.77Å; F199-W211 HydrophobicContact CD1-CB 3.72Å; F199-W211 HydrophobicContact CD2-CB 4.37Å; F199-W211 AromaticContact CD2-CD1 3.88Å; F199-W211 HydrophobicContact CD2-CG 4.42Å; F199-W211 HydrophobicContact CE1-CB 3.26Å; F199-W211 AromaticContact CE1-CG 3.88Å; F199-W211 HydrophobicContact CE1-CG 3.88Å; F199-W211 HydrophobicContact CE2-CB 3.96Å; F199-W211 AromaticContact CE2-CD1 3.3Å; F199-W211 AromaticContact CE2-CG 3.75Å; F199-W211 HydrophobicContact CE2-CG 3.75Å; F199-W211 HydrophobicContact CG-CB 4.26Å; F199-W211 HydrophobicContact CZ-CB 3.39Å; F199-W211 AromaticContact CZ-CD1 3.51Å; F199-W211 HydrophobicContact CZ-CD2 4.26Å; F199-W211 AromaticContact CZ-CG 3.43Å; F199-W211 HydrophobicContact CZ-CG 3.43Å; F199-W211 VanDerWaalsContact CZ-CG 3.43Å; F199-W211 PolarHBondContact N-O 3.11Å; F199-W211 VanDerWaalsContact N-O 3.07Å; F199-W211 PolarHBondContact O-N 3.11Å; F199-V213 HydrophobicContact CD1-CG2 3.75Å; F199-V213 HydrophobicContact CE1-CG2 4.35Å
200	V	98.9	Very high	98.5	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	145.6	172	-68.6	0	0	0	0	110.2	L190 S191 K209 L210 I232 F234 F241	L190-V200 CarbonylContact C-O 3.5Å; L190-V200 WeakPolarHBondContact CA-O 3.23Å; S191-V200 PolarHBondContact N-O 3.16Å; S191-V200 PolarHBondContact O-N 2.89Å; V200-K209 CarbonylContact C-O 3.59Å; V200-K209 WeakPolarHBondContact CA-O 3.42Å; V200-L210 HydrophobicContact CG1-CB 4.46Å; V200-L210 HydrophobicContact CG1-CD1 3.67Å; V200-I232 HydrophobicContact CB-CD1 3.58Å; V200-I232 HydrophobicContact CB-CG1 4.26Å; V200-I232 HydrophobicContact CG2-CD1 3.48Å; V200-I232 VanDerWaalsContact CG2-CD1 3.48Å; V200-I232 HydrophobicContact CG2-CG1 3.57Å; V200-I232 HydrophobicContact CG2-CG2 4.22Å; V200-F234 HydrophobicContact CB-CE2 4.17Å; V200-F234 HydrophobicContact CB-CZ 4.34Å; V200-F234 HydrophobicContact CG1-CE1 4.22Å; V200-F234 HydrophobicContact CG1-CE2 3.93Å; V200-F234 HydrophobicContact CG1-CZ 3.59Å; V200-F234 HydrophobicContact CG2-CD2 3.87Å; V200-F234 HydrophobicContact CG2-CE2 3.6Å; V200-F234 HydrophobicContact CG2-CZ 4.12Å; V200-F241 HydrophobicContact CG1-CD1 4.1Å; V200-F241 HydrophobicContact CG1-CE1 4.35Å; V200-F241 HydrophobicContact CG1-CG 4.26Å; V200-F241 HydrophobicContact CG2-CB 4.45Å; V200-F241 HydrophobicContact CG2-CG 4.48Å
201	S	98.9	Very high	98.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.6	173	60	0	0	0	0	111.3	H183 S189 A208 K209 W211	H183-S201 PolarHBondContact NE2-OG 2.76Å; S189-S201 CarbonylContact O-C 3.59Å; S189-S201 VanDerWaalsContact O-CA 3.28Å; S189-S201 WeakPolarHBondContact O-CA 3.17Å; S201-A208 CarbonylContact O-C 3.51Å; S201-A208 WeakPolarHBondContact O-CA 3.36Å; S201-K209 PolarHBondContact N-O 2.82Å; S201-K209 PolarHBondContact O-N 2.95Å; S201-W211 PolarHBondContact OG-NE1 2.87Å
202	G	98.8	Very high	98.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.8	173.2	0	0	0	0	0	110.9	M188 S189	M188-G202 PolarHBondContact N-O 3.03Å; S189-G202 PolarHBondContact N-O 3.13Å; S189-G202 PolarHBondContact O-N 2.91Å
203	A	98.8	Very high	98.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	171.1	-173.1	0	0	0	0	0	113.7	H183 D186 V187 D205 A206 S207 I229	H183-A203 HydrophobicContact CB-CB 4.27Å; H183-A203 WeakPolarHBondContact ND1-CB 2.99Å; D186-A203 CarbonylContact O-C 3.53Å; D186-A203 WeakPolarHBondContact O-CA 3.26Å; D186-A203 VanDerWaalsContact O-CB 3.26Å; D186-A203 WeakPolarHBondContact O-CB 3.46Å; V187-A203 HydrophobicContact CG2-CB 4.41Å; A203-D205 WeakPolarHBondContact CB-OD1 3.3Å; A203-D205 PolarHBondContact O-N 2.86Å; A203-A206 PolarHBondContact O-N 2.88Å; A203-S207 PolarHBondContact N-O 2.95Å; A203-I229 PolarHBondContact O-N 2.85Å; A203-I229 VanDerWaalsContact O-N 3.11Å
204	C	98.8	Very high	98.4	Very high	37 Å²	37	40 Å²	40	25%	0.25	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	13.5	172.6	-61.8	0	0	0	0	113.8	D186 M188 D228	D186-C204 HydrophobicContact CB-CB 4.39Å; D186-C204 PolarHBondContact O-N 3.18Å; M188-C204 VanDerWaalsContact CG-SG 3.6Å; C204-D228 VanDerWaalsContact CA-OD1 3.3Å; C204-D228 WeakPolarHBondContact CA-OD1 3.2Å; C204-D228 HydrophobicContact CB-CB 4.34Å; C204-D228 WeakPolarHBondContact CB-OD1 3.46Å; C204-D228 PolarHBondContact SG-OD2 2.84Å
205	D	98.2	Very high	98.5	Very high	37 Å²	37	40.9 Å²	40.9	20%	0.198	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	15.7	168.6	63.9	12	0	0	0	112.2	H183 T184 A203 S207 K209	H183-D205 WeakPolarHBondContact CA-OD2 3.39Å; H183-D205 IonicContact CE1-OD1 3.37Å; H183-D205 IonicContact CG-OD2 2.72Å; H183-D205 IonicContact ND1-OD1 2.71Å; H183-D205 PolarHBondContact ND1-OD1 2.59Å; H183-D205 IonicContact ND1-OD2 3.73Å; H183-D205 PolarHBondContact ND1-OD2 2.76Å; T184-D205 PolarHBondContact N-OD2 3.34Å; T184-D205 WeakPolarHBondContact OG1-CB 3.22Å; A203-D205 WeakPolarHBondContact CB-OD1 3.3Å; A203-D205 PolarHBondContact O-N 2.86Å; D205-S207 PolarHBondContact O-N 2.95Å; D205-S207 VanDerWaalsContact OD1-CB 3.31Å; D205-S207 WeakPolarHBondContact OD1-CB 3.26Å; D205-S207 PolarHBondContact OD1-N 2.81Å; D205-S207 PolarHBondContact OD1-OG 3.27Å; D205-S207 PolarHBondContact OD2-OG 3.08Å; D205-K209 IonicContact OD2-NZ 3.29Å
206	A	98.3	Very high	98.4	Very high	23 Å²	23	37.7 Å²	37.7	19%	0.19	18%	0.18	C	C	.	.	S	Bend	trans	54.1	20.4	-174.8	0	0	0	0	0	114.4	A203 S227	A203-A206 PolarHBondContact O-N 2.88Å; A206-S227 WeakPolarHBondContact CB-O 3.14Å
207	S	98.5	Very high	98.4	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.5	179.5	81.6	0	0	0	0	112.5	H183 A203 D205 K209 F222 I229	H183-S207 PolarHBondContact CE1-O 2.92Å; H183-S207 PolarHBondContact ND1-OG 2.97Å; A203-S207 PolarHBondContact N-O 2.95Å; D205-S207 PolarHBondContact O-N 2.95Å; D205-S207 VanDerWaalsContact OD1-CB 3.31Å; D205-S207 WeakPolarHBondContact OD1-CB 3.26Å; D205-S207 PolarHBondContact OD1-N 2.81Å; D205-S207 PolarHBondContact OD1-OG 3.27Å; D205-S207 PolarHBondContact OD2-OG 3.08Å; S207-K209 PolarHBondContact OG-NZ 2.88Å; S207-F222 WeakPolarHBondContact CA-O 3.33Å; S207-I229 VanDerWaalsContact C-CD1 3.49Å
208	A	98.9	Very high	98.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.1	164.8	0	0	0	0	0	109.4	S201 F222 I229 I232 F241 T243	S201-A208 CarbonylContact O-C 3.51Å; S201-A208 WeakPolarHBondContact O-CA 3.36Å; A208-F222 HydrophobicContact CB-CB 4.34Å; A208-F222 PolarHBondContact N-O 2.69Å; A208-F222 PolarHBondContact O-N 2.96Å; A208-I229 HydrophobicContact CB-CD1 4.19Å; A208-I232 HydrophobicContact CB-CD1 3.84Å; A208-F241 HydrophobicContact CB-CE2 3.81Å; A208-F241 HydrophobicContact CB-CZ 4.12Å; A208-T243 HydrophobicContact CB-CG2 4.21Å
209	K	98.9	Very high	98.3	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.078	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.4	180	-70.1	-166.8	176.8	72.4	0	111.6	G182 H183 V200 S201 D205 S207 W211 Q220 T221	G182-K209 WeakPolarHBondContact O-CE 3.34Å; G182-K209 PolarHBondContact O-NZ 3.44Å; H183-K209 PolarHBondContact ND1-NZ 3.15Å; V200-K209 CarbonylContact C-O 3.59Å; V200-K209 WeakPolarHBondContact CA-O 3.42Å; S201-K209 PolarHBondContact N-O 2.82Å; S201-K209 PolarHBondContact O-N 2.95Å; D205-K209 IonicContact OD2-NZ 3.29Å; S207-K209 PolarHBondContact OG-NZ 2.88Å; K209-W211 HydrophobicContact CB-CZ2 3.99Å; K209-W211 HydrophobicContact CD-CH2 4.28Å; K209-W211 HydrophobicContact CD-CZ2 3.72Å; K209-W211 HydrophobicContact CG-CZ2 4.48Å; K209-Q220 WeakPolarHBondContact CA-O 3.41Å; K209-T221 HydrophobicContact CG-CG2 4.28Å
210	L	98.9	Very high	98.3	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.037	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124	172.2	-179.2	73.6	0	0	0	109.3	L198 V200 C218 R219 Q220 F234 L255	L198-L210 HydrophobicContact CB-CD1 4.01Å; L198-L210 HydrophobicContact CD1-CD1 4.17Å; L198-L210 HydrophobicContact CD1-CD2 4.27Å; V200-L210 HydrophobicContact CG1-CB 4.46Å; V200-L210 HydrophobicContact CG1-CD1 3.67Å; L210-C218 CarbonylContact O-C 3.56Å; L210-C218 WeakPolarHBondContact O-CA 3.28Å; L210-R219 HydrophobicContact CD2-CB 4.42Å; L210-R219 PolarHBondContact O-N 3.15Å; L210-Q220 HydrophobicContact CB-CB 4Å; L210-Q220 HydrophobicContact CD2-CB 4.31Å; L210-Q220 HydrophobicContact CD2-CG 4.27Å; L210-Q220 VanDerWaalsContact CD2-OE1 3.27Å; L210-Q220 PolarHBondContact N-O 3.04Å; L210-F234 HydrophobicContact CD1-CZ 4.14Å; L210-L255 HydrophobicContact CD1-CD1 4.14Å; L210-L255 HydrophobicContact CD1-CD2 4.28Å; L210-L255 HydrophobicContact CD2-CD1 4.28Å; L210-L255 HydrophobicContact CD2-CD2 4.17Å
211	W	98.9	Very high	98.3	Very high	3 Å²	3	42 Å²	42	1%	0.011	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.6	-177.4	-58	93.7	0	0	0	111.1	F180 T181 L198 F199 S201 K209 C218	F180-W211 HydrophobicContact CB-CD2 4.02Å; F180-W211 HydrophobicContact CB-CE3 3.71Å; F180-W211 HydrophobicContact CB-CH2 4.17Å; F180-W211 HydrophobicContact CB-CZ2 4.43Å; F180-W211 HydrophobicContact CB-CZ3 3.79Å; F180-W211 HydrophobicContact CD1-CB 4.33Å; F180-W211 HydrophobicContact CD1-CD2 4.22Å; F180-W211 AromaticContact CD1-CE3 3.73Å; F180-W211 HydrophobicContact CD1-CE3 3.73Å; F180-W211 HydrophobicContact CD1-CG 4.49Å; F180-W211 HydrophobicContact CD1-CZ3 4.41Å; F180-W211 HydrophobicContact CG-CD2 4.37Å; F180-W211 HydrophobicContact CG-CE3 4.11Å; T181-W211 WeakPolarHBondContact O-CH2 3.39Å; L198-W211 VanDerWaalsContact CA-O 3.27Å; L198-W211 WeakPolarHBondContact CA-O 3.13Å; F199-W211 HydrophobicContact CD1-CB 3.72Å; F199-W211 HydrophobicContact CD2-CB 4.37Å; F199-W211 AromaticContact CD2-CD1 3.88Å; F199-W211 HydrophobicContact CD2-CG 4.42Å; F199-W211 HydrophobicContact CE1-CB 3.26Å; F199-W211 AromaticContact CE1-CG 3.88Å; F199-W211 HydrophobicContact CE1-CG 3.88Å; F199-W211 HydrophobicContact CE2-CB 3.96Å; F199-W211 AromaticContact CE2-CD1 3.3Å; F199-W211 AromaticContact CE2-CG 3.75Å; F199-W211 HydrophobicContact CE2-CG 3.75Å; F199-W211 HydrophobicContact CG-CB 4.26Å; F199-W211 HydrophobicContact CZ-CB 3.39Å; F199-W211 AromaticContact CZ-CD1 3.51Å; F199-W211 HydrophobicContact CZ-CD2 4.26Å; F199-W211 AromaticContact CZ-CG 3.43Å; F199-W211 HydrophobicContact CZ-CG 3.43Å; F199-W211 VanDerWaalsContact CZ-CG 3.43Å; F199-W211 PolarHBondContact N-O 3.11Å; F199-W211 VanDerWaalsContact N-O 3.07Å; F199-W211 PolarHBondContact O-N 3.11Å; S201-W211 PolarHBondContact OG-NE1 2.87Å; K209-W211 HydrophobicContact CB-CZ2 3.99Å; K209-W211 HydrophobicContact CD-CH2 4.28Å; K209-W211 HydrophobicContact CD-CZ2 3.72Å; K209-W211 HydrophobicContact CG-CZ2 4.48Å; W211-C218 HydrophobicContact CD2-CB 4.14Å; W211-C218 HydrophobicContact CE3-CB 3.66Å; W211-C218 VanDerWaalsContact CE3-N 3.33Å; W211-C218 HydrophobicContact CH2-CB 3.85Å; W211-C218 HydrophobicContact CZ2-CB 4.31Å; W211-C218 HydrophobicContact CZ3-CB 3.51Å
212	D	98.6	Very high	98.3	Very high	16 Å²	16	42.1 Å²	42.1	9%	0.086	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.7	167.3	-173.5	-51.1	0	0	0	109.8	L198 R214 E215 G216 M217 R219	L198-D212 HydrophobicContact CD2-CB 3.93Å; D212-R214 VanDerWaalsContact C-N 3.26Å; D212-R214 PolarHBondContact O-N 3.21Å; D212-R214 WeakPolarHBondContact OD1-CA 3.44Å; D212-R214 WeakPolarHBondContact OD1-CB 3.26Å; D212-R214 PolarHBondContact OD1-N 2.94Å; D212-E215 HydrophobicContact CB-CB 4.04Å; D212-E215 HydrophobicContact CB-CG 4.46Å; D212-E215 PolarHBondContact OD1-N 2.81Å; D212-G216 PolarHBondContact O-N 3.4Å; D212-M217 PolarHBondContact N-O 2.82Å; D212-M217 VanDerWaalsContact N-O 3.1Å; D212-R219 HydrophobicContact CB-CG 4.43Å; D212-R219 IonicContact OD2-CZ 3.56Å; D212-R219 IonicContact OD2-NE 2.69Å; D212-R219 PolarHBondContact OD2-NE 2.76Å; D212-R219 IonicContact OD2-NH1 2.77Å; D212-R219 IonicContact OD2-NH2 3.36Å; D212-R219 PolarHBondContact OD2-NH2 2.77Å
