A0A093HXZ1_STRCA Loading...

Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-3

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

AlphaFold DB , UniProt , Accession A0A093HXZ1, Species STRCA (Struthio camelus australis), Gene n/a, 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	57.7	Low	89.6	Confident	238 Å²	238	117.7 Å²	117.7	100%	1.172	60%	0.602	S	S	*	*				0	36.9	0	-139	-175.6	-64.2	0	0	109.6
2	G	77.3	Confident	90.1	Very high	59 Å²	59	117.2 Å²	117.2	61%	0.608	60%	0.595	S	S	*	*			trans	-122.3	162.5	-154.5	0	0	0	0	0	112.8	M4	G2-M4 VanDerWaalsContact C-N 3.29Å; G2-M4 PolarHBondContact O-N 2.73Å
3	E	92.1	Very high	90.7	Very high	150 Å²	150	117.5 Å²	117.5	70%	0.701	59%	0.592	S	S	*	*	S	Bend	trans	62.1	-62.2	-178.5	-62.8	-178.7	-178.6	0	0	116.2	E5 Q6 M7	E3-E5 PolarHBondContact O-N 3.47Å; E3-Q6 WeakPolarHBondContact O-CB 2.79Å; E3-Q6 PolarHBondContact O-N 2.96Å; E3-M7 WeakPolarHBondContact O-CG 3.43Å; E3-M7 PolarHBondContact O-N 3.18Å
4	M	92.1	Very high	91.2	Very high	125 Å²	125	115.1 Å²	115.1	62%	0.616	58%	0.582	S	S	*	*	H	α-helix	trans	-62.2	-44.2	-177.6	-176.1	-176.2	-67.5	0	0	112.3	G2 Q6 M7 K8	G2-M4 VanDerWaalsContact C-N 3.29Å; G2-M4 PolarHBondContact O-N 2.73Å; M4-Q6 VanDerWaalsContact C-N 3.31Å; M4-M7 PolarHBondContact O-N 2.89Å; M4-K8 WeakPolarHBondContact O-CG 3.34Å; M4-K8 PolarHBondContact O-N 3.46Å
5	E	93.9	Very high	91.5	Very high	92 Å²	92	115.5 Å²	115.5	43%	0.43	58%	0.578	S	S	.	*	H	α-helix	trans	-68.6	-34.3	178.6	-167.1	58.9	-156.6	0	0	111.5	E3 K8 Q9	E3-E5 PolarHBondContact O-N 3.47Å; E5-K8 PolarHBondContact O-N 3.48Å; E5-Q9 VanDerWaalsContact O-CG 3.3Å; E5-Q9 WeakPolarHBondContact O-CG 3.45Å; E5-Q9 PolarHBondContact O-N 2.71Å
6	Q	95.4	Very high	91.8	Very high	128 Å²	128	116.9 Å²	116.9	60%	0.598	58%	0.58	S	S	*	*	H	α-helix	trans	-65.5	-45.9	175.3	-175.5	178.4	-0.8	0	0	111.3	E3 M4 K8 Q9 E10	E3-Q6 WeakPolarHBondContact O-CB 2.79Å; E3-Q6 PolarHBondContact O-N 2.96Å; M4-Q6 VanDerWaalsContact C-N 3.31Å; Q6-K8 VanDerWaalsContact C-N 3.31Å; Q6-K8 PolarHBondContact O-N 3.3Å; Q6-Q9 PolarHBondContact O-N 3.26Å; Q6-E10 WeakPolarHBondContact O-CB 3.33Å; Q6-E10 PolarHBondContact O-N 3.22Å
7	M	95.3	Very high	92.1	Very high	117 Å²	117	116.1 Å²	116.1	58%	0.576	57%	0.574	S	S	*	*	H	α-helix	trans	-62.9	-37.2	176	-72.3	-172.7	-71.8	0	0	112.2	E3 M4 A11	E3-M7 WeakPolarHBondContact O-CG 3.43Å; E3-M7 PolarHBondContact O-N 3.18Å; M4-M7 PolarHBondContact O-N 2.89Å; M7-A11 WeakPolarHBondContact O-CB 3.47Å; M7-A11 PolarHBondContact O-N 3.4Å
8	K	94.5	Very high	92.4	Very high	117 Å²	117	114.3 Å²	114.3	51%	0.509	57%	0.566	S	S	.	*	H	α-helix	trans	-63.6	-46.3	173.9	-75.8	178.5	-179.1	178.7	0	111.8	M4 E5 Q6 E10 A11 E12	M4-K8 WeakPolarHBondContact O-CG 3.34Å; M4-K8 PolarHBondContact O-N 3.46Å; E5-K8 PolarHBondContact O-N 3.48Å; Q6-K8 VanDerWaalsContact C-N 3.31Å; Q6-K8 PolarHBondContact O-N 3.3Å; K8-E10 VanDerWaalsContact C-N 3.35Å; K8-A11 PolarHBondContact O-N 3.3Å; K8-E12 PolarHBondContact O-N 2.94Å
9	Q	95.5	Very high	92.5	Very high	121 Å²	121	111.1 Å²	111.1	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-63	-42.3	177.6	-72.8	174.7	6.6	0	0	111.7	E5 Q6 E12 Q13	E5-Q9 VanDerWaalsContact O-CG 3.3Å; E5-Q9 WeakPolarHBondContact O-CG 3.45Å; E5-Q9 PolarHBondContact O-N 2.71Å; Q6-Q9 PolarHBondContact O-N 3.26Å; Q9-E12 PolarHBondContact O-N 2.76Å; Q9-Q13 WeakPolarHBondContact O-CB 3.14Å; Q9-Q13 PolarHBondContact O-N 3.33Å
10	E	97.1	Very high	92.8	Very high	106 Å²	106	110 Å²	110	50%	0.495	56%	0.555	S	S	.	*	H	α-helix	trans	-61.6	-44.8	174.9	-175.1	176.1	-175.7	0	0	111.4	Q6 K8 E12 Q13 L14	Q6-E10 WeakPolarHBondContact O-CB 3.33Å; Q6-E10 PolarHBondContact O-N 3.22Å; K8-E10 VanDerWaalsContact C-N 3.35Å; E10-E12 PolarHBondContact O-N 3.41Å; E10-Q13 PolarHBondContact O-N 3.31Å; E10-L14 HydrophobicContact CG-CD1 4.2Å; E10-L14 WeakPolarHBondContact O-CG 3.45Å; E10-L14 PolarHBondContact O-N 3.05Å
11	A	95	Very high	93	Very high	42 Å²	42	107.4 Å²	107.4	35%	0.347	55%	0.551	S	S	.	*	H	α-helix	trans	-61.1	-45.1	176.9	0	0	0	0	0	112.4	M7 K8 Q13 L14 K15	M7-A11 WeakPolarHBondContact O-CB 3.47Å; M7-A11 PolarHBondContact O-N 3.4Å; K8-A11 PolarHBondContact O-N 3.3Å; A11-Q13 VanDerWaalsContact C-N 3.33Å; A11-L14 PolarHBondContact O-N 3.27Å; A11-K15 WeakPolarHBondContact O-CG 3.1Å; A11-K15 PolarHBondContact O-N 3Å
12	E	95.8	Very high	94.8	Very high	111 Å²	111	98 Å²	98	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-65.5	-36.6	175.9	-70.7	-54.5	133.1	0	0	112.3	K8 Q9 E10 K15 K16	K8-E12 PolarHBondContact O-N 2.94Å; Q9-E12 PolarHBondContact O-N 2.76Å; E10-E12 PolarHBondContact O-N 3.41Å; E12-K15 PolarHBondContact O-N 3.18Å; E12-K15 IonicContact OE1-NZ 3.29Å; E12-K15 PolarHBondContact OE1-NZ 3.08Å; E12-K16 WeakPolarHBondContact O-CB 3.34Å; E12-K16 PolarHBondContact O-N 3.08Å
13	Q	97.8	Very high	95.7	Very high	121 Å²	121	103 Å²	103	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-44.4	174.3	-176	176.4	2.8	0	0	111.8	Q9 E10 A11 K16 Q17	Q9-Q13 WeakPolarHBondContact O-CB 3.14Å; Q9-Q13 PolarHBondContact O-N 3.33Å; E10-Q13 PolarHBondContact O-N 3.31Å; A11-Q13 VanDerWaalsContact C-N 3.33Å; Q13-K16 PolarHBondContact O-N 2.83Å; Q13-Q17 WeakPolarHBondContact O-CG 3.45Å; Q13-Q17 PolarHBondContact O-N 2.76Å
14	L	97.6	Very high	95.9	Very high	84 Å²	84	99.9 Å²	99.9	44%	0.44	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-42.5	176.6	-71.8	170.6	0	0	0	111.6	E10 A11 K16 Q17 I18	E10-L14 HydrophobicContact CG-CD1 4.2Å; E10-L14 WeakPolarHBondContact O-CG 3.45Å; E10-L14 PolarHBondContact O-N 3.05Å; A11-L14 PolarHBondContact O-N 3.27Å; L14-K16 VanDerWaalsContact C-N 3.3Å; L14-K16 PolarHBondContact O-N 2.88Å; L14-Q17 PolarHBondContact O-N 3.14Å; L14-I18 WeakPolarHBondContact O-CG1 3.38Å; L14-I18 PolarHBondContact O-N 2.95Å
15	K	95.2	Very high	96	Very high	122 Å²	122	98 Å²	98	53%	0.53	51%	0.505	S	S	.	.	H	α-helix	trans	-57.5	-43.7	173.2	-74	175.1	-171.8	173.3	0	111.6	A11 E12 I18 A19	A11-K15 WeakPolarHBondContact O-CG 3.1Å; A11-K15 PolarHBondContact O-N 3Å; E12-K15 PolarHBondContact O-N 3.18Å; E12-K15 IonicContact OE1-NZ 3.29Å; E12-K15 PolarHBondContact OE1-NZ 3.08Å; K15-I18 PolarHBondContact O-N 3.24Å; K15-A19 WeakPolarHBondContact O-CB 3.25Å; K15-A19 PolarHBondContact O-N 3.18Å
16	K	96.4	Very high	96	Very high	138 Å²	138	96.2 Å²	96.2	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-44.1	176.7	-174.9	179.2	177.2	-177.9	0	111.9	E12 Q13 L14 I18 A19 D20	E12-K16 WeakPolarHBondContact O-CB 3.34Å; E12-K16 PolarHBondContact O-N 3.08Å; Q13-K16 PolarHBondContact O-N 2.83Å; L14-K16 VanDerWaalsContact C-N 3.3Å; L14-K16 PolarHBondContact O-N 2.88Å; K16-I18 VanDerWaalsContact C-N 3.3Å; K16-I18 PolarHBondContact O-N 3.35Å; K16-A19 PolarHBondContact O-N 2.96Å; K16-D20 WeakPolarHBondContact O-CB 3.41Å; K16-D20 PolarHBondContact O-N 3.16Å
17	Q	97.8	Very high	96	Very high	103 Å²	103	97 Å²	97	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-59.1	-42.2	175.9	-73.2	174.6	3.2	0	0	111.9	Q13 L14 D20 A21	Q13-Q17 WeakPolarHBondContact O-CG 3.45Å; Q13-Q17 PolarHBondContact O-N 2.76Å; L14-Q17 PolarHBondContact O-N 3.14Å; Q17-D20 PolarHBondContact O-N 3.44Å; Q17-A21 WeakPolarHBondContact O-CB 3.4Å; Q17-A21 PolarHBondContact O-N 2.88Å
18	I	96.7	Very high	96	Very high	83 Å²	83	94.3 Å²	94.3	43%	0.426	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-46	175.3	-67.5	164.9	0	0	0	110.6	L14 K15 K16 D20 A21 R22	L14-I18 WeakPolarHBondContact O-CG1 3.38Å; L14-I18 PolarHBondContact O-N 2.95Å; K15-I18 PolarHBondContact O-N 3.24Å; K16-I18 VanDerWaalsContact C-N 3.3Å; K16-I18 PolarHBondContact O-N 3.35Å; I18-D20 PolarHBondContact O-N 3.2Å; I18-A21 PolarHBondContact O-N 2.81Å; I18-R22 HydrophobicContact CG2-CG 4.45Å; I18-R22 WeakPolarHBondContact O-CG 3.41Å; I18-R22 PolarHBondContact O-N 3.25Å
19	A	95.1	Very high	96	Very high	53 Å²	53	92.1 Å²	92.1	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-61.5	-42.9	178.3	0	0	0	0	0	112.2	K15 K16 R22 K23	K15-A19 WeakPolarHBondContact O-CB 3.25Å; K15-A19 PolarHBondContact O-N 3.18Å; K16-A19 PolarHBondContact O-N 2.96Å; A19-R22 PolarHBondContact O-N 3.03Å; A19-K23 WeakPolarHBondContact O-CB 3.29Å; A19-K23 PolarHBondContact O-N 3.1Å
20	D	97.1	Very high	95.9	Very high	90 Å²	90	87.8 Å²	87.8	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-39.6	176.5	-70.8	-24.3	0	0	0	111.2	K16 Q17 I18 K23 A24	K16-D20 WeakPolarHBondContact O-CB 3.41Å; K16-D20 PolarHBondContact O-N 3.16Å; Q17-D20 PolarHBondContact O-N 3.44Å; I18-D20 PolarHBondContact O-N 3.2Å; D20-K23 PolarHBondContact O-N 3.37Å; D20-A24 WeakPolarHBondContact O-CB 3.46Å; D20-A24 PolarHBondContact O-N 2.92Å
21	A	97.5	Very high	95.7	Very high	56 Å²	56	85.7 Å²	85.7	46%	0.463	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-44.4	175.9	0	0	0	0	0	112.6	Q17 I18 A24 C25	Q17-A21 WeakPolarHBondContact O-CB 3.4Å; Q17-A21 PolarHBondContact O-N 2.88Å; I18-A21 PolarHBondContact O-N 2.81Å; A21-A24 WeakPolarHBondContact O-CB 3.37Å; A21-A24 PolarHBondContact O-N 3.41Å; A21-C25 PolarHBondContact O-N 3.47Å; A21-C25 PolarHBondContact O-SG 3.06Å
22	R	96.1	Very high	95.7	Very high	41 Å²	41	89.3 Å²	89.3	16%	0.155	49%	0.492	C	S	.	.	H	α-helix	trans	-59.8	-46.5	174.4	-73.5	173.7	179.3	177.5	-7	111.1	I18 A19 A24 C25 A26 T221 S223 D258 Q259	I18-R22 HydrophobicContact CG2-CG 4.45Å; I18-R22 WeakPolarHBondContact O-CG 3.41Å; I18-R22 PolarHBondContact O-N 3.25Å; A19-R22 PolarHBondContact O-N 3.03Å; R22-A24 VanDerWaalsContact C-N 3.3Å; R22-A24 PolarHBondContact O-N 2.97Å; R22-C25 CarbonylContact O-C 3.58Å; R22-C25 PolarHBondContact O-N 3.41Å; R22-A26 PolarHBondContact O-N 3.27Å; R22-A26 VanDerWaalsContact O-N 3.1Å; R22-T221 PolarHBondContact NH2-O 2.67Å; R22-S223 PolarHBondContact NH1-OG 3.42Å; R22-D258 WeakPolarHBondContact CD-O 3.37Å; R22-D258 VanDerWaalsContact CZ-O 3.23Å; R22-D258 IonicContact CZ-OD2 2.81Å; R22-D258 VanDerWaalsContact CZ-OD2 3.23Å; R22-D258 PolarHBondContact NE-O 3.44Å; R22-D258 IonicContact NE-OD2 3.41Å; R22-D258 PolarHBondContact NE-OD2 3.43Å; R22-D258 PolarHBondContact NH2-O 2.95Å; R22-D258 IonicContact NH2-OD1 3.94Å; R22-D258 IonicContact NH2-OD2 3.28Å; R22-D258 PolarHBondContact NH2-OD2 3.25Å; R22-Q259 PolarHBondContact O-OE1 3.46Å
23	K	94.9	Very high	95.7	Very high	163 Å²	163	89.5 Å²	89.5	71%	0.709	50%	0.495	S	S	*	.	H	α-helix	trans	-62	-36.5	177.1	-172.4	176.1	-178.5	178.1	0	112.6	A19 D20 C25 A26	A19-K23 WeakPolarHBondContact O-CB 3.29Å; A19-K23 PolarHBondContact O-N 3.1Å; D20-K23 PolarHBondContact O-N 3.37Å; K23-C25 PolarHBondContact O-N 3.26Å; K23-A26 PolarHBondContact O-N 2.81Å
24	A	96.4	Very high	95.6	Very high	84 Å²	84	84.3 Å²	84.3	69%	0.694	47%	0.472	S	S	*	.	H	α-helix	trans	-65.3	-28.9	175.7	0	0	0	0	0	112.7	D20 A21 R22	D20-A24 WeakPolarHBondContact O-CB 3.46Å; D20-A24 PolarHBondContact O-N 2.92Å; A21-A24 WeakPolarHBondContact O-CB 3.37Å; A21-A24 PolarHBondContact O-N 3.41Å; R22-A24 VanDerWaalsContact C-N 3.3Å; R22-A24 PolarHBondContact O-N 2.97Å
25	C	95.3	Very high	95.4	Very high	87 Å²	87	84.7 Å²	84.7	59%	0.588	48%	0.481	S	S	*	.	H	α-helix	trans	-90.1	-5.7	176	-63.5	0	0	0	0	113.9	A21 R22 K23 D27	A21-C25 PolarHBondContact O-N 3.47Å; A21-C25 PolarHBondContact O-SG 3.06Å; R22-C25 CarbonylContact O-C 3.58Å; R22-C25 PolarHBondContact O-N 3.41Å; K23-C25 PolarHBondContact O-N 3.26Å; C25-D27 VanDerWaalsContact C-N 3.3Å; C25-D27 PolarHBondContact O-N 3.28Å; C25-D27 VanDerWaalsContact O-N 3.08Å
26	A	93.1	Very high	95.3	Very high	53 Å²	53	82.5 Å²	82.5	44%	0.438	49%	0.493	S	S	.	.			trans	-84.9	68.1	179.8	0	0	0	0	0	111.1	R22 K23	R22-A26 PolarHBondContact O-N 3.27Å; R22-A26 VanDerWaalsContact O-N 3.1Å; K23-A26 PolarHBondContact O-N 2.81Å
27	D	95.1	Very high	95.3	Very high	146 Å²	146	78.6 Å²	78.6	78%	0.781	48%	0.481	S	S	*	.			trans	-78.2	-32.6	-175.6	64.9	-27.3	0	0	0	113.9	C25	C25-D27 VanDerWaalsContact C-N 3.3Å; C25-D27 PolarHBondContact O-N 3.28Å; C25-D27 VanDerWaalsContact O-N 3.08Å
28	T	95.3	Very high	95.1	Very high	60 Å²	60	81.8 Å²	81.8	37%	0.368	50%	0.496	S	S	.	.			trans	-143.7	167.4	178.4	-175.4	0	0	0	0	111.3	Q32 I33	T28-Q32 PolarHBondContact OG1-OE1 3.41Å; T28-I33 HydrophobicContact CG2-CD1 3.7Å; T28-I33 HydrophobicContact CG2-CG1 3.95Å
29	T	95	Very high	95	Very high	71 Å²	71	80.2 Å²	80.2	44%	0.436	49%	0.49	S	S	.	.			trans	-106.3	155.5	172.1	61.7	0	0	0	0	111.5	A31 Q32 I33	T29-A31 PolarHBondContact O-N 3.23Å; T29-Q32 PolarHBondContact O-N 3.41Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.32Å; T29-Q32 PolarHBondContact OG1-N 2.87Å; T29-Q32 PolarHBondContact OG1-OE1 3.49Å; T29-Q32 VanDerWaalsContact OG1-OE1 3.05Å; T29-I33 PolarHBondContact O-N 2.88Å
30	L	94.4	Very high	95	Very high	29 Å²	29	79.7 Å²	79.7	15%	0.152	48%	0.481	C	S	.	.	H	α-helix	trans	-58.5	-38.7	175.2	-176.5	61.3	0	0	0	111.6	Q32 I33 V34 I262	L30-Q32 VanDerWaalsContact C-N 3.3Å; L30-Q32 PolarHBondContact O-N 3.35Å; L30-I33 PolarHBondContact O-N 3.21Å; L30-V34 HydrophobicContact CD1-CG1 3.93Å; L30-V34 HydrophobicContact CG-CG1 4.45Å; L30-V34 WeakPolarHBondContact O-CG2 3.5Å; L30-V34 PolarHBondContact O-N 2.82Å; L30-I262 HydrophobicContact CD2-CB 4.03Å; L30-I262 HydrophobicContact CD2-CD1 4.17Å; L30-I262 HydrophobicContact CD2-CG2 3.79Å
31	A	92.9	Very high	94.9	Very high	62 Å²	62	78 Å²	78	51%	0.512	49%	0.485	S	S	.	.	H	α-helix	trans	-58.7	-38.3	178.1	0	0	0	0	0	113	T29 S35	T29-A31 PolarHBondContact O-N 3.23Å; A31-S35 PolarHBondContact O-N 2.83Å
32	Q	94.6	Very high	94.8	Very high	119 Å²	119	85.1 Å²	85.1	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-69.6	-45.3	176.2	-74.5	165.3	-34.3	0	0	111.7	T28 T29 L30 V34 S35	T28-Q32 PolarHBondContact OG1-OE1 3.41Å; T29-Q32 PolarHBondContact O-N 3.41Å; T29-Q32 WeakPolarHBondContact OG1-CG 3.32Å; T29-Q32 PolarHBondContact OG1-N 2.87Å; T29-Q32 PolarHBondContact OG1-OE1 3.49Å; T29-Q32 VanDerWaalsContact OG1-OE1 3.05Å; L30-Q32 VanDerWaalsContact C-N 3.3Å; L30-Q32 PolarHBondContact O-N 3.35Å; Q32-V34 VanDerWaalsContact C-N 3.31Å; Q32-V34 PolarHBondContact O-N 3Å; Q32-S35 WeakPolarHBondContact O-CB 3.39Å; Q32-S35 PolarHBondContact O-N 2.8Å; Q32-S35 PolarHBondContact O-OG 3.44Å
33	I	95.8	Very high	94.8	Very high	115 Å²	115	84.8 Å²	84.8	59%	0.59	50%	0.5	S	S	*	.	H	α-helix	trans	-60	-43	179.8	-64	172.8	0	0	0	110.9	T28 T29 L30 S35	T28-I33 HydrophobicContact CG2-CD1 3.7Å; T28-I33 HydrophobicContact CG2-CG1 3.95Å; T29-I33 PolarHBondContact O-N 2.88Å; L30-I33 PolarHBondContact O-N 3.21Å; I33-S35 VanDerWaalsContact C-N 3.33Å; I33-S35 PolarHBondContact O-N 2.91Å
34	V	95.4	Very high	94.9	Very high	12 Å²	12	83.1 Å²	83.1	7%	0.073	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	14.6	-175.3	-57.1	0	0	0	0	113.3	L30 Q32 G36 V37 L300 K301	L30-V34 HydrophobicContact CD1-CG1 3.93Å; L30-V34 HydrophobicContact CG-CG1 4.45Å; L30-V34 WeakPolarHBondContact O-CG2 3.5Å; L30-V34 PolarHBondContact O-N 2.82Å; Q32-V34 VanDerWaalsContact C-N 3.31Å; Q32-V34 PolarHBondContact O-N 3Å; V34-G36 PolarHBondContact O-N 2.94Å; V34-V37 HydrophobicContact CB-CB 4.37Å; V34-V37 HydrophobicContact CB-CG2 4.12Å; V34-V37 WeakPolarHBondContact O-CB 3.32Å; V34-V37 PolarHBondContact O-N 2.96Å; V34-L300 HydrophobicContact CB-CB 4.4Å; V34-L300 HydrophobicContact CG1-CB 4.27Å; V34-L300 HydrophobicContact CG1-CD2 4.28Å; V34-L300 HydrophobicContact CG2-CB 4.25Å; V34-L300 WeakPolarHBondContact CG2-O 3.23Å; V34-K301 HydrophobicContact CG2-CD 4.29Å; V34-K301 WeakPolarHBondContact O-CE 3.41Å; V34-K301 PolarHBondContact O-NZ 3.29Å