213	V	98.4	Very high	98.2	Very high	16 Å²	16	46.4 Å²	46.4	10%	0.097	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-36.5	-176.3	175.4	0	0	0	0	111.6	L152 L168 R197 F199	L152-V213 HydrophobicContact CD1-CG1 3.79Å; L168-V213 HydrophobicContact CD1-CG1 4.48Å; L168-V213 HydrophobicContact CD2-CG1 3.93Å; R197-V213 WeakPolarHBondContact O-CB 3.3Å; R197-V213 WeakPolarHBondContact O-CG2 3.36Å; R197-V213 PolarHBondContact O-N 3.42Å; F199-V213 HydrophobicContact CD1-CG2 3.75Å; F199-V213 HydrophobicContact CE1-CG2 4.35Å
214	R	97.7	Very high	97.8	Very high	235 Å²	235	47.8 Å²	47.8	89%	0.887	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-40.3	-175.7	-177.9	-180	178	-176.8	-0.2	111.9	D212	D212-R214 VanDerWaalsContact C-N 3.26Å; D212-R214 PolarHBondContact O-N 3.21Å; D212-R214 WeakPolarHBondContact OD1-CA 3.44Å; D212-R214 WeakPolarHBondContact OD1-CB 3.26Å; D212-R214 PolarHBondContact OD1-N 2.94Å
215	E	97.6	Very high	97.8	Very high	99 Å²	99	46.7 Å²	46.7	46%	0.463	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-21.9	-178.3	-66.4	178.3	164.3	0	0	113	D212 M217 R219	D212-E215 HydrophobicContact CB-CB 4.04Å; D212-E215 HydrophobicContact CB-CG 4.46Å; D212-E215 PolarHBondContact OD1-N 2.81Å; E215-M217 VanDerWaalsContact C-N 3.28Å; E215-M217 HydrophobicContact CB-CE 4.2Å; E215-M217 HydrophobicContact CB-CG 4Å; E215-M217 HydrophobicContact CG-CE 4.42Å; E215-M217 PolarHBondContact O-N 2.61Å; E215-M217 WeakPolarHBondContact OE2-CE 3.25Å; E215-R219 IonicContact OE1-NH2 2.79Å; E215-R219 PolarHBondContact OE1-NH2 2.85Å; E215-R219 IonicContact OE2-CZ 3.61Å; E215-R219 VanDerWaalsContact OE2-CZ 3.24Å; E215-R219 IonicContact OE2-NE 3.99Å; E215-R219 PolarHBondContact OE2-NE 3.27Å; E215-R219 IonicContact OE2-NH2 3.53Å; E215-R219 PolarHBondContact OE2-NH2 3.43Å
216	G	96.7	Very high	97.8	Very high	20 Å²	20	53.2 Å²	53.2	21%	0.206	27%	0.268	C	S	.	.			trans	78.2	9	178.7	0	0	0	0	0	114.6	D212	D212-G216 PolarHBondContact O-N 3.4Å
217	M	96	Very high	97.8	Very high	101 Å²	101	54.1 Å²	54.1	50%	0.498	27%	0.273	S	S	.	.	S	Bend	trans	-122.3	151.9	-174	65.3	175.3	174.5	0	0	113.6	D212 E215	D212-M217 PolarHBondContact N-O 2.82Å; D212-M217 VanDerWaalsContact N-O 3.1Å; E215-M217 VanDerWaalsContact C-N 3.28Å; E215-M217 HydrophobicContact CB-CE 4.2Å; E215-M217 HydrophobicContact CB-CG 4Å; E215-M217 HydrophobicContact CG-CE 4.42Å; E215-M217 PolarHBondContact O-N 2.61Å; E215-M217 WeakPolarHBondContact OE2-CE 3.25Å
218	C	98.3	Very high	97.8	Very high	45 Å²	45	56.5 Å²	56.5	30%	0.304	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.2	171.7	175.3	0	0	0	0	109.7	L210 W211 Q220	L210-C218 CarbonylContact O-C 3.56Å; L210-C218 WeakPolarHBondContact O-CA 3.28Å; W211-C218 HydrophobicContact CD2-CB 4.14Å; W211-C218 HydrophobicContact CE3-CB 3.66Å; W211-C218 VanDerWaalsContact CE3-N 3.33Å; W211-C218 HydrophobicContact CH2-CB 3.85Å; W211-C218 HydrophobicContact CZ2-CB 4.31Å; W211-C218 HydrophobicContact CZ3-CB 3.51Å; C218-Q220 PolarHBondContact SG-O 3.43Å
219	R	98.3	Very high	97.8	Very high	123 Å²	123	56.6 Å²	56.6	46%	0.464	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-33.3	178.8	-70.3	-170.9	169	-177	3.5	113.6	L210 D212 E215	L210-R219 HydrophobicContact CD2-CB 4.42Å; L210-R219 PolarHBondContact O-N 3.15Å; D212-R219 HydrophobicContact CB-CG 4.43Å; D212-R219 IonicContact OD2-CZ 3.56Å; D212-R219 IonicContact OD2-NE 2.69Å; D212-R219 PolarHBondContact OD2-NE 2.76Å; D212-R219 IonicContact OD2-NH1 2.77Å; D212-R219 IonicContact OD2-NH2 3.36Å; D212-R219 PolarHBondContact OD2-NH2 2.77Å; E215-R219 IonicContact OE1-NH2 2.79Å; E215-R219 PolarHBondContact OE1-NH2 2.85Å; E215-R219 IonicContact OE2-CZ 3.61Å; E215-R219 VanDerWaalsContact OE2-CZ 3.24Å; E215-R219 IonicContact OE2-NE 3.99Å; E215-R219 PolarHBondContact OE2-NE 3.27Å; E215-R219 IonicContact OE2-NH2 3.53Å; E215-R219 PolarHBondContact OE2-NH2 3.43Å
220	Q	98.6	Very high	97.8	Very high	41 Å²	41	56.7 Å²	56.7	19%	0.192	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.5	-179.7	-68	176.4	-40.6	0	0	110.9	K209 L210 C218 F222 L255 D258	K209-Q220 WeakPolarHBondContact CA-O 3.41Å; L210-Q220 HydrophobicContact CB-CB 4Å; L210-Q220 HydrophobicContact CD2-CB 4.31Å; L210-Q220 HydrophobicContact CD2-CG 4.27Å; L210-Q220 VanDerWaalsContact CD2-OE1 3.27Å; L210-Q220 PolarHBondContact N-O 3.04Å; C218-Q220 PolarHBondContact SG-O 3.43Å; Q220-F222 HydrophobicContact CB-CD2 4.46Å; Q220-F222 HydrophobicContact CB-CE2 3.67Å; Q220-F222 HydrophobicContact CB-CZ 3.98Å; Q220-L255 PolarHBondContact NE2-O 2.86Å; Q220-D258 VanDerWaalsContact CD-OD1 3.25Å; Q220-D258 WeakPolarHBondContact CG-OD1 3.26Å; Q220-D258 PolarHBondContact NE2-OD1 2.91Å
221	T	98.6	Very high	97.8	Very high	54 Å²	54	56.7 Å²	56.7	33%	0.331	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.6	172.6	-61.8	0	0	0	0	109.5	R22 K209 T223	R22-T221 PolarHBondContact NH2-O 3.49Å; K209-T221 HydrophobicContact CG-CG2 4.28Å; T221-T223 HydrophobicContact CG2-CG2 4.42Å
222	F	98.7	Very high	97.8	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.013	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.4	178.8	-59.7	-86.4	0	0	0	108.8	S207 A208 Q220 F241 F253 L255	S207-F222 WeakPolarHBondContact CA-O 3.33Å; A208-F222 HydrophobicContact CB-CB 4.34Å; A208-F222 PolarHBondContact N-O 2.69Å; A208-F222 PolarHBondContact O-N 2.96Å; Q220-F222 HydrophobicContact CB-CD2 4.46Å; Q220-F222 HydrophobicContact CB-CE2 3.67Å; Q220-F222 HydrophobicContact CB-CZ 3.98Å; F222-F241 HydrophobicContact CB-CZ 4.21Å; F222-F241 HydrophobicContact CD1-CZ 4.42Å; F222-F241 AromaticContact CD2-CE1 3.7Å; F222-F241 HydrophobicContact CD2-CE1 3.7Å; F222-F241 AromaticContact CD2-CZ 3.41Å; F222-F241 HydrophobicContact CD2-CZ 3.41Å; F222-F241 VanDerWaalsContact CD2-CZ 3.41Å; F222-F241 AromaticContact CE2-CE1 3.55Å; F222-F241 HydrophobicContact CE2-CE1 3.55Å; F222-F241 AromaticContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CG-CE1 4.26Å; F222-F241 AromaticContact CG-CZ 3.76Å; F222-F241 HydrophobicContact CG-CZ 3.76Å; F222-F241 AromaticContact CZ-CE1 4Å; F222-F241 HydrophobicContact CZ-CE1 4Å; F222-F241 HydrophobicContact CZ-CZ 4.45Å; F222-F253 HydrophobicContact CB-CD1 3.9Å; F222-F253 HydrophobicContact CB-CE1 4Å; F222-F253 HydrophobicContact CB-CG 4.41Å; F222-F253 HydrophobicContact CD1-CB 4.24Å; F222-F253 AromaticContact CD1-CD1 3.74Å; F222-F253 HydrophobicContact CD1-CD1 3.74Å; F222-F253 HydrophobicContact CD1-CG 4.28Å; F222-F253 HydrophobicContact CE1-CB 4.48Å; F222-F253 HydrophobicContact CG-CD1 4.08Å; F222-F253 HydrophobicContact CG-CG 4.43Å; F222-L255 HydrophobicContact CE2-CD2 3.83Å; F222-L255 HydrophobicContact CZ-CD2 3.74Å
223	T	96.2	Very high	97.8	Very high	90 Å²	90	57.3 Å²	57.3	55%	0.552	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	142.8	172.5	53.2	0	0	0	0	107.9	T221	T221-T223 HydrophobicContact CG2-CG2 4.42Å
224	G	91.8	Very high	97.8	Very high	29 Å²	29	57.1 Å²	57.1	30%	0.299	29%	0.291	S	S	.	.			trans	176.4	-33.5	-177.8	0	0	0	0	0	113.5	R251	G224-R251 PolarHBondContact O-NH1 3.08Å; G224-R251 PolarHBondContact O-NH2 3.34Å
225	H	98	Very high	97.9	Very high	15 Å²	15	48 Å²	48	7%	0.069	26%	0.257	C	S	.	.			trans	-69.7	155.2	173.3	-80	-66.5	0	0	0	112.8	I229 T243 S245 D247 T249 R251	H225-I229 HydrophobicContact CB-CG1 4.25Å; H225-T243 PolarHBondContact CD2-OG1 3.43Å; H225-T243 PolarHBondContact NE2-OG1 2.97Å; H225-S245 VanDerWaalsContact CE1-CB 3.44Å; H225-S245 WeakPolarHBondContact CE1-CB 3.48Å; H225-S245 WeakPolarHBondContact ND1-CB 3.09Å; H225-D247 WeakPolarHBondContact CA-OD2 3.25Å; H225-D247 IonicContact CE1-OD1 3.43Å; H225-D247 IonicContact CE1-OD2 3.67Å; H225-D247 IonicContact CG-OD2 3.44Å; H225-D247 IonicContact ND1-OD1 3.68Å; H225-D247 PolarHBondContact ND1-OD1 3.09Å; H225-D247 IonicContact ND1-OD2 2.84Å; H225-D247 PolarHBondContact ND1-OD2 3.13Å; H225-T249 PolarHBondContact CE1-O 2.8Å; H225-T249 PolarHBondContact CE1-OG1 3.31Å; H225-T249 PolarHBondContact ND1-OG1 3.36Å; H225-R251 VanDerWaalsContact CE1-CD 3.45Å; H225-R251 WeakPolarHBondContact CE1-CD 3.1Å; H225-R251 PolarHBondContact ND1-NE 3.04Å
226	E	98	Very high	97.9	Very high	173 Å²	173	45.8 Å²	45.8	81%	0.808	25%	0.252	S	S	*	.	S	Bend	trans	-100.4	-7.7	178.2	-61.7	-176.5	176.4	0	0	112.6	D247	E226-D247 HydrophobicContact CB-CB 4.25Å; E226-D247 PolarHBondContact N-OD2 3.33Å
227	S	98.5	Very high	98	Very high	43 Å²	43	49.3 Å²	49.3	30%	0.301	27%	0.266	S	S	.	.	S	Bend	trans	-145.1	-170.5	-178.9	-160.9	0	0	0	0	111.4	A206 S245	A206-S227 WeakPolarHBondContact CB-O 3.14Å; S227-S245 PolarHBondContact O-OG 2.88Å
228	D	98.7	Very high	98.1	Very high	55 Å²	55	45.1 Å²	45.1	29%	0.294	25%	0.249	S	C	.	.			trans	-61.8	138.9	-175	-66.1	-8.9	0	0	0	111.4	C204 S245 D246	C204-D228 VanDerWaalsContact CA-OD1 3.3Å; C204-D228 WeakPolarHBondContact CA-OD1 3.2Å; C204-D228 HydrophobicContact CB-CB 4.34Å; C204-D228 WeakPolarHBondContact CB-OD1 3.46Å; C204-D228 PolarHBondContact SG-OD2 2.84Å; D228-S245 WeakPolarHBondContact O-CA 3.29Å; D228-S245 VanDerWaalsContact O-CB 3.22Å; D228-S245 WeakPolarHBondContact O-CB 3.3Å; D228-S245 PolarHBondContact O-OG 2.96Å; D228-D246 PolarHBondContact O-N 3.17Å; D228-D246 VanDerWaalsContact O-N 3.11Å
229	I	98.9	Very high	98.1	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	101.5	175.1	-58.5	-180	0	0	0	108.7	M188 A203 S207 A208 H225 T243	M188-I229 WeakPolarHBondContact CB-O 3.47Å; A203-I229 PolarHBondContact O-N 2.85Å; A203-I229 VanDerWaalsContact O-N 3.11Å; S207-I229 VanDerWaalsContact C-CD1 3.49Å; A208-I229 HydrophobicContact CB-CD1 4.19Å; H225-I229 HydrophobicContact CB-CG1 4.25Å; I229-T243 HydrophobicContact CD1-CG2 4.47Å; I229-T243 HydrophobicContact CG2-CG2 3.91Å
230	N	98.7	Very high	98.1	Very high	21 Å²	21	41.5 Å²	41.5	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-34.4	-177.7	-70.8	-43.3	0	0	0	113.4	S189 G244 D246 I273	S189-N230 VanDerWaalsContact CB-O 3.32Å; S189-N230 WeakPolarHBondContact CB-O 3.19Å; S189-N230 PolarHBondContact OG-O 3.36Å; S189-N230 VanDerWaalsContact OG-O 3.13Å; N230-G244 PolarHBondContact N-O 2.84Å; N230-D246 PolarHBondContact ND2-OD1 3.29Å; N230-D246 PolarHBondContact ND2-OD2 3.01Å; N230-I273 VanDerWaalsContact CB-O 3.24Å; N230-I273 WeakPolarHBondContact CB-O 3.36Å; N230-I273 PolarHBondContact ND2-O 3.46Å
231	A	98.7	Very high	98.2	Very high	6 Å²	6	39.6 Å²	39.6	5%	0.05	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144	-173.2	0	0	0	0	0	111.8	S189 T243 G244 V276	S189-A231 VanDerWaalsContact OG-CA 3.31Å; S189-A231 WeakPolarHBondContact OG-CA 3.23Å; A231-T243 CarbonylContact O-C 3.51Å; A231-T243 VanDerWaalsContact O-CA 3.24Å; A231-T243 WeakPolarHBondContact O-CA 3.13Å; A231-G244 PolarHBondContact N-O 2.68Å; A231-G244 PolarHBondContact O-N 3.22Å; A231-V276 HydrophobicContact CB-CG1 4.41Å; A231-V276 HydrophobicContact CB-CG2 3.91Å
232	I	98.9	Very high	98.2	Very high	12 Å²	12	37 Å²	37	6%	0.062	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	139.5	177.1	-161.8	164.3	0	0	0	110	S189 S191 V200 A208 F241 A242 T243	S189-I232 WeakPolarHBondContact OG-CG2 3.33Å; S189-I232 PolarHBondContact OG-N 3.45Å; S191-I232 WeakPolarHBondContact CB-O 3.34Å; V200-I232 HydrophobicContact CB-CD1 3.58Å; V200-I232 HydrophobicContact CB-CG1 4.26Å; V200-I232 HydrophobicContact CG2-CD1 3.48Å; V200-I232 VanDerWaalsContact CG2-CD1 3.48Å; V200-I232 HydrophobicContact CG2-CG1 3.57Å; V200-I232 HydrophobicContact CG2-CG2 4.22Å; A208-I232 HydrophobicContact CB-CD1 3.84Å; I232-F241 HydrophobicContact CD1-CD2 3.81Å; I232-F241 HydrophobicContact CD1-CE2 3.9Å; I232-F241 HydrophobicContact CG1-CD2 3.84Å; I232-F241 HydrophobicContact CG1-CE2 4.38Å; I232-A242 CarbonylContact C-O 3.53Å; I232-A242 WeakPolarHBondContact CA-O 3.38Å; I232-T243 HydrophobicContact CB-CG2 4.37Å; I232-T243 HydrophobicContact CD1-CG2 3.86Å; I232-T243 HydrophobicContact CG1-CG2 3.78Å
233	C	98.8	Very high	98.2	Very high	21 Å²	21	36.9 Å²	36.9	14%	0.142	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	129.4	-179.8	-175.8	0	0	0	0	110.9	F241 A242 V276	C233-F241 CarbonylContact O-C 3.53Å; C233-F241 VanDerWaalsContact O-CA 3.32Å; C233-F241 WeakPolarHBondContact O-CA 3.33Å; C233-F241 WeakPolarHBondContact O-CB 3.42Å; C233-A242 PolarHBondContact N-O 3.16Å; C233-A242 PolarHBondContact O-N 3.47Å; C233-V276 HydrophobicContact CB-CG2 4Å
234	F	98.8	Very high	98.3	Very high	12 Å²	12	32.6 Å²	32.6	5%	0.053	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	142	171.2	-89.5	-79.5	0	0	0	112.3	S191 L192 A193 V200 L210 F241 L255 F278	S191-F234 WeakPolarHBondContact O-CD2 3.44Å; S191-F234 WeakPolarHBondContact O-CE2 3.45Å; S191-F234 PolarHBondContact OG-N 3.4Å; L192-F234 VanDerWaalsContact O-CD2 3.22Å; L192-F234 WeakPolarHBondContact O-CD2 3.21Å; A193-F234 HydrophobicContact CB-CD2 4.32Å; A193-F234 HydrophobicContact CB-CE1 4.13Å; A193-F234 HydrophobicContact CB-CE2 3.85Å; A193-F234 HydrophobicContact CB-CZ 3.74Å; A193-F234 VanDerWaalsContact N-CE2 3.25Å; V200-F234 HydrophobicContact CB-CE2 4.17Å; V200-F234 HydrophobicContact CB-CZ 4.34Å; V200-F234 HydrophobicContact CG1-CE1 4.22Å; V200-F234 HydrophobicContact CG1-CE2 3.93Å; V200-F234 HydrophobicContact CG1-CZ 3.59Å; V200-F234 HydrophobicContact CG2-CD2 3.87Å; V200-F234 HydrophobicContact CG2-CE2 3.6Å; V200-F234 HydrophobicContact CG2-CZ 4.12Å; L210-F234 HydrophobicContact CD1-CZ 4.14Å; F234-F241 HydrophobicContact CD1-CB 4.29Å; F234-L255 HydrophobicContact CE1-CD1 4.11Å; F234-F278 WeakPolarHBondContact O-CD2 3.45Å
235	F	98.8	Very high	98.6	Very high	42 Å²	42	31.2 Å²	31.2	18%	0.184	17%	0.172	C	C	.	.			trans	-65.6	146	161.8	-169.9	-90.3	0	0	0	109.2	N237 G238 A240 F278 G282	F235-N237 HydrophobicContact CD1-CB 4.24Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.1Å; F235-N237 HydrophobicContact CE1-CB 4.46Å; F235-N237 PolarHBondContact O-N 2.85Å; F235-G238 PolarHBondContact O-N 3.36Å; F235-A240 HydrophobicContact CB-CB 3.83Å; F235-A240 VanDerWaalsContact CB-O 3.22Å; F235-A240 WeakPolarHBondContact CB-O 3.33Å; F235-A240 HydrophobicContact CG-CB 4.37Å; F235-A240 PolarHBondContact N-O 3.34Å; F235-F278 HydrophobicContact CB-CE2 4.21Å; F235-F278 HydrophobicContact CD2-CD1 4.02Å; F235-F278 HydrophobicContact CD2-CD2 4.47Å; F235-F278 AromaticContact CD2-CE1 3.71Å; F235-F278 HydrophobicContact CD2-CE1 3.71Å; F235-F278 HydrophobicContact CD2-CE2 4.18Å; F235-F278 HydrophobicContact CD2-CG 4.38Å; F235-F278 AromaticContact CD2-CZ 3.8Å; F235-F278 HydrophobicContact CD2-CZ 3.8Å; F235-F278 HydrophobicContact CE2-CD1 4.36Å; F235-F278 HydrophobicContact CE2-CE1 4.16Å; F235-G282 VanDerWaalsContact CE2-CA 3.49Å; F235-G282 WeakPolarHBondContact CE2-O 3.13Å
236	P	98.5	Very high	98.7	Very high	53 Å²	53	33.3 Å²	33.3	34%	0.344	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-23	-169.8	-31.1	36.8	0	0	0	116.9	P194 F278 K280	P194-P236 WeakPolarHBondContact CG-O 3.39Å; P236-F278 HydrophobicContact CG-CB 4.32Å; P236-K280 WeakPolarHBondContact CG-O 3.44Å
237	N	98	Very high	98.7	Very high	94 Å²	94	26.8 Å²	26.8	50%	0.503	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-5.5	178.3	72.6	9.2	0	0	0	114.4	F235 N239	F235-N237 HydrophobicContact CD1-CB 4.24Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.1Å; F235-N237 HydrophobicContact CE1-CB 4.46Å; F235-N237 PolarHBondContact O-N 2.85Å; N237-N239 VanDerWaalsContact C-N 3.31Å; N237-N239 PolarHBondContact O-N 2.84Å; N237-N239 PolarHBondContact OD1-N 3.25Å
238	G	98.4	Very high	98.7	Very high	14 Å²	14	25.1 Å²	25.1	14%	0.144	14%	0.143	C	C	.	.	S	Bend	trans	77.3	0.7	179.8	0	0	0	0	0	116.5	F235 L255	F235-G238 PolarHBondContact O-N 3.36Å; G238-L255 WeakPolarHBondContact O-CD1 3.27Å
239	N	98.6	Very high	98.7	Very high	79 Å²	79	23.4 Å²	23.4	42%	0.422	14%	0.135	S	C	.	.	S	Bend	trans	-97.2	-7.9	-178.6	-67.5	-54.9	0	0	0	114.1	N237 L255	N237-N239 VanDerWaalsContact C-N 3.31Å; N237-N239 PolarHBondContact O-N 2.84Å; N237-N239 PolarHBondContact OD1-N 3.25Å; N239-L255 WeakPolarHBondContact O-CB 3.36Å; N239-L255 WeakPolarHBondContact O-CG 3.29Å; N239-L255 PolarHBondContact O-N 2.89Å
240	A	98.8	Very high	98.7	Very high	13 Å²	13	23.3 Å²	23.3	11%	0.107	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	165.6	178.3	0	0	0	0	0	109.5	F235 L252 F253	F235-A240 HydrophobicContact CB-CB 3.83Å; F235-A240 VanDerWaalsContact CB-O 3.22Å; F235-A240 WeakPolarHBondContact CB-O 3.33Å; F235-A240 HydrophobicContact CG-CB 4.37Å; F235-A240 PolarHBondContact N-O 3.34Å; A240-L252 HydrophobicContact CB-CD1 4.08Å; A240-F253 CarbonylContact C-O 3.56Å; A240-F253 WeakPolarHBondContact CA-O 3.44Å; A240-F253 WeakPolarHBondContact CB-O 3.48Å
241	F	98.9	Very high	98.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	152.5	174.3	66.3	-86.8	0	0	0	110.7	V200 A208 F222 I232 C233 F234 T243 L252 F253 L255	V200-F241 HydrophobicContact CG1-CD1 4.1Å; V200-F241 HydrophobicContact CG1-CE1 4.35Å; V200-F241 HydrophobicContact CG1-CG 4.26Å; V200-F241 HydrophobicContact CG2-CB 4.45Å; V200-F241 HydrophobicContact CG2-CG 4.48Å; A208-F241 HydrophobicContact CB-CE2 3.81Å; A208-F241 HydrophobicContact CB-CZ 4.12Å; F222-F241 HydrophobicContact CB-CZ 4.21Å; F222-F241 HydrophobicContact CD1-CZ 4.42Å; F222-F241 AromaticContact CD2-CE1 3.7Å; F222-F241 HydrophobicContact CD2-CE1 3.7Å; F222-F241 AromaticContact CD2-CZ 3.41Å; F222-F241 HydrophobicContact CD2-CZ 3.41Å; F222-F241 VanDerWaalsContact CD2-CZ 3.41Å; F222-F241 AromaticContact CE2-CE1 3.55Å; F222-F241 HydrophobicContact CE2-CE1 3.55Å; F222-F241 AromaticContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CE2-CZ 3.8Å; F222-F241 HydrophobicContact CG-CE1 4.26Å; F222-F241 AromaticContact CG-CZ 3.76Å; F222-F241 HydrophobicContact CG-CZ 3.76Å; F222-F241 AromaticContact CZ-CE1 4Å; F222-F241 HydrophobicContact CZ-CE1 4Å; F222-F241 HydrophobicContact CZ-CZ 4.45Å; I232-F241 HydrophobicContact CD1-CD2 3.81Å; I232-F241 HydrophobicContact CD1-CE2 3.9Å; I232-F241 HydrophobicContact CG1-CD2 3.84Å; I232-F241 HydrophobicContact CG1-CE2 4.38Å; C233-F241 CarbonylContact O-C 3.53Å; C233-F241 VanDerWaalsContact O-CA 3.32Å; C233-F241 WeakPolarHBondContact O-CA 3.33Å; C233-F241 WeakPolarHBondContact O-CB 3.42Å; F234-F241 HydrophobicContact CD1-CB 4.29Å; F241-T243 HydrophobicContact CD2-CG2 4.09Å; F241-T243 HydrophobicContact CE2-CG2 3.87Å; F241-L252 WeakPolarHBondContact O-CD1 3.39Å; F241-F253 HydrophobicContact CD1-CB 4.12Å; F241-F253 HydrophobicContact CD2-CB 4.38Å; F241-F253 HydrophobicContact CD2-CD2 4.28Å; F241-F253 HydrophobicContact CE1-CB 3.57Å; F241-F253 HydrophobicContact CE1-CG 4.39Å; F241-F253 HydrophobicContact CE2-CB 3.87Å; F241-F253 AromaticContact CE2-CD2 3.6Å; F241-F253 HydrophobicContact CE2-CD2 3.6Å; F241-F253 HydrophobicContact CE2-CE2 4.45Å; F241-F253 AromaticContact CE2-CG 3.96Å; F241-F253 HydrophobicContact CE2-CG 3.96Å; F241-F253 HydrophobicContact CG-CB 4.5Å; F241-F253 HydrophobicContact CZ-CB 3.43Å; F241-F253 VanDerWaalsContact CZ-CB 3.43Å; F241-F253 AromaticContact CZ-CD2 3.9Å; F241-F253 HydrophobicContact CZ-CD2 3.9Å; F241-F253 AromaticContact CZ-CG 3.76Å; F241-F253 HydrophobicContact CZ-CG 3.76Å; F241-F253 PolarHBondContact N-O 3.06Å; F241-F253 PolarHBondContact O-N 3.06Å; F241-L255 HydrophobicContact CD1-CD2 3.68Å; F241-L255 HydrophobicContact CD1-CG 4.46Å; F241-L255 HydrophobicContact CE1-CD2 3.56Å
242	A	98.9	Very high	98.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.3	173.5	0	0	0	0	0	111.4	I232 C233 R251 F278 L285	I232-A242 CarbonylContact C-O 3.53Å; I232-A242 WeakPolarHBondContact CA-O 3.38Å; C233-A242 PolarHBondContact N-O 3.16Å; C233-A242 PolarHBondContact O-N 3.47Å; A242-R251 CarbonylContact C-O 3.54Å; A242-R251 WeakPolarHBondContact CA-O 3.42Å; A242-F278 HydrophobicContact CB-CE2 3.48Å; A242-F278 VanDerWaalsContact CB-CE2 3.48Å; A242-F278 HydrophobicContact CB-CZ 3.56Å; A242-L285 HydrophobicContact CB-CD1 3.93Å; A242-L285 HydrophobicContact CB-CD2 4.03Å
243	T	98.9	Very high	98.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	155.1	172.4	50.8	0	0	0	0	110.4	A208 H225 I229 A231 I232 F241 C250 R251 F253	A208-T243 HydrophobicContact CB-CG2 4.21Å; H225-T243 PolarHBondContact CD2-OG1 3.43Å; H225-T243 PolarHBondContact NE2-OG1 2.97Å; I229-T243 HydrophobicContact CD1-CG2 4.47Å; I229-T243 HydrophobicContact CG2-CG2 3.91Å; A231-T243 CarbonylContact O-C 3.51Å; A231-T243 VanDerWaalsContact O-CA 3.24Å; A231-T243 WeakPolarHBondContact O-CA 3.13Å; I232-T243 HydrophobicContact CB-CG2 4.37Å; I232-T243 HydrophobicContact CD1-CG2 3.86Å; I232-T243 HydrophobicContact CG1-CG2 3.78Å; F241-T243 HydrophobicContact CD2-CG2 4.09Å; F241-T243 HydrophobicContact CE2-CG2 3.87Å; T243-C250 CarbonylContact O-C 3.49Å; T243-C250 WeakPolarHBondContact O-CA 3.46Å; T243-C250 WeakPolarHBondContact O-CB 3.47Å; T243-R251 PolarHBondContact N-O 3.45Å; T243-R251 PolarHBondContact O-N 2.58Å; T243-R251 PolarHBondContact OG1-O 3.48Å; T243-F253 HydrophobicContact CG2-CD2 4.44Å; T243-F253 HydrophobicContact CG2-CE2 4.25Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.29Å
244	G	98.8	Very high	98.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134	168.4	0	0	0	0	0	110.3	N230 A231	N230-G244 PolarHBondContact N-O 2.84Å; A231-G244 PolarHBondContact N-O 2.68Å; A231-G244 PolarHBondContact O-N 3.22Å
245	S	98.8	Very high	98.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	164.6	-172	176.6	0	0	0	0	113	H225 S227 D228 D247 A248 T249 I273	H225-S245 VanDerWaalsContact CE1-CB 3.44Å; H225-S245 WeakPolarHBondContact CE1-CB 3.48Å; H225-S245 WeakPolarHBondContact ND1-CB 3.09Å; S227-S245 PolarHBondContact O-OG 2.88Å; D228-S245 WeakPolarHBondContact O-CA 3.29Å; D228-S245 VanDerWaalsContact O-CB 3.22Å; D228-S245 WeakPolarHBondContact O-CB 3.3Å; D228-S245 PolarHBondContact O-OG 2.96Å; S245-D247 WeakPolarHBondContact CB-OD1 3.45Å; S245-D247 PolarHBondContact O-N 2.5Å; S245-D247 PolarHBondContact OG-N 2.76Å; S245-A248 PolarHBondContact O-N 3.26Å; S245-T249 PolarHBondContact N-O 3.08Å; S245-I273 PolarHBondContact O-N 3.02Å
246	D	98.7	Very high	98.6	Very high	60 Å²	60	32.1 Å²	32.1	32%	0.321	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-9.9	168.4	-77.1	-38.5	0	0	0	113.9	D228 N230 A248	D228-D246 PolarHBondContact O-N 3.17Å; D228-D246 VanDerWaalsContact O-N 3.11Å; N230-D246 PolarHBondContact ND2-OD1 3.29Å; N230-D246 PolarHBondContact ND2-OD2 3.01Å; D246-A248 PolarHBondContact O-N 3.49Å; D246-A248 VanDerWaalsContact O-N 3.15Å
247	D	98.4	Very high	98.6	Very high	35 Å²	35	31.1 Å²	31.1	19%	0.187	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	9	169.5	71.8	14	0	0	0	114.1	H225 E226 S245 T249	H225-D247 WeakPolarHBondContact CA-OD2 3.25Å; H225-D247 IonicContact CE1-OD1 3.43Å; H225-D247 IonicContact CE1-OD2 3.67Å; H225-D247 IonicContact CG-OD2 3.44Å; H225-D247 IonicContact ND1-OD1 3.68Å; H225-D247 PolarHBondContact ND1-OD1 3.09Å; H225-D247 IonicContact ND1-OD2 2.84Å; H225-D247 PolarHBondContact ND1-OD2 3.13Å; E226-D247 HydrophobicContact CB-CB 4.25Å; E226-D247 PolarHBondContact N-OD2 3.33Å; S245-D247 WeakPolarHBondContact CB-OD1 3.45Å; S245-D247 PolarHBondContact O-N 2.5Å; S245-D247 PolarHBondContact OG-N 2.76Å; D247-T249 VanDerWaalsContact CG-OG1 3.29Å; D247-T249 PolarHBondContact O-N 2.71Å; D247-T249 WeakPolarHBondContact OD1-CA 3.41Å; D247-T249 WeakPolarHBondContact OD1-CB 3.19Å; D247-T249 PolarHBondContact OD1-N 3.37Å; D247-T249 PolarHBondContact OD1-OG1 2.87Å; D247-T249 PolarHBondContact OD2-OG1 2.92Å
248	A	98.3	Very high	98.6	Very high	9 Å²	9	28.5 Å²	28.5	7%	0.074	15%	0.146	C	C	.	.	S	Bend	trans	63.5	9.4	-177.5	0	0	0	0	0	115.4	S245 D246 C271	S245-A248 PolarHBondContact O-N 3.26Å; D246-A248 PolarHBondContact O-N 3.49Å; D246-A248 VanDerWaalsContact O-N 3.15Å; A248-C271 VanDerWaalsContact CB-O 3.27Å; A248-C271 WeakPolarHBondContact CB-O 3.44Å