35	S	92.5	Very high	94.9	Very high	91 Å²	91	81.1 Å²	81.1	64%	0.636	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-38.2	-177.7	53.6	0	0	0	0	113.2	A31 Q32 I33 V37 K301	A31-S35 PolarHBondContact O-N 2.83Å; Q32-S35 WeakPolarHBondContact O-CB 3.39Å; Q32-S35 PolarHBondContact O-N 2.8Å; Q32-S35 PolarHBondContact O-OG 3.44Å; I33-S35 VanDerWaalsContact C-N 3.33Å; I33-S35 PolarHBondContact O-N 2.91Å; S35-V37 VanDerWaalsContact C-N 3.35Å; S35-V37 PolarHBondContact O-N 2.75Å; S35-K301 PolarHBondContact O-NZ 3.12Å
36	G	94.1	Very high	95	Very high	76 Å²	76	85 Å²	85	78%	0.784	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-4.6	177.3	0	0	0	0	0	116.2	V34	V34-G36 PolarHBondContact O-N 2.94Å
37	V	95.5	Very high	95.3	Very high	56 Å²	56	85.1 Å²	85.1	34%	0.339	47%	0.47	S	S	.	.	S	Bend	trans	-84.5	135.8	177.7	-178	0	0	0	0	109.1	V34 S35 L300 K301	V34-V37 HydrophobicContact CB-CB 4.37Å; V34-V37 HydrophobicContact CB-CG2 4.12Å; V34-V37 WeakPolarHBondContact O-CB 3.32Å; V34-V37 PolarHBondContact O-N 2.96Å; S35-V37 VanDerWaalsContact C-N 3.35Å; S35-V37 PolarHBondContact O-N 2.75Å; V37-L300 HydrophobicContact CG1-CD1 4.31Å; V37-K301 WeakPolarHBondContact O-CE 3.25Å; V37-K301 PolarHBondContact O-NZ 3.47Å
38	E	94.6	Very high	95.4	Very high	171 Å²	171	83.7 Å²	83.7	80%	0.799	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-75.2	144.6	172.9	-66.6	-175.7	172.2	0	0	111.2	R283	E38-R283 PolarHBondContact O-NH2 2.85Å
39	V	94.2	Very high	95.5	Very high	50 Å²	50	86 Å²	86	30%	0.303	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-63.1	141.3	172.5	-174.3	0	0	0	0	108.7	G41 D298 K301 E303 V305	V39-G41 PolarHBondContact O-N 2.84Å; V39-D298 HydrophobicContact CG1-CB 4.5Å; V39-K301 HydrophobicContact CB-CG 4.47Å; V39-K301 HydrophobicContact CG2-CB 4.24Å; V39-K301 HydrophobicContact CG2-CD 4.27Å; V39-K301 HydrophobicContact CG2-CG 3.9Å; V39-E303 HydrophobicContact CG1-CB 4.14Å; V39-E303 WeakPolarHBondContact CG1-OE2 3.34Å; V39-E303 WeakPolarHBondContact CG2-OE2 3.36Å; V39-V305 HydrophobicContact CG1-CG1 3.85Å
40	V	95.3	Very high	95.6	Very high	42 Å²	42	84.1 Å²	84.1	26%	0.255	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-59.2	130.2	172.1	-175.3	0	0	0	0	109.3	I43 R283 L284 D298 V305	V40-I43 HydrophobicContact CG1-CD1 3.96Å; V40-I43 HydrophobicContact CG1-CG1 4.11Å; V40-R283 HydrophobicContact CG2-CG 3.73Å; V40-R283 VanDerWaalsContact CG2-CZ 3.41Å; V40-L284 HydrophobicContact CG2-CD2 4.41Å; V40-D298 WeakPolarHBondContact CG2-OD2 3.37Å; V40-D298 PolarHBondContact N-OD2 3.1Å; V40-V305 HydrophobicContact CB-CG1 4.33Å; V40-V305 VanDerWaalsContact O-CG1 3.25Å; V40-V305 WeakPolarHBondContact O-CG1 3.22Å
41	G	94.4	Very high	95.8	Very high	53 Å²	53	82.8 Å²	82.8	55%	0.546	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-56.6	162.1	175.2	0	0	0	0	0	112.4	V39 I43	V39-G41 PolarHBondContact O-N 2.84Å; G41-I43 WeakPolarHBondContact O-CG1 3.38Å; G41-I43 PolarHBondContact O-N 2.85Å; G41-I43 VanDerWaalsContact O-N 3.08Å
42	R	96.1	Very high	96	Very high	206 Å²	206	87.3 Å²	87.3	78%	0.777	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-52.7	118.9	-176	-175.5	178.3	178.4	-179.1	3.5	111.8	Q44 V305	R42-Q44 HydrophobicContact CG-CG 4.28Å; R42-V305 CarbonylContact C-O 3.57Å; R42-V305 WeakPolarHBondContact CA-O 3.39Å
43	I	96.8	Very high	96.1	Very high	34 Å²	34	82.9 Å²	82.9	17%	0.174	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-88	123	178.7	-58.9	-172.8	0	0	0	109.3	V40 G41 M45 L284 I296 V305	V40-I43 HydrophobicContact CG1-CD1 3.96Å; V40-I43 HydrophobicContact CG1-CG1 4.11Å; G41-I43 WeakPolarHBondContact O-CG1 3.38Å; G41-I43 PolarHBondContact O-N 2.85Å; G41-I43 VanDerWaalsContact O-N 3.08Å; I43-M45 HydrophobicContact CG2-CG 3.74Å; I43-M45 HydrophobicContact CG2-SD 4.49Å; I43-L284 HydrophobicContact CD1-CD1 3.41Å; I43-L284 VanDerWaalsContact CD1-CD1 3.41Å; I43-L284 HydrophobicContact CD1-CD2 3.37Å; I43-L284 HydrophobicContact CD1-CG 4.03Å; I43-I296 HydrophobicContact CB-CD1 4.35Å; I43-I296 HydrophobicContact CD1-CG2 4.11Å; I43-I296 HydrophobicContact CG2-CD1 3.83Å; I43-V305 HydrophobicContact CD1-CG2 3.81Å; I43-V305 HydrophobicContact CG1-CB 4.44Å; I43-V305 HydrophobicContact CG1-CG2 4.03Å; I43-V305 PolarHBondContact N-O 2.76Å
44	Q	95.9	Very high	96.2	Very high	129 Å²	129	77.8 Å²	77.8	60%	0.603	40%	0.4	S	S	*	.			trans	-122.8	85.1	176.9	-64.3	-175.8	-0.2	0	0	109.4	R42	R42-Q44 HydrophobicContact CG-CG 4.28Å
45	M	97.2	Very high	96.3	Very high	42 Å²	42	83.9 Å²	83.9	21%	0.207	43%	0.432	C	S	.	.			trans	-78.5	149.6	172.6	-44.6	-178.3	84.9	0	0	109.4	I43 I296 L308 V327 W339	I43-M45 HydrophobicContact CG2-CG 3.74Å; I43-M45 HydrophobicContact CG2-SD 4.49Å; M45-I296 HydrophobicContact CG-CD1 4.11Å; M45-I296 HydrophobicContact SD-CD1 3.74Å; M45-L308 HydrophobicContact CB-CD2 3.66Å; M45-L308 HydrophobicContact CG-CD2 3.96Å; M45-L308 HydrophobicContact SD-CD1 4.31Å; M45-L308 HydrophobicContact SD-CD2 4.03Å; M45-V327 HydrophobicContact CE-CG2 3.75Å; M45-V327 HydrophobicContact SD-CG2 4.35Å; M45-W339 HydrophobicContact CB-CB 4.12Å; M45-W339 HydrophobicContact CE-CB 4.48Å; M45-W339 HydrophobicContact SD-CB 4.48Å
46	R	97.4	Very high	96.5	Very high	168 Å²	168	81 Å²	81	63%	0.634	41%	0.414	S	S	*	.			trans	-116.3	146	175.7	-63.8	-176.1	-178.2	-175.6	0.6	110	R48 W339 N340	R46-R48 PolarHBondContact O-N 2.99Å; R46-R48 VanDerWaalsContact O-N 3.16Å; R46-W339 WeakPolarHBondContact O-CA 3.43Å; R46-N340 PolarHBondContact N-O 3.43Å; R46-N340 VanDerWaalsContact N-O 3.14Å; R46-N340 PolarHBondContact O-N 2.86Å
47	T	97.9	Very high	96.7	Very high	55 Å²	55	81 Å²	81	34%	0.337	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	117.8	169.9	-49	0	0	0	0	109	R49 K337 I338 W339	T47-R49 VanDerWaalsContact CG2-O 3.27Å; T47-R49 WeakPolarHBondContact CG2-O 3.33Å; T47-K337 HydrophobicContact CG2-CB 3.99Å; T47-K337 HydrophobicContact CG2-CD 4.28Å; T47-K337 HydrophobicContact CG2-CG 4.12Å; T47-I338 CarbonylContact C-O 3.57Å; T47-I338 WeakPolarHBondContact CA-O 3.39Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.47Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.24Å
48	R	97.8	Very high	96.9	Very high	117 Å²	117	78.3 Å²	78.3	44%	0.442	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-32.2	175.5	-58.2	-52.2	175	168.2	0.2	112.5	R46 I338 N340	R46-R48 PolarHBondContact O-N 2.99Å; R46-R48 VanDerWaalsContact O-N 3.16Å; R48-I338 PolarHBondContact N-O 3.22Å; R48-N340 WeakPolarHBondContact CD-OD1 3.47Å; R48-N340 WeakPolarHBondContact CG-OD1 3.3Å; R48-N340 PolarHBondContact NE-O 3.01Å; R48-N340 PolarHBondContact NE-OD1 2.87Å; R48-N340 PolarHBondContact NH2-O 3.44Å
49	R	97.6	Very high	97	Very high	109 Å²	109	73 Å²	73	41%	0.411	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.9	-178.7	-57.5	-67.5	-175.6	-88.8	-1	110.2	T47 Y85 T87 K337 I338	T47-R49 VanDerWaalsContact CG2-O 3.27Å; T47-R49 WeakPolarHBondContact CG2-O 3.33Å; R49-Y85 PolarHBondContact NE-O 3.41Å; R49-T87 HydrophobicContact CB-CG2 4.09Å; R49-T87 HydrophobicContact CG-CG2 4.17Å; R49-K337 WeakPolarHBondContact O-CA 3.37Å; R49-I338 HydrophobicContact CB-CB 4.04Å; R49-I338 HydrophobicContact CB-CG1 4.01Å; R49-I338 PolarHBondContact N-O 3.2Å; R49-I338 PolarHBondContact O-N 3.37Å
50	T	98	Very high	97.2	Very high	31 Å²	31	71.2 Å²	71.2	19%	0.19	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	112.7	170	-54.8	0	0	0	0	107.7	R52 F335 L336 K337	T50-R52 HydrophobicContact CG2-CG 4.2Å; T50-F335 HydrophobicContact CG2-CB 4.27Å; T50-F335 HydrophobicContact CG2-CD1 4.13Å; T50-F335 HydrophobicContact CG2-CG 4.35Å; T50-L336 CarbonylContact C-O 3.56Å; T50-L336 WeakPolarHBondContact CA-O 3.46Å; T50-K337 HydrophobicContact CG2-CG 4.42Å
51	L	98.1	Very high	97.4	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.7	179.3	-50.6	-178.6	0	0	0	108.3	L70 W82 T84 T87 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.33Å; L51-L70 HydrophobicContact CD1-CD2 3.94Å; L51-L70 HydrophobicContact CD1-CG 4.43Å; L51-W82 HydrophobicContact CB-CD2 4.16Å; L51-W82 HydrophobicContact CB-CE3 3.9Å; L51-W82 HydrophobicContact CB-CH2 4.24Å; L51-W82 HydrophobicContact CB-CZ2 4.49Å; L51-W82 HydrophobicContact CB-CZ3 3.94Å; L51-W82 HydrophobicContact CD1-CB 4.02Å; L51-W82 HydrophobicContact CD1-CD2 4.02Å; L51-W82 HydrophobicContact CD1-CE3 4.35Å; L51-W82 HydrophobicContact CD1-CG 3.89Å; L51-W82 HydrophobicContact CD2-CE3 4.35Å; L51-W82 HydrophobicContact CG-CE3 4.43Å; L51-T84 HydrophobicContact CD1-CG2 4.43Å; L51-T87 HydrophobicContact CD2-CG2 3.82Å; L51-L336 HydrophobicContact CB-CB 4.09Å; L51-L336 HydrophobicContact CB-CD1 4.42Å; L51-L336 HydrophobicContact CD1-CB 4.09Å; L51-L336 HydrophobicContact CG-CB 4.29Å; L51-L336 PolarHBondContact N-O 2.93Å; L51-L336 PolarHBondContact O-N 2.89Å; L51-I338 HydrophobicContact CD1-CD1 4.45Å
52	R	97.5	Very high	97.6	Very high	156 Å²	156	69.7 Å²	69.7	59%	0.589	32%	0.315	S	S	*	.			trans	-116.8	130.5	-176.8	-59	-172.2	174.1	80.2	-2.5	110.1	T50 W82 K89 F335	T50-R52 HydrophobicContact CG2-CG 4.2Å; R52-W82 WeakPolarHBondContact O-CH2 3.32Å; R52-W82 WeakPolarHBondContact O-CZ3 3.47Å; R52-K89 WeakPolarHBondContact O-CE 3.45Å; R52-K89 PolarHBondContact O-NZ 2.95Å; R52-F335 HydrophobicContact CB-CE1 4.4Å; R52-F335 HydrophobicContact CG-CD1 3.85Å; R52-F335 HydrophobicContact CG-CE1 3.77Å
53	G	95.8	Very high	97.7	Very high	26 Å²	26	60.7 Å²	60.7	27%	0.268	28%	0.281	S	S	.	.			trans	162.8	-17.6	175.2	0	0	0	0	0	116.4
54	H	98.1	Very high	97.7	Very high	8 Å²	8	59.4 Å²	59.4	4%	0.037	28%	0.275	C	S	.	.			trans	-73.9	151.8	166.2	-74.1	-60.7	0	0	0	110.5	I58 S72 S74 D76 I80	H54-I58 HydrophobicContact CB-CD1 4.49Å; H54-I58 HydrophobicContact CB-CG1 4.21Å; H54-S72 PolarHBondContact NE2-OG 3.14Å; H54-S74 WeakPolarHBondContact CE1-CB 3.33Å; H54-S74 WeakPolarHBondContact ND1-CB 3.31Å; H54-D76 VanDerWaalsContact CA-OD2 3.24Å; H54-D76 WeakPolarHBondContact CA-OD2 3.28Å; H54-D76 WeakPolarHBondContact CB-OD2 3.22Å; H54-D76 IonicContact CG-OD2 3.56Å; H54-D76 IonicContact ND1-OD1 2.81Å; H54-D76 IonicContact ND1-OD2 3.92Å; H54-D76 PolarHBondContact ND1-OD2 2.87Å; H54-D76 VanDerWaalsContact ND1-OD2 3.09Å; H54-I80 VanDerWaalsContact CE1-CD1 3.47Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.2Å
55	L	96.9	Very high	97.6	Very high	140 Å²	140	57.3 Å²	57.3	73%	0.733	27%	0.272	S	S	*	.	S	Bend	trans	-112.6	-3.2	-179.8	-58.7	178.3	0	0	0	112.3	D76	L55-D76 HydrophobicContact CB-CB 4.25Å; L55-D76 PolarHBondContact N-OD2 3.47Å
56	A	97.8	Very high	97.5	Very high	31 Å²	31	59 Å²	59	26%	0.256	28%	0.282	S	S	.	.	S	Bend	trans	-144	-174.1	-179	0	0	0	0	0	110.3	I58 S74 Q75 D76 S334	A56-I58 PolarHBondContact O-N 2.86Å; A56-S74 PolarHBondContact O-OG 3.47Å; A56-Q75 HydrophobicContact CB-CB 4.24Å; A56-D76 HydrophobicContact CB-CB 3.89Å; A56-S334 WeakPolarHBondContact O-CA 3.38Å; A56-S334 WeakPolarHBondContact O-CB 3.36Å
57	K	98.2	Very high	97.4	Very high	75 Å²	75	51.4 Å²	51.4	33%	0.326	25%	0.254	S	S	.	.			trans	-60.3	128.6	-177.9	-60.6	175.3	177.4	-175.4	0	111.1	Y59 S74 Q75 W332	K57-Y59 HydrophobicContact CB-CD2 4.32Å; K57-Y59 HydrophobicContact CB-CE2 4.04Å; K57-Y59 HydrophobicContact CD-CE2 4.49Å; K57-S74 WeakPolarHBondContact O-CA 3.23Å; K57-S74 PolarHBondContact O-OG 2.77Å; K57-Q75 PolarHBondContact O-N 3.47Å; K57-W332 HydrophobicContact CB-CB 4.21Å; K57-W332 HydrophobicContact CB-CD2 4.49Å; K57-W332 HydrophobicContact CB-CG 3.9Å; K57-W332 HydrophobicContact CD-CB 4.31Å; K57-W332 HydrophobicContact CD-CD2 3.67Å; K57-W332 HydrophobicContact CD-CE3 3.97Å; K57-W332 HydrophobicContact CD-CG 3.86Å; K57-W332 HydrophobicContact CG-CB 3.89Å; K57-W332 HydrophobicContact CG-CD2 4.19Å; K57-W332 HydrophobicContact CG-CG 3.83Å
58	I	98.6	Very high	97.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.6	169.6	-63.3	157.2	0	0	0	108	H54 A56 A73 S316 S331 S334 F335 L336	H54-I58 HydrophobicContact CB-CD1 4.49Å; H54-I58 HydrophobicContact CB-CG1 4.21Å; A56-I58 PolarHBondContact O-N 2.86Å; I58-A73 WeakPolarHBondContact CA-O 3.15Å; I58-S316 VanDerWaalsContact O-CB 3.28Å; I58-S316 WeakPolarHBondContact O-CB 3.25Å; I58-S316 PolarHBondContact O-OG 3.08Å; I58-S331 WeakPolarHBondContact CB-O 3.42Å; I58-S331 PolarHBondContact N-O 2.85Å; I58-S334 WeakPolarHBondContact CD1-O 3.47Å; I58-F335 VanDerWaalsContact CD1-C 3.5Å; I58-F335 WeakPolarHBondContact CD1-O 3.25Å; I58-L336 HydrophobicContact CD1-CD1 3.44Å; I58-L336 VanDerWaalsContact CD1-CD1 3.44Å; I58-L336 HydrophobicContact CD1-CG 3.87Å; I58-L336 HydrophobicContact CG1-CD1 4.44Å
59	Y	98.3	Very high	97.3	Very high	60 Å²	60	48.4 Å²	48.4	24%	0.235	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-41.2	179.1	-95.5	-108.2	0	0	0	112.5	K57 A73 Q75 M101 W332	K57-Y59 HydrophobicContact CB-CD2 4.32Å; K57-Y59 HydrophobicContact CB-CE2 4.04Å; K57-Y59 HydrophobicContact CD-CE2 4.49Å; Y59-A73 PolarHBondContact N-O 2.83Å; Y59-Q75 HydrophobicContact CD2-CG 3.78Å; Y59-Q75 HydrophobicContact CE2-CG 3.67Å; Y59-Q75 PolarHBondContact OH-NE2 3.48Å; Y59-M101 HydrophobicContact CD1-CG 4.48Å; Y59-W332 HydrophobicContact CE2-CZ2 4.29Å; Y59-W332 AromaticContact CE2-NE1 3.62Å; Y59-W332 AromaticContact CZ-CZ2 3.86Å; Y59-W332 AromaticContact CZ-NE1 3.94Å; Y59-W332 WeakPolarHBondContact OH-CZ2 3.26Å
60	A	98.3	Very high	97.3	Very high	13 Å²	13	43.2 Å²	43.2	11%	0.107	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	153.3	-176.7	0	0	0	0	0	111.3	S72 A73 M101	A60-S72 WeakPolarHBondContact O-CA 3.34Å; A60-A73 HydrophobicContact CB-CB 4.46Å; A60-A73 PolarHBondContact O-N 2.93Å; A60-M101 WeakPolarHBondContact CB-O 3.47Å
61	M	98.4	Very high	97.3	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153.1	167.1	72.1	79.5	53.8	0	0	109	W63 L70 V71 C317 A328 L336	M61-W63 HydrophobicContact CE-CD2 4.32Å; M61-W63 HydrophobicContact CE-CG 4.23Å; M61-L70 HydrophobicContact CE-CB 3.99Å; M61-L70 HydrophobicContact CE-CD1 4.12Å; M61-L70 HydrophobicContact CE-CD2 3.76Å; M61-L70 HydrophobicContact CE-CG 4.2Å; M61-V71 CarbonylContact C-O 3.57Å; M61-V71 WeakPolarHBondContact CA-O 3.49Å; M61-C317 HydrophobicContact CG-CB 4.13Å; M61-C317 VanDerWaalsContact CG-SG 3.58Å; M61-A328 HydrophobicContact CE-CB 3.37Å; M61-A328 HydrophobicContact SD-CB 4.12Å; M61-L336 HydrophobicContact CB-CD2 3.91Å; M61-L336 HydrophobicContact CG-CD2 4.36Å
62	H	98.6	Very high	97.3	Very high	52 Å²	52	41.7 Å²	41.7	24%	0.241	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	129	173	-167.5	-162	0	0	0	109.8	L70 V71 Y105	H62-L70 WeakPolarHBondContact O-CA 3.48Å; H62-V71 HydrophobicContact CB-CG1 4.07Å; H62-V71 PolarHBondContact N-O 2.87Å; H62-V71 PolarHBondContact O-N 2.77Å; H62-Y105 PolarHBondContact ND1-N 3.23Å; H62-Y105 VanDerWaalsContact ND1-N 3.11Å