249	T	98.6	Very high	98.6	Very high	19 Å²	19	29.7 Å²	29.7	12%	0.117	15%	0.148	C	C	.	.			trans	-106.2	141.2	177.3	74.2	0	0	0	0	112.5	H225 S245 D247 R251 T263 I273	H225-T249 PolarHBondContact CE1-O 2.8Å; H225-T249 PolarHBondContact CE1-OG1 3.31Å; H225-T249 PolarHBondContact ND1-OG1 3.36Å; S245-T249 PolarHBondContact N-O 3.08Å; D247-T249 VanDerWaalsContact CG-OG1 3.29Å; D247-T249 PolarHBondContact O-N 2.71Å; D247-T249 WeakPolarHBondContact OD1-CA 3.41Å; D247-T249 WeakPolarHBondContact OD1-CB 3.19Å; D247-T249 PolarHBondContact OD1-N 3.37Å; D247-T249 PolarHBondContact OD1-OG1 2.87Å; D247-T249 PolarHBondContact OD2-OG1 2.92Å; T249-R251 PolarHBondContact OG1-NE 2.88Å; T249-T263 HydrophobicContact CG2-CG2 4.22Å; T249-I273 WeakPolarHBondContact O-CD1 3.39Å
250	C	98.8	Very high	98.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	147.1	157.4	-60	0	0	0	0	108.6	T243 Y264 I273 L285 A287	T243-C250 CarbonylContact O-C 3.49Å; T243-C250 WeakPolarHBondContact O-CA 3.46Å; T243-C250 WeakPolarHBondContact O-CB 3.47Å; C250-Y264 HydrophobicContact CB-CD2 3.75Å; C250-Y264 HydrophobicContact CB-CG 4.35Å; C250-Y264 PolarHBondContact N-O 3.18Å; C250-Y264 PolarHBondContact O-N 2.77Å; C250-I273 HydrophobicContact CB-CD1 4.45Å; C250-I273 WeakPolarHBondContact SG-CD1 3.22Å; C250-L285 HydrophobicContact CB-CD2 4Å; C250-A287 VanDerWaalsContact SG-CB 3.59Å
251	R	98.8	Very high	98.5	Very high	31 Å²	31	30.3 Å²	30.3	12%	0.117	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	140.8	174.8	-67.3	177.2	-172.9	-118.8	6.5	110.5	G224 H225 A242 T243 T249 F253 E260 M262 T263	G224-R251 PolarHBondContact O-NH1 3.08Å; G224-R251 PolarHBondContact O-NH2 3.34Å; H225-R251 VanDerWaalsContact CE1-CD 3.45Å; H225-R251 WeakPolarHBondContact CE1-CD 3.1Å; H225-R251 PolarHBondContact ND1-NE 3.04Å; A242-R251 CarbonylContact C-O 3.54Å; A242-R251 WeakPolarHBondContact CA-O 3.42Å; T243-R251 PolarHBondContact N-O 3.45Å; T243-R251 PolarHBondContact O-N 2.58Å; T243-R251 PolarHBondContact OG1-O 3.48Å; T249-R251 PolarHBondContact OG1-NE 2.88Å; R251-F253 HydrophobicContact CB-CD2 4.3Å; R251-F253 HydrophobicContact CB-CE2 3.53Å; R251-F253 HydrophobicContact CB-CZ 3.94Å; R251-E260 HydrophobicContact CB-CG 4.45Å; R251-E260 WeakPolarHBondContact CD-OE2 3.36Å; R251-E260 IonicContact CZ-OE1 3.59Å; R251-E260 IonicContact CZ-OE2 3.27Å; R251-E260 IonicContact NE-OE2 2.92Å; R251-E260 IonicContact NH1-OE1 3.55Å; R251-E260 PolarHBondContact NH1-OE1 3.24Å; R251-E260 IonicContact NH1-OE2 3.89Å; R251-E260 PolarHBondContact NH1-OE2 3.01Å; R251-M262 WeakPolarHBondContact CA-O 3.44Å; R251-T263 HydrophobicContact CG-CG2 4.16Å
252	L	98.9	Very high	98.5	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.047	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.4	173.3	177.2	62.7	0	0	0	109	L30 A240 F241 L261 M262 Y264 F278	L30-L252 HydrophobicContact CD2-CD2 3.96Å; A240-L252 HydrophobicContact CB-CD1 4.08Å; F241-L252 WeakPolarHBondContact O-CD1 3.39Å; L252-L261 HydrophobicContact CG-CB 4.42Å; L252-L261 PolarHBondContact O-N 3.22Å; L252-M262 HydrophobicContact CB-CB 4.27Å; L252-M262 PolarHBondContact N-O 2.79Å; L252-M262 PolarHBondContact O-N 3.27Å; L252-Y264 HydrophobicContact CB-CE2 3.9Å; L252-Y264 WeakPolarHBondContact CD2-OH 3.42Å; L252-F278 HydrophobicContact CD1-CZ 4.04Å
253	F	98.8	Very high	98.5	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.018	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.9	177.1	-64.4	-89	0	0	0	110.7	F222 A240 F241 T243 R251 E260	F222-F253 HydrophobicContact CB-CD1 3.9Å; F222-F253 HydrophobicContact CB-CE1 4Å; F222-F253 HydrophobicContact CB-CG 4.41Å; F222-F253 HydrophobicContact CD1-CB 4.24Å; F222-F253 AromaticContact CD1-CD1 3.74Å; F222-F253 HydrophobicContact CD1-CD1 3.74Å; F222-F253 HydrophobicContact CD1-CG 4.28Å; F222-F253 HydrophobicContact CE1-CB 4.48Å; F222-F253 HydrophobicContact CG-CD1 4.08Å; F222-F253 HydrophobicContact CG-CG 4.43Å; A240-F253 CarbonylContact C-O 3.56Å; A240-F253 WeakPolarHBondContact CA-O 3.44Å; A240-F253 WeakPolarHBondContact CB-O 3.48Å; F241-F253 HydrophobicContact CD1-CB 4.12Å; F241-F253 HydrophobicContact CD2-CB 4.38Å; F241-F253 HydrophobicContact CD2-CD2 4.28Å; F241-F253 HydrophobicContact CE1-CB 3.57Å; F241-F253 HydrophobicContact CE1-CG 4.39Å; F241-F253 HydrophobicContact CE2-CB 3.87Å; F241-F253 AromaticContact CE2-CD2 3.6Å; F241-F253 HydrophobicContact CE2-CD2 3.6Å; F241-F253 HydrophobicContact CE2-CE2 4.45Å; F241-F253 AromaticContact CE2-CG 3.96Å; F241-F253 HydrophobicContact CE2-CG 3.96Å; F241-F253 HydrophobicContact CG-CB 4.5Å; F241-F253 HydrophobicContact CZ-CB 3.43Å; F241-F253 VanDerWaalsContact CZ-CB 3.43Å; F241-F253 AromaticContact CZ-CD2 3.9Å; F241-F253 HydrophobicContact CZ-CD2 3.9Å; F241-F253 AromaticContact CZ-CG 3.76Å; F241-F253 HydrophobicContact CZ-CG 3.76Å; F241-F253 PolarHBondContact N-O 3.06Å; F241-F253 PolarHBondContact O-N 3.06Å; T243-F253 HydrophobicContact CG2-CD2 4.44Å; T243-F253 HydrophobicContact CG2-CE2 4.25Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.29Å; R251-F253 HydrophobicContact CB-CD2 4.3Å; R251-F253 HydrophobicContact CB-CE2 3.53Å; R251-F253 HydrophobicContact CB-CZ 3.94Å; F253-E260 HydrophobicContact CD1-CB 3.86Å; F253-E260 HydrophobicContact CD1-CG 4.45Å; F253-E260 HydrophobicContact CE1-CB 3.66Å; F253-E260 HydrophobicContact CE1-CG 4.16Å; F253-E260 HydrophobicContact CZ-CB 4.41Å; F253-E260 HydrophobicContact CZ-CG 4.46Å
254	D	98.6	Very high	98.4	Very high	35 Å²	35	33.6 Å²	33.6	19%	0.187	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.8	175.5	179.7	-4.7	0	0	0	110.4	R256 A257 D258 Q259 L261	D254-R256 VanDerWaalsContact C-N 3.27Å; D254-R256 PolarHBondContact O-N 2.9Å; D254-R256 WeakPolarHBondContact OD1-CB 3.46Å; D254-R256 PolarHBondContact OD1-N 2.84Å; D254-A257 HydrophobicContact CB-CB 4.03Å; D254-D258 WeakPolarHBondContact O-CA 3.34Å; D254-D258 PolarHBondContact O-N 3.48Å; D254-Q259 PolarHBondContact N-O 3.42Å; D254-Q259 PolarHBondContact O-N 2.51Å; D254-L261 HydrophobicContact CB-CD1 3.59Å; D254-L261 HydrophobicContact CB-CD2 3.92Å; D254-L261 HydrophobicContact CB-CG 3.61Å
255	L	98.6	Very high	98.4	Very high	17 Å²	17	36.7 Å²	36.7	9%	0.089	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-26.2	179.5	-59.3	-171.4	0	0	0	112.7	L210 Q220 F222 F234 G238 N239 F241	L210-L255 HydrophobicContact CD1-CD1 4.14Å; L210-L255 HydrophobicContact CD1-CD2 4.28Å; L210-L255 HydrophobicContact CD2-CD1 4.28Å; L210-L255 HydrophobicContact CD2-CD2 4.17Å; Q220-L255 PolarHBondContact NE2-O 2.86Å; F222-L255 HydrophobicContact CE2-CD2 3.83Å; F222-L255 HydrophobicContact CZ-CD2 3.74Å; F234-L255 HydrophobicContact CE1-CD1 4.11Å; G238-L255 WeakPolarHBondContact O-CD1 3.27Å; N239-L255 WeakPolarHBondContact O-CB 3.36Å; N239-L255 WeakPolarHBondContact O-CG 3.29Å; N239-L255 PolarHBondContact O-N 2.89Å; F241-L255 HydrophobicContact CD1-CD2 3.68Å; F241-L255 HydrophobicContact CD1-CG 4.46Å; F241-L255 HydrophobicContact CE1-CD2 3.56Å
256	R	98.4	Very high	98.3	Very high	203 Å²	203	39.9 Å²	39.9	77%	0.766	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-38.8	-177.3	-56.2	-56.1	-57.4	-178.4	1.1	111.9	D254 D258	D254-R256 VanDerWaalsContact C-N 3.27Å; D254-R256 PolarHBondContact O-N 2.9Å; D254-R256 WeakPolarHBondContact OD1-CB 3.46Å; D254-R256 PolarHBondContact OD1-N 2.84Å; R256-D258 VanDerWaalsContact C-N 3.28Å
257	A	98	Very high	98.1	Very high	32 Å²	32	44.4 Å²	44.4	26%	0.264	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-17	172.9	0	0	0	0	0	112.4	D254 Q259 L261	D254-A257 HydrophobicContact CB-CB 4.03Å; A257-Q259 HydrophobicContact CB-CG 3.98Å; A257-Q259 PolarHBondContact O-N 2.89Å; A257-L261 HydrophobicContact CB-CD2 4.36Å
258	D	98.4	Very high	98	Very high	39 Å²	39	49 Å²	49	21%	0.209	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	31.4	-176	-163.9	68.5	0	0	0	112.8	R22 Q220 D254 R256	R22-D258 WeakPolarHBondContact CD-O 3.4Å; R22-D258 IonicContact CZ-OD2 3.9Å; R22-D258 VanDerWaalsContact CZ-OD2 3.26Å; R22-D258 PolarHBondContact NE-O 2.86Å; R22-D258 IonicContact NE-OD2 3.43Å; R22-D258 PolarHBondContact NE-OD2 3.12Å; R22-D258 PolarHBondContact NH2-O 2.82Å; R22-D258 IonicContact NH2-OD1 3.53Å; R22-D258 IonicContact NH2-OD2 2.85Å; R22-D258 PolarHBondContact NH2-OD2 2.99Å; Q220-D258 VanDerWaalsContact CD-OD1 3.25Å; Q220-D258 WeakPolarHBondContact CG-OD1 3.26Å; Q220-D258 PolarHBondContact NE2-OD1 2.91Å; D254-D258 WeakPolarHBondContact O-CA 3.34Å; D254-D258 PolarHBondContact O-N 3.48Å; R256-D258 VanDerWaalsContact C-N 3.28Å
259	Q	97.3	Very high	97.9	Very high	39 Å²	39	49.2 Å²	49.2	18%	0.182	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	172.1	-177.9	64.6	-171.6	-7	0	0	112.8	R22 D254 A257	R22-Q259 PolarHBondContact O-OE1 3.3Å; D254-Q259 PolarHBondContact N-O 3.42Å; D254-Q259 PolarHBondContact O-N 2.51Å; A257-Q259 HydrophobicContact CB-CG 3.98Å; A257-Q259 PolarHBondContact O-N 2.89Å
260	E	98.2	Very high	97.8	Very high	52 Å²	52	55.2 Å²	55.2	24%	0.243	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	134.1	171.4	-174.1	178.1	159.2	0	0	110.6	R251 F253 T263	R251-E260 HydrophobicContact CB-CG 4.45Å; R251-E260 WeakPolarHBondContact CD-OE2 3.36Å; R251-E260 IonicContact CZ-OE1 3.59Å; R251-E260 IonicContact CZ-OE2 3.27Å; R251-E260 IonicContact NE-OE2 2.92Å; R251-E260 IonicContact NH1-OE1 3.55Å; R251-E260 PolarHBondContact NH1-OE1 3.24Å; R251-E260 IonicContact NH1-OE2 3.89Å; R251-E260 PolarHBondContact NH1-OE2 3.01Å; F253-E260 HydrophobicContact CD1-CB 3.86Å; F253-E260 HydrophobicContact CD1-CG 4.45Å; F253-E260 HydrophobicContact CE1-CB 3.66Å; F253-E260 HydrophobicContact CE1-CG 4.16Å; F253-E260 HydrophobicContact CZ-CB 4.41Å; F253-E260 HydrophobicContact CZ-CG 4.46Å; E260-T263 PolarHBondContact OE1-OG1 3.32Å
261	L	97.8	Very high	97.7	Very high	53 Å²	53	57.1 Å²	57.1	28%	0.277	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-36.8	175	-67.4	-168.6	0	0	0	113.2	L30 L252 D254 A257	L30-L261 HydrophobicContact CB-CB 4.4Å; L30-L261 HydrophobicContact CD2-CB 4.34Å; L30-L261 HydrophobicContact CD2-CD1 4.45Å; L252-L261 HydrophobicContact CG-CB 4.42Å; L252-L261 PolarHBondContact O-N 3.22Å; D254-L261 HydrophobicContact CB-CD1 3.59Å; D254-L261 HydrophobicContact CB-CD2 3.92Å; D254-L261 HydrophobicContact CB-CG 3.61Å; A257-L261 HydrophobicContact CB-CD2 4.36Å
262	M	98	Very high	97.7	Very high	12 Å²	12	56 Å²	56	6%	0.059	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	137.7	-170	-170.3	164.1	-81.9	0	0	111.7	L30 R251 L252 Y264 A302	L30-M262 HydrophobicContact CB-CE 3.88Å; L30-M262 HydrophobicContact CD2-CB 4.31Å; L30-M262 HydrophobicContact CD2-CE 3.78Å; L30-M262 HydrophobicContact CD2-SD 4.13Å; L30-M262 HydrophobicContact CG-CE 3.7Å; R251-M262 WeakPolarHBondContact CA-O 3.44Å; L252-M262 HydrophobicContact CB-CB 4.27Å; L252-M262 PolarHBondContact N-O 2.79Å; L252-M262 PolarHBondContact O-N 3.27Å; M262-Y264 HydrophobicContact CG-CD1 4.41Å; M262-Y264 HydrophobicContact CG-CE1 3.86Å; M262-Y264 HydrophobicContact SD-CD1 4.48Å; M262-Y264 HydrophobicContact SD-CE1 3.58Å; M262-Y264 VanDerWaalsContact SD-CE1 3.58Å; M262-A302 HydrophobicContact CE-CB 4.42Å; M262-A302 HydrophobicContact CG-CB 3.95Å; M262-A302 HydrophobicContact SD-CB 3.76Å
263	T	98.4	Very high	97.7	Very high	56 Å²	56	55.6 Å²	55.6	34%	0.344	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	133.7	169.6	-39	0	0	0	0	109.2	T249 R251 E260	T249-T263 HydrophobicContact CG2-CG2 4.22Å; R251-T263 HydrophobicContact CG-CG2 4.16Å; E260-T263 PolarHBondContact OE1-OG1 3.32Å
264	Y	98.5	Very high	97.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	110.6	172.5	-48	-82.5	0	0	0	109	C250 L252 M262 L285 W297 A299 A302	C250-Y264 HydrophobicContact CB-CD2 3.75Å; C250-Y264 HydrophobicContact CB-CG 4.35Å; C250-Y264 PolarHBondContact N-O 3.18Å; C250-Y264 PolarHBondContact O-N 2.77Å; L252-Y264 HydrophobicContact CB-CE2 3.9Å; L252-Y264 WeakPolarHBondContact CD2-OH 3.42Å; M262-Y264 HydrophobicContact CG-CD1 4.41Å; M262-Y264 HydrophobicContact CG-CE1 3.86Å; M262-Y264 HydrophobicContact SD-CD1 4.48Å; M262-Y264 HydrophobicContact SD-CE1 3.58Å; M262-Y264 VanDerWaalsContact SD-CE1 3.58Å; Y264-L285 HydrophobicContact CD2-CD2 3.72Å; Y264-L285 HydrophobicContact CE2-CD2 3.62Å; Y264-L285 HydrophobicContact CG-CD2 4.46Å; Y264-W297 HydrophobicContact CD1-CB 4.17Å; Y264-W297 HydrophobicContact CD1-CE3 4.38Å; Y264-W297 HydrophobicContact CD1-CG 4.46Å; Y264-W297 HydrophobicContact CG-CG 4.47Å; Y264-A299 WeakPolarHBondContact OH-CA 3.28Å; Y264-A299 PolarHBondContact OH-O 2.89Å; Y264-A302 HydrophobicContact CD1-CB 4.18Å; Y264-A302 HydrophobicContact CE1-CB 4.42Å
265	S	97.6	Very high	97.7	Very high	66 Å²	66	55.3 Å²	55.3	46%	0.462	29%	0.291	S	S	.	.			trans	-146.7	160.3	-179.2	65.3	0	0	0	0	110.8	W297	S265-W297 WeakPolarHBondContact O-CH2 3.44Å
266	H	97.1	Very high	97.7	Very high	67 Å²	67	55 Å²	55	31%	0.31	29%	0.29	S	S	.	.			trans	-148.6	136.4	174.3	-172	62.1	0	0	0	109.4	N268 I269 W297 R304	H266-N268 PolarHBondContact NE2-ND2 3.22Å; H266-N268 PolarHBondContact O-N 3.17Å; H266-I269 HydrophobicContact CB-CB 4.47Å; H266-I269 HydrophobicContact CB-CD1 3.86Å; H266-I269 HydrophobicContact CB-CG1 4.05Å; H266-I269 PolarHBondContact O-N 3.37Å; H266-W297 HydrophobicContact CB-CH2 3.96Å; H266-R304 PolarHBondContact NE2-NH2 2.92Å
267	D	95.6	Very high	97.7	Very high	154 Å²	154	46.1 Å²	46.1	82%	0.824	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.2	-172	-58.1	-29.3	0	0	0	114.4
268	N	95.6	Very high	97.7	Very high	132 Å²	132	45.1 Å²	45.1	71%	0.706	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-3.5	178.7	-60.5	-56.5	0	0	0	113.8	H266	H266-N268 PolarHBondContact NE2-ND2 3.22Å; H266-N268 PolarHBondContact O-N 3.17Å
269	I	95.7	Very high	97.7	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.067	25%	0.245	C	C	.	.			trans	-107.2	104	179.9	-57.7	176.2	0	0	0	107.5	H266 Y289 W297	H266-I269 HydrophobicContact CB-CB 4.47Å; H266-I269 HydrophobicContact CB-CD1 3.86Å; H266-I269 HydrophobicContact CB-CG1 4.05Å; H266-I269 PolarHBondContact O-N 3.37Å; I269-Y289 HydrophobicContact CG2-CD1 3.56Å; I269-Y289 HydrophobicContact CG2-CE1 3.35Å; I269-W297 HydrophobicContact CD1-CH2 4.49Å; I269-W297 HydrophobicContact CD1-CZ2 4.09Å
270	I	96.4	Very high	97.8	Very high	146 Å²	146	48.5 Å²	48.5	75%	0.749	26%	0.264	S	S	*	.			trans	-116.2	2.7	-178.6	62	170.7	0	0	0	112.8
271	C	97.4	Very high	97.8	Very high	40 Å²	40	50.1 Å²	50.1	27%	0.27	28%	0.281	S	S	.	.	S	Bend	trans	-95.2	144.9	-177.9	-69.7	0	0	0	0	110.5	A248 Y289 D290 D291	A248-C271 VanDerWaalsContact CB-O 3.27Å; A248-C271 WeakPolarHBondContact CB-O 3.44Å; C271-Y289 WeakPolarHBondContact O-CD1 3.31Å; C271-D290 HydrophobicContact CB-CB 4.13Å; C271-D291 HydrophobicContact CB-CB 3.89Å
272	G	97.8	Very high	97.8	Very high	8 Å²	8	47.7 Å²	47.7	8%	0.082	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-63.7	154.2	-178.3	0	0	0	0	0	113.7	Y289 D290	G272-Y289 WeakPolarHBondContact O-CA 3.41Å; G272-D290 PolarHBondContact O-N 2.8Å
273	I	98.7	Very high	97.9	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.5	176.7	-63.9	145.6	0	0	0	109.3	N230 S245 T249 C250 V276 A287 Y289	N230-I273 VanDerWaalsContact CB-O 3.24Å; N230-I273 WeakPolarHBondContact CB-O 3.36Å; N230-I273 PolarHBondContact ND2-O 3.46Å; S245-I273 PolarHBondContact O-N 3.02Å; T249-I273 WeakPolarHBondContact O-CD1 3.39Å; C250-I273 HydrophobicContact CB-CD1 4.45Å; C250-I273 WeakPolarHBondContact SG-CD1 3.22Å; I273-V276 HydrophobicContact CG2-CG1 3.72Å; I273-A287 HydrophobicContact CG2-CB 4.36Å; I273-Y289 HydrophobicContact CD1-CE1 3.83Å; I273-Y289 HydrophobicContact CG1-CD1 3.63Å; I273-Y289 HydrophobicContact CG1-CE1 3.23Å; I273-Y289 HydrophobicContact CG1-CE2 4.2Å; I273-Y289 HydrophobicContact CG1-CG 4.26Å
274	T	98.6	Very high	97.9	Very high	16 Å²	16	48.3 Å²	48.3	10%	0.098	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-26.2	-173.2	67.9	0	0	0	0	112.6	G288 R314 V315	T274-G288 PolarHBondContact N-O 2.95Å; T274-G288 PolarHBondContact OG1-O 3.09Å; T274-R314 HydrophobicContact CG2-CG 4.12Å; T274-R314 VanDerWaalsContact CG2-CZ 3.49Å; T274-R314 VanDerWaalsContact CG2-NE 3.32Å; T274-V315 VanDerWaalsContact CB-O 3.28Å; T274-V315 WeakPolarHBondContact CB-O 3.28Å; T274-V315 WeakPolarHBondContact CG2-O 3.36Å; T274-V315 PolarHBondContact OG1-O 3.28Å
275	S	98.7	Very high	97.9	Very high	17 Å²	17	48.3 Å²	48.3	12%	0.119	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	141.8	-176.1	-163.9	0	0	0	0	110.4	A287 G288 L318	S275-A287 CarbonylContact O-C 3.57Å; S275-A287 WeakPolarHBondContact O-CA 3.24Å; S275-G288 PolarHBondContact O-N 2.7Å; S275-L318 PolarHBondContact OG-N 2.62Å
276	V	98.8	Very high	97.9	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.055	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.3	175.1	-62	0	0	0	0	110.4	A231 C233 I273 L285 L286 A287	A231-V276 HydrophobicContact CB-CG1 4.41Å; A231-V276 HydrophobicContact CB-CG2 3.91Å; C233-V276 HydrophobicContact CB-CG2 4Å; I273-V276 HydrophobicContact CG2-CG1 3.72Å; V276-L285 HydrophobicContact CB-CD1 4.24Å; V276-L286 CarbonylContact C-O 3.54Å; V276-L286 VanDerWaalsContact CA-O 3.27Å; V276-L286 WeakPolarHBondContact CA-O 3.14Å; V276-A287 HydrophobicContact CG1-CB 4.03Å
277	S	98.8	Very high	98	Very high	18 Å²	18	42.1 Å²	42.1	13%	0.126	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	140.1	172.7	-165.9	0	0	0	0	111	L286	S277-L286 PolarHBondContact N-O 2.78Å; S277-L286 WeakPolarHBondContact O-CB 3.43Å; S277-L286 PolarHBondContact O-N 3.44Å
278	F	98.8	Very high	98.2	Very high	11 Å²	11	34.8 Å²	34.8	5%	0.048	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	146	173.3	-78.9	-76.5	0	0	0	111.6	F234 F235 P236 A242 L252 G282 L285 A299 V320	F234-F278 WeakPolarHBondContact O-CD2 3.45Å; F235-F278 HydrophobicContact CB-CE2 4.21Å; F235-F278 HydrophobicContact CD2-CD1 4.02Å; F235-F278 HydrophobicContact CD2-CD2 4.47Å; F235-F278 AromaticContact CD2-CE1 3.71Å; F235-F278 HydrophobicContact CD2-CE1 3.71Å; F235-F278 HydrophobicContact CD2-CE2 4.18Å; F235-F278 HydrophobicContact CD2-CG 4.38Å; F235-F278 AromaticContact CD2-CZ 3.8Å; F235-F278 HydrophobicContact CD2-CZ 3.8Å; F235-F278 HydrophobicContact CE2-CD1 4.36Å; F235-F278 HydrophobicContact CE2-CE1 4.16Å; P236-F278 HydrophobicContact CG-CB 4.32Å; A242-F278 HydrophobicContact CB-CE2 3.48Å; A242-F278 VanDerWaalsContact CB-CE2 3.48Å; A242-F278 HydrophobicContact CB-CZ 3.56Å; L252-F278 HydrophobicContact CD1-CZ 4.04Å; F278-G282 WeakPolarHBondContact CD1-O 3.24Å; F278-L285 HydrophobicContact CD1-CB 4.24Å; F278-L285 HydrophobicContact CD1-CD1 4.16Å; F278-L285 HydrophobicContact CD2-CD1 4.34Å; F278-L285 HydrophobicContact CE1-CB 3.99Å; F278-L285 HydrophobicContact CE1-CD1 3.99Å; F278-L285 HydrophobicContact CE1-CG 4.46Å; F278-L285 HydrophobicContact CE2-CD1 4.2Å; F278-L285 HydrophobicContact CG-CD1 4.34Å; F278-L285 HydrophobicContact CZ-CD1 4.01Å; F278-A299 HydrophobicContact CE1-CB 4.09Å; F278-V320 WeakPolarHBondContact O-CG2 3.45Å
279	S	98.7	Very high	98.3	Very high	19 Å²	19	28.6 Å²	28.6	13%	0.133	16%	0.157	C	C	.	.			trans	-60.2	161.8	157.9	59.1	0	0	0	0	111.4	S281 G282 R283 L284	S279-S281 VanDerWaalsContact C-N 3.26Å; S279-S281 PolarHBondContact O-N 3.32Å; S279-S281 VanDerWaalsContact O-N 3.13Å; S279-G282 WeakPolarHBondContact O-CA 3.25Å; S279-G282 PolarHBondContact O-N 3.29Å; S279-R283 PolarHBondContact OG-N 2.83Å; S279-L284 PolarHBondContact N-O 2.6Å; S279-L284 PolarHBondContact OG-N 2.93Å; S279-L284 PolarHBondContact OG-O 3.26Å
280	K	98.4	Very high	98.4	Very high	130 Å²	130	30.6 Å²	30.6	57%	0.565	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-38.9	-178.5	-177.8	174.5	-173.2	65.5	0	114.7	P236 G282 D322 D323	P236-K280 WeakPolarHBondContact CG-O 3.44Å; K280-G282 VanDerWaalsContact C-N 3.33Å; K280-D322 PolarHBondContact NZ-O 3.46Å; K280-D323 WeakPolarHBondContact CD-O 3.5Å
281	S	98.3	Very high	98.5	Very high	86 Å²	86	26 Å²	26	60%	0.601	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.5	177.9	63.2	0	0	0	0	113.5	S279 R283	S279-S281 VanDerWaalsContact C-N 3.26Å; S279-S281 PolarHBondContact O-N 3.32Å; S279-S281 VanDerWaalsContact O-N 3.13Å; S281-R283 PolarHBondContact O-N 3.18Å; S281-R283 WeakPolarHBondContact OG-CB 3.44Å; S281-R283 PolarHBondContact OG-N 3.14Å
282	G	98.4	Very high	98.5	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.021	15%	0.149	C	C	.	.	S	Bend	trans	77.4	-3.1	-170.4	0	0	0	0	0	114.4	F235 F278 S279 K280 L284 A299	F235-G282 VanDerWaalsContact CE2-CA 3.49Å; F235-G282 WeakPolarHBondContact CE2-O 3.13Å; F278-G282 WeakPolarHBondContact CD1-O 3.24Å; S279-G282 WeakPolarHBondContact O-CA 3.25Å; S279-G282 PolarHBondContact O-N 3.29Å; K280-G282 VanDerWaalsContact C-N 3.33Å; G282-L284 VanDerWaalsContact C-N 3.35Å; G282-L284 PolarHBondContact O-N 2.9Å; G282-A299 VanDerWaalsContact O-CB 3.31Å; G282-A299 WeakPolarHBondContact O-CB 3.21Å
283	R	98.4	Very high	98.5	Very high	59 Å²	59	29.7 Å²	29.7	22%	0.223	16%	0.156	C	C	.	.	S	Bend	trans	-67.8	-34.2	-177.1	-178.4	59.3	-172.5	-83	1.8	113.1	D38 V40 S279 S281 D298 A299	D38-R283 PolarHBondContact O-NH2 2.78Å; V40-R283 HydrophobicContact CG2-CG 3.76Å; S279-R283 PolarHBondContact OG-N 2.83Å; S281-R283 PolarHBondContact O-N 3.18Å; S281-R283 WeakPolarHBondContact OG-CB 3.44Å; S281-R283 PolarHBondContact OG-N 3.14Å; R283-D298 IonicContact CZ-OD1 3.34Å; R283-D298 IonicContact CZ-OD2 2.99Å; R283-D298 IonicContact NE-OD1 2.81Å; R283-D298 PolarHBondContact NE-OD1 2.85Å; R283-D298 IonicContact NE-OD2 3.83Å; R283-D298 PolarHBondContact NE-OD2 2.91Å; R283-D298 IonicContact NH2-OD1 3.92Å; R283-D298 IonicContact NH2-OD2 2.99Å; R283-D298 PolarHBondContact NH2-OD2 2.82Å; R283-A299 WeakPolarHBondContact O-CB 3.21Å; R283-A299 PolarHBondContact O-N 3.25Å
284	L	98.7	Very high	98.5	Very high	22 Å²	22	29.7 Å²	29.7	12%	0.115	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134	173.3	-58	177.8	0	0	0	110.2	V40 I43 S279 G282 V296 W297 A305	V40-L284 HydrophobicContact CB-CD2 4.49Å; V40-L284 HydrophobicContact CG1-CD2 4.2Å; V40-L284 HydrophobicContact CG2-CD2 4.2Å; I43-L284 HydrophobicContact CD1-CD1 4.26Å; I43-L284 HydrophobicContact CG1-CD1 4.11Å; I43-L284 HydrophobicContact CG1-CD2 4.34Å; S279-L284 PolarHBondContact N-O 2.6Å; S279-L284 PolarHBondContact OG-N 2.93Å; S279-L284 PolarHBondContact OG-O 3.26Å; G282-L284 VanDerWaalsContact C-N 3.35Å; G282-L284 PolarHBondContact O-N 2.9Å; L284-V296 HydrophobicContact CB-CG1 4.16Å; L284-V296 HydrophobicContact CD1-CG1 4.08Å; L284-V296 HydrophobicContact CD2-CG1 4.15Å; L284-V296 HydrophobicContact CG-CG1 4.36Å; L284-W297 WeakPolarHBondContact CA-O 3.28Å; L284-A305 HydrophobicContact CD2-CB 4.41Å
285	L	98.8	Very high	98.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.5	166.9	174.8	64	0	0	0	108.5	A242 C250 Y264 V276 F278 W297 A299	A242-L285 HydrophobicContact CB-CD1 3.93Å; A242-L285 HydrophobicContact CB-CD2 4.03Å; C250-L285 HydrophobicContact CB-CD2 4Å; Y264-L285 HydrophobicContact CD2-CD2 3.72Å; Y264-L285 HydrophobicContact CE2-CD2 3.62Å; Y264-L285 HydrophobicContact CG-CD2 4.46Å; V276-L285 HydrophobicContact CB-CD1 4.24Å; F278-L285 HydrophobicContact CD1-CB 4.24Å; F278-L285 HydrophobicContact CD1-CD1 4.16Å; F278-L285 HydrophobicContact CD2-CD1 4.34Å; F278-L285 HydrophobicContact CE1-CB 3.99Å; F278-L285 HydrophobicContact CE1-CD1 3.99Å; F278-L285 HydrophobicContact CE1-CG 4.46Å; F278-L285 HydrophobicContact CE2-CD1 4.2Å; F278-L285 HydrophobicContact CG-CD1 4.34Å; F278-L285 HydrophobicContact CZ-CD1 4.01Å; L285-W297 HydrophobicContact CB-CB 4.27Å; L285-W297 PolarHBondContact N-O 2.86Å; L285-W297 PolarHBondContact O-N 3.28Å; L285-A299 HydrophobicContact CB-CB 4.4Å