63	W	98.3	Very high	97.4	Very high	17 Å²	17	34.3 Å²	34.3	6%	0.064	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	146.8	172.3	-73.7	106.4	0	0	0	111.1	M61 L70 T84 G319 T321 A328 I338	M61-W63 HydrophobicContact CE-CD2 4.32Å; M61-W63 HydrophobicContact CE-CG 4.23Å; W63-L70 HydrophobicContact CD2-CB 4.11Å; W63-L70 HydrophobicContact CD2-CD2 4.43Å; W63-L70 HydrophobicContact CE3-CB 3.8Å; W63-L70 HydrophobicContact CE3-CD2 4.23Å; W63-L70 HydrophobicContact CH2-CD2 3.97Å; W63-L70 HydrophobicContact CZ2-CD2 4.15Å; W63-L70 HydrophobicContact CZ3-CB 4.26Å; W63-L70 HydrophobicContact CZ3-CD2 4Å; W63-T84 HydrophobicContact CE3-CG2 4.39Å; W63-T84 HydrophobicContact CH2-CG2 3.49Å; W63-T84 VanDerWaalsContact CH2-CG2 3.49Å; W63-T84 HydrophobicContact CZ3-CG2 3.34Å; W63-G319 PolarHBondContact NE1-O 3.08Å; W63-T321 HydrophobicContact CD2-CG2 3.7Å; W63-T321 HydrophobicContact CE3-CG2 3.77Å; W63-T321 HydrophobicContact CG-CG2 4.35Å; W63-T321 HydrophobicContact CH2-CG2 3.67Å; W63-T321 HydrophobicContact CZ2-CG2 3.61Å; W63-T321 HydrophobicContact CZ3-CG2 3.75Å; W63-A328 HydrophobicContact CZ2-CB 3.49Å; W63-A328 VanDerWaalsContact CZ2-CB 3.49Å; W63-I338 HydrophobicContact CH2-CD1 3.83Å; W63-I338 HydrophobicContact CZ2-CD1 3.83Å
64	S	96.8	Very high	97.5	Very high	7 Å²	7	33 Å²	33	5%	0.049	17%	0.171	C	C	.	.			trans	-77.7	160.4	163.1	-169.1	0	0	0	0	110.3	D66 S67 L69	S64-D66 WeakPolarHBondContact CB-OD1 3.43Å; S64-D66 PolarHBondContact O-N 2.77Å; S64-S67 PolarHBondContact O-N 2.89Å; S64-L69 WeakPolarHBondContact CB-O 3.46Å; S64-L69 PolarHBondContact N-O 3.3Å
65	T	94.4	Very high	97.4	Very high	85 Å²	85	34.4 Å²	34.4	52%	0.521	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.5	178.1	48.1	0	0	0	0	112.9	S67 P107	T65-S67 PolarHBondContact O-N 3.26Å; T65-P107 HydrophobicContact CG2-CB 4.14Å; T65-P107 PolarHBondContact OG1-O 3.41Å
66	D	93.8	Very high	97.3	Very high	79 Å²	79	29.5 Å²	29.5	42%	0.422	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-3.4	176.9	74.2	-1.3	0	0	0	114.3	S64 K68 L69	S64-D66 WeakPolarHBondContact CB-OD1 3.43Å; S64-D66 PolarHBondContact O-N 2.77Å; D66-K68 PolarHBondContact O-N 2.93Å; D66-K68 PolarHBondContact OD1-N 2.87Å; D66-L69 PolarHBondContact OD1-N 3.05Å; D66-L69 WeakPolarHBondContact OD2-CG 3.48Å
67	S	95.4	Very high	97.2	Very high	7 Å²	7	28.5 Å²	28.5	5%	0.049	15%	0.145	C	C	.	.	S	Bend	trans	57.1	16.9	-178.1	-58.1	0	0	0	0	114.5	S64 T65 A322 D323	S64-S67 PolarHBondContact O-N 2.89Å; T65-S67 PolarHBondContact O-N 3.26Å; S67-A322 PolarHBondContact OG-N 2.93Å; S67-D323 WeakPolarHBondContact CB-OD2 3.49Å; S67-D323 PolarHBondContact OG-N 2.79Å
68	K	95.8	Very high	97.2	Very high	77 Å²	77	28.7 Å²	28.7	34%	0.335	15%	0.146	S	C	.	.	S	Bend	trans	-121.3	-48.7	-176.8	-178.2	-172.7	174.5	-164	0	111.2	D66 D83 T84 Y85	D66-K68 PolarHBondContact O-N 2.93Å; D66-K68 PolarHBondContact OD1-N 2.87Å; K68-D83 WeakPolarHBondContact CE-OD1 3.34Å; K68-D83 WeakPolarHBondContact CE-OD2 3.31Å; K68-D83 IonicContact NZ-OD1 3.67Å; K68-D83 IonicContact NZ-OD2 3.52Å; K68-D83 PolarHBondContact NZ-OD2 3.43Å; K68-T84 WeakPolarHBondContact O-CB 3.33Å; K68-T84 WeakPolarHBondContact O-CG2 3.1Å; K68-T84 PolarHBondContact O-N 3.49Å; K68-T84 VanDerWaalsContact O-N 3.08Å; K68-T84 PolarHBondContact O-OG1 2.81Å; K68-Y85 HydrophobicContact CG-CD1 4.38Å; K68-Y85 HydrophobicContact CG-CG 4.38Å
69	L	97.6	Very high	97.1	Very high	33 Å²	33	28.7 Å²	28.7	17%	0.173	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	145.9	179	-61.5	-179.5	0	0	0	110.3	S64 D66 W82 D83 V90 Y105	S64-L69 WeakPolarHBondContact CB-O 3.46Å; S64-L69 PolarHBondContact N-O 3.3Å; D66-L69 PolarHBondContact OD1-N 3.05Å; D66-L69 WeakPolarHBondContact OD2-CG 3.48Å; L69-W82 VanDerWaalsContact CA-O 3.31Å; L69-W82 WeakPolarHBondContact CA-O 3.38Å; L69-W82 WeakPolarHBondContact CD2-O 3.33Å; L69-D83 HydrophobicContact CD2-CB 4.19Å; L69-V90 HydrophobicContact CD2-CG2 4.03Å; L69-Y105 HydrophobicContact CB-CE2 4.18Å
70	L	97.9	Very high	97.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	152.6	167	72.1	84.8	0	0	0	110.1	L51 M61 H62 W63 V81 W82 T84 A328 L336 I338	L51-L70 HydrophobicContact CD1-CD1 4.33Å; L51-L70 HydrophobicContact CD1-CD2 3.94Å; L51-L70 HydrophobicContact CD1-CG 4.43Å; M61-L70 HydrophobicContact CE-CB 3.99Å; M61-L70 HydrophobicContact CE-CD1 4.12Å; M61-L70 HydrophobicContact CE-CD2 3.76Å; M61-L70 HydrophobicContact CE-CG 4.2Å; H62-L70 WeakPolarHBondContact O-CA 3.48Å; W63-L70 HydrophobicContact CD2-CB 4.11Å; W63-L70 HydrophobicContact CD2-CD2 4.43Å; W63-L70 HydrophobicContact CE3-CB 3.8Å; W63-L70 HydrophobicContact CE3-CD2 4.23Å; W63-L70 HydrophobicContact CH2-CD2 3.97Å; W63-L70 HydrophobicContact CZ2-CD2 4.15Å; W63-L70 HydrophobicContact CZ3-CB 4.26Å; W63-L70 HydrophobicContact CZ3-CD2 4Å; L70-V81 CarbonylContact O-C 3.47Å; L70-V81 WeakPolarHBondContact O-CA 3.46Å; L70-W82 HydrophobicContact CD1-CB 4.31Å; L70-W82 HydrophobicContact CD1-CG 4.09Å; L70-W82 HydrophobicContact CG-CB 4.24Å; L70-W82 PolarHBondContact N-O 3.16Å; L70-W82 VanDerWaalsContact N-O 3.15Å; L70-W82 PolarHBondContact O-N 3.04Å; L70-T84 HydrophobicContact CB-CG2 4.44Å; L70-T84 HydrophobicContact CD2-CG2 3.26Å; L70-T84 HydrophobicContact CG-CG2 3.78Å; L70-A328 HydrophobicContact CD2-CB 4.28Å; L70-L336 HydrophobicContact CD1-CD2 3.88Å; L70-I338 HydrophobicContact CD2-CD1 3.98Å
71	V	98.6	Very high	97.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	142.5	169.9	65.4	0	0	0	0	109.6	M61 H62 L79 I80 V81 C103 Y105 V112	M61-V71 CarbonylContact C-O 3.57Å; M61-V71 WeakPolarHBondContact CA-O 3.49Å; H62-V71 HydrophobicContact CB-CG1 4.07Å; H62-V71 PolarHBondContact N-O 2.87Å; H62-V71 PolarHBondContact O-N 2.77Å; V71-L79 HydrophobicContact CG2-CD1 3.8Å; V71-L79 HydrophobicContact CG2-CD2 3.77Å; V71-L79 HydrophobicContact CG2-CG 3.5Å; V71-I80 CarbonylContact C-O 3.54Å; V71-I80 WeakPolarHBondContact CA-O 3.03Å; V71-V81 HydrophobicContact CB-CG2 4.4Å; V71-V81 HydrophobicContact CG2-CG2 4.17Å; V71-C103 HydrophobicContact CG1-CB 4.31Å; V71-Y105 HydrophobicContact CB-CD2 3.94Å; V71-Y105 HydrophobicContact CB-CE2 4.44Å; V71-Y105 HydrophobicContact CG1-CD2 3.91Å; V71-Y105 HydrophobicContact CG1-CG 4.47Å; V71-V112 HydrophobicContact CB-CG1 4.25Å; V71-V112 HydrophobicContact CG1-CG1 4.44Å; V71-V112 HydrophobicContact CG2-CB 4.45Å; V71-V112 HydrophobicContact CG2-CG1 4.2Å
72	S	98.6	Very high	97.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.8	172.3	64.5	0	0	0	0	111.7	H54 A60 L79 I80 W82	H54-S72 PolarHBondContact NE2-OG 3.14Å; A60-S72 WeakPolarHBondContact O-CA 3.34Å; S72-L79 WeakPolarHBondContact O-CA 3.35Å; S72-I80 PolarHBondContact N-O 3.36Å; S72-I80 PolarHBondContact O-N 3.41Å; S72-W82 PolarHBondContact OG-NE1 2.84Å
73	A	98.4	Very high	97	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.1	-178.6	0	0	0	0	0	111	I58 Y59 A60 L79 V100 C103	I58-A73 WeakPolarHBondContact CA-O 3.15Å; Y59-A73 PolarHBondContact N-O 2.83Å; A60-A73 HydrophobicContact CB-CB 4.46Å; A60-A73 PolarHBondContact O-N 2.93Å; A73-L79 HydrophobicContact CB-CD1 3.73Å; A73-V100 HydrophobicContact CB-CB 4.37Å; A73-V100 HydrophobicContact CB-CG1 3.72Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; A73-C103 HydrophobicContact CB-CB 3.91Å
74	S	98.2	Very high	96.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	153.3	-175.5	170.6	0	0	0	0	112.2	H54 A56 K57 D76 G77 K78 V100	H54-S74 WeakPolarHBondContact CE1-CB 3.33Å; H54-S74 WeakPolarHBondContact ND1-CB 3.31Å; A56-S74 PolarHBondContact O-OG 3.47Å; K57-S74 WeakPolarHBondContact O-CA 3.23Å; K57-S74 PolarHBondContact O-OG 2.77Å; S74-D76 VanDerWaalsContact CB-OD1 3.28Å; S74-D76 WeakPolarHBondContact CB-OD1 3.43Å; S74-D76 PolarHBondContact O-N 2.98Å; S74-D76 VanDerWaalsContact O-N 3.08Å; S74-D76 PolarHBondContact OG-N 2.88Å; S74-D76 PolarHBondContact OG-OD1 2.72Å; S74-D76 PolarHBondContact OG-OD2 3.48Å; S74-G77 PolarHBondContact O-N 2.99Å; S74-G77 VanDerWaalsContact O-N 3.12Å; S74-K78 PolarHBondContact N-O 2.6Å; S74-V100 WeakPolarHBondContact O-CG1 3.33Å
75	Q	96.8	Very high	96.8	Very high	36 Å²	36	28.6 Å²	28.6	17%	0.168	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-2	176.5	-74.7	-174	-23.3	0	0	114.8	A56 K57 Y59 G77 S98 W99	A56-Q75 HydrophobicContact CB-CB 4.24Å; K57-Q75 PolarHBondContact O-N 3.47Å; Y59-Q75 HydrophobicContact CD2-CG 3.78Å; Y59-Q75 HydrophobicContact CE2-CG 3.67Å; Y59-Q75 PolarHBondContact OH-NE2 3.48Å; Q75-G77 PolarHBondContact O-N 3.27Å; Q75-S98 CarbonylContact C-O 3.59Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.48Å; Q75-W99 VanDerWaalsContact NE2-CE3 3.29Å; Q75-W99 VanDerWaalsContact NE2-CZ3 3.31Å
76	D	95.6	Very high	96.9	Very high	38 Å²	38	27.7 Å²	27.7	20%	0.203	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	3	168.1	61.2	19.8	0	0	0	112.8	H54 L55 A56 S74 K78	H54-D76 VanDerWaalsContact CA-OD2 3.24Å; H54-D76 WeakPolarHBondContact CA-OD2 3.28Å; H54-D76 WeakPolarHBondContact CB-OD2 3.22Å; H54-D76 IonicContact CG-OD2 3.56Å; H54-D76 IonicContact ND1-OD1 2.81Å; H54-D76 IonicContact ND1-OD2 3.92Å; H54-D76 PolarHBondContact ND1-OD2 2.87Å; H54-D76 VanDerWaalsContact ND1-OD2 3.09Å; L55-D76 HydrophobicContact CB-CB 4.25Å; L55-D76 PolarHBondContact N-OD2 3.47Å; A56-D76 HydrophobicContact CB-CB 3.89Å; S74-D76 VanDerWaalsContact CB-OD1 3.28Å; S74-D76 WeakPolarHBondContact CB-OD1 3.43Å; S74-D76 PolarHBondContact O-N 2.98Å; S74-D76 VanDerWaalsContact O-N 3.08Å; S74-D76 PolarHBondContact OG-N 2.88Å; S74-D76 PolarHBondContact OG-OD1 2.72Å; S74-D76 PolarHBondContact OG-OD2 3.48Å; D76-K78 WeakPolarHBondContact OD1-CB 3.3Å; D76-K78 PolarHBondContact OD1-N 3.13Å
77	G	95.8	Very high	97	Very high	10 Å²	10	26.5 Å²	26.5	10%	0.103	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	29.2	-177.8	0	0	0	0	0	112.8	S74 Q75 L95	S74-G77 PolarHBondContact O-N 2.99Å; S74-G77 VanDerWaalsContact O-N 3.12Å; Q75-G77 PolarHBondContact O-N 3.27Å; G77-L95 WeakPolarHBondContact O-CB 3.13Å; G77-L95 PolarHBondContact O-N 3.03Å
78	K	96.8	Very high	97.1	Very high	78 Å²	78	31 Å²	31	34%	0.339	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.1	175.9	-59	-179.2	-178.4	173.1	0	112.1	S74 D76 I80 I93	S74-K78 PolarHBondContact N-O 2.6Å; D76-K78 WeakPolarHBondContact OD1-CB 3.3Å; D76-K78 PolarHBondContact OD1-N 3.13Å; K78-I80 HydrophobicContact CB-CG1 4.23Å; K78-I93 WeakPolarHBondContact CA-O 3.5Å
79	L	97.4	Very high	97.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119	161.2	-160.5	79.6	0	0	0	108.2	V71 S72 A73 I93 L95 C103 V112 C114	V71-L79 HydrophobicContact CG2-CD1 3.8Å; V71-L79 HydrophobicContact CG2-CD2 3.77Å; V71-L79 HydrophobicContact CG2-CG 3.5Å; S72-L79 WeakPolarHBondContact O-CA 3.35Å; A73-L79 HydrophobicContact CB-CD1 3.73Å; L79-I93 HydrophobicContact CB-CB 4.18Å; L79-I93 HydrophobicContact CD2-CD1 4.13Å; L79-I93 PolarHBondContact N-O 3.4Å; L79-I93 PolarHBondContact O-N 3.45Å; L79-L95 HydrophobicContact CB-CD2 4.04Å; L79-L95 HydrophobicContact CB-CG 4.42Å; L79-C103 HydrophobicContact CD1-CB 3.62Å; L79-V112 HydrophobicContact CD2-CB 4.04Å; L79-V112 HydrophobicContact CD2-CG2 3.54Å; L79-C114 HydrophobicContact CD1-CB 3.94Å
80	I	98.1	Very high	97	Very high	2 Å²	2	34 Å²	34	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.1	-179	-56.1	178.4	0	0	0	109.3	H54 V71 S72 K78 W82 K89 H91 A92	H54-I80 VanDerWaalsContact CE1-CD1 3.47Å; H54-I80 WeakPolarHBondContact CE1-CD1 3.2Å; V71-I80 CarbonylContact C-O 3.54Å; V71-I80 WeakPolarHBondContact CA-O 3.03Å; S72-I80 PolarHBondContact N-O 3.36Å; S72-I80 PolarHBondContact O-N 3.41Å; K78-I80 HydrophobicContact CB-CG1 4.23Å; I80-W82 HydrophobicContact CB-CZ2 3.83Å; I80-W82 HydrophobicContact CD1-CH2 4.19Å; I80-W82 HydrophobicContact CD1-CZ2 3.73Å; I80-W82 HydrophobicContact CG1-CZ2 4.37Å; I80-W82 HydrophobicContact CG2-CD2 3.69Å; I80-W82 HydrophobicContact CG2-CE3 4.26Å; I80-W82 HydrophobicContact CG2-CG 4.13Å; I80-W82 HydrophobicContact CG2-CH2 4.12Å; I80-W82 HydrophobicContact CG2-CZ2 3.52Å; I80-W82 HydrophobicContact CG2-CZ3 4.46Å; I80-W82 VanDerWaalsContact O-CD1 3.27Å; I80-W82 PolarHBondContact O-NE1 2.91Å; I80-K89 HydrophobicContact CG2-CB 4.14Å; I80-K89 HydrophobicContact CG2-CD 4.21Å; I80-K89 HydrophobicContact CG2-CG 3.9Å; I80-H91 WeakPolarHBondContact CA-O 3.39Å; I80-H91 WeakPolarHBondContact CG2-O 3.26Å; I80-A92 HydrophobicContact CG1-CB 4.47Å
81	V	97.7	Very high	96.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.6	169.6	-178.8	0	0	0	0	108.3	L70 V71 K89 V90 H91 Y105 V112 L126	L70-V81 CarbonylContact O-C 3.47Å; L70-V81 WeakPolarHBondContact O-CA 3.46Å; V71-V81 HydrophobicContact CB-CG2 4.4Å; V71-V81 HydrophobicContact CG2-CG2 4.17Å; V81-K89 CarbonylContact O-C 3.6Å; V81-V90 HydrophobicContact CB-CB 4.5Å; V81-V90 HydrophobicContact CG1-CB 4.25Å; V81-V90 PolarHBondContact O-N 3.28Å; V81-H91 HydrophobicContact CB-CB 4.1Å; V81-H91 HydrophobicContact CG2-CB 4.22Å; V81-H91 PolarHBondContact N-O 3.4Å; V81-H91 PolarHBondContact O-N 2.94Å; V81-Y105 HydrophobicContact CG1-CE2 4.01Å; V81-V112 HydrophobicContact CG2-CG1 4.4Å; V81-L126 HydrophobicContact CG2-CD1 4.31Å; V81-L126 HydrophobicContact CG2-CD2 4.28Å
82	W	98.3	Very high	96.6	Very high	1 Å²	1	39.3 Å²	39.3	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144	-173.6	-51	80.2	0	0	0	111.1	L51 R52 L69 L70 S72 I80 N88 K89 L336	L51-W82 HydrophobicContact CB-CD2 4.16Å; L51-W82 HydrophobicContact CB-CE3 3.9Å; L51-W82 HydrophobicContact CB-CH2 4.24Å; L51-W82 HydrophobicContact CB-CZ2 4.49Å; L51-W82 HydrophobicContact CB-CZ3 3.94Å; L51-W82 HydrophobicContact CD1-CB 4.02Å; L51-W82 HydrophobicContact CD1-CD2 4.02Å; L51-W82 HydrophobicContact CD1-CE3 4.35Å; L51-W82 HydrophobicContact CD1-CG 3.89Å; L51-W82 HydrophobicContact CD2-CE3 4.35Å; L51-W82 HydrophobicContact CG-CE3 4.43Å; R52-W82 WeakPolarHBondContact O-CH2 3.32Å; R52-W82 WeakPolarHBondContact O-CZ3 3.47Å; L69-W82 VanDerWaalsContact CA-O 3.31Å; L69-W82 WeakPolarHBondContact CA-O 3.38Å; L69-W82 WeakPolarHBondContact CD2-O 3.33Å; L70-W82 HydrophobicContact CD1-CB 4.31Å; L70-W82 HydrophobicContact CD1-CG 4.09Å; L70-W82 HydrophobicContact CG-CB 4.24Å; L70-W82 PolarHBondContact N-O 3.16Å; L70-W82 VanDerWaalsContact N-O 3.15Å; L70-W82 PolarHBondContact O-N 3.04Å; S72-W82 PolarHBondContact OG-NE1 2.84Å; I80-W82 HydrophobicContact CB-CZ2 3.83Å; I80-W82 HydrophobicContact CD1-CH2 4.19Å; I80-W82 HydrophobicContact CD1-CZ2 3.73Å; I80-W82 HydrophobicContact CG1-CZ2 4.37Å; I80-W82 HydrophobicContact CG2-CD2 3.69Å; I80-W82 HydrophobicContact CG2-CE3 4.26Å; I80-W82 HydrophobicContact CG2-CG 4.13Å; I80-W82 HydrophobicContact CG2-CH2 4.12Å; I80-W82 HydrophobicContact CG2-CZ2 3.52Å; I80-W82 HydrophobicContact CG2-CZ3 4.46Å; I80-W82 VanDerWaalsContact O-CD1 3.27Å; I80-W82 PolarHBondContact O-NE1 2.91Å; W82-N88 WeakPolarHBondContact CA-O 3.21Å; W82-K89 HydrophobicContact CE3-CG 3.8Å; W82-K89 HydrophobicContact CH2-CD 4.37Å; W82-K89 HydrophobicContact CH2-CG 4.15Å; W82-K89 HydrophobicContact CZ3-CD 4.2Å; W82-K89 HydrophobicContact CZ3-CG 3.58Å; W82-L336 HydrophobicContact CZ2-CD1 4.37Å
83	D	97.5	Very high	96.5	Very high	18 Å²	18	39.5 Å²	39.5	10%	0.096	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	110.6	157.6	-179.5	-27.1	0	0	0	108	K68 L69 Y85 T86 T87 N88 V90	K68-D83 WeakPolarHBondContact CE-OD1 3.34Å; K68-D83 WeakPolarHBondContact CE-OD2 3.31Å; K68-D83 IonicContact NZ-OD1 3.67Å; K68-D83 IonicContact NZ-OD2 3.52Å; K68-D83 PolarHBondContact NZ-OD2 3.43Å; L69-D83 HydrophobicContact CD2-CB 4.19Å; D83-Y85 VanDerWaalsContact C-N 3.28Å; D83-Y85 PolarHBondContact O-N 2.95Å; D83-Y85 WeakPolarHBondContact OD1-CB 3.46Å; D83-Y85 PolarHBondContact OD1-N 3.03Å; D83-T86 WeakPolarHBondContact CB-OG1 3.38Å; D83-T86 PolarHBondContact OD1-N 2.89Å; D83-T86 PolarHBondContact OD2-OG1 3.39Å; D83-T87 WeakPolarHBondContact O-CA 3.19Å; D83-T87 PolarHBondContact O-N 3.2Å; D83-N88 PolarHBondContact N-O 3.26Å; D83-V90 HydrophobicContact CB-CG2 4.06Å