286	L	98.8	Very high	98.5	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.016	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.2	176.4	-64.4	140.5	0	0	0	108.4	V276 S277 V296 L308 L318 V320 V327	V276-L286 CarbonylContact C-O 3.54Å; V276-L286 VanDerWaalsContact CA-O 3.27Å; V276-L286 WeakPolarHBondContact CA-O 3.14Å; S277-L286 PolarHBondContact N-O 2.78Å; S277-L286 WeakPolarHBondContact O-CB 3.43Å; S277-L286 PolarHBondContact O-N 3.44Å; L286-V296 HydrophobicContact CD2-CB 4.48Å; L286-V296 HydrophobicContact CD2-CG1 4.12Å; L286-V296 HydrophobicContact CD2-CG2 3.86Å; L286-L308 HydrophobicContact CD2-CD1 4.29Å; L286-L318 HydrophobicContact CB-CD1 3.85Å; L286-L318 HydrophobicContact CB-CD2 3.8Å; L286-L318 HydrophobicContact CD1-CD2 4.46Å; L286-V320 HydrophobicContact CD1-CG2 3.38Å; L286-V327 HydrophobicContact CD1-CG1 4.03Å; L286-V327 HydrophobicContact CD1-CG2 3.74Å; L286-V327 HydrophobicContact CD2-CG1 4.38Å; L286-V327 HydrophobicContact CD2-CG2 4.38Å
287	A	98.9	Very high	98.4	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	125.6	179.5	0	0	0	0	0	110.3	C250 I273 S275 V276 Y289 C294 N295	C250-A287 VanDerWaalsContact SG-CB 3.59Å; I273-A287 HydrophobicContact CG2-CB 4.36Å; S275-A287 CarbonylContact O-C 3.57Å; S275-A287 WeakPolarHBondContact O-CA 3.24Å; V276-A287 HydrophobicContact CG1-CB 4.03Å; A287-Y289 HydrophobicContact CB-CD2 4.27Å; A287-Y289 HydrophobicContact CB-CE2 3.47Å; A287-Y289 VanDerWaalsContact CB-CE2 3.47Å; A287-Y289 WeakPolarHBondContact O-CD2 3.24Å; A287-Y289 WeakPolarHBondContact O-CE2 3.49Å; A287-C294 CarbonylContact O-C 3.57Å; A287-C294 WeakPolarHBondContact O-CA 3.33Å; A287-N295 PolarHBondContact N-O 2.89Å; A287-N295 PolarHBondContact O-N 2.97Å
288	G	98.7	Very high	98.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.1	173.4	0	0	0	0	0	110.7	T274 S275	T274-G288 PolarHBondContact N-O 2.95Å; T274-G288 PolarHBondContact OG1-O 3.09Å; S275-G288 PolarHBondContact O-N 2.7Å
289	Y	98.5	Very high	98.4	Very high	1 Å²	1	26.8 Å²	26.8	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	161.6	-172.5	-72.4	-105	0	0	0	111.6	I269 C271 G272 I273 A287 D291 F292 N293 N295 W297 V315	I269-Y289 HydrophobicContact CG2-CD1 3.56Å; I269-Y289 HydrophobicContact CG2-CE1 3.35Å; C271-Y289 WeakPolarHBondContact O-CD1 3.31Å; G272-Y289 WeakPolarHBondContact O-CA 3.41Å; I273-Y289 HydrophobicContact CD1-CE1 3.83Å; I273-Y289 HydrophobicContact CG1-CD1 3.63Å; I273-Y289 HydrophobicContact CG1-CE1 3.23Å; I273-Y289 HydrophobicContact CG1-CE2 4.2Å; I273-Y289 HydrophobicContact CG1-CG 4.26Å; A287-Y289 HydrophobicContact CB-CD2 4.27Å; A287-Y289 HydrophobicContact CB-CE2 3.47Å; A287-Y289 VanDerWaalsContact CB-CE2 3.47Å; A287-Y289 WeakPolarHBondContact O-CD2 3.24Å; A287-Y289 WeakPolarHBondContact O-CE2 3.49Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.45Å; Y289-D291 PolarHBondContact O-N 2.87Å; Y289-F292 PolarHBondContact O-N 2.91Å; Y289-N293 PolarHBondContact N-O 3.05Å; Y289-N295 HydrophobicContact CD2-CB 4.33Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.26Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.29Å; Y289-N295 HydrophobicContact CE2-CB 3.72Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.29Å; Y289-W297 PolarHBondContact OH-NE1 3.37Å; Y289-W297 VanDerWaalsContact OH-NE1 3.08Å; Y289-V315 PolarHBondContact O-N 3.36Å
290	D	97.9	Very high	98.4	Very high	55 Å²	55	28.5 Å²	28.5	29%	0.294	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.8	176	-162.7	55.1	0	0	0	113.5	C271 G272 F292 R314	C271-D290 HydrophobicContact CB-CB 4.13Å; G272-D290 PolarHBondContact O-N 2.8Å; D290-F292 WeakPolarHBondContact O-CD1 3.25Å; D290-F292 VanDerWaalsContact O-CE1 3.26Å; D290-F292 WeakPolarHBondContact O-CE1 3.37Å; D290-F292 PolarHBondContact O-N 3.18Å; D290-R314 VanDerWaalsContact CG-NH1 3.34Å; D290-R314 WeakPolarHBondContact OD1-CD 3.43Å; D290-R314 WeakPolarHBondContact OD1-CG 3.5Å; D290-R314 IonicContact OD1-CZ 2.77Å; D290-R314 IonicContact OD1-NE 3.88Å; D290-R314 PolarHBondContact OD1-NE 2.93Å; D290-R314 IonicContact OD1-NH1 2.9Å; D290-R314 PolarHBondContact OD1-NH1 3.39Å; D290-R314 IonicContact OD2-NH1 3.99Å
291	D	97.4	Very high	98.3	Very high	49 Å²	49	25.1 Å²	25.1	26%	0.262	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	14.5	174.4	76.8	-20.5	0	0	0	114	C271 Y289 N293	C271-D291 HydrophobicContact CB-CB 3.89Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.45Å; Y289-D291 PolarHBondContact O-N 2.87Å; D291-N293 PolarHBondContact O-N 2.85Å; D291-N293 PolarHBondContact O-ND2 2.88Å; D291-N293 WeakPolarHBondContact OD1-CB 3.38Å; D291-N293 PolarHBondContact OD1-N 2.86Å; D291-N293 PolarHBondContact OD2-ND2 3.49Å
292	F	98.1	Very high	98.3	Very high	86 Å²	86	22.8 Å²	22.8	38%	0.377	12%	0.116	S	C	.	.	S	Bend	trans	76	0.5	175.4	-39	-21.1	0	0	0	114.3	Y289 D290 N313	Y289-F292 PolarHBondContact O-N 2.91Å; D290-F292 WeakPolarHBondContact O-CD1 3.25Å; D290-F292 VanDerWaalsContact O-CE1 3.26Å; D290-F292 WeakPolarHBondContact O-CE1 3.37Å; D290-F292 PolarHBondContact O-N 3.18Å; F292-N313 WeakPolarHBondContact CB-O 2.9Å; F292-N313 VanDerWaalsContact CD1-CA 3.48Å; F292-N313 VanDerWaalsContact CG-C 3.45Å
293	N	97.7	Very high	98.2	Very high	41 Å²	41	27.4 Å²	27.4	22%	0.219	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	157.3	-179.9	-59.5	-53.4	0	0	0	111.7	Y289 D291 V307 A309	Y289-N293 PolarHBondContact N-O 3.05Å; D291-N293 PolarHBondContact O-N 2.85Å; D291-N293 PolarHBondContact O-ND2 2.88Å; D291-N293 WeakPolarHBondContact OD1-CB 3.38Å; D291-N293 PolarHBondContact OD1-N 2.86Å; D291-N293 PolarHBondContact OD2-ND2 3.49Å; N293-V307 HydrophobicContact CB-CG2 4.12Å; N293-A309 WeakPolarHBondContact OD1-CA 3.43Å; N293-A309 WeakPolarHBondContact OD1-CB 3.15Å
294	C	98.4	Very high	98.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.3	158.5	-53.7	0	0	0	0	109.8	A287 L308 L318 T329	A287-C294 CarbonylContact O-C 3.57Å; A287-C294 WeakPolarHBondContact O-CA 3.33Å; C294-L308 HydrophobicContact CB-CB 4.06Å; C294-L308 HydrophobicContact CB-CD1 4.25Å; C294-L308 HydrophobicContact CB-CG 4.37Å; C294-L308 PolarHBondContact N-O 3.23Å; C294-L308 VanDerWaalsContact N-O 3.14Å; C294-L308 PolarHBondContact O-N 3.34Å; C294-L318 HydrophobicContact CB-CD1 4.27Å; C294-T329 VanDerWaalsContact SG-CG2 3.58Å
295	N	98.4	Very high	98.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.011	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	143.6	173.8	-65.1	-76.8	0	0	0	110	A287 Y289 R304	A287-N295 PolarHBondContact N-O 2.89Å; A287-N295 PolarHBondContact O-N 2.97Å; Y289-N295 HydrophobicContact CD2-CB 4.33Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.26Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.29Å; Y289-N295 HydrophobicContact CE2-CB 3.72Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.29Å; N295-R304 WeakPolarHBondContact OD1-CD 3.28Å; N295-R304 PolarHBondContact OD1-NH1 2.8Å
296	V	98.6	Very high	98.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.6	176.9	-166.6	0	0	0	0	107.9	L284 L286 R304 A305 G306 L308	L284-V296 HydrophobicContact CB-CG1 4.16Å; L284-V296 HydrophobicContact CD1-CG1 4.08Å; L284-V296 HydrophobicContact CD2-CG1 4.15Å; L284-V296 HydrophobicContact CG-CG1 4.36Å; L286-V296 HydrophobicContact CD2-CB 4.48Å; L286-V296 HydrophobicContact CD2-CG1 4.12Å; L286-V296 HydrophobicContact CD2-CG2 3.86Å; V296-R304 CarbonylContact O-C 3.6Å; V296-A305 PolarHBondContact O-N 2.71Å; V296-G306 PolarHBondContact N-O 2.76Å; V296-G306 PolarHBondContact O-N 3.43Å; V296-G306 VanDerWaalsContact O-N 3.09Å; V296-L308 HydrophobicContact CG2-CD1 4.48Å; V296-L308 HydrophobicContact CG2-CD2 4.34Å; V296-L308 HydrophobicContact CG2-CG 4.09Å
297	W	98.7	Very high	98	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.011	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	138.9	-177.3	-62.9	98.9	0	0	0	111.1	Y264 S265 H266 I269 L284 L285 Y289 A299 R304	Y264-W297 HydrophobicContact CD1-CB 4.17Å; Y264-W297 HydrophobicContact CD1-CE3 4.38Å; Y264-W297 HydrophobicContact CD1-CG 4.46Å; Y264-W297 HydrophobicContact CG-CG 4.47Å; S265-W297 WeakPolarHBondContact O-CH2 3.44Å; H266-W297 HydrophobicContact CB-CH2 3.96Å; I269-W297 HydrophobicContact CD1-CH2 4.49Å; I269-W297 HydrophobicContact CD1-CZ2 4.09Å; L284-W297 WeakPolarHBondContact CA-O 3.28Å; L285-W297 HydrophobicContact CB-CB 4.27Å; L285-W297 PolarHBondContact N-O 2.86Å; L285-W297 PolarHBondContact O-N 3.28Å; Y289-W297 PolarHBondContact OH-NE1 3.37Å; Y289-W297 VanDerWaalsContact OH-NE1 3.08Å; W297-A299 PolarHBondContact O-N 3.13Å; W297-R304 HydrophobicContact CE3-CB 4.13Å; W297-R304 HydrophobicContact CH2-CB 4.48Å; W297-R304 HydrophobicContact CZ3-CB 4.03Å
298	D	98.5	Very high	98	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	106.6	162.3	-174.7	-20.2	0	0	0	108.4	V40 R283 L300 K301 A302 D303	V40-D298 WeakPolarHBondContact CG2-OD2 3.25Å; R283-D298 IonicContact CZ-OD1 3.34Å; R283-D298 IonicContact CZ-OD2 2.99Å; R283-D298 IonicContact NE-OD1 2.81Å; R283-D298 PolarHBondContact NE-OD1 2.85Å; R283-D298 IonicContact NE-OD2 3.83Å; R283-D298 PolarHBondContact NE-OD2 2.91Å; R283-D298 IonicContact NH2-OD1 3.92Å; R283-D298 IonicContact NH2-OD2 2.99Å; R283-D298 PolarHBondContact NH2-OD2 2.82Å; D298-L300 PolarHBondContact O-N 2.88Å; D298-L300 PolarHBondContact OD1-N 2.94Å; D298-L300 VanDerWaalsContact OD1-N 3.07Å; D298-K301 HydrophobicContact CB-CB 4.1Å; D298-K301 HydrophobicContact CB-CG 4.49Å; D298-K301 PolarHBondContact O-N 2.89Å; D298-K301 VanDerWaalsContact O-N 3.13Å; D298-K301 WeakPolarHBondContact OD2-CG 3.49Å; D298-A302 PolarHBondContact O-N 3.42Å; D298-D303 PolarHBondContact N-O 3.41Å
299	A	98.4	Very high	97.9	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.008	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.4	-172.9	0	0	0	0	0	113.4	Y264 F278 G282 R283 L285 W297	Y264-A299 WeakPolarHBondContact OH-CA 3.28Å; Y264-A299 PolarHBondContact OH-O 2.89Å; F278-A299 HydrophobicContact CE1-CB 4.09Å; G282-A299 VanDerWaalsContact O-CB 3.31Å; G282-A299 WeakPolarHBondContact O-CB 3.21Å; R283-A299 WeakPolarHBondContact O-CB 3.21Å; R283-A299 PolarHBondContact O-N 3.25Å; L285-A299 HydrophobicContact CB-CB 4.4Å; W297-A299 PolarHBondContact O-N 3.13Å
300	L	98.1	Very high	97.8	Very high	55 Å²	55	36.1 Å²	36.1	29%	0.288	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-16.2	178.6	-65.5	-178.8	0	0	0	113.7	L30 T34 D298	L30-L300 HydrophobicContact CD1-CD2 4.41Å; L30-L300 HydrophobicContact CD2-CD2 4.49Å; T34-L300 WeakPolarHBondContact CB-O 3.47Å; T34-L300 HydrophobicContact CG2-CB 4.11Å; T34-L300 HydrophobicContact CG2-CD2 4.37Å; T34-L300 PolarHBondContact OG1-O 3.29Å; D298-L300 PolarHBondContact O-N 2.88Å; D298-L300 PolarHBondContact OD1-N 2.94Å; D298-L300 VanDerWaalsContact OD1-N 3.07Å
301	K	97.3	Very high	97.9	Very high	59 Å²	59	34 Å²	34	26%	0.257	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-6.7	-171.7	-56.3	-66.4	-67.8	-150.7	0	113.8	T34 N35 I37 D298 D303	T34-K301 PolarHBondContact O-NZ 3.48Å; N35-K301 PolarHBondContact O-NZ 3.28Å; N35-K301 VanDerWaalsContact O-NZ 3.1Å; I37-K301 HydrophobicContact CB-CD 4.39Å; I37-K301 PolarHBondContact O-NZ 3.43Å; D298-K301 HydrophobicContact CB-CB 4.1Å; D298-K301 HydrophobicContact CB-CG 4.49Å; D298-K301 PolarHBondContact O-N 2.89Å; D298-K301 VanDerWaalsContact O-N 3.13Å; D298-K301 WeakPolarHBondContact OD2-CG 3.49Å; K301-D303 HydrophobicContact CB-CB 4.49Å; K301-D303 PolarHBondContact O-N 3.11Å