84	T	95.7	Very high	96.3	Very high	6 Å²	6	44.6 Å²	44.6	4%	0.037	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.6	-174.4	59.6	0	0	0	0	114.4	L51 W63 K68 L70 I338	L51-T84 HydrophobicContact CD1-CG2 4.43Å; W63-T84 HydrophobicContact CE3-CG2 4.39Å; W63-T84 HydrophobicContact CH2-CG2 3.49Å; W63-T84 VanDerWaalsContact CH2-CG2 3.49Å; W63-T84 HydrophobicContact CZ3-CG2 3.34Å; K68-T84 WeakPolarHBondContact O-CB 3.33Å; K68-T84 WeakPolarHBondContact O-CG2 3.1Å; K68-T84 PolarHBondContact O-N 3.49Å; K68-T84 VanDerWaalsContact O-N 3.08Å; K68-T84 PolarHBondContact O-OG1 2.81Å; L70-T84 HydrophobicContact CB-CG2 4.44Å; L70-T84 HydrophobicContact CD2-CG2 3.26Å; L70-T84 HydrophobicContact CG-CG2 3.78Å; T84-I338 HydrophobicContact CG2-CD1 4.17Å
85	Y	94.9	Very high	96.1	Very high	130 Å²	130	45.8 Å²	45.8	51%	0.51	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-43.5	-179.3	-72.3	13.4	0	0	0	110.2	R49 K68 D83	R49-Y85 PolarHBondContact NE-O 3.41Å; K68-Y85 HydrophobicContact CG-CD1 4.38Å; K68-Y85 HydrophobicContact CG-CG 4.38Å; D83-Y85 VanDerWaalsContact C-N 3.28Å; D83-Y85 PolarHBondContact O-N 2.95Å; D83-Y85 WeakPolarHBondContact OD1-CB 3.46Å; D83-Y85 PolarHBondContact OD1-N 3.03Å
86	T	96.5	Very high	95.7	Very high	66 Å²	66	52.9 Å²	52.9	41%	0.405	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-13.3	-177.4	64	0	0	0	0	113.8	D83 N88	D83-T86 WeakPolarHBondContact CB-OG1 3.38Å; D83-T86 PolarHBondContact OD1-N 2.89Å; D83-T86 PolarHBondContact OD2-OG1 3.39Å; T86-N88 PolarHBondContact O-N 3.07Å; T86-N88 WeakPolarHBondContact OG1-CB 3.41Å; T86-N88 PolarHBondContact OG1-N 2.94Å; T86-N88 PolarHBondContact OG1-ND2 2.57Å
87	T	96.7	Very high	95.5	Very high	54 Å²	54	52.5 Å²	52.5	33%	0.331	27%	0.273	S	S	.	.			trans	63.3	9.9	-171.1	72.6	0	0	0	0	115.4	R49 L51 D83	R49-T87 HydrophobicContact CB-CG2 4.09Å; R49-T87 HydrophobicContact CG-CG2 4.17Å; L51-T87 HydrophobicContact CD2-CG2 3.82Å; D83-T87 WeakPolarHBondContact O-CA 3.19Å; D83-T87 PolarHBondContact O-N 3.2Å
88	N	96.9	Very high	95.3	Very high	102 Å²	102	54.5 Å²	54.5	55%	0.545	29%	0.286	S	S	.	.			trans	-74.1	146.4	179.1	-70.5	-26.3	0	0	0	111.3	W82 D83 T86	W82-N88 WeakPolarHBondContact CA-O 3.21Å; D83-N88 PolarHBondContact N-O 3.26Å; T86-N88 PolarHBondContact O-N 3.07Å; T86-N88 WeakPolarHBondContact OG1-CB 3.41Å; T86-N88 PolarHBondContact OG1-N 2.94Å; T86-N88 PolarHBondContact OG1-ND2 2.57Å
89	K	96.1	Very high	95.1	Very high	103 Å²	103	57.2 Å²	57.2	45%	0.448	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	112.6	170.1	-58.1	177.2	-176.1	71	0	107.5	R52 I80 V81 W82	R52-K89 WeakPolarHBondContact O-CE 3.45Å; R52-K89 PolarHBondContact O-NZ 2.95Å; I80-K89 HydrophobicContact CG2-CB 4.14Å; I80-K89 HydrophobicContact CG2-CD 4.21Å; I80-K89 HydrophobicContact CG2-CG 3.9Å; V81-K89 CarbonylContact O-C 3.6Å; W82-K89 HydrophobicContact CE3-CG 3.8Å; W82-K89 HydrophobicContact CH2-CD 4.37Å; W82-K89 HydrophobicContact CH2-CG 4.15Å; W82-K89 HydrophobicContact CZ3-CD 4.2Å; W82-K89 HydrophobicContact CZ3-CG 3.58Å
90	V	94.5	Very high	95.1	Very high	69 Å²	69	57.4 Å²	57.4	42%	0.418	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-45.8	176	-174.5	0	0	0	0	109.4	L69 V81 D83	L69-V90 HydrophobicContact CD2-CG2 4.03Å; V81-V90 HydrophobicContact CB-CB 4.5Å; V81-V90 HydrophobicContact CG1-CB 4.25Å; V81-V90 PolarHBondContact O-N 3.28Å; D83-V90 HydrophobicContact CB-CG2 4.06Å
91	H	94.3	Very high	95	Very high	50 Å²	50	59.4 Å²	59.4	23%	0.231	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147	175.2	-59.9	-70.9	0	0	0	110.8	I80 V81 I93 V133	I80-H91 WeakPolarHBondContact CA-O 3.39Å; I80-H91 WeakPolarHBondContact CG2-O 3.26Å; V81-H91 HydrophobicContact CB-CB 4.1Å; V81-H91 HydrophobicContact CG2-CB 4.22Å; V81-H91 PolarHBondContact N-O 3.4Å; V81-H91 PolarHBondContact O-N 2.94Å; H91-I93 HydrophobicContact CB-CG1 4.35Å; H91-V133 HydrophobicContact CB-CG2 4.43Å; H91-V133 WeakPolarHBondContact ND1-CG2 3.3Å
92	A	94.9	Very high	95	Very high	62 Å²	62	59.6 Å²	59.6	51%	0.512	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	101.9	168.5	0	0	0	0	0	107.8	I80	I80-A92 HydrophobicContact CG1-CB 4.47Å
93	I	95.3	Very high	95	Very high	5 Å²	5	59.5 Å²	59.5	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.8	-171.9	-57.1	159.7	0	0	0	107.7	K78 L79 H91 V112 Y124 L126 V133	K78-I93 WeakPolarHBondContact CA-O 3.5Å; L79-I93 HydrophobicContact CB-CB 4.18Å; L79-I93 HydrophobicContact CD2-CD1 4.13Å; L79-I93 PolarHBondContact N-O 3.4Å; L79-I93 PolarHBondContact O-N 3.45Å; H91-I93 HydrophobicContact CB-CG1 4.35Å; I93-V112 HydrophobicContact CD1-CG2 3.96Å; I93-Y124 HydrophobicContact CD1-CG 4.47Å; I93-Y124 HydrophobicContact CG2-CD1 3.57Å; I93-Y124 HydrophobicContact CG2-CE1 3.44Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.44Å; I93-Y124 HydrophobicContact CG2-CG 4.28Å; I93-L126 HydrophobicContact CD1-CD2 4.03Å; I93-V133 HydrophobicContact CD1-CB 4.38Å; I93-V133 HydrophobicContact CD1-CG1 3.63Å; I93-V133 HydrophobicContact CG1-CB 4.05Å; I93-V133 HydrophobicContact CG1-CG1 3.77Å; I93-V133 HydrophobicContact CG1-CG2 4.41Å
94	P	94.9	Very high	95.1	Very high	106 Å²	106	58.7 Å²	58.7	69%	0.688	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	129.6	172.4	30.1	-32.2	0	0	0	109.9
95	L	94.3	Very high	95.2	Very high	25 Å²	25	59 Å²	59	13%	0.131	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-89.1	151.5	176.7	-57.4	-178.3	0	0	0	110.1	G77 L79 S97 V100 C114 Y124	G77-L95 WeakPolarHBondContact O-CB 3.13Å; G77-L95 PolarHBondContact O-N 3.03Å; L79-L95 HydrophobicContact CB-CD2 4.04Å; L79-L95 HydrophobicContact CB-CG 4.42Å; L95-S97 VanDerWaalsContact CB-O 3.31Å; L95-S97 WeakPolarHBondContact CB-O 3.47Å; L95-V100 HydrophobicContact CD1-CB 3.87Å; L95-V100 HydrophobicContact CD1-CG1 4.13Å; L95-V100 HydrophobicContact CD1-CG2 4.03Å; L95-C114 WeakPolarHBondContact CD2-SG 3.15Å; L95-Y124 HydrophobicContact CD2-CE2 4.14Å; L95-Y124 VanDerWaalsContact CD2-OH 3.26Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.48Å
96	R	88.8	Confident	95.3	Very high	186 Å²	186	52.8 Å²	52.8	70%	0.702	28%	0.278	S	S	*	.	S	Bend	trans	-72.7	-41.5	173.4	-69.5	-176	-178.8	165.1	9.1	111.5	E138	R96-E138 IonicContact CZ-OE1 2.8Å; R96-E138 IonicContact CZ-OE2 3.47Å; R96-E138 IonicContact NE-OE1 3.8Å; R96-E138 IonicContact NH1-OE1 2.71Å; R96-E138 PolarHBondContact NH1-OE1 2.71Å; R96-E138 IonicContact NH1-OE2 3.03Å; R96-E138 PolarHBondContact NH1-OE2 2.84Å; R96-E138 IonicContact NH2-OE1 3.67Å
97	S	90.9	Very high	95.3	Very high	29 Å²	29	51.7 Å²	51.7	20%	0.203	27%	0.272	C	S	.	.			trans	-99.1	133.2	173.8	-176.5	0	0	0	0	110	L95 W99 D118	L95-S97 VanDerWaalsContact CB-O 3.31Å; L95-S97 WeakPolarHBondContact CB-O 3.47Å; S97-W99 VanDerWaalsContact C-N 3.32Å; S97-W99 PolarHBondContact OG-N 3.42Å; S97-D118 VanDerWaalsContact CB-OD2 3.3Å; S97-D118 WeakPolarHBondContact CB-OD2 3.31Å
98	S	90.7	Very high	95.2	Very high	52 Å²	52	51.6 Å²	51.6	36%	0.364	27%	0.273	S	S	.	.	S	Bend	trans	-74.3	-25.1	173.7	55.8	0	0	0	0	112.3	Q75 V100	Q75-S98 CarbonylContact C-O 3.59Å; Q75-S98 VanDerWaalsContact CA-O 3.24Å; Q75-S98 WeakPolarHBondContact CA-O 3.48Å; S98-V100 VanDerWaalsContact C-N 3.31Å; S98-V100 PolarHBondContact O-N 2.8Å
99	W	93.4	Very high	95.1	Very high	135 Å²	135	47.5 Å²	47.5	51%	0.511	26%	0.255	S	S	.	.			trans	-88.7	66.6	-172.7	-65.4	97.6	0	0	0	112	Q75 S97 G116 L117	Q75-W99 VanDerWaalsContact NE2-CE3 3.29Å; Q75-W99 VanDerWaalsContact NE2-CZ3 3.31Å; S97-W99 VanDerWaalsContact C-N 3.32Å; S97-W99 PolarHBondContact OG-N 3.42Å; W99-G116 WeakPolarHBondContact O-CA 3.34Å; W99-L117 HydrophobicContact CB-CB 3.82Å; W99-L117 HydrophobicContact CB-CD1 3.69Å; W99-L117 HydrophobicContact CB-CG 3.79Å; W99-L117 HydrophobicContact CD2-CD1 3.91Å; W99-L117 HydrophobicContact CE3-CD1 4.02Å; W99-L117 HydrophobicContact CG-CD1 3.78Å; W99-L117 HydrophobicContact CG-CG 4.43Å; W99-L117 PolarHBondContact O-N 3.26Å
100	V	96.1	Very high	94.9	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	136.9	174.9	68.2	0	0	0	0	110.8	A73 S74 L95 S98 T102 C114 G115	A73-V100 HydrophobicContact CB-CB 4.37Å; A73-V100 HydrophobicContact CB-CG1 3.72Å; A73-V100 HydrophobicContact CB-CG2 3.7Å; S74-V100 WeakPolarHBondContact O-CG1 3.33Å; L95-V100 HydrophobicContact CD1-CB 3.87Å; L95-V100 HydrophobicContact CD1-CG1 4.13Å; L95-V100 HydrophobicContact CD1-CG2 4.03Å; S98-V100 VanDerWaalsContact C-N 3.31Å; S98-V100 PolarHBondContact O-N 2.8Å; V100-T102 WeakPolarHBondContact CG2-O 3.36Å; V100-C114 HydrophobicContact CG2-CB 3.89Å; V100-G115 WeakPolarHBondContact CG2-O 3.44Å
101	M	97.3	Very high	95	Very high	45 Å²	45	42.5 Å²	42.5	22%	0.222	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	-29.8	178.7	-66.7	-179.8	69.7	0	0	112	Y59 A60 G115 L117 Y145 L146	Y59-M101 HydrophobicContact CD1-CG 4.48Å; A60-M101 WeakPolarHBondContact CB-O 3.47Å; M101-G115 PolarHBondContact N-O 2.89Å; M101-L117 HydrophobicContact SD-CD2 3.97Å; M101-L117 HydrophobicContact SD-CG 4.46Å; M101-Y145 HydrophobicContact CE-CD2 3.61Å; M101-Y145 HydrophobicContact CE-CE2 3.69Å; M101-Y145 HydrophobicContact SD-CD2 3.54Å; M101-Y145 VanDerWaalsContact SD-CD2 3.54Å; M101-Y145 HydrophobicContact SD-CE2 4.24Å; M101-Y145 HydrophobicContact SD-CG 4.05Å; M101-L146 WeakPolarHBondContact CB-O 3.38Å
102	T	98.1	Very high	95.2	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	153.1	-178.2	-179.3	0	0	0	0	112.6	V100 C114 G115 L146 S147 C148 C149	V100-T102 WeakPolarHBondContact CG2-O 3.36Å; T102-C114 VanDerWaalsContact O-CA 3.23Å; T102-C114 WeakPolarHBondContact O-CA 3.5Å; T102-C114 WeakPolarHBondContact O-CB 3.42Å; T102-G115 PolarHBondContact N-O 2.99Å; T102-G115 VanDerWaalsContact N-O 3.08Å; T102-G115 PolarHBondContact O-N 3.05Å; T102-L146 HydrophobicContact CG2-CD2 3.7Å; T102-L146 HydrophobicContact CG2-CG 4.1Å; T102-S147 WeakPolarHBondContact CB-O 3.2Å; T102-C148 WeakPolarHBondContact OG1-CA 3.44Å; T102-C149 HydrophobicContact CG2-CB 4.37Å; T102-C149 PolarHBondContact OG1-N 2.87Å; T102-C149 VanDerWaalsContact OG1-N 3.15Å; T102-C149 PolarHBondContact OG1-SG 2.76Å
103	C	98.1	Very high	95.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	155.1	159.9	60.7	0	0	0	0	111.7	V71 A73 L79 A113 C114 R150	V71-C103 HydrophobicContact CG1-CB 4.31Å; A73-C103 HydrophobicContact CB-CB 3.91Å; L79-C103 HydrophobicContact CD1-CB 3.62Å; C103-A113 CarbonylContact C-O 3.59Å; C103-A113 WeakPolarHBondContact CA-O 3.47Å; C103-A113 WeakPolarHBondContact CB-O 3.39Å; C103-C114 HydrophobicContact CB-CB 4.43Å; C103-R150 PolarHBondContact O-NH1 2.84Å
104	A	98.4	Very high	95.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.6	174.8	0	0	0	0	0	111.5	V112 A113 C149 F151	A104-V112 CarbonylContact O-C 3.58Å; A104-V112 WeakPolarHBondContact O-CA 3.11Å; A104-A113 HydrophobicContact CB-CB 4.46Å; A104-A113 PolarHBondContact N-O 3.2Å; A104-A113 PolarHBondContact O-N 2.93Å; A104-C149 WeakPolarHBondContact CB-O 3.33Å; A104-F151 HydrophobicContact CB-CD2 3.83Å; A104-F151 HydrophobicContact CB-CE2 3.96Å
105	Y	97.9	Very high	95.5	Very high	12 Å²	12	32.2 Å²	32.2	5%	0.047	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.2	165.6	-140.1	-58.4	0	0	0	109.3	H62 L69 V71 V81 V112 L126	H62-Y105 PolarHBondContact ND1-N 3.23Å; H62-Y105 VanDerWaalsContact ND1-N 3.11Å; L69-Y105 HydrophobicContact CB-CE2 4.18Å; V71-Y105 HydrophobicContact CB-CD2 3.94Å; V71-Y105 HydrophobicContact CB-CE2 4.44Å; V71-Y105 HydrophobicContact CG1-CD2 3.91Å; V71-Y105 HydrophobicContact CG1-CG 4.47Å; V81-Y105 HydrophobicContact CG1-CE2 4.01Å; Y105-V112 HydrophobicContact CD1-CG1 4.26Å; Y105-V112 HydrophobicContact CD2-CG1 4.06Å; Y105-V112 HydrophobicContact CE1-CG1 4.29Å; Y105-V112 HydrophobicContact CE2-CG1 4.15Å; Y105-V112 HydrophobicContact CG-CG1 4.12Å; Y105-L126 HydrophobicContact CE1-CD1 4.04Å; Y105-L126 VanDerWaalsContact OH-CD1 3.26Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.32Å
106	A	97.5	Very high	95.6	Very high	1 Å²	1	31 Å²	31	1%	0.008	16%	0.157	C	C	.	.			trans	-70.5	143	172.9	0	0	0	0	0	111.3	S108 G109 F111 F151	A106-S108 PolarHBondContact O-N 3.39Å; A106-S108 VanDerWaalsContact O-N 3.1Å; A106-G109 PolarHBondContact O-N 2.98Å; A106-F111 HydrophobicContact CB-CB 3.88Å; A106-F111 WeakPolarHBondContact CB-O 3.17Å; A106-F111 PolarHBondContact N-O 2.95Å; A106-F151 HydrophobicContact CB-CB 4.31Å; A106-F151 HydrophobicContact CB-CD1 4.09Å; A106-F151 HydrophobicContact CB-CD2 3.87Å; A106-F151 HydrophobicContact CB-CE1 4.32Å; A106-F151 HydrophobicContact CB-CE2 4.12Å; A106-F151 HydrophobicContact CB-CG 3.84Å; A106-F151 HydrophobicContact CB-CZ 4.33Å
107	P	95.6	Very high	96	Very high	43 Å²	43	26.4 Å²	26.4	28%	0.279	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.8	-179.3	-28	34.3	0	0	0	114.9	T65 G109 F196	T65-P107 HydrophobicContact CG2-CB 4.14Å; T65-P107 PolarHBondContact OG1-O 3.41Å; P107-G109 VanDerWaalsContact C-N 3.27Å; P107-G109 PolarHBondContact O-N 3.28Å; P107-F196 HydrophobicContact CG-CE1 4.36Å; P107-F196 HydrophobicContact CG-CZ 4.27Å
108	S	95.3	Very high	96.1	Very high	51 Å²	51	27.1 Å²	27.1	36%	0.357	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.4	177.5	67.2	0	0	0	0	114.4	A106 N110 D154	A106-S108 PolarHBondContact O-N 3.39Å; A106-S108 VanDerWaalsContact O-N 3.1Å; S108-N110 VanDerWaalsContact C-N 3.28Å; S108-N110 WeakPolarHBondContact CB-ND2 3.47Å; S108-N110 VanDerWaalsContact OG-CB 3.31Å; S108-N110 WeakPolarHBondContact OG-CB 3.27Å; S108-N110 PolarHBondContact OG-N 3.35Å; S108-N110 PolarHBondContact OG-ND2 3.31Å; S108-D154 WeakPolarHBondContact CB-OD1 3.49Å; S108-D154 WeakPolarHBondContact CB-OD2 3.41Å; S108-D154 PolarHBondContact OG-OD1 2.76Å; S108-D154 PolarHBondContact OG-OD2 2.94Å; S108-D154 VanDerWaalsContact OG-OD2 3.05Å
109	G	93.9	Very high	96.4	Very high	17 Å²	17	27 Å²	27	18%	0.175	14%	0.142	C	C	.	.	S	Bend	trans	81.4	-1.8	-169.6	0	0	0	0	0	114.9	A106 P107	A106-G109 PolarHBondContact O-N 2.98Å; P107-G109 VanDerWaalsContact C-N 3.27Å; P107-G109 PolarHBondContact O-N 3.28Å
110	N	93.3	Very high	96.4	Very high	38 Å²	38	23.1 Å²	23.1	20%	0.203	13%	0.13	C	C	.	.	S	Bend	trans	-85.1	-32.8	-170.8	-63.2	-29.4	0	0	0	113.8	S108 L126 K127 D154	S108-N110 VanDerWaalsContact C-N 3.28Å; S108-N110 WeakPolarHBondContact CB-ND2 3.47Å; S108-N110 VanDerWaalsContact OG-CB 3.31Å; S108-N110 WeakPolarHBondContact OG-CB 3.27Å; S108-N110 PolarHBondContact OG-N 3.35Å; S108-N110 PolarHBondContact OG-ND2 3.31Å; N110-L126 WeakPolarHBondContact O-CB 3.44Å; N110-L126 PolarHBondContact O-N 2.96Å; N110-K127 VanDerWaalsContact OD1-CD 3.23Å; N110-K127 WeakPolarHBondContact OD1-CD 3.05Å; N110-K127 WeakPolarHBondContact OD1-CE 3.35Å; N110-K127 PolarHBondContact OD1-NZ 2.82Å; N110-D154 PolarHBondContact ND2-OD2 3.46Å
111	F	96.5	Very high	96.5	Very high	29 Å²	29	23 Å²	23	13%	0.127	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.7	-172.9	-58.8	-83.4	0	0	0	112.2	A106 I123 Y124 N125 F151 D154	A106-F111 HydrophobicContact CB-CB 3.88Å; A106-F111 WeakPolarHBondContact CB-O 3.17Å; A106-F111 PolarHBondContact N-O 2.95Å; F111-I123 HydrophobicContact CB-CG2 4.2Å; F111-I123 HydrophobicContact CD1-CG2 3.91Å; F111-I123 HydrophobicContact CG-CG2 4.32Å; F111-Y124 VanDerWaalsContact CA-O 3.25Å; F111-Y124 WeakPolarHBondContact CA-O 3.31Å; F111-N125 HydrophobicContact CD1-CB 3.98Å; F111-N125 HydrophobicContact CE1-CB 3.74Å; F111-F151 HydrophobicContact CB-CE1 4.21Å; F111-F151 HydrophobicContact CB-CZ 3.98Å; F111-D154 HydrophobicContact CD2-CB 4.08Å; F111-D154 HydrophobicContact CE2-CB 3.82Å
112	V	97.8	Very high	96.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.7	163.2	-67.1	0	0	0	0	109.2	V71 L79 V81 I93 A104 Y105 Y124 L126	V71-V112 HydrophobicContact CB-CG1 4.25Å; V71-V112 HydrophobicContact CG1-CG1 4.44Å; V71-V112 HydrophobicContact CG2-CB 4.45Å; V71-V112 HydrophobicContact CG2-CG1 4.2Å; L79-V112 HydrophobicContact CD2-CB 4.04Å; L79-V112 HydrophobicContact CD2-CG2 3.54Å; V81-V112 HydrophobicContact CG2-CG1 4.4Å; I93-V112 HydrophobicContact CD1-CG2 3.96Å; A104-V112 CarbonylContact O-C 3.58Å; A104-V112 WeakPolarHBondContact O-CA 3.11Å; Y105-V112 HydrophobicContact CD1-CG1 4.26Å; Y105-V112 HydrophobicContact CD2-CG1 4.06Å; Y105-V112 HydrophobicContact CE1-CG1 4.29Å; Y105-V112 HydrophobicContact CE2-CG1 4.15Å; Y105-V112 HydrophobicContact CG-CG1 4.12Å; V112-Y124 HydrophobicContact CG2-CD2 4.43Å; V112-Y124 HydrophobicContact CG2-CG 4.48Å; V112-Y124 PolarHBondContact N-O 3.22Å; V112-Y124 PolarHBondContact O-N 2.93Å; V112-L126 HydrophobicContact CG1-CD1 3.78Å; V112-L126 HydrophobicContact CG1-CD2 4.48Å; V112-L126 HydrophobicContact CG1-CG 4.3Å; V112-L126 HydrophobicContact CG2-CD2 3.85Å; V112-L126 HydrophobicContact CG2-CG 4.27Å
113	A	98.1	Very high	96.4	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	154	174.7	0	0	0	0	0	110.4	C103 A104 S122 I123 F151 I157	C103-A113 CarbonylContact C-O 3.59Å; C103-A113 WeakPolarHBondContact CA-O 3.47Å; C103-A113 WeakPolarHBondContact CB-O 3.39Å; A104-A113 HydrophobicContact CB-CB 4.46Å; A104-A113 PolarHBondContact N-O 3.2Å; A104-A113 PolarHBondContact O-N 2.93Å; A113-S122 CarbonylContact C-O 3.56Å; A113-S122 VanDerWaalsContact CA-O 3.23Å; A113-S122 WeakPolarHBondContact CA-O 3.43Å; A113-I123 HydrophobicContact CB-CG1 4.25Å; A113-F151 HydrophobicContact CB-CE2 3.53Å; A113-F151 HydrophobicContact CB-CZ 3.54Å; A113-I157 HydrophobicContact CB-CD1 3.64Å
114	C	97.8	Very high	96.3	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.034	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	165.4	166.8	70.2	0	0	0	0	111.4	L79 L95 V100 T102 C103 C121 S122 Y124	L79-C114 HydrophobicContact CD1-CB 3.94Å; L95-C114 WeakPolarHBondContact CD2-SG 3.15Å; V100-C114 HydrophobicContact CG2-CB 3.89Å; T102-C114 VanDerWaalsContact O-CA 3.23Å; T102-C114 WeakPolarHBondContact O-CA 3.5Å; T102-C114 WeakPolarHBondContact O-CB 3.42Å; C103-C114 HydrophobicContact CB-CB 4.43Å; C114-C121 CarbonylContact O-C 3.59Å; C114-C121 WeakPolarHBondContact O-CA 3.46Å; C114-S122 PolarHBondContact N-O 2.76Å; C114-S122 PolarHBondContact O-N 2.79Å; C114-Y124 VanDerWaalsContact SG-CE2 3.58Å
115	G	96.8	Very high	96.1	Very high	2 Å²	2	23.2 Å²	23.2	2%	0.021	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	174.3	170.4	0	0	0	0	0	111.5	V100 M101 T102 M120	V100-G115 WeakPolarHBondContact CG2-O 3.44Å; M101-G115 PolarHBondContact N-O 2.89Å; T102-G115 PolarHBondContact N-O 2.99Å; T102-G115 VanDerWaalsContact N-O 3.08Å; T102-G115 PolarHBondContact O-N 3.05Å; G115-M120 WeakPolarHBondContact CA-O 3.16Å
116	G	96.1	Very high	95.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	-125.4	176.1	0	0	0	0	0	112.2	W99 D118 N119 Y145 L146	W99-G116 WeakPolarHBondContact O-CA 3.34Å; G116-D118 PolarHBondContact N-OD1 3.35Å; G116-D118 PolarHBondContact O-N 3.16Å; G116-D118 VanDerWaalsContact O-N 3.12Å; G116-N119 PolarHBondContact O-N 2.77Å; G116-N119 VanDerWaalsContact O-N 3.15Å; G116-Y145 CarbonylContact O-C 3.57Å; G116-Y145 WeakPolarHBondContact O-CA 3.28Å; G116-L146 PolarHBondContact O-N 3.41Å
117	L	95.8	Very high	95	Very high	88 Å²	88	30.1 Å²	30.1	46%	0.461	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-4.5	-175	-62.3	-175.4	0	0	0	114.5	W99 M101 N119 Y145	W99-L117 HydrophobicContact CB-CB 3.82Å; W99-L117 HydrophobicContact CB-CD1 3.69Å; W99-L117 HydrophobicContact CB-CG 3.79Å; W99-L117 HydrophobicContact CD2-CD1 3.91Å; W99-L117 HydrophobicContact CE3-CD1 4.02Å; W99-L117 HydrophobicContact CG-CD1 3.78Å; W99-L117 HydrophobicContact CG-CG 4.43Å; W99-L117 PolarHBondContact O-N 3.26Å; M101-L117 HydrophobicContact SD-CD2 3.97Å; M101-L117 HydrophobicContact SD-CG 4.46Å; L117-N119 PolarHBondContact O-OD1 3.05Å; L117-Y145 HydrophobicContact CD2-CD1 4.41Å; L117-Y145 HydrophobicContact CD2-CG 4.1Å
118	D	94.6	Very high	93.8	Very high	44 Å²	44	29.9 Å²	29.9	24%	0.235	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1	172.6	57.6	-4.3	0	0	0	113.1	S97 G116 M120	S97-D118 VanDerWaalsContact CB-OD2 3.3Å; S97-D118 WeakPolarHBondContact CB-OD2 3.31Å; G116-D118 PolarHBondContact N-OD1 3.35Å; G116-D118 PolarHBondContact O-N 3.16Å; G116-D118 VanDerWaalsContact O-N 3.12Å; D118-M120 HydrophobicContact CB-CE 4.01Å; D118-M120 WeakPolarHBondContact O-CG 3.46Å; D118-M120 PolarHBondContact O-N 3.32Å; D118-M120 PolarHBondContact OD1-N 3.27Å
119	N	95.4	Very high	92.3	Very high	50 Å²	50	39.9 Å²	39.9	27%	0.267	19%	0.191	S	C	.	.	S	Bend	trans	59.2	15.7	-180	-52.7	-5.7	0	0	0	113.3	G116 L117 T143 G144 Y145	G116-N119 PolarHBondContact O-N 2.77Å; G116-N119 VanDerWaalsContact O-N 3.15Å; L117-N119 PolarHBondContact O-OD1 3.05Å; N119-T143 PolarHBondContact ND2-O 3.18Å; N119-G144 VanDerWaalsContact CB-O 3.25Å; N119-G144 WeakPolarHBondContact CB-O 3.45Å; N119-G144 VanDerWaalsContact CG-C 3.42Å; N119-G144 PolarHBondContact OD1-O 2.96Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.39Å; N119-Y145 PolarHBondContact OD1-N 3.18Å
120	M	94.9	Very high	90.8	Very high	53 Å²	53	45.8 Å²	45.8	26%	0.261	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	143.5	-176.8	-70.6	-173.5	-69.7	0	0	110.5	G115 D118 L139	G115-M120 WeakPolarHBondContact CA-O 3.16Å; D118-M120 HydrophobicContact CB-CE 4.01Å; D118-M120 WeakPolarHBondContact O-CG 3.46Å; D118-M120 PolarHBondContact O-N 3.32Å; D118-M120 PolarHBondContact OD1-N 3.27Å; M120-L139 WeakPolarHBondContact CA-O 3.3Å
121	C	97.1	Very high	89.5	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	106.3	165.1	-175.6	0	0	0	0	109	C114 L139 L146 T159	C114-C121 CarbonylContact O-C 3.59Å; C114-C121 WeakPolarHBondContact O-CA 3.46Å; C121-L139 HydrophobicContact CB-CB 4.14Å; C121-L139 HydrophobicContact CB-CD1 4.3Å; C121-L139 PolarHBondContact N-O 3.46Å; C121-L139 PolarHBondContact O-N 2.95Å; C121-L146 HydrophobicContact CB-CD1 4.5Å; C121-L146 HydrophobicContact CB-CD2 3.63Å; C121-T159 HydrophobicContact CB-CG2 4.12Å
122	S	97.1	Very high	88.6	Confident	6 Å²	6	51 Å²	51	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.3	176.4	-61.1	0	0	0	0	110.4	A113 C114	A113-S122 CarbonylContact C-O 3.56Å; A113-S122 VanDerWaalsContact CA-O 3.23Å; A113-S122 WeakPolarHBondContact CA-O 3.43Å; C114-S122 PolarHBondContact N-O 2.76Å; C114-S122 PolarHBondContact O-N 2.79Å
123	I	97.2	Very high	88	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.4	179.4	-60.6	171.5	0	0	0	108.7	F111 A113 S136 R137 L139 F151 I157 I171	F111-I123 HydrophobicContact CB-CG2 4.2Å; F111-I123 HydrophobicContact CD1-CG2 3.91Å; F111-I123 HydrophobicContact CG-CG2 4.32Å; A113-I123 HydrophobicContact CB-CG1 4.25Å; I123-S136 WeakPolarHBondContact O-CB 3.5Å; I123-S136 PolarHBondContact O-N 3.36Å; I123-R137 HydrophobicContact CB-CB 4.39Å; I123-R137 PolarHBondContact N-O 3.38Å; I123-R137 PolarHBondContact O-N 3.29Å; I123-L139 HydrophobicContact CD1-CD1 3.81Å; I123-L139 HydrophobicContact CD1-CG 4.27Å; I123-F151 HydrophobicContact CG2-CE1 4.41Å; I123-F151 HydrophobicContact CG2-CZ 4.27Å; I123-I157 HydrophobicContact CD1-CG2 4.33Å; I123-I171 HydrophobicContact CD1-CB 4.1Å; I123-I171 HydrophobicContact CD1-CD1 3.8Å; I123-I171 HydrophobicContact CD1-CG1 3.54Å; I123-I171 HydrophobicContact CD1-CG2 3.58Å; I123-I171 HydrophobicContact CG2-CG2 4.43Å
124	Y	95.9	Very high	87.4	Confident	7 Å²	7	58 Å²	58	3%	0.027	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	134.6	-177.4	-59.6	-95.9	0	0	0	110	I93 L95 F111 V112 C114 V133 V135	I93-Y124 HydrophobicContact CD1-CG 4.47Å; I93-Y124 HydrophobicContact CG2-CD1 3.57Å; I93-Y124 HydrophobicContact CG2-CE1 3.44Å; I93-Y124 VanDerWaalsContact CG2-CE1 3.44Å; I93-Y124 HydrophobicContact CG2-CG 4.28Å; L95-Y124 HydrophobicContact CD2-CE2 4.14Å; L95-Y124 VanDerWaalsContact CD2-OH 3.26Å; L95-Y124 WeakPolarHBondContact CD2-OH 3.48Å; F111-Y124 VanDerWaalsContact CA-O 3.25Å; F111-Y124 WeakPolarHBondContact CA-O 3.31Å; V112-Y124 HydrophobicContact CG2-CD2 4.43Å; V112-Y124 HydrophobicContact CG2-CG 4.48Å; V112-Y124 PolarHBondContact N-O 3.22Å; V112-Y124 PolarHBondContact O-N 2.93Å; C114-Y124 VanDerWaalsContact SG-CE2 3.58Å; Y124-V133 HydrophobicContact CD1-CG1 4.25Å; Y124-V135 HydrophobicContact CD1-CG2 3.97Å; Y124-V135 HydrophobicContact CE1-CB 4.41Å; Y124-V135 HydrophobicContact CE1-CG2 3.41Å; Y124-V135 VanDerWaalsContact CE1-CG2 3.41Å
125	N	94.1	Very high	86.9	Confident	41 Å²	41	60.3 Å²	60.3	22%	0.219	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.4	174	-172.8	-17.4	0	0	0	109.7	F111 K127 T128 K134	F111-N125 HydrophobicContact CD1-CB 3.98Å; F111-N125 HydrophobicContact CE1-CB 3.74Å; N125-K127 PolarHBondContact OD1-N 2.93Å; N125-T128 HydrophobicContact CB-CG2 4.27Å; N125-K134 PolarHBondContact N-O 3.18Å
126	L	90.5	Very high	86.6	Confident	16 Å²	16	62.6 Å²	62.6	8%	0.084	32%	0.319	C	S	.	.	S	Bend	trans	-80.3	-24.9	178.9	-61.2	-176.2	0	0	0	112.8	V81 I93 Y105 N110 V112 T128 V133	V81-L126 HydrophobicContact CG2-CD1 4.31Å; V81-L126 HydrophobicContact CG2-CD2 4.28Å; I93-L126 HydrophobicContact CD1-CD2 4.03Å; Y105-L126 HydrophobicContact CE1-CD1 4.04Å; Y105-L126 VanDerWaalsContact OH-CD1 3.26Å; Y105-L126 WeakPolarHBondContact OH-CD1 3.32Å; N110-L126 WeakPolarHBondContact O-CB 3.44Å; N110-L126 PolarHBondContact O-N 2.96Å; V112-L126 HydrophobicContact CG1-CD1 3.78Å; V112-L126 HydrophobicContact CG1-CD2 4.48Å; V112-L126 HydrophobicContact CG1-CG 4.3Å; V112-L126 HydrophobicContact CG2-CD2 3.85Å; V112-L126 HydrophobicContact CG2-CG 4.27Å; L126-T128 PolarHBondContact O-N 3.45Å; L126-V133 HydrophobicContact CD2-CG1 4.23Å; L126-V133 HydrophobicContact CD2-CG2 4.22Å
127	K	82.4	Confident	86.5	Confident	141 Å²	141	67.3 Å²	67.3	61%	0.613	34%	0.337	S	S	*	.			trans	-98.5	65.7	-179.8	-66.4	-171	-175.6	161.1	0	110.9	N110 N125	N110-K127 VanDerWaalsContact OD1-CD 3.23Å; N110-K127 WeakPolarHBondContact OD1-CD 3.05Å; N110-K127 WeakPolarHBondContact OD1-CE 3.35Å; N110-K127 PolarHBondContact OD1-NZ 2.82Å; N125-K127 PolarHBondContact OD1-N 2.93Å
128	T	69.7	Low	86.5	Confident	39 Å²	39	66 Å²	66	24%	0.239	33%	0.328	C	S	.	.			trans	-92.8	135.1	171.4	52.4	0	0	0	0	111	N125 L126 E130 G131 N132	N125-T128 HydrophobicContact CB-CG2 4.27Å; L126-T128 PolarHBondContact O-N 3.45Å; T128-E130 PolarHBondContact O-N 3.32Å; T128-E130 VanDerWaalsContact O-N 3.14Å; T128-G131 PolarHBondContact O-N 2.87Å; T128-N132 PolarHBondContact OG1-O 3.05Å
129	R	62.7	Low	86.5	Confident	261 Å²	261	64 Å²	64	99%	0.985	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.8	176.9	-66.9	-176.4	179.8	-175.2	0.2	113.2
130	E	62.6	Low	86.3	Confident	141 Å²	141	65.8 Å²	65.8	66%	0.659	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	3	-174.5	-62.1	179.3	171.4	0	0	113.5	T128 N132 K134	T128-E130 PolarHBondContact O-N 3.32Å; T128-E130 VanDerWaalsContact O-N 3.14Å; E130-N132 PolarHBondContact O-N 2.88Å; E130-K134 IonicContact OE2-NZ 2.87Å; E130-K134 PolarHBondContact OE2-NZ 3.18Å
131	G	67.3	Low	85.9	Confident	58 Å²	58	65.7 Å²	65.7	60%	0.598	34%	0.342	S	S	*	.	S	Bend	trans	73.8	-22.5	177.9	0	0	0	0	0	115.8	T128	T128-G131 PolarHBondContact O-N 2.87Å
132	N	77.7	Confident	85.8	Confident	117 Å²	117	66.5 Å²	66.5	63%	0.626	35%	0.346	S	S	*	.	S	Bend	trans	-88.7	124.6	174.3	-76.2	-11.4	0	0	0	111.2	T128 E130 K134	T128-N132 PolarHBondContact OG1-O 3.05Å; E130-N132 PolarHBondContact O-N 2.88Å; N132-K134 PolarHBondContact O-N 2.91Å
133	V	84.6	Confident	85.7	Confident	34 Å²	34	71.9 Å²	71.9	21%	0.206	38%	0.378	C	S	.	.			trans	-70.6	119.4	172.9	178.9	0	0	0	0	108.7	H91 I93 Y124 L126	H91-V133 HydrophobicContact CB-CG2 4.43Å; H91-V133 WeakPolarHBondContact ND1-CG2 3.3Å; I93-V133 HydrophobicContact CD1-CB 4.38Å; I93-V133 HydrophobicContact CD1-CG1 3.63Å; I93-V133 HydrophobicContact CG1-CB 4.05Å; I93-V133 HydrophobicContact CG1-CG1 3.77Å; I93-V133 HydrophobicContact CG1-CG2 4.41Å; Y124-V133 HydrophobicContact CD1-CG1 4.25Å; L126-V133 HydrophobicContact CD2-CG1 4.23Å; L126-V133 HydrophobicContact CD2-CG2 4.22Å
134	K	84.7	Confident	85.6	Confident	115 Å²	115	72.5 Å²	72.5	50%	0.5	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	153.2	178.4	-68.9	178.2	179.4	167.4	0	110.1	N125 E130 N132 S136	N125-K134 PolarHBondContact N-O 3.18Å; E130-K134 IonicContact OE2-NZ 2.87Å; E130-K134 PolarHBondContact OE2-NZ 3.18Å; N132-K134 PolarHBondContact O-N 2.91Å; K134-S136 PolarHBondContact O-N 3.11Å
135	V	88.8	Confident	85.7	Confident	52 Å²	52	74.4 Å²	74.4	32%	0.315	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	120.8	168.1	-177.5	0	0	0	0	107.7	Y124 E138	Y124-V135 HydrophobicContact CD1-CG2 3.97Å; Y124-V135 HydrophobicContact CE1-CB 4.41Å; Y124-V135 HydrophobicContact CE1-CG2 3.41Å; Y124-V135 VanDerWaalsContact CE1-CG2 3.41Å; V135-E138 HydrophobicContact CG1-CG 3.63Å
136	S	89.9	Confident	85.8	Confident	51 Å²	51	72.5 Å²	72.5	36%	0.357	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-41.4	176	-168.2	0	0	0	0	111.1	I123 K134	I123-S136 WeakPolarHBondContact O-CB 3.5Å; I123-S136 PolarHBondContact O-N 3.36Å; K134-S136 PolarHBondContact O-N 3.11Å
137	R	93.9	Very high	86.2	Confident	99 Å²	99	72.3 Å²	72.3	37%	0.374	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	149.1	-178.3	-160.3	68.8	66.8	-153	2.6	110.9	I123 L139 I171 E172	I123-R137 HydrophobicContact CB-CB 4.39Å; I123-R137 PolarHBondContact N-O 3.38Å; I123-R137 PolarHBondContact O-N 3.29Å; R137-L139 HydrophobicContact CG-CD2 3.81Å; R137-I171 HydrophobicContact CB-CG2 4.47Å; R137-I171 PolarHBondContact NE-O 3.39Å; R137-E172 PolarHBondContact NH2-O 3.2Å
138	E	94.8	Very high	86.9	Confident	59 Å²	59	66.1 Å²	66.1	28%	0.276	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.4	168.4	-63.1	-179.2	159.2	0	0	107	R96 V135	R96-E138 IonicContact CZ-OE1 2.8Å; R96-E138 IonicContact CZ-OE2 3.47Å; R96-E138 IonicContact NE-OE1 3.8Å; R96-E138 IonicContact NH1-OE1 2.71Å; R96-E138 PolarHBondContact NH1-OE1 2.71Å; R96-E138 IonicContact NH1-OE2 3.03Å; R96-E138 PolarHBondContact NH1-OE2 2.84Å; R96-E138 IonicContact NH2-OE1 3.67Å; V135-E138 HydrophobicContact CG1-CG 3.63Å
139	L	95.1	Very high	88.3	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.3	-180	-53.1	175.8	0	0	0	108.1	M120 C121 I123 R137 I157 W169	M120-L139 WeakPolarHBondContact CA-O 3.3Å; C121-L139 HydrophobicContact CB-CB 4.14Å; C121-L139 HydrophobicContact CB-CD1 4.3Å; C121-L139 PolarHBondContact N-O 3.46Å; C121-L139 PolarHBondContact O-N 2.95Å; I123-L139 HydrophobicContact CD1-CD1 3.81Å; I123-L139 HydrophobicContact CD1-CG 4.27Å; R137-L139 HydrophobicContact CG-CD2 3.81Å; L139-I157 HydrophobicContact CD1-CG2 3.61Å; L139-W169 HydrophobicContact CB-CD2 4.12Å; L139-W169 HydrophobicContact CB-CE3 3.92Å; L139-W169 HydrophobicContact CB-CH2 4.18Å; L139-W169 HydrophobicContact CB-CZ2 4.46Å; L139-W169 HydrophobicContact CB-CZ3 3.94Å; L139-W169 HydrophobicContact CD1-CB 3.76Å; L139-W169 HydrophobicContact CD1-CD2 3.96Å; L139-W169 HydrophobicContact CD1-CE3 4.26Å; L139-W169 HydrophobicContact CD1-CG 3.74Å; L139-W169 HydrophobicContact CD2-CE3 4.06Å; L139-W169 HydrophobicContact CG-CD2 4.45Å; L139-W169 HydrophobicContact CG-CE3 4.3Å