302	A	97.4	Very high	97.9	Very high	37 Å²	37	37.8 Å²	37.8	31%	0.306	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	29	-174.1	0	0	0	0	0	114.2	M262 Y264 D298	M262-A302 HydrophobicContact CE-CB 4.42Å; M262-A302 HydrophobicContact CG-CB 3.95Å; M262-A302 HydrophobicContact SD-CB 3.76Å; Y264-A302 HydrophobicContact CD1-CB 4.18Å; Y264-A302 HydrophobicContact CE1-CB 4.42Å; D298-A302 PolarHBondContact O-N 3.42Å
303	D	97	Very high	97.9	Very high	100 Å²	100	36.4 Å²	36.4	54%	0.535	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	147	-179.7	-178.3	-109.5	0	0	0	111	D298 K301 A305	D298-D303 PolarHBondContact N-O 3.41Å; K301-D303 HydrophobicContact CB-CB 4.49Å; K301-D303 PolarHBondContact O-N 3.11Å; D303-A305 PolarHBondContact O-N 3.46Å; D303-A305 VanDerWaalsContact O-N 3.14Å
304	R	97.6	Very high	97.9	Very high	94 Å²	94	37 Å²	37	36%	0.355	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	94.9	177.9	-175.3	177	57	177.1	-6	110.1	H266 N295 V296 W297 G306	H266-R304 PolarHBondContact NE2-NH2 2.92Å; N295-R304 WeakPolarHBondContact OD1-CD 3.28Å; N295-R304 PolarHBondContact OD1-NH1 2.8Å; V296-R304 CarbonylContact O-C 3.6Å; W297-R304 HydrophobicContact CE3-CB 4.13Å; W297-R304 HydrophobicContact CH2-CB 4.48Å; W297-R304 HydrophobicContact CZ3-CB 4.03Å; R304-G306 VanDerWaalsContact C-N 3.29Å; R304-G306 WeakPolarHBondContact CG-O 3.24Å; R304-G306 PolarHBondContact O-N 3.06Å
305	A	97.8	Very high	98	Very high	7 Å²	7	37 Å²	37	6%	0.058	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	-27	177.4	0	0	0	0	0	113.6	R42 I43 L284 V296 D303	R42-A305 CarbonylContact C-O 3.57Å; R42-A305 WeakPolarHBondContact CA-O 3.5Å; I43-A305 HydrophobicContact CG1-CB 4.01Å; I43-A305 PolarHBondContact N-O 2.83Å; L284-A305 HydrophobicContact CD2-CB 4.41Å; V296-A305 PolarHBondContact O-N 2.71Å; D303-A305 PolarHBondContact O-N 3.46Å; D303-A305 VanDerWaalsContact O-N 3.14Å
306	G	97.6	Very high	98	Very high	7 Å²	7	37.6 Å²	37.6	7%	0.072	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	173.9	-179.1	0	0	0	0	0	114.7	V296 R304	V296-G306 PolarHBondContact N-O 2.76Å; V296-G306 PolarHBondContact O-N 3.43Å; V296-G306 VanDerWaalsContact O-N 3.09Å; R304-G306 VanDerWaalsContact C-N 3.29Å; R304-G306 WeakPolarHBondContact CG-O 3.24Å; R304-G306 PolarHBondContact O-N 3.06Å
307	V	97.8	Very high	98	Very high	66 Å²	66	38 Å²	38	40%	0.4	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	132.8	175.3	61.9	0	0	0	0	109.7	N293 A309	N293-V307 HydrophobicContact CB-CG2 4.12Å; V307-A309 HydrophobicContact CG2-CB 4.49Å
308	L	98.2	Very high	98	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	85.4	174.6	-46.6	-179.2	0	0	0	108	M45 L286 C294 V296 W339	M45-L308 HydrophobicContact CB-CD2 3.7Å; M45-L308 HydrophobicContact CG-CD2 4.36Å; M45-L308 HydrophobicContact SD-CD1 4.3Å; M45-L308 HydrophobicContact SD-CD2 4.12Å; L286-L308 HydrophobicContact CD2-CD1 4.29Å; C294-L308 HydrophobicContact CB-CB 4.06Å; C294-L308 HydrophobicContact CB-CD1 4.25Å; C294-L308 HydrophobicContact CB-CG 4.37Å; C294-L308 PolarHBondContact N-O 3.23Å; C294-L308 VanDerWaalsContact N-O 3.14Å; C294-L308 PolarHBondContact O-N 3.34Å; V296-L308 HydrophobicContact CG2-CD1 4.48Å; V296-L308 HydrophobicContact CG2-CD2 4.34Å; V296-L308 HydrophobicContact CG2-CG 4.09Å; L308-W339 HydrophobicContact CB-CD2 4.25Å; L308-W339 HydrophobicContact CB-CE3 4.24Å; L308-W339 HydrophobicContact CB-CH2 4.02Å; L308-W339 HydrophobicContact CB-CZ2 4.04Å; L308-W339 HydrophobicContact CB-CZ3 4.12Å; L308-W339 HydrophobicContact CD1-CB 4.41Å; L308-W339 HydrophobicContact CD1-CD2 4.04Å; L308-W339 HydrophobicContact CD1-CE3 4.5Å; L308-W339 HydrophobicContact CD1-CG 3.98Å; L308-W339 HydrophobicContact CD2-CD2 4.45Å; L308-W339 HydrophobicContact CD2-CE3 4.09Å; L308-W339 HydrophobicContact CD2-CZ3 4.46Å; L308-W339 HydrophobicContact CG-CD2 4.49Å
309	A	96.7	Very high	98	Very high	69 Å²	69	38.9 Å²	38.9	57%	0.57	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	102.6	177.4	0	0	0	0	0	109	N293 V307	N293-A309 WeakPolarHBondContact OD1-CA 3.43Å; N293-A309 WeakPolarHBondContact OD1-CB 3.15Å; V307-A309 HydrophobicContact CG2-CB 4.49Å
310	G	96.9	Very high	98	Very high	22 Å²	22	39.8 Å²	39.8	23%	0.227	23%	0.228	C	C	.	.			trans	-159.3	-11.9	178.4	0	0	0	0	0	116	K337	G310-K337 WeakPolarHBondContact O-CE 3.41Å; G310-K337 PolarHBondContact O-NZ 3.32Å
311	H	98.4	Very high	98	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.046	22%	0.216	C	C	.	.			trans	-84	151.9	171.9	-75.6	-71.5	0	0	0	110.7	V315 T329 S331 D333 F335	H311-V315 HydrophobicContact CB-CG2 4.34Å; H311-T329 PolarHBondContact NE2-O 3.48Å; H311-T329 PolarHBondContact NE2-OG1 2.82Å; H311-S331 VanDerWaalsContact CG-CB 3.49Å; H311-S331 WeakPolarHBondContact ND1-CB 3.44Å; H311-D333 WeakPolarHBondContact CA-OD2 3.16Å; H311-D333 IonicContact CE1-OD2 3.19Å; H311-D333 IonicContact CG-OD2 3.26Å; H311-D333 IonicContact ND1-OD1 3.31Å; H311-D333 PolarHBondContact ND1-OD1 3.4Å; H311-D333 IonicContact ND1-OD2 3.98Å; H311-D333 PolarHBondContact ND1-OD2 2.67Å; H311-F335 PolarHBondContact CE1-O 3.47Å
312	D	98.1	Very high	98	Very high	130 Å²	130	39.1 Å²	39.1	70%	0.695	23%	0.227	S	C	*	.	S	Bend	trans	-101.4	9.8	178.5	-65.9	-46.6	0	0	0	112	D333	D312-D333 HydrophobicContact CB-CB 4.44Å; D312-D333 PolarHBondContact N-OD2 2.85Å
313	N	98.3	Very high	98.1	Very high	56 Å²	56	40.8 Å²	40.8	30%	0.299	23%	0.232	S	C	.	.	S	Bend	trans	-159.9	173.6	178.4	-149.7	-35.1	0	0	0	110.7	F292 V315 S331 W332 D333	F292-N313 WeakPolarHBondContact CB-O 2.9Å; F292-N313 VanDerWaalsContact CD1-CA 3.48Å; F292-N313 VanDerWaalsContact CG-C 3.45Å; N313-V315 PolarHBondContact O-N 3.33Å; N313-S331 VanDerWaalsContact C-OG 3.31Å; N313-S331 PolarHBondContact O-OG 3.38Å; N313-W332 HydrophobicContact CB-CB 3.97Å; N313-D333 HydrophobicContact CB-CB 4.07Å
314	R	98.4	Very high	98.1	Very high	53 Å²	53	37.8 Å²	37.8	20%	0.2	22%	0.224	C	C	.	.			trans	-42.8	125	-179.7	175.6	-177.4	-174.5	121.5	-6.7	111.1	T274 D290 S316 S331 W332	T274-R314 HydrophobicContact CG2-CG 4.12Å; T274-R314 VanDerWaalsContact CG2-CZ 3.49Å; T274-R314 VanDerWaalsContact CG2-NE 3.32Å; D290-R314 VanDerWaalsContact CG-NH1 3.34Å; D290-R314 WeakPolarHBondContact OD1-CD 3.43Å; D290-R314 WeakPolarHBondContact OD1-CG 3.5Å; D290-R314 IonicContact OD1-CZ 2.77Å; D290-R314 IonicContact OD1-NE 3.88Å; D290-R314 PolarHBondContact OD1-NE 2.93Å; D290-R314 IonicContact OD1-NH1 2.9Å; D290-R314 PolarHBondContact OD1-NH1 3.39Å; D290-R314 IonicContact OD2-NH1 3.99Å; R314-S316 PolarHBondContact O-N 3.3Å; R314-S331 VanDerWaalsContact O-CA 3.26Å; R314-S331 WeakPolarHBondContact O-CA 3.28Å; R314-S331 WeakPolarHBondContact O-CB 3.3Å; R314-S331 PolarHBondContact O-OG 2.94Å; R314-W332 HydrophobicContact CB-CD2 3.92Å; R314-W332 HydrophobicContact CB-CE3 3.79Å; R314-W332 HydrophobicContact CB-CG 4.26Å; R314-W332 HydrophobicContact CB-CZ3 4.3Å; R314-W332 HydrophobicContact CG-CD2 4.34Å; R314-W332 HydrophobicContact CG-CE3 4.42Å; R314-W332 PolarHBondContact O-N 3.31Å
315	V	98.7	Very high	98.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	123.5	167.5	-177.8	0	0	0	0	106.5	T274 Y289 H311 N313	T274-V315 VanDerWaalsContact CB-O 3.28Å; T274-V315 WeakPolarHBondContact CB-O 3.28Å; T274-V315 WeakPolarHBondContact CG2-O 3.36Å; T274-V315 PolarHBondContact OG1-O 3.28Å; Y289-V315 PolarHBondContact O-N 3.36Å; H311-V315 HydrophobicContact CB-CG2 4.34Å; N313-V315 PolarHBondContact O-N 3.33Å
316	S	98.5	Very high	98.1	Very high	16 Å²	16	38.8 Å²	38.8	11%	0.112	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-27.2	-175.5	67.5	0	0	0	0	112.8	I58 Y59 R314 G330	I58-S316 PolarHBondContact O-OG 2.99Å; Y59-S316 PolarHBondContact O-OG 3.4Å; R314-S316 PolarHBondContact O-N 3.3Å; S316-G330 PolarHBondContact N-O 3.2Å; S316-G330 PolarHBondContact OG-O 2.75Å
317	C	98.6	Very high	98.2	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.061	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	148.3	-178.1	58.4	0	0	0	0	111.5	Y59 M61 T329 G330	Y59-C317 WeakPolarHBondContact O-CB 3.38Å; M61-C317 HydrophobicContact CG-CB 4.07Å; M61-C317 VanDerWaalsContact CG-SG 3.54Å; C317-T329 CarbonylContact O-C 3.45Å; C317-T329 WeakPolarHBondContact O-CA 3.47Å; C317-G330 PolarHBondContact N-O 2.82Å; C317-G330 PolarHBondContact O-N 3.09Å
318	L	98.7	Very high	98.2	Very high	13 Å²	13	35.6 Å²	35.6	7%	0.068	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	139.3	179.7	-172.9	152.7	0	0	0	108.9	S275 L286 C294 V320 V327 A328 T329	S275-L318 PolarHBondContact OG-N 2.62Å; L286-L318 HydrophobicContact CB-CD1 3.85Å; L286-L318 HydrophobicContact CB-CD2 3.8Å; L286-L318 HydrophobicContact CD1-CD2 4.46Å; C294-L318 HydrophobicContact CB-CD1 4.27Å; L318-V320 HydrophobicContact CD2-CG2 4.44Å; L318-V327 HydrophobicContact CD2-CG1 4.05Å; L318-V327 HydrophobicContact CG-CG1 4.13Å; L318-A328 CarbonylContact C-O 3.54Å; L318-A328 WeakPolarHBondContact CA-O 3.47Å; L318-T329 HydrophobicContact CD1-CG2 3.84Å; L318-T329 HydrophobicContact CG-CG2 3.96Å
319	G	98.5	Very high	98.3	Very high	10 Å²	10	35.5 Å²	35.5	10%	0.103	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	134.9	175.2	0	0	0	0	0	112.3	W63 A328	W63-G319 PolarHBondContact NE1-O 3.22Å; G319-A328 PolarHBondContact N-O 3.2Å; G319-A328 PolarHBondContact O-N 3.12Å
320	V	98.7	Very high	98.4	Very high	21 Å²	21	32.2 Å²	32.2	13%	0.127	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.2	172.5	-172.7	0	0	0	0	108.7	F278 L286 L318 V327	F278-V320 WeakPolarHBondContact O-CG2 3.45Å; L286-V320 HydrophobicContact CD1-CG2 3.38Å; L318-V320 HydrophobicContact CD2-CG2 4.44Å; V320-V327 HydrophobicContact CG2-CG1 4.31Å; V320-V327 HydrophobicContact CG2-CG2 4.16Å
321	T	98.7	Very high	98.4	Very high	4 Å²	4	31.2 Å²	31.2	3%	0.025	18%	0.176	C	C	.	.			trans	-68.8	151.3	173.7	56.4	0	0	0	0	111.6	W63 D323 G324 M325 A326	W63-T321 HydrophobicContact CD2-CG2 3.62Å; W63-T321 HydrophobicContact CE3-CG2 3.8Å; W63-T321 HydrophobicContact CG-CG2 4.18Å; W63-T321 HydrophobicContact CH2-CG2 3.87Å; W63-T321 HydrophobicContact CZ2-CG2 3.7Å; W63-T321 HydrophobicContact CZ3-CG2 3.91Å; T321-D323 WeakPolarHBondContact CB-OD1 3.44Å; T321-D323 PolarHBondContact O-N 2.81Å; T321-D323 PolarHBondContact OG1-OD1 3.11Å; T321-G324 WeakPolarHBondContact O-CA 3.45Å; T321-G324 PolarHBondContact O-N 3.13Å; T321-G324 PolarHBondContact OG1-N 3.28Å; T321-M325 PolarHBondContact OG1-N 2.89Å; T321-A326 HydrophobicContact CG2-CB 4.3Å; T321-A326 PolarHBondContact N-O 3.17Å; T321-A326 VanDerWaalsContact N-O 3.07Å; T321-A326 PolarHBondContact OG1-N 2.95Å; T321-A326 VanDerWaalsContact OG1-N 3.17Å; T321-A326 PolarHBondContact OG1-O 2.97Å
322	D	97.7	Very high	98.5	Very high	95 Å²	95	33.8 Å²	33.8	51%	0.508	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.1	-179.6	-72.3	-25	0	0	0	112.9	T65 K280 G324	T65-D322 WeakPolarHBondContact CA-OD2 3.43Å; K280-D322 PolarHBondContact NZ-O 3.46Å; D322-G324 VanDerWaalsContact C-N 3.29Å
323	D	98.2	Very high	98.5	Very high	73 Å²	73	28.7 Å²	28.7	39%	0.39	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.6	173.4	70.3	-2.8	0	0	0	113.7	S67 K280 T321 M325	S67-D323 PolarHBondContact OG-N 3.15Å; S67-D323 PolarHBondContact OG-OD1 3.31Å; K280-D323 WeakPolarHBondContact CD-O 3.5Å; T321-D323 WeakPolarHBondContact CB-OD1 3.44Å; T321-D323 PolarHBondContact O-N 2.81Å; T321-D323 PolarHBondContact OG1-OD1 3.11Å; D323-M325 PolarHBondContact O-N 3.19Å; D323-M325 VanDerWaalsContact OD1-CB 3.25Å; D323-M325 WeakPolarHBondContact OD1-CB 3.38Å; D323-M325 PolarHBondContact OD1-N 2.81Å
324	G	98.1	Very high	98.5	Very high	36 Å²	36	27 Å²	27	37%	0.371	15%	0.151	S	C	.	.	S	Bend	trans	71.3	11	-178.7	0	0	0	0	0	114.9	T321 D322	T321-G324 WeakPolarHBondContact O-CA 3.45Å; T321-G324 PolarHBondContact O-N 3.13Å; T321-G324 PolarHBondContact OG1-N 3.28Å; D322-G324 VanDerWaalsContact C-N 3.29Å