140	S	91.3	Very high	90	Very high	88 Å²	88	54.6 Å²	54.6	62%	0.615	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	98.2	-174.2	62	0	0	0	0	110.6
141	A	86.8	Confident	91.7	Very high	52 Å²	52	48.2 Å²	48.2	43%	0.43	28%	0.278	S	S	.	.			trans	-148.6	-18.2	169.4	0	0	0	0	0	113.2	W169	A141-W169 HydrophobicContact CB-CH2 3.31Å; A141-W169 HydrophobicContact CB-CZ2 4.12Å; A141-W169 HydrophobicContact CB-CZ3 4.06Å
142	H	94	Very high	93.1	Very high	18 Å²	18	46.4 Å²	46.4	8%	0.083	26%	0.255	C	S	.	.			trans	-64.9	141.9	173.1	-76.6	-58.3	0	0	0	111.4	T159 S161 D163 T165	H142-T159 PolarHBondContact NE2-OG1 2.94Å; H142-S161 VanDerWaalsContact CE1-CB 3.47Å; H142-S161 WeakPolarHBondContact CE1-CB 3.37Å; H142-S161 VanDerWaalsContact CG-CB 3.49Å; H142-S161 WeakPolarHBondContact ND1-CB 3.33Å; H142-D163 VanDerWaalsContact CA-OD2 3.27Å; H142-D163 WeakPolarHBondContact CA-OD2 3.49Å; H142-D163 VanDerWaalsContact CB-OD2 3.31Å; H142-D163 WeakPolarHBondContact CB-OD2 3.21Å; H142-D163 IonicContact CG-OD2 2.74Å; H142-D163 IonicContact ND1-OD1 3.09Å; H142-D163 IonicContact ND1-OD2 3.55Å; H142-D163 PolarHBondContact ND1-OD2 3.37Å; H142-T165 PolarHBondContact CE1-OG1 2.89Å; H142-T165 PolarHBondContact ND1-OG1 2.83Å
143	T	95.4	Very high	94	Very high	118 Å²	118	44.1 Å²	44.1	72%	0.724	24%	0.243	S	C	*	.	S	Bend	trans	-98.2	-8.6	176.5	56.1	0	0	0	0	112.1	N119 D163	N119-T143 PolarHBondContact ND2-O 3.18Å; T143-D163 PolarHBondContact N-OD2 3.27Å; T143-D163 VanDerWaalsContact OG1-CB 3.28Å; T143-D163 WeakPolarHBondContact OG1-CB 3.29Å
144	G	95.8	Very high	94.6	Very high	13 Å²	13	44.3 Å²	44.3	13%	0.134	24%	0.243	C	C	.	.	S	Bend	trans	-119.4	177.1	174.1	0	0	0	0	0	112.4	N119 S161	N119-G144 VanDerWaalsContact CB-O 3.25Å; N119-G144 WeakPolarHBondContact CB-O 3.45Å; N119-G144 VanDerWaalsContact CG-C 3.42Å; N119-G144 PolarHBondContact OD1-O 2.96Å; G144-S161 PolarHBondContact O-OG 2.88Å
145	Y	96.8	Very high	95.2	Very high	48 Å²	48	42.6 Å²	42.6	19%	0.188	24%	0.239	C	C	.	.			trans	-65.9	146.4	-178.7	60.1	-94.3	0	0	0	111.5	M101 G116 L117 N119 S147 S161 G162 D186	M101-Y145 HydrophobicContact CE-CD2 3.61Å; M101-Y145 HydrophobicContact CE-CE2 3.69Å; M101-Y145 HydrophobicContact SD-CD2 3.54Å; M101-Y145 VanDerWaalsContact SD-CD2 3.54Å; M101-Y145 HydrophobicContact SD-CE2 4.24Å; M101-Y145 HydrophobicContact SD-CG 4.05Å; G116-Y145 CarbonylContact O-C 3.57Å; G116-Y145 WeakPolarHBondContact O-CA 3.28Å; L117-Y145 HydrophobicContact CD2-CD1 4.41Å; L117-Y145 HydrophobicContact CD2-CG 4.1Å; N119-Y145 WeakPolarHBondContact OD1-CA 3.39Å; N119-Y145 PolarHBondContact OD1-N 3.18Å; Y145-S147 PolarHBondContact O-N 2.71Å; Y145-S161 CarbonylContact O-C 3.57Å; Y145-S161 VanDerWaalsContact O-CA 3.22Å; Y145-S161 WeakPolarHBondContact O-CA 3.42Å; Y145-S161 PolarHBondContact O-OG 3.05Å; Y145-G162 PolarHBondContact O-N 2.77Å; Y145-D186 WeakPolarHBondContact CE1-OD2 3.42Å; Y145-D186 WeakPolarHBondContact OH-CB 3.18Å; Y145-D186 PolarHBondContact OH-OD2 2.85Å
146	L	97.9	Very high	95.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.3	175.2	-158.3	77.7	0	0	0	110.1	M101 T102 G116 C121 C149 T159	M101-L146 WeakPolarHBondContact CB-O 3.38Å; T102-L146 HydrophobicContact CG2-CD2 3.7Å; T102-L146 HydrophobicContact CG2-CG 4.1Å; G116-L146 PolarHBondContact O-N 3.41Å; C121-L146 HydrophobicContact CB-CD1 4.5Å; C121-L146 HydrophobicContact CB-CD2 3.63Å; L146-C149 HydrophobicContact CD2-CB 4.46Å; L146-T159 HydrophobicContact CD1-CG2 3.91Å
147	S	97.6	Very high	96	Very high	12 Å²	12	39 Å²	39	8%	0.084	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-41.2	-176.1	61.2	0	0	0	0	113.2	T102 Y145 S160 C187 M188	T102-S147 WeakPolarHBondContact CB-O 3.2Å; Y145-S147 PolarHBondContact O-N 2.71Å; S147-S160 PolarHBondContact N-O 3.2Å; S147-S160 WeakPolarHBondContact OG-CB 3.11Å; S147-S160 PolarHBondContact OG-O 2.71Å; S147-S160 VanDerWaalsContact OG-O 3.14Å; S147-S160 PolarHBondContact OG-OG 2.81Å; S147-C187 WeakPolarHBondContact CB-O 3.35Å; S147-C187 PolarHBondContact OG-O 3.09Å; S147-M188 WeakPolarHBondContact CB-O 3.01Å
148	C	98.2	Very high	96.2	Very high	11 Å²	11	34.3 Å²	34.3	7%	0.074	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.6	178	-166.5	0	0	0	0	111.1	T102 T159 S160 L190	T102-C148 WeakPolarHBondContact OG1-CA 3.44Å; C148-T159 WeakPolarHBondContact O-CA 3.34Å; C148-S160 VanDerWaalsContact CB-OG 3.27Å; C148-S160 WeakPolarHBondContact CB-OG 3.42Å; C148-S160 PolarHBondContact N-OG 3.02Å; C148-S160 VanDerWaalsContact N-OG 3.13Å; C148-S160 PolarHBondContact O-N 2.87Å; C148-S160 PolarHBondContact O-OG 3.04Å; C148-L190 HydrophobicContact CB-CD2 4.43Å; C148-L190 HydrophobicContact CB-CG 4.07Å
149	C	98.2	Very high	96.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	146.8	171.3	64.3	0	0	0	0	111.2	T102 A104 L146 I157 V158 T159	T102-C149 HydrophobicContact CG2-CB 4.37Å; T102-C149 PolarHBondContact OG1-N 2.87Å; T102-C149 VanDerWaalsContact OG1-N 3.15Å; T102-C149 PolarHBondContact OG1-SG 2.76Å; A104-C149 WeakPolarHBondContact CB-O 3.33Å; L146-C149 HydrophobicContact CD2-CB 4.46Å; C149-I157 HydrophobicContact CB-CD1 4.06Å; C149-I157 HydrophobicContact CB-CG1 4.45Å; C149-V158 CarbonylContact C-O 3.53Å; C149-V158 VanDerWaalsContact CA-O 3.25Å; C149-V158 WeakPolarHBondContact CA-O 3.31Å; C149-T159 HydrophobicContact CB-CG2 3.98Å
150	R	98.5	Very high	96.6	Very high	58 Å²	58	31.4 Å²	31.4	22%	0.219	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	131.2	175.1	-68.5	-65.3	177.9	-102	4.6	110.8	C103 I157 V158 L190 V192	C103-R150 PolarHBondContact O-NH1 2.84Å; R150-I157 WeakPolarHBondContact O-CG1 3.49Å; R150-V158 PolarHBondContact N-O 2.88Å; R150-V158 PolarHBondContact O-N 3.34Å; R150-L190 HydrophobicContact CB-CD1 3.72Å; R150-L190 HydrophobicContact CG-CD1 3.5Å; R150-L190 VanDerWaalsContact CG-CD1 3.5Å; R150-V192 HydrophobicContact CB-CG2 3.63Å; R150-V192 HydrophobicContact CG-CG2 4.28Å
151	F	98.4	Very high	96.9	Very high	8 Å²	8	27.2 Å²	27.2	4%	0.035	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	139.5	172.6	-70.7	-86.8	0	0	0	110.3	A104 A106 F111 A113 I123 D153 I157 I171	A104-F151 HydrophobicContact CB-CD2 3.83Å; A104-F151 HydrophobicContact CB-CE2 3.96Å; A106-F151 HydrophobicContact CB-CB 4.31Å; A106-F151 HydrophobicContact CB-CD1 4.09Å; A106-F151 HydrophobicContact CB-CD2 3.87Å; A106-F151 HydrophobicContact CB-CE1 4.32Å; A106-F151 HydrophobicContact CB-CE2 4.12Å; A106-F151 HydrophobicContact CB-CG 3.84Å; A106-F151 HydrophobicContact CB-CZ 4.33Å; F111-F151 HydrophobicContact CB-CE1 4.21Å; F111-F151 HydrophobicContact CB-CZ 3.98Å; A113-F151 HydrophobicContact CB-CE2 3.53Å; A113-F151 HydrophobicContact CB-CZ 3.54Å; I123-F151 HydrophobicContact CG2-CE1 4.41Å; I123-F151 HydrophobicContact CG2-CZ 4.27Å; F151-D153 WeakPolarHBondContact CD1-O 3.48Å; F151-I157 HydrophobicContact CD1-CB 4.14Å; F151-I157 HydrophobicContact CD1-CD1 4.14Å; F151-I157 HydrophobicContact CD1-CG1 4.28Å; F151-I157 HydrophobicContact CD2-CD1 4.26Å; F151-I157 HydrophobicContact CE1-CB 4.46Å; F151-I157 HydrophobicContact CE1-CD1 3.98Å; F151-I157 HydrophobicContact CE2-CD1 4.1Å; F151-I157 HydrophobicContact CG-CD1 4.28Å; F151-I157 HydrophobicContact CG-CG1 4.38Å; F151-I157 HydrophobicContact CZ-CD1 3.97Å; F151-I171 HydrophobicContact CD1-CD1 3.84Å; F151-I171 HydrophobicContact CE1-CD1 3.62Å
152	L	97.8	Very high	97.4	Very high	20 Å²	20	25.3 Å²	25.3	11%	0.105	14%	0.138	C	C	.	.	S	Bend	trans	-89.8	-41.5	164.3	-54.4	-179.2	0	0	0	110.1	N156 V158 L168 V192 F196 V213	L152-N156 HydrophobicContact CB-CB 4.12Å; L152-N156 HydrophobicContact CD1-CB 4.24Å; L152-N156 HydrophobicContact CG-CB 4.49Å; L152-N156 PolarHBondContact N-O 3.29Å; L152-V158 HydrophobicContact CD1-CG2 3.97Å; L152-V158 HydrophobicContact CD2-CG2 4.05Å; L152-V158 HydrophobicContact CG-CG2 4.02Å; L152-L168 HydrophobicContact CD1-CD1 3.68Å; L152-V192 HydrophobicContact CD2-CB 4.33Å; L152-V192 HydrophobicContact CD2-CG1 3.52Å; L152-V192 HydrophobicContact CD2-CG2 3.81Å; L152-F196 HydrophobicContact CB-CD1 4.27Å; L152-F196 HydrophobicContact CD2-CB 4.48Å; L152-F196 HydrophobicContact CD2-CD1 4.01Å; L152-V213 HydrophobicContact CD1-CG1 3.63Å; L152-V213 HydrophobicContact CD1-CG2 4.43Å
153	D	96.5	Very high	97.6	Very high	68 Å²	68	25.8 Å²	25.8	36%	0.364	14%	0.142	S	C	.	.	S	Bend	trans	-154.4	-167.2	175	57.6	46.2	0	0	0	108.7	F151 N155 N156	F151-D153 WeakPolarHBondContact CD1-O 3.48Å; D153-N155 PolarHBondContact O-N 3Å; D153-N155 WeakPolarHBondContact OD1-CA 3.32Å; D153-N155 PolarHBondContact OD1-N 3.48Å; D153-N156 PolarHBondContact N-O 3.19Å; D153-N156 WeakPolarHBondContact OD1-CB 3.32Å; D153-N156 PolarHBondContact OD1-N 3.23Å; D153-N156 PolarHBondContact OD1-ND2 2.87Å; D153-N156 VanDerWaalsContact OD1-ND2 3.07Å; D153-N156 PolarHBondContact OD2-ND2 3.42Å
154	D	96.1	Very high	97.7	Very high	39 Å²	39	22.2 Å²	22.2	21%	0.209	12%	0.12	C	C	.	.	S	Bend	trans	-72.4	-14.6	-179.8	-80.4	2.3	0	0	0	114.1	S108 N110 F111 I171	S108-D154 WeakPolarHBondContact CB-OD1 3.49Å; S108-D154 WeakPolarHBondContact CB-OD2 3.41Å; S108-D154 PolarHBondContact OG-OD1 2.76Å; S108-D154 PolarHBondContact OG-OD2 2.94Å; S108-D154 VanDerWaalsContact OG-OD2 3.05Å; N110-D154 PolarHBondContact ND2-OD2 3.46Å; F111-D154 HydrophobicContact CD2-CB 4.08Å; F111-D154 HydrophobicContact CE2-CB 3.82Å; D154-I171 WeakPolarHBondContact O-CD1 3.33Å
155	N	96.8	Very high	97.8	Very high	79 Å²	79	22.5 Å²	22.5	42%	0.422	12%	0.119	S	C	.	.	S	Bend	trans	-112.1	-15	-176.4	-70.6	-4.3	0	0	0	113.2	D153 D170 I171	D153-N155 PolarHBondContact O-N 3Å; D153-N155 WeakPolarHBondContact OD1-CA 3.32Å; D153-N155 PolarHBondContact OD1-N 3.48Å; N155-D170 WeakPolarHBondContact O-CA 3.43Å; N155-I171 WeakPolarHBondContact O-CB 2.95Å; N155-I171 WeakPolarHBondContact O-CG1 3.39Å; N155-I171 PolarHBondContact O-N 3.21Å
156	N	97.9	Very high	97.9	Very high	28 Å²	28	20.2 Å²	20.2	15%	0.15	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.1	-175.5	-60.9	-71.4	0	0	0	111.5	L152 D153 L168 W169 K177	L152-N156 HydrophobicContact CB-CB 4.12Å; L152-N156 HydrophobicContact CD1-CB 4.24Å; L152-N156 HydrophobicContact CG-CB 4.49Å; L152-N156 PolarHBondContact N-O 3.29Å; D153-N156 PolarHBondContact N-O 3.19Å; D153-N156 WeakPolarHBondContact OD1-CB 3.32Å; D153-N156 PolarHBondContact OD1-N 3.23Å; D153-N156 PolarHBondContact OD1-ND2 2.87Å; D153-N156 VanDerWaalsContact OD1-ND2 3.07Å; D153-N156 PolarHBondContact OD2-ND2 3.42Å; N156-L168 HydrophobicContact CB-CD1 4.27Å; N156-W169 WeakPolarHBondContact CA-O 3.15Å; N156-K177 PolarHBondContact OD1-NZ 2.96Å
157	I	98.4	Very high	97.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.8	175.2	-169.9	170.3	0	0	0	110	A113 I123 L139 C149 R150 F151 W169 I171	A113-I157 HydrophobicContact CB-CD1 3.64Å; I123-I157 HydrophobicContact CD1-CG2 4.33Å; L139-I157 HydrophobicContact CD1-CG2 3.61Å; C149-I157 HydrophobicContact CB-CD1 4.06Å; C149-I157 HydrophobicContact CB-CG1 4.45Å; R150-I157 WeakPolarHBondContact O-CG1 3.49Å; F151-I157 HydrophobicContact CD1-CB 4.14Å; F151-I157 HydrophobicContact CD1-CD1 4.14Å; F151-I157 HydrophobicContact CD1-CG1 4.28Å; F151-I157 HydrophobicContact CD2-CD1 4.26Å; F151-I157 HydrophobicContact CE1-CB 4.46Å; F151-I157 HydrophobicContact CE1-CD1 3.98Å; F151-I157 HydrophobicContact CE2-CD1 4.1Å; F151-I157 HydrophobicContact CG-CD1 4.28Å; F151-I157 HydrophobicContact CG-CG1 4.38Å; F151-I157 HydrophobicContact CZ-CD1 3.97Å; I157-W169 HydrophobicContact CG2-CB 3.76Å; I157-W169 HydrophobicContact CG2-CG 4.24Å; I157-W169 PolarHBondContact N-O 3.06Å; I157-W169 PolarHBondContact O-N 2.9Å; I157-I171 HydrophobicContact CB-CD1 4.13Å; I157-I171 HydrophobicContact CB-CG1 4.44Å; I157-I171 HydrophobicContact CG2-CD1 4.14Å; I157-I171 HydrophobicContact CG2-CG1 3.93Å
158	V	98.6	Very high	97.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137	171.9	-175.8	0	0	0	0	108.9	C149 R150 L152 A167 L168 L190 F199	C149-V158 CarbonylContact C-O 3.53Å; C149-V158 VanDerWaalsContact CA-O 3.25Å; C149-V158 WeakPolarHBondContact CA-O 3.31Å; R150-V158 PolarHBondContact N-O 2.88Å; R150-V158 PolarHBondContact O-N 3.34Å; L152-V158 HydrophobicContact CD1-CG2 3.97Å; L152-V158 HydrophobicContact CD2-CG2 4.05Å; L152-V158 HydrophobicContact CG-CG2 4.02Å; V158-A167 CarbonylContact C-O 3.54Å; V158-A167 VanDerWaalsContact CA-O 3.27Å; V158-A167 WeakPolarHBondContact CA-O 3.27Å; V158-L168 HydrophobicContact CG2-CD1 3.88Å; V158-L190 HydrophobicContact CG1-CD2 3.98Å; V158-F199 HydrophobicContact CG1-CD1 4.37Å; V158-F199 HydrophobicContact CG1-CD2 4.21Å; V158-F199 HydrophobicContact CG1-CE1 4.26Å; V158-F199 HydrophobicContact CG1-CE2 4.12Å; V158-F199 HydrophobicContact CG1-CG 4.34Å; V158-F199 HydrophobicContact CG1-CZ 4.15Å
159	T	98.6	Very high	97.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152	176.8	57.9	0	0	0	0	111.5	C121 H142 L146 C148 C149 C166 A167 W169 L190	C121-T159 HydrophobicContact CB-CG2 4.12Å; H142-T159 PolarHBondContact NE2-OG1 2.94Å; L146-T159 HydrophobicContact CD1-CG2 3.91Å; C148-T159 WeakPolarHBondContact O-CA 3.34Å; C149-T159 HydrophobicContact CB-CG2 3.98Å; T159-C166 CarbonylContact O-C 3.56Å; T159-C166 WeakPolarHBondContact O-CA 3.35Å; T159-C166 VanDerWaalsContact O-CB 3.27Å; T159-C166 WeakPolarHBondContact O-CB 3.35Å; T159-A167 PolarHBondContact N-O 2.97Å; T159-A167 PolarHBondContact O-N 2.66Å; T159-W169 PolarHBondContact OG1-NE1 2.92Å; T159-L190 VanDerWaalsContact C-CD2 3.47Å
160	S	98.2	Very high	97.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.2	166.9	53.6	0	0	0	0	110.2	S147 C148 C187	S147-S160 PolarHBondContact N-O 3.2Å; S147-S160 WeakPolarHBondContact OG-CB 3.11Å; S147-S160 PolarHBondContact OG-O 2.71Å; S147-S160 VanDerWaalsContact OG-O 3.14Å; S147-S160 PolarHBondContact OG-OG 2.81Å; C148-S160 VanDerWaalsContact CB-OG 3.27Å; C148-S160 WeakPolarHBondContact CB-OG 3.42Å; C148-S160 PolarHBondContact N-OG 3.02Å; C148-S160 VanDerWaalsContact N-OG 3.13Å; C148-S160 PolarHBondContact O-N 2.87Å; C148-S160 PolarHBondContact O-OG 3.04Å; S160-C187 WeakPolarHBondContact CB-SG 3.3Å
161	S	98.3	Very high	97.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	155.6	-174.4	173.8	0	0	0	0	112.8	H142 G144 Y145 D163 T164 T165 C187	H142-S161 VanDerWaalsContact CE1-CB 3.47Å; H142-S161 WeakPolarHBondContact CE1-CB 3.37Å; H142-S161 VanDerWaalsContact CG-CB 3.49Å; H142-S161 WeakPolarHBondContact ND1-CB 3.33Å; G144-S161 PolarHBondContact O-OG 2.88Å; Y145-S161 CarbonylContact O-C 3.57Å; Y145-S161 VanDerWaalsContact O-CA 3.22Å; Y145-S161 WeakPolarHBondContact O-CA 3.42Å; Y145-S161 PolarHBondContact O-OG 3.05Å; S161-D163 VanDerWaalsContact CB-OD1 3.26Å; S161-D163 WeakPolarHBondContact CB-OD1 3.31Å; S161-D163 PolarHBondContact O-N 2.95Å; S161-D163 PolarHBondContact OG-N 3.09Å; S161-D163 VanDerWaalsContact OG-N 3.14Å; S161-D163 PolarHBondContact OG-OD1 2.97Å; S161-D163 PolarHBondContact OG-OD2 3.33Å; S161-T164 PolarHBondContact O-N 2.88Å; S161-T165 PolarHBondContact N-O 3.12Å; S161-C187 WeakPolarHBondContact O-CB 3.16Å; S161-C187 PolarHBondContact O-N 2.72Å
162	G	97.8	Very high	97.6	Very high	11 Å²	11	24.6 Å²	24.6	11%	0.113	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-6.1	168.4	0	0	0	0	0	114	Y145 T164	Y145-G162 PolarHBondContact O-N 2.77Å; G162-T164 PolarHBondContact O-N 3.37Å
163	D	97.6	Very high	97.5	Very high	29 Å²	29	27.6 Å²	27.6	16%	0.155	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	15.1	170.1	62.8	28.8	0	0	0	114.2	H142 T143 S161 T165	H142-D163 VanDerWaalsContact CA-OD2 3.27Å; H142-D163 WeakPolarHBondContact CA-OD2 3.49Å; H142-D163 VanDerWaalsContact CB-OD2 3.31Å; H142-D163 WeakPolarHBondContact CB-OD2 3.21Å; H142-D163 IonicContact CG-OD2 2.74Å; H142-D163 IonicContact ND1-OD1 3.09Å; H142-D163 IonicContact ND1-OD2 3.55Å; H142-D163 PolarHBondContact ND1-OD2 3.37Å; T143-D163 PolarHBondContact N-OD2 3.27Å; T143-D163 VanDerWaalsContact OG1-CB 3.28Å; T143-D163 WeakPolarHBondContact OG1-CB 3.29Å; S161-D163 VanDerWaalsContact CB-OD1 3.26Å; S161-D163 WeakPolarHBondContact CB-OD1 3.31Å; S161-D163 PolarHBondContact O-N 2.95Å; S161-D163 PolarHBondContact OG-N 3.09Å; S161-D163 VanDerWaalsContact OG-N 3.14Å; S161-D163 PolarHBondContact OG-OD1 2.97Å; S161-D163 PolarHBondContact OG-OD2 3.33Å; D163-T165 PolarHBondContact O-N 3.24Å; D163-T165 VanDerWaalsContact OD1-CB 3.29Å; D163-T165 WeakPolarHBondContact OD1-CB 3.28Å; D163-T165 WeakPolarHBondContact OD1-CG2 3.22Å; D163-T165 PolarHBondContact OD1-N 2.91Å; D163-T165 PolarHBondContact OD1-OG1 2.94Å
164	T	98	Very high	97.4	Very high	43 Å²	43	25.3 Å²	25.3	26%	0.264	14%	0.144	S	C	.	.	S	Bend	trans	67.4	8.9	-177.8	88	0	0	0	0	115.5	S161 G162 H183 G185	S161-T164 PolarHBondContact O-N 2.88Å; G162-T164 PolarHBondContact O-N 3.37Å; T164-H183 PolarHBondContact OG1-O 2.84Å; T164-G185 WeakPolarHBondContact CB-O 3.39Å; T164-G185 WeakPolarHBondContact CG2-O 3.44Å
165	T	97.8	Very high	97.4	Very high	18 Å²	18	29.9 Å²	29.9	11%	0.11	16%	0.164	C	C	.	.			trans	-110.9	155.9	-179.5	78.6	0	0	0	0	113.1	H142 S161 D163 V179 L181	H142-T165 PolarHBondContact CE1-OG1 2.89Å; H142-T165 PolarHBondContact ND1-OG1 2.83Å; S161-T165 PolarHBondContact N-O 3.12Å; D163-T165 PolarHBondContact O-N 3.24Å; D163-T165 VanDerWaalsContact OD1-CB 3.29Å; D163-T165 WeakPolarHBondContact OD1-CB 3.28Å; D163-T165 WeakPolarHBondContact OD1-CG2 3.22Å; D163-T165 PolarHBondContact OD1-N 2.91Å; D163-T165 PolarHBondContact OD1-OG1 2.94Å; T165-V179 HydrophobicContact CG2-CG1 4.47Å; T165-L181 HydrophobicContact CG2-CD2 3.55Å
166	C	98.5	Very high	97.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	157.9	158.1	-58.1	0	0	0	0	109.6	T159 F180 F199	T159-C166 CarbonylContact O-C 3.56Å; T159-C166 WeakPolarHBondContact O-CA 3.35Å; T159-C166 VanDerWaalsContact O-CB 3.27Å; T159-C166 WeakPolarHBondContact O-CB 3.35Å; C166-F180 HydrophobicContact CB-CB 4.03Å; C166-F180 HydrophobicContact CB-CD2 4.13Å; C166-F180 HydrophobicContact CB-CG 4.48Å; C166-F180 PolarHBondContact N-O 3.36Å; C166-F180 VanDerWaalsContact N-O 3.17Å; C166-F180 PolarHBondContact O-N 3Å; C166-F199 HydrophobicContact CB-CE2 3.96Å; C166-F199 HydrophobicContact CB-CZ 4.02Å
167	A	98.3	Very high	97.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	137.9	-177.4	0	0	0	0	0	111.8	V158 T159 W169 Q176 T178	V158-A167 CarbonylContact C-O 3.54Å; V158-A167 VanDerWaalsContact CA-O 3.27Å; V158-A167 WeakPolarHBondContact CA-O 3.27Å; T159-A167 PolarHBondContact N-O 2.97Å; T159-A167 PolarHBondContact O-N 2.66Å; A167-W169 HydrophobicContact CB-CZ2 4.16Å; A167-W169 VanDerWaalsContact CB-NE1 3.34Å; A167-Q176 HydrophobicContact CB-CG 4.11Å; A167-T178 WeakPolarHBondContact CA-O 3.49Å
168	L	98.5	Very high	97.3	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.068	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.8	166.1	175.6	66.7	0	0	0	108.6	L152 N156 V158 Q176 K177 T178 F180 V213	L152-L168 HydrophobicContact CD1-CD1 3.68Å; N156-L168 HydrophobicContact CB-CD1 4.27Å; V158-L168 HydrophobicContact CG2-CD1 3.88Å; L168-Q176 CarbonylContact O-C 3.52Å; L168-K177 HydrophobicContact CB-CB 4.5Å; L168-K177 HydrophobicContact CD2-CB 4.15Å; L168-K177 HydrophobicContact CD2-CD 4.34Å; L168-K177 HydrophobicContact CG-CB 4.13Å; L168-K177 HydrophobicContact CG-CD 4.4Å; L168-K177 PolarHBondContact O-N 2.74Å; L168-T178 PolarHBondContact N-O 3.46Å; L168-T178 PolarHBondContact O-N 3.47Å; L168-F180 HydrophobicContact CB-CE2 3.84Å; L168-F180 HydrophobicContact CB-CZ 4.29Å; L168-V213 HydrophobicContact CD1-CG1 4.34Å; L168-V213 HydrophobicContact CD2-CG1 3.92Å
169	W	98.3	Very high	97.2	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	147.1	-176.1	-59.8	86.7	0	0	0	112	L139 A141 N156 I157 T159 A167 Q176	L139-W169 HydrophobicContact CB-CD2 4.12Å; L139-W169 HydrophobicContact CB-CE3 3.92Å; L139-W169 HydrophobicContact CB-CH2 4.18Å; L139-W169 HydrophobicContact CB-CZ2 4.46Å; L139-W169 HydrophobicContact CB-CZ3 3.94Å; L139-W169 HydrophobicContact CD1-CB 3.76Å; L139-W169 HydrophobicContact CD1-CD2 3.96Å; L139-W169 HydrophobicContact CD1-CE3 4.26Å; L139-W169 HydrophobicContact CD1-CG 3.74Å; L139-W169 HydrophobicContact CD2-CE3 4.06Å; L139-W169 HydrophobicContact CG-CD2 4.45Å; L139-W169 HydrophobicContact CG-CE3 4.3Å; A141-W169 HydrophobicContact CB-CH2 3.31Å; A141-W169 HydrophobicContact CB-CZ2 4.12Å; A141-W169 HydrophobicContact CB-CZ3 4.06Å; N156-W169 WeakPolarHBondContact CA-O 3.15Å; I157-W169 HydrophobicContact CG2-CB 3.76Å; I157-W169 HydrophobicContact CG2-CG 4.24Å; I157-W169 PolarHBondContact N-O 3.06Å; I157-W169 PolarHBondContact O-N 2.9Å; T159-W169 PolarHBondContact OG1-NE1 2.92Å; A167-W169 HydrophobicContact CB-CZ2 4.16Å; A167-W169 VanDerWaalsContact CB-NE1 3.34Å; W169-Q176 HydrophobicContact CD2-CB 4.46Å; W169-Q176 HydrophobicContact CE3-CB 4.02Å; W169-Q176 HydrophobicContact CH2-CB 4.4Å; W169-Q176 HydrophobicContact CZ3-CB 4Å
170	D	97.6	Very high	97.2	Very high	25 Å²	25	37.5 Å²	37.5	13%	0.134	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114.9	161.9	-172.2	-68.2	0	0	0	109.2	N155 E172 T173 G174 Q175 K177	N155-D170 WeakPolarHBondContact O-CA 3.43Å; D170-E172 VanDerWaalsContact C-N 3.34Å; D170-E172 WeakPolarHBondContact OD1-CB 3.32Å; D170-E172 PolarHBondContact OD1-N 2.81Å; D170-E172 VanDerWaalsContact OD1-N 3.08Å; D170-T173 VanDerWaalsContact CB-OG1 3.29Å; D170-T173 WeakPolarHBondContact CB-OG1 3.31Å; D170-T173 VanDerWaalsContact CG-OG1 3.29Å; D170-T173 PolarHBondContact OD1-N 2.65Å; D170-T173 PolarHBondContact OD1-OG1 3.25Å; D170-G174 VanDerWaalsContact O-CA 3.25Å; D170-G174 WeakPolarHBondContact O-CA 3.15Å; D170-G174 PolarHBondContact O-N 2.96Å; D170-Q175 PolarHBondContact N-O 2.92Å; D170-Q175 PolarHBondContact O-N 2.75Å; D170-K177 HydrophobicContact CB-CD 3.91Å; D170-K177 HydrophobicContact CB-CG 3.99Å; D170-K177 WeakPolarHBondContact OD2-CE 3.33Å; D170-K177 IonicContact OD2-NZ 3.51Å; D170-K177 PolarHBondContact OD2-NZ 3.33Å
171	I	96.5	Very high	97.2	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.036	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-33	-175	-61.4	171.7	0	0	0	111.2	I123 R137 F151 D154 N155 I157	I123-I171 HydrophobicContact CD1-CB 4.1Å; I123-I171 HydrophobicContact CD1-CD1 3.8Å; I123-I171 HydrophobicContact CD1-CG1 3.54Å; I123-I171 HydrophobicContact CD1-CG2 3.58Å; I123-I171 HydrophobicContact CG2-CG2 4.43Å; R137-I171 HydrophobicContact CB-CG2 4.47Å; R137-I171 PolarHBondContact NE-O 3.39Å; F151-I171 HydrophobicContact CD1-CD1 3.84Å; F151-I171 HydrophobicContact CE1-CD1 3.62Å; D154-I171 WeakPolarHBondContact O-CD1 3.33Å; N155-I171 WeakPolarHBondContact O-CB 2.95Å; N155-I171 WeakPolarHBondContact O-CG1 3.39Å; N155-I171 PolarHBondContact O-N 3.21Å; I157-I171 HydrophobicContact CB-CD1 4.13Å; I157-I171 HydrophobicContact CB-CG1 4.44Å; I157-I171 HydrophobicContact CG2-CD1 4.14Å; I157-I171 HydrophobicContact CG2-CG1 3.93Å
172	E	94.6	Very high	97.1	Very high	133 Å²	133	45.4 Å²	45.4	62%	0.621	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-50.2	-178.6	-175.7	175.7	-177.2	0	0	110.3	R137 D170	R137-E172 PolarHBondContact NH2-O 3.2Å; D170-E172 VanDerWaalsContact C-N 3.34Å; D170-E172 WeakPolarHBondContact OD1-CB 3.32Å; D170-E172 PolarHBondContact OD1-N 2.81Å; D170-E172 VanDerWaalsContact OD1-N 3.08Å
173	T	95.3	Very high	97.1	Very high	82 Å²	82	45.3 Å²	45.3	50%	0.503	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-21.4	-179.6	62.2	0	0	0	0	113.4	D170 Q175	D170-T173 VanDerWaalsContact CB-OG1 3.29Å; D170-T173 WeakPolarHBondContact CB-OG1 3.31Å; D170-T173 VanDerWaalsContact CG-OG1 3.29Å; D170-T173 PolarHBondContact OD1-N 2.65Å; D170-T173 PolarHBondContact OD1-OG1 3.25Å; T173-Q175 PolarHBondContact O-N 2.78Å; T173-Q175 PolarHBondContact OG1-N 2.77Å
174	G	94.8	Very high	97.1	Very high	21 Å²	21	49.9 Å²	49.9	22%	0.216	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	12.7	-173.5	0	0	0	0	0	113.8	D170	D170-G174 VanDerWaalsContact O-CA 3.25Å; D170-G174 WeakPolarHBondContact O-CA 3.15Å; D170-G174 PolarHBondContact O-N 2.96Å
175	Q	95.2	Very high	97.1	Very high	134 Å²	134	48.4 Å²	48.4	63%	0.626	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	149.6	-176	-64.9	-169.3	-10.7	0	0	112.2	D170 T173 K177	D170-Q175 PolarHBondContact N-O 2.92Å; D170-Q175 PolarHBondContact O-N 2.75Å; T173-Q175 PolarHBondContact O-N 2.78Å; T173-Q175 PolarHBondContact OG1-N 2.77Å; Q175-K177 PolarHBondContact O-N 3.48Å
176	Q	96.2	Very high	97.1	Very high	64 Å²	64	50.3 Å²	50.3	30%	0.299	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.6	171.1	-172.3	173	10.9	0	0	109.5	A167 L168 W169 T178 V179	A167-Q176 HydrophobicContact CB-CG 4.11Å; L168-Q176 CarbonylContact O-C 3.52Å; W169-Q176 HydrophobicContact CD2-CB 4.46Å; W169-Q176 HydrophobicContact CE3-CB 4.02Å; W169-Q176 HydrophobicContact CH2-CB 4.4Å; W169-Q176 HydrophobicContact CZ3-CB 4Å; Q176-T178 PolarHBondContact NE2-O 3.38Å; Q176-V179 VanDerWaalsContact CD-CG2 3.44Å; Q176-V179 HydrophobicContact CG-CG2 4.21Å
177	K	96.6	Very high	97.1	Very high	101 Å²	101	50.3 Å²	50.3	44%	0.439	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-42.1	176.1	-79.8	175.2	158.7	153.3	0	111.8	N156 L168 D170 Q175	N156-K177 PolarHBondContact OD1-NZ 2.96Å; L168-K177 HydrophobicContact CB-CB 4.5Å; L168-K177 HydrophobicContact CD2-CB 4.15Å; L168-K177 HydrophobicContact CD2-CD 4.34Å; L168-K177 HydrophobicContact CG-CB 4.13Å; L168-K177 HydrophobicContact CG-CD 4.4Å; L168-K177 PolarHBondContact O-N 2.74Å; D170-K177 HydrophobicContact CB-CD 3.91Å; D170-K177 HydrophobicContact CB-CG 3.99Å; D170-K177 WeakPolarHBondContact OD2-CE 3.33Å; D170-K177 IonicContact OD2-NZ 3.51Å; D170-K177 PolarHBondContact OD2-NZ 3.33Å; Q175-K177 PolarHBondContact O-N 3.48Å
178	T	97.8	Very high	97.1	Very high	37 Å²	37	52.6 Å²	52.6	23%	0.227	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140.9	-172.9	-49	0	0	0	0	110.1	A167 L168 Q176 F180	A167-T178 WeakPolarHBondContact CA-O 3.49Å; L168-T178 PolarHBondContact N-O 3.46Å; L168-T178 PolarHBondContact O-N 3.47Å; Q176-T178 PolarHBondContact NE2-O 3.38Å; T178-F180 HydrophobicContact CG2-CE1 4.08Å; T178-F180 HydrophobicContact CG2-CE2 4.22Å; T178-F180 HydrophobicContact CG2-CZ 3.89Å
179	V	97.8	Very high	97	Very high	65 Å²	65	52.5 Å²	52.5	39%	0.394	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.9	172.8	-166.6	0	0	0	0	107.3	T165 Q176 L181	T165-V179 HydrophobicContact CG2-CG1 4.47Å; Q176-V179 VanDerWaalsContact CD-CG2 3.44Å; Q176-V179 HydrophobicContact CG-CG2 4.21Å; V179-L181 HydrophobicContact CG1-CD2 4.25Å; V179-L181 HydrophobicContact CG1-CG 4.03Å
180	F	98.4	Very high	97	Very high	1 Å²	1	52.5 Å²	52.5	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	103.6	176.9	-56.8	-87.3	0	0	0	108.5	C166 L168 T178 F199 W211	C166-F180 HydrophobicContact CB-CB 4.03Å; C166-F180 HydrophobicContact CB-CD2 4.13Å; C166-F180 HydrophobicContact CB-CG 4.48Å; C166-F180 PolarHBondContact N-O 3.36Å; C166-F180 VanDerWaalsContact N-O 3.17Å; C166-F180 PolarHBondContact O-N 3Å; L168-F180 HydrophobicContact CB-CE2 3.84Å; L168-F180 HydrophobicContact CB-CZ 4.29Å; T178-F180 HydrophobicContact CG2-CE1 4.08Å; T178-F180 HydrophobicContact CG2-CE2 4.22Å; T178-F180 HydrophobicContact CG2-CZ 3.89Å; F180-F199 HydrophobicContact CB-CZ 4.26Å; F180-F199 AromaticContact CD1-CE1 3.94Å; F180-F199 HydrophobicContact CD1-CE1 3.94Å; F180-F199 AromaticContact CD1-CZ 3.94Å; F180-F199 HydrophobicContact CD1-CZ 3.94Å; F180-F199 AromaticContact CD2-CE1 3.92Å; F180-F199 HydrophobicContact CD2-CE1 3.92Å; F180-F199 AromaticContact CD2-CZ 3.62Å; F180-F199 HydrophobicContact CD2-CZ 3.62Å; F180-F199 AromaticContact CE1-CE1 3.67Å; F180-F199 HydrophobicContact CE1-CE1 3.67Å; F180-F199 HydrophobicContact CE1-CZ 4.14Å; F180-F199 AromaticContact CE2-CE1 3.67Å; F180-F199 HydrophobicContact CE2-CE1 3.67Å; F180-F199 AromaticContact CE2-CZ 3.86Å; F180-F199 HydrophobicContact CE2-CZ 3.86Å; F180-F199 HydrophobicContact CG-CE1 4.06Å; F180-F199 AromaticContact CG-CZ 3.68Å; F180-F199 HydrophobicContact CG-CZ 3.68Å; F180-F199 AromaticContact CZ-CE1 3.56Å; F180-F199 HydrophobicContact CZ-CE1 3.56Å; F180-F199 HydrophobicContact CZ-CZ 4.14Å; F180-W211 HydrophobicContact CB-CD2 4.08Å; F180-W211 HydrophobicContact CB-CE3 3.78Å; F180-W211 HydrophobicContact CB-CH2 4.29Å; F180-W211 HydrophobicContact CB-CZ3 3.88Å; F180-W211 HydrophobicContact CD1-CB 4.1Å; F180-W211 HydrophobicContact CD1-CD2 4.17Å; F180-W211 AromaticContact CD1-CE3 3.76Å; F180-W211 HydrophobicContact CD1-CE3 3.76Å; F180-W211 HydrophobicContact CD1-CG 4.33Å; F180-W211 HydrophobicContact CE1-CB 4.3Å; F180-W211 HydrophobicContact CG-CD2 4.44Å; F180-W211 HydrophobicContact CG-CE3 4.21Å
181	L	96.9	Very high	97	Very high	126 Å²	126	52 Å²	52	66%	0.66	29%	0.292	S	S	*	.			trans	-102.9	132.8	-179.6	-68.5	164.4	0	0	0	109.6	T165 V179 W211	T165-L181 HydrophobicContact CG2-CD2 3.55Å; V179-L181 HydrophobicContact CG1-CD2 4.25Å; V179-L181 HydrophobicContact CG1-CG 4.03Å; L181-W211 WeakPolarHBondContact O-CH2 3.47Å
182	G	95.9	Very high	97.1	Very high	39 Å²	39	52.9 Å²	52.9	40%	0.402	30%	0.298	S	S	.	.			trans	162.3	-14.3	172.7	0	0	0	0	0	116.2	K209	G182-K209 WeakPolarHBondContact O-CE 3.14Å; G182-K209 PolarHBondContact O-NZ 2.62Å
183	H	98.1	Very high	97.2	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.046	27%	0.27	C	S	.	.			trans	-76.3	149.1	168.1	-79.9	-65.5	0	0	0	111.3	T164 S201 A203 D205 T207	T164-H183 PolarHBondContact OG1-O 2.84Å; H183-S201 PolarHBondContact CD2-OG 3.31Å; H183-S201 PolarHBondContact NE2-OG 2.98Å; H183-A203 HydrophobicContact CB-CB 4.28Å; H183-A203 VanDerWaalsContact ND1-CB 3.3Å; H183-A203 WeakPolarHBondContact ND1-CB 3.45Å; H183-D205 VanDerWaalsContact CA-OD2 3.31Å; H183-D205 WeakPolarHBondContact CA-OD2 3.39Å; H183-D205 WeakPolarHBondContact CB-OD2 3.41Å; H183-D205 IonicContact CE1-OD1 2.72Å; H183-D205 IonicContact CG-OD2 2.87Å; H183-D205 IonicContact ND1-OD1 3.45Å; H183-D205 PolarHBondContact ND1-OD1 2.83Å; H183-D205 IonicContact ND1-OD2 3.81Å; H183-D205 PolarHBondContact ND1-OD2 3.4Å; H183-T207 PolarHBondContact CE1-O 3.32Å
184	T	97.6	Very high	97.1	Very high	124 Å²	124	46.4 Å²	46.4	76%	0.761	27%	0.269	S	S	*	.	S	Bend	trans	-108.7	0.4	178.4	56.9	0	0	0	0	113.2	D205	T184-D205 PolarHBondContact N-OD2 2.91Å; T184-D205 VanDerWaalsContact OG1-CB 3.25Å; T184-D205 WeakPolarHBondContact OG1-CB 3.41Å