325	M	97.8	Very high	98.5	Very high	107 Å²	107	27.7 Å²	27.7	53%	0.527	16%	0.156	S	C	.	.	S	Bend	trans	-73.4	-26.9	-176	-175.3	60.5	96.5	0	0	113.5	T321 D323 N340	T321-M325 PolarHBondContact OG1-N 2.89Å; D323-M325 PolarHBondContact O-N 3.19Å; D323-M325 VanDerWaalsContact OD1-CB 3.25Å; D323-M325 WeakPolarHBondContact OD1-CB 3.38Å; D323-M325 PolarHBondContact OD1-N 2.81Å; M325-N340 VanDerWaalsContact O-CG 3.27Å; M325-N340 PolarHBondContact O-ND2 3.3Å
326	A	98.1	Very high	98.5	Very high	15 Å²	15	27.7 Å²	27.7	12%	0.124	16%	0.156	C	C	.	.			trans	-149.3	160.5	-178.7	0	0	0	0	0	113.1	T321 I338 W339	T321-A326 HydrophobicContact CG2-CB 4.3Å; T321-A326 PolarHBondContact N-O 3.17Å; T321-A326 VanDerWaalsContact N-O 3.07Å; T321-A326 PolarHBondContact OG1-N 2.95Å; T321-A326 VanDerWaalsContact OG1-N 3.17Å; T321-A326 PolarHBondContact OG1-O 2.97Å; A326-I338 HydrophobicContact CB-CG2 3.9Å; A326-W339 WeakPolarHBondContact CA-O 3.21Å
327	V	98.7	Very high	98.5	Very high	7 Å²	7	28.5 Å²	28.5	4%	0.042	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.9	171.7	-172.9	0	0	0	0	108.5	M45 L286 L318 V320 T329 I338 W339	M45-V327 HydrophobicContact CE-CG2 4.49Å; L286-V327 HydrophobicContact CD1-CG1 4.03Å; L286-V327 HydrophobicContact CD1-CG2 3.74Å; L286-V327 HydrophobicContact CD2-CG1 4.38Å; L286-V327 HydrophobicContact CD2-CG2 4.38Å; L318-V327 HydrophobicContact CD2-CG1 4.05Å; L318-V327 HydrophobicContact CG-CG1 4.13Å; V320-V327 HydrophobicContact CG2-CG1 4.31Å; V320-V327 HydrophobicContact CG2-CG2 4.16Å; V327-T329 HydrophobicContact CG1-CG2 4.47Å; V327-I338 CarbonylContact O-C 3.52Å; V327-I338 WeakPolarHBondContact O-CA 3.41Å; V327-W339 HydrophobicContact CB-CB 4.37Å; V327-W339 PolarHBondContact N-O 3.29Å; V327-W339 PolarHBondContact O-N 3.38Å
328	A	98.8	Very high	98.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.6	169.5	0	0	0	0	0	110.5	M61 W63 L318 G319 K337	M61-A328 HydrophobicContact CE-CB 3.58Å; M61-A328 HydrophobicContact SD-CB 4.35Å; W63-A328 HydrophobicContact CZ2-CB 3.6Å; L318-A328 CarbonylContact C-O 3.54Å; L318-A328 WeakPolarHBondContact CA-O 3.47Å; G319-A328 PolarHBondContact N-O 3.2Å; G319-A328 PolarHBondContact O-N 3.12Å; A328-K337 CarbonylContact C-O 3.38Å; A328-K337 VanDerWaalsContact CA-O 3.3Å; A328-K337 WeakPolarHBondContact CA-O 3.34Å
329	T	98.9	Very high	98.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.7	172.6	60.2	0	0	0	0	109.2	C294 H311 C317 L318 V327 L336 K337 W339	C294-T329 VanDerWaalsContact SG-CG2 3.58Å; H311-T329 PolarHBondContact NE2-O 3.48Å; H311-T329 PolarHBondContact NE2-OG1 2.82Å; C317-T329 CarbonylContact O-C 3.45Å; C317-T329 WeakPolarHBondContact O-CA 3.47Å; L318-T329 HydrophobicContact CD1-CG2 3.84Å; L318-T329 HydrophobicContact CG-CG2 3.96Å; V327-T329 HydrophobicContact CG1-CG2 4.47Å; T329-L336 CarbonylContact O-C 3.49Å; T329-L336 VanDerWaalsContact O-CA 3.26Å; T329-L336 WeakPolarHBondContact O-CA 3.17Å; T329-K337 PolarHBondContact N-O 2.92Å; T329-K337 PolarHBondContact O-N 3.01Å; T329-W339 PolarHBondContact OG1-NE1 2.95Å
330	G	98.7	Very high	98.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.6	175.1	0	0	0	0	0	111.2	S316 C317 L336	S316-G330 PolarHBondContact N-O 3.2Å; S316-G330 PolarHBondContact OG-O 2.75Å; C317-G330 PolarHBondContact N-O 2.82Å; C317-G330 PolarHBondContact O-N 3.09Å; G330-L336 VanDerWaalsContact CA-CD2 3.5Å
331	S	98.8	Very high	98.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	164	-174.2	167	0	0	0	0	112.4	I58 H311 N313 R314 D333 S334 F335	I58-S331 PolarHBondContact N-O 2.85Å; H311-S331 VanDerWaalsContact CG-CB 3.49Å; H311-S331 WeakPolarHBondContact ND1-CB 3.44Å; N313-S331 VanDerWaalsContact C-OG 3.31Å; N313-S331 PolarHBondContact O-OG 3.38Å; R314-S331 VanDerWaalsContact O-CA 3.26Å; R314-S331 WeakPolarHBondContact O-CA 3.28Å; R314-S331 WeakPolarHBondContact O-CB 3.3Å; R314-S331 PolarHBondContact O-OG 2.94Å; S331-D333 VanDerWaalsContact CB-OD1 3.25Å; S331-D333 WeakPolarHBondContact CB-OD1 3.47Å; S331-D333 PolarHBondContact O-N 3.48Å; S331-D333 VanDerWaalsContact OG-CG 3.31Å; S331-D333 PolarHBondContact OG-N 2.87Å; S331-D333 VanDerWaalsContact OG-N 3.17Å; S331-D333 PolarHBondContact OG-OD1 3.26Å; S331-S334 PolarHBondContact O-N 3Å; S331-S334 VanDerWaalsContact O-N 3.14Å; S331-F335 PolarHBondContact N-O 3.38Å
332	W	98.5	Very high	98.3	Very high	64 Å²	64	34.2 Å²	34.2	24%	0.242	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8	170.6	-71	4.9	0	0	0	114	K57 N313 R314 S334	K57-W332 HydrophobicContact CB-CB 4.16Å; K57-W332 HydrophobicContact CB-CG 3.95Å; K57-W332 HydrophobicContact CD-CB 4.09Å; K57-W332 HydrophobicContact CD-CD2 3.75Å; K57-W332 HydrophobicContact CD-CE3 4.21Å; K57-W332 HydrophobicContact CD-CG 3.71Å; K57-W332 HydrophobicContact CG-CB 3.85Å; K57-W332 HydrophobicContact CG-CD2 4.45Å; K57-W332 HydrophobicContact CG-CG 3.88Å; N313-W332 HydrophobicContact CB-CB 3.97Å; R314-W332 HydrophobicContact CB-CD2 3.92Å; R314-W332 HydrophobicContact CB-CE3 3.79Å; R314-W332 HydrophobicContact CB-CG 4.26Å; R314-W332 HydrophobicContact CB-CZ3 4.3Å; R314-W332 HydrophobicContact CG-CD2 4.34Å; R314-W332 HydrophobicContact CG-CE3 4.42Å; R314-W332 PolarHBondContact O-N 3.31Å; W332-S334 PolarHBondContact O-N 3.09Å
333	D	98.3	Very high	98.4	Very high	23 Å²	23	30.8 Å²	30.8	12%	0.123	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	1.9	167.3	68.2	10.2	0	0	0	113.7	H311 D312 N313 S331 F335	H311-D333 WeakPolarHBondContact CA-OD2 3.16Å; H311-D333 IonicContact CE1-OD2 3.19Å; H311-D333 IonicContact CG-OD2 3.26Å; H311-D333 IonicContact ND1-OD1 3.31Å; H311-D333 PolarHBondContact ND1-OD1 3.4Å; H311-D333 IonicContact ND1-OD2 3.98Å; H311-D333 PolarHBondContact ND1-OD2 2.67Å; D312-D333 HydrophobicContact CB-CB 4.44Å; D312-D333 PolarHBondContact N-OD2 2.85Å; N313-D333 HydrophobicContact CB-CB 4.07Å; S331-D333 VanDerWaalsContact CB-OD1 3.25Å; S331-D333 WeakPolarHBondContact CB-OD1 3.47Å; S331-D333 PolarHBondContact O-N 3.48Å; S331-D333 VanDerWaalsContact OG-CG 3.31Å; S331-D333 PolarHBondContact OG-N 2.87Å; S331-D333 VanDerWaalsContact OG-N 3.17Å; S331-D333 PolarHBondContact OG-OD1 3.26Å; D333-F335 HydrophobicContact CB-CD2 4.38Å; D333-F335 PolarHBondContact O-N 3.32Å; D333-F335 WeakPolarHBondContact OD1-CB 3.28Å; D333-F335 PolarHBondContact OD1-N 2.63Å
334	S	98.4	Very high	98.4	Very high	22 Å²	22	28.3 Å²	28.3	15%	0.154	15%	0.152	C	C	.	.	S	Bend	trans	68.9	16.1	179.8	-40	0	0	0	0	114.3	A56 S331 W332	A56-S334 VanDerWaalsContact O-CB 3.25Å; A56-S334 WeakPolarHBondContact O-CB 3.43Å; A56-S334 PolarHBondContact O-OG 3.21Å; S331-S334 PolarHBondContact O-N 3Å; S331-S334 VanDerWaalsContact O-N 3.14Å; W332-S334 PolarHBondContact O-N 3.09Å
335	F	98.6	Very high	98.4	Very high	66 Å²	66	27.8 Å²	27.8	29%	0.289	14%	0.138	S	C	.	.			trans	-111.8	144.8	174	-59.4	-47.5	0	0	0	113.1	T50 R52 I58 H311 S331 D333	T50-F335 HydrophobicContact CG2-CB 4.05Å; T50-F335 HydrophobicContact CG2-CD1 4.17Å; T50-F335 HydrophobicContact CG2-CG 4.05Å; R52-F335 HydrophobicContact CB-CE1 4.33Å; R52-F335 HydrophobicContact CG-CD1 3.88Å; R52-F335 HydrophobicContact CG-CE1 3.72Å; I58-F335 WeakPolarHBondContact CD1-O 3.45Å; H311-F335 PolarHBondContact CE1-O 3.47Å; S331-F335 PolarHBondContact N-O 3.38Å; D333-F335 HydrophobicContact CB-CD2 4.38Å; D333-F335 PolarHBondContact O-N 3.32Å; D333-F335 WeakPolarHBondContact OD1-CB 3.28Å; D333-F335 PolarHBondContact OD1-N 2.63Å
336	L	98.8	Very high	98.4	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.7	159	-67.5	149.4	0	0	0	108.6	T50 L51 I58 M61 L70 S72 T329 G330	T50-L336 CarbonylContact C-O 3.56Å; T50-L336 WeakPolarHBondContact CA-O 3.39Å; L51-L336 HydrophobicContact CB-CB 4.05Å; L51-L336 HydrophobicContact CD1-CB 3.98Å; L51-L336 HydrophobicContact CD1-CD1 4Å; L51-L336 HydrophobicContact CG-CB 4.16Å; L51-L336 PolarHBondContact N-O 3.15Å; L51-L336 PolarHBondContact O-N 2.85Å; I58-L336 HydrophobicContact CD1-CD1 4.48Å; I58-L336 HydrophobicContact CD1-CG 3.9Å; I58-L336 HydrophobicContact CG2-CD2 4.37Å; M61-L336 HydrophobicContact CB-CD2 4.11Å; M61-L336 HydrophobicContact CG-CD2 4.17Å; L70-L336 HydrophobicContact CD1-CD1 3.97Å; S72-L336 VanDerWaalsContact CB-CD1 3.48Å; T329-L336 CarbonylContact O-C 3.49Å; T329-L336 VanDerWaalsContact O-CA 3.26Å; T329-L336 WeakPolarHBondContact O-CA 3.17Å; G330-L336 VanDerWaalsContact CA-CD2 3.5Å
337	K	98.7	Very high	98.4	Very high	32 Å²	32	23.1 Å²	23.1	14%	0.139	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.7	173.3	-67.1	-166.6	-179.9	-147.3	0	109.7	T47 G310 A328 T329 W339	T47-K337 HydrophobicContact CG2-CB 3.96Å; T47-K337 HydrophobicContact CG2-CD 4.07Å; T47-K337 HydrophobicContact CG2-CG 4.08Å; G310-K337 WeakPolarHBondContact O-CE 3.41Å; G310-K337 PolarHBondContact O-NZ 3.32Å; A328-K337 CarbonylContact C-O 3.38Å; A328-K337 VanDerWaalsContact CA-O 3.3Å; A328-K337 WeakPolarHBondContact CA-O 3.34Å; T329-K337 PolarHBondContact N-O 2.92Å; T329-K337 PolarHBondContact O-N 3.01Å; K337-W339 HydrophobicContact CB-CZ2 4.08Å; K337-W339 HydrophobicContact CD-CH2 4.43Å; K337-W339 HydrophobicContact CD-CZ2 3.87Å
338	I	98.7	Very high	98.4	Very high	10 Å²	10	24.3 Å²	24.3	5%	0.051	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.3	173.8	-51.6	-171.6	0	0	0	108.1	T47 R48 R49 L51 W63 L70 S84 A326 V327	T47-I338 CarbonylContact C-O 3.54Å; R48-I338 PolarHBondContact N-O 2.82Å; R49-I338 HydrophobicContact CB-CB 4.07Å; R49-I338 HydrophobicContact CB-CD1 4.15Å; R49-I338 HydrophobicContact CB-CG1 4.17Å; R49-I338 PolarHBondContact N-O 3.44Å; R49-I338 PolarHBondContact O-N 3.26Å; L51-I338 HydrophobicContact CD1-CD1 4.36Å; L51-I338 HydrophobicContact CD2-CD1 4.42Å; L51-I338 HydrophobicContact CG-CD1 4.47Å; W63-I338 HydrophobicContact CH2-CD1 4.26Å; L70-I338 HydrophobicContact CD2-CD1 4.4Å; S84-I338 VanDerWaalsContact CB-CD1 3.42Å; A326-I338 HydrophobicContact CB-CG2 3.9Å; V327-I338 CarbonylContact O-C 3.52Å; V327-I338 WeakPolarHBondContact O-CA 3.41Å
339	W	98.6	Very high	98.4	Very high	11 Å²	11	26.3 Å²	26.3	4%	0.042	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.5	-178.2	-51.8	88.6	0	0	0	110.4	M45 R46 T47 L308 A326 V327 T329 K337	M45-W339 HydrophobicContact CB-CB 4.36Å; R46-W339 WeakPolarHBondContact O-CA 3.17Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.33Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.18Å; L308-W339 HydrophobicContact CB-CD2 4.25Å; L308-W339 HydrophobicContact CB-CE3 4.24Å; L308-W339 HydrophobicContact CB-CH2 4.02Å; L308-W339 HydrophobicContact CB-CZ2 4.04Å; L308-W339 HydrophobicContact CB-CZ3 4.12Å; L308-W339 HydrophobicContact CD1-CB 4.41Å; L308-W339 HydrophobicContact CD1-CD2 4.04Å; L308-W339 HydrophobicContact CD1-CE3 4.5Å; L308-W339 HydrophobicContact CD1-CG 3.98Å; L308-W339 HydrophobicContact CD2-CD2 4.45Å; L308-W339 HydrophobicContact CD2-CE3 4.09Å; L308-W339 HydrophobicContact CD2-CZ3 4.46Å; L308-W339 HydrophobicContact CG-CD2 4.49Å; A326-W339 WeakPolarHBondContact CA-O 3.21Å; V327-W339 HydrophobicContact CB-CB 4.37Å; V327-W339 PolarHBondContact N-O 3.29Å; V327-W339 PolarHBondContact O-N 3.38Å; T329-W339 PolarHBondContact OG1-NE1 2.95Å; K337-W339 HydrophobicContact CB-CZ2 4.08Å; K337-W339 HydrophobicContact CD-CH2 4.43Å; K337-W339 HydrophobicContact CD-CZ2 3.87Å
340	N	95.7	Very high	98.3	Very high	87 Å²	87	28.7 Å²	28.7	47%	0.465	14%	0.137	S	C	.	.			trans	-156.6	0	170.2	-176.7	-11.4	0	0	0	108.4	R46 R48 M325	R46-N340 PolarHBondContact O-N 3.44Å; R46-N340 VanDerWaalsContact O-N 3.13Å; R48-N340 HydrophobicContact CG-CB 3.93Å; R48-N340 VanDerWaalsContact CZ-O 3.27Å; R48-N340 PolarHBondContact NE-O 3.15Å; R48-N340 PolarHBondContact NH2-O 2.62Å; M325-N340 VanDerWaalsContact O-CG 3.27Å; M325-N340 PolarHBondContact O-ND2 3.3Å

Retrieved 340 of 340 residues in 543.7 ms (Link to these results)

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