185	G	97.6	Very high	97	Very high	13 Å²	13	49.1 Å²	49.1	13%	0.134	28%	0.278	C	S	.	.	S	Bend	trans	-139.1	174.4	173.8	0	0	0	0	0	110.8	T164 C187	T164-G185 WeakPolarHBondContact CB-O 3.39Å; T164-G185 WeakPolarHBondContact CG2-O 3.44Å; G185-C187 PolarHBondContact O-N 2.71Å
186	D	98.3	Very high	97	Very high	57 Å²	57	47 Å²	47	31%	0.305	27%	0.267	S	S	.	.			trans	-53.5	127.2	-178.9	-63.1	20.9	0	0	0	110.5	Y145 M188 A203 C204	Y145-D186 WeakPolarHBondContact CE1-OD2 3.42Å; Y145-D186 WeakPolarHBondContact OH-CB 3.18Å; Y145-D186 PolarHBondContact OH-OD2 2.85Å; D186-M188 HydrophobicContact CB-SD 4.36Å; D186-M188 PolarHBondContact O-N 3.43Å; D186-A203 CarbonylContact O-C 3.5Å; D186-A203 WeakPolarHBondContact O-CA 3.41Å; D186-A203 VanDerWaalsContact O-CB 3.26Å; D186-A203 WeakPolarHBondContact O-CB 3.31Å; D186-C204 HydrophobicContact CB-CB 4.4Å; D186-C204 PolarHBondContact O-N 2.86Å
187	C	98.1	Very high	97	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119	175.4	-172.5	0	0	0	0	108.1	S147 S160 S161 G185 S201	S147-C187 WeakPolarHBondContact CB-O 3.35Å; S147-C187 PolarHBondContact OG-O 3.09Å; S160-C187 WeakPolarHBondContact CB-SG 3.3Å; S161-C187 WeakPolarHBondContact O-CB 3.16Å; S161-C187 PolarHBondContact O-N 2.72Å; G185-C187 PolarHBondContact O-N 2.71Å; C187-S201 VanDerWaalsContact SG-CB 3.59Å
188	M	98.3	Very high	97.1	Very high	48 Å²	48	47.4 Å²	47.4	24%	0.236	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-33.7	-169.6	-67.6	-59.6	-74.3	0	0	113	S147 D186 G202 C204 I229	S147-M188 WeakPolarHBondContact CB-O 3.01Å; D186-M188 HydrophobicContact CB-SD 4.36Å; D186-M188 PolarHBondContact O-N 3.43Å; M188-G202 PolarHBondContact N-O 3.45Å; M188-C204 VanDerWaalsContact CG-SG 3.57Å; M188-I229 WeakPolarHBondContact CB-O 3.45Å
189	S	97.3	Very high	97.1	Very high	12 Å²	12	45.6 Å²	45.6	8%	0.084	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	156.5	-178.2	60.4	0	0	0	0	112.3	S201 G202 N230 A231 I232	S189-S201 CarbonylContact O-C 3.53Å; S189-S201 VanDerWaalsContact O-CA 3.27Å; S189-S201 WeakPolarHBondContact O-CA 2.96Å; S189-G202 PolarHBondContact N-O 3.18Å; S189-G202 PolarHBondContact O-N 3.08Å; S189-N230 VanDerWaalsContact CB-O 3.29Å; S189-N230 WeakPolarHBondContact CB-O 3.36Å; S189-N230 PolarHBondContact OG-O 3.05Å; S189-A231 WeakPolarHBondContact OG-CA 3.22Å; S189-I232 WeakPolarHBondContact OG-CG2 3.42Å; S189-I232 PolarHBondContact OG-N 3.4Å
190	L	98.2	Very high	97.2	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	153.2	171.4	72.3	86.5	0	0	0	110.5	C148 R150 V158 T159 V192 F199 I200	C148-L190 HydrophobicContact CB-CD2 4.43Å; C148-L190 HydrophobicContact CB-CG 4.07Å; R150-L190 HydrophobicContact CB-CD1 3.72Å; R150-L190 HydrophobicContact CG-CD1 3.5Å; R150-L190 VanDerWaalsContact CG-CD1 3.5Å; V158-L190 HydrophobicContact CG1-CD2 3.98Å; T159-L190 VanDerWaalsContact C-CD2 3.47Å; L190-V192 HydrophobicContact CD1-CG2 4.4Å; L190-F199 HydrophobicContact CB-CD2 4.47Å; L190-I200 CarbonylContact C-O 3.51Å; L190-I200 WeakPolarHBondContact CA-O 3.2Å; L190-I200 WeakPolarHBondContact CB-O 3.21Å
191	A	98.2	Very high	97.2	Very high	15 Å²	15	42.5 Å²	42.5	12%	0.124	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150.5	166.7	0	0	0	0	0	110.4	F199 I200 F234	A191-F199 CarbonylContact O-C 3.59Å; A191-F199 VanDerWaalsContact O-CA 3.28Å; A191-F199 WeakPolarHBondContact O-CA 3.49Å; A191-F199 VanDerWaalsContact O-CB 3.29Å; A191-F199 WeakPolarHBondContact O-CB 3.26Å; A191-I200 HydrophobicContact CB-CD1 3.44Å; A191-I200 VanDerWaalsContact CB-CD1 3.44Å; A191-I200 VanDerWaalsContact N-CD1 3.32Å; A191-I200 PolarHBondContact N-O 3.27Å; A191-I200 WeakPolarHBondContact O-CD1 3.42Å; A191-I200 PolarHBondContact O-N 2.88Å; A191-F234 HydrophobicContact CB-CD2 4.18Å; A191-F234 WeakPolarHBondContact O-CE2 3.47Å
192	V	98	Very high	97.3	Very high	26 Å²	26	36.5 Å²	36.5	16%	0.158	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.3	179.9	-178.7	0	0	0	0	108.9	R150 L152 L190 F196 F199 F234	R150-V192 HydrophobicContact CB-CG2 3.63Å; R150-V192 HydrophobicContact CG-CG2 4.28Å; L152-V192 HydrophobicContact CD2-CB 4.33Å; L152-V192 HydrophobicContact CD2-CG1 3.52Å; L152-V192 HydrophobicContact CD2-CG2 3.81Å; L190-V192 HydrophobicContact CD1-CG2 4.4Å; V192-F196 HydrophobicContact CG1-CB 4.33Å; V192-F196 HydrophobicContact CG1-CD1 3.6Å; V192-F196 HydrophobicContact CG1-CE1 4.26Å; V192-F196 HydrophobicContact CG1-CG 4.23Å; V192-F199 HydrophobicContact CG2-CB 4.34Å; V192-F234 VanDerWaalsContact C-CD2 3.43Å; V192-F234 VanDerWaalsContact C-CE2 3.46Å; V192-F234 VanDerWaalsContact O-CD2 3.32Å; V192-F234 WeakPolarHBondContact O-CD2 3.38Å
193	S	96.6	Very high	97.4	Very high	4 Å²	4	34.6 Å²	34.6	3%	0.028	19%	0.189	C	C	.	.			trans	-63.6	153.5	175.6	55.7	0	0	0	0	111.3	D195 F196 K197 L198	S193-D195 PolarHBondContact O-N 2.82Å; S193-D195 PolarHBondContact OG-OD1 2.89Å; S193-F196 PolarHBondContact O-N 2.85Å; S193-K197 PolarHBondContact OG-N 2.95Å; S193-L198 VanDerWaalsContact CB-O 3.31Å; S193-L198 WeakPolarHBondContact CB-O 3.29Å; S193-L198 PolarHBondContact N-O 2.81Å; S193-L198 WeakPolarHBondContact OG-CA 3.42Å; S193-L198 PolarHBondContact OG-N 3.04Å; S193-L198 PolarHBondContact OG-O 3.38Å
194	P	92.8	Very high	97.4	Very high	74 Å²	74	35.9 Å²	35.9	48%	0.481	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.7	179.5	-26.6	35.2	0	0	0	115
195	D	93.6	Very high	97.4	Very high	79 Å²	79	31.4 Å²	31.4	42%	0.422	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3	178.4	81	-15.3	0	0	0	113.9	S193 K197	S193-D195 PolarHBondContact O-N 2.82Å; S193-D195 PolarHBondContact OG-OD1 2.89Å; D195-K197 PolarHBondContact O-N 3.3Å; D195-K197 VanDerWaalsContact O-N 3.12Å; D195-K197 WeakPolarHBondContact OD1-CB 3.29Å; D195-K197 PolarHBondContact OD1-N 3.19Å; D195-K197 WeakPolarHBondContact OD2-CD 3.48Å; D195-K197 WeakPolarHBondContact OD2-CE 3.4Å; D195-K197 WeakPolarHBondContact OD2-CG 3.26Å; D195-K197 IonicContact OD2-NZ 2.72Å; D195-K197 PolarHBondContact OD2-NZ 2.55Å
196	F	95.5	Very high	97.5	Very high	89 Å²	89	31.8 Å²	31.8	39%	0.39	17%	0.172	S	C	.	.	S	Bend	trans	60	12.1	179.7	-60.5	-89.2	0	0	0	115.6	P107 L152 V192 S193	P107-F196 HydrophobicContact CG-CE1 4.36Å; P107-F196 HydrophobicContact CG-CZ 4.27Å; L152-F196 HydrophobicContact CB-CD1 4.27Å; L152-F196 HydrophobicContact CD2-CB 4.48Å; L152-F196 HydrophobicContact CD2-CD1 4.01Å; V192-F196 HydrophobicContact CG1-CB 4.33Å; V192-F196 HydrophobicContact CG1-CD1 3.6Å; V192-F196 HydrophobicContact CG1-CE1 4.26Å; V192-F196 HydrophobicContact CG1-CG 4.23Å; S193-F196 PolarHBondContact O-N 2.85Å
197	K	96.1	Very high	97.5	Very high	133 Å²	133	30.2 Å²	30.2	58%	0.578	16%	0.164	S	C	*	.	S	Bend	trans	-89.3	-31.1	179.8	-60.6	-171.3	-160.1	115.6	0	113	S193 D195 V213	S193-K197 PolarHBondContact OG-N 2.95Å; D195-K197 PolarHBondContact O-N 3.3Å; D195-K197 VanDerWaalsContact O-N 3.12Å; D195-K197 WeakPolarHBondContact OD1-CB 3.29Å; D195-K197 PolarHBondContact OD1-N 3.19Å; D195-K197 WeakPolarHBondContact OD2-CD 3.48Å; D195-K197 WeakPolarHBondContact OD2-CE 3.4Å; D195-K197 WeakPolarHBondContact OD2-CG 3.26Å; D195-K197 IonicContact OD2-NZ 2.72Å; D195-K197 PolarHBondContact OD2-NZ 2.55Å; K197-V213 VanDerWaalsContact O-CB 3.32Å; K197-V213 WeakPolarHBondContact O-CB 3.15Å; K197-V213 VanDerWaalsContact O-CG2 3.31Å; K197-V213 WeakPolarHBondContact O-CG2 3.4Å; K197-V213 PolarHBondContact O-N 2.72Å
198	L	97.8	Very high	97.5	Very high	40 Å²	40	30.2 Å²	30.2	21%	0.209	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	156	179.6	-54	176.6	0	0	0	110.5	S193 L210 W211 D212	S193-L198 VanDerWaalsContact CB-O 3.31Å; S193-L198 WeakPolarHBondContact CB-O 3.29Å; S193-L198 PolarHBondContact N-O 2.81Å; S193-L198 WeakPolarHBondContact OG-CA 3.42Å; S193-L198 PolarHBondContact OG-N 3.04Å; S193-L198 PolarHBondContact OG-O 3.38Å; L198-L210 HydrophobicContact CB-CD1 4.02Å; L198-L210 HydrophobicContact CD1-CD1 4.15Å; L198-L210 HydrophobicContact CD1-CD2 4.32Å; L198-W211 VanDerWaalsContact CA-O 3.27Å; L198-W211 WeakPolarHBondContact CA-O 3.32Å; L198-D212 HydrophobicContact CD2-CB 4.11Å
199	F	98.6	Very high	97.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	155.6	161.9	74.8	-84.4	0	0	0	109.7	V158 C166 F180 L190 A191 V192 W211 V213	V158-F199 HydrophobicContact CG1-CD1 4.37Å; V158-F199 HydrophobicContact CG1-CD2 4.21Å; V158-F199 HydrophobicContact CG1-CE1 4.26Å; V158-F199 HydrophobicContact CG1-CE2 4.12Å; V158-F199 HydrophobicContact CG1-CG 4.34Å; V158-F199 HydrophobicContact CG1-CZ 4.15Å; C166-F199 HydrophobicContact CB-CE2 3.96Å; C166-F199 HydrophobicContact CB-CZ 4.02Å; F180-F199 HydrophobicContact CB-CZ 4.26Å; F180-F199 AromaticContact CD1-CE1 3.94Å; F180-F199 HydrophobicContact CD1-CE1 3.94Å; F180-F199 AromaticContact CD1-CZ 3.94Å; F180-F199 HydrophobicContact CD1-CZ 3.94Å; F180-F199 AromaticContact CD2-CE1 3.92Å; F180-F199 HydrophobicContact CD2-CE1 3.92Å; F180-F199 AromaticContact CD2-CZ 3.62Å; F180-F199 HydrophobicContact CD2-CZ 3.62Å; F180-F199 AromaticContact CE1-CE1 3.67Å; F180-F199 HydrophobicContact CE1-CE1 3.67Å; F180-F199 HydrophobicContact CE1-CZ 4.14Å; F180-F199 AromaticContact CE2-CE1 3.67Å; F180-F199 HydrophobicContact CE2-CE1 3.67Å; F180-F199 AromaticContact CE2-CZ 3.86Å; F180-F199 HydrophobicContact CE2-CZ 3.86Å; F180-F199 HydrophobicContact CG-CE1 4.06Å; F180-F199 AromaticContact CG-CZ 3.68Å; F180-F199 HydrophobicContact CG-CZ 3.68Å; F180-F199 AromaticContact CZ-CE1 3.56Å; F180-F199 HydrophobicContact CZ-CE1 3.56Å; F180-F199 HydrophobicContact CZ-CZ 4.14Å; L190-F199 HydrophobicContact CB-CD2 4.47Å; A191-F199 CarbonylContact O-C 3.59Å; A191-F199 VanDerWaalsContact O-CA 3.28Å; A191-F199 WeakPolarHBondContact O-CA 3.49Å; A191-F199 VanDerWaalsContact O-CB 3.29Å; A191-F199 WeakPolarHBondContact O-CB 3.26Å; V192-F199 HydrophobicContact CG2-CB 4.34Å; F199-W211 HydrophobicContact CD1-CB 3.71Å; F199-W211 HydrophobicContact CD1-CG 4.45Å; F199-W211 HydrophobicContact CD2-CB 4.42Å; F199-W211 AromaticContact CD2-CD1 3.77Å; F199-W211 HydrophobicContact CD2-CG 4.39Å; F199-W211 HydrophobicContact CE1-CB 3.26Å; F199-W211 AromaticContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE2-CB 4.04Å; F199-W211 AromaticContact CE2-CD1 3.25Å; F199-W211 AromaticContact CE2-CG 3.74Å; F199-W211 HydrophobicContact CE2-CG 3.74Å; F199-W211 AromaticContact CE2-NE1 3.9Å; F199-W211 HydrophobicContact CG-CB 4.27Å; F199-W211 HydrophobicContact CZ-CB 3.44Å; F199-W211 VanDerWaalsContact CZ-CB 3.44Å; F199-W211 AromaticContact CZ-CD1 3.47Å; F199-W211 VanDerWaalsContact CZ-CD1 3.47Å; F199-W211 HydrophobicContact CZ-CD2 4.22Å; F199-W211 AromaticContact CZ-CG 3.42Å; F199-W211 HydrophobicContact CZ-CG 3.42Å; F199-W211 VanDerWaalsContact CZ-CG 3.42Å; F199-W211 PolarHBondContact N-O 3.44Å; F199-W211 VanDerWaalsContact N-O 3.09Å; F199-W211 PolarHBondContact O-N 3.11Å; F199-V213 HydrophobicContact CD1-CG2 3.78Å; F199-V213 HydrophobicContact CE1-CG2 4.47Å
200	I	98.6	Very high	97.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.8	168.5	47.6	46.4	0	0	0	110.7	L190 A191 K209 L210 I232 F234 I241	L190-I200 CarbonylContact C-O 3.51Å; L190-I200 WeakPolarHBondContact CA-O 3.2Å; L190-I200 WeakPolarHBondContact CB-O 3.21Å; A191-I200 HydrophobicContact CB-CD1 3.44Å; A191-I200 VanDerWaalsContact CB-CD1 3.44Å; A191-I200 VanDerWaalsContact N-CD1 3.32Å; A191-I200 PolarHBondContact N-O 3.27Å; A191-I200 WeakPolarHBondContact O-CD1 3.42Å; A191-I200 PolarHBondContact O-N 2.88Å; I200-K209 CarbonylContact C-O 3.55Å; I200-K209 WeakPolarHBondContact CA-O 3.24Å; I200-L210 HydrophobicContact CG2-CB 4.04Å; I200-L210 HydrophobicContact CG2-CD1 3.44Å; I200-L210 VanDerWaalsContact CG2-CD1 3.44Å; I200-L210 HydrophobicContact CG2-CG 4.37Å; I200-I232 HydrophobicContact CB-CD1 3.81Å; I200-I232 HydrophobicContact CD1-CB 3.99Å; I200-I232 HydrophobicContact CD1-CD1 3.58Å; I200-I232 HydrophobicContact CD1-CG1 3.44Å; I200-I232 VanDerWaalsContact CD1-CG1 3.44Å; I200-I232 HydrophobicContact CD1-CG2 3.43Å; I200-I232 VanDerWaalsContact CD1-CG2 3.43Å; I200-I232 HydrophobicContact CG1-CD1 3.67Å; I200-I232 HydrophobicContact CG1-CG1 3.88Å; I200-F234 HydrophobicContact CB-CE2 4.39Å; I200-F234 HydrophobicContact CB-CZ 4.4Å; I200-F234 HydrophobicContact CD1-CD2 4.22Å; I200-F234 HydrophobicContact CD1-CE2 4.05Å; I200-F234 HydrophobicContact CG1-CD2 4.02Å; I200-F234 HydrophobicContact CG1-CE2 3.58Å; I200-F234 HydrophobicContact CG1-CZ 3.89Å; I200-F234 HydrophobicContact CG2-CE2 4.43Å; I200-F234 HydrophobicContact CG2-CZ 3.95Å; I200-I241 HydrophobicContact CG1-CB 4.47Å; I200-I241 HydrophobicContact CG1-CG2 3.84Å; I200-I241 HydrophobicContact CG2-CD1 4.13Å; I200-I241 HydrophobicContact CG2-CG2 4.05Å
201	S	98.7	Very high	97.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.2	171.1	57.1	0	0	0	0	110.8	H183 C187 S189 A208 K209 W211	H183-S201 PolarHBondContact CD2-OG 3.31Å; H183-S201 PolarHBondContact NE2-OG 2.98Å; C187-S201 VanDerWaalsContact SG-CB 3.59Å; S189-S201 CarbonylContact O-C 3.53Å; S189-S201 VanDerWaalsContact O-CA 3.27Å; S189-S201 WeakPolarHBondContact O-CA 2.96Å; S201-A208 CarbonylContact O-C 3.57Å; S201-A208 WeakPolarHBondContact O-CA 3.25Å; S201-K209 PolarHBondContact N-O 3.36Å; S201-K209 PolarHBondContact O-N 2.97Å; S201-W211 PolarHBondContact OG-NE1 3.36Å
202	G	98.6	Very high	97.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.1	171.8	0	0	0	0	0	110.4	M188 S189 I229	M188-G202 PolarHBondContact N-O 3.45Å; S189-G202 PolarHBondContact N-O 3.18Å; S189-G202 PolarHBondContact O-N 3.08Å; G202-I229 CarbonylContact C-O 3.55Å
203	A	98.7	Very high	97.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	171.4	-171.9	0	0	0	0	0	113.5	H183 D186 D205 A206 T207 I229	H183-A203 HydrophobicContact CB-CB 4.28Å; H183-A203 VanDerWaalsContact ND1-CB 3.3Å; H183-A203 WeakPolarHBondContact ND1-CB 3.45Å; D186-A203 CarbonylContact O-C 3.5Å; D186-A203 WeakPolarHBondContact O-CA 3.41Å; D186-A203 VanDerWaalsContact O-CB 3.26Å; D186-A203 WeakPolarHBondContact O-CB 3.31Å; A203-D205 PolarHBondContact O-N 3.03Å; A203-A206 PolarHBondContact O-N 2.89Å; A203-T207 PolarHBondContact N-O 3.46Å; A203-I229 PolarHBondContact O-N 2.98Å
204	C	98.6	Very high	97.6	Very high	37 Å²	37	39.5 Å²	39.5	25%	0.25	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	0.8	172.8	-62.4	0	0	0	0	113.8	D186 M188 A206 D228	D186-C204 HydrophobicContact CB-CB 4.4Å; D186-C204 PolarHBondContact O-N 2.86Å; M188-C204 VanDerWaalsContact CG-SG 3.57Å; C204-A206 PolarHBondContact O-N 3.15Å; C204-D228 WeakPolarHBondContact CA-OD1 3.5Å; C204-D228 HydrophobicContact CB-CB 4.33Å; C204-D228 VanDerWaalsContact SG-CG 3.53Å; C204-D228 PolarHBondContact SG-OD2 3.26Å
205	D	98.2	Very high	97.7	Very high	30 Å²	30	41.2 Å²	41.2	16%	0.16	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	11	168.8	63.4	20.6	0	0	0	113.1	H183 T184 A203 T207	H183-D205 VanDerWaalsContact CA-OD2 3.31Å; H183-D205 WeakPolarHBondContact CA-OD2 3.39Å; H183-D205 WeakPolarHBondContact CB-OD2 3.41Å; H183-D205 IonicContact CE1-OD1 2.72Å; H183-D205 IonicContact CG-OD2 2.87Å; H183-D205 IonicContact ND1-OD1 3.45Å; H183-D205 PolarHBondContact ND1-OD1 2.83Å; H183-D205 IonicContact ND1-OD2 3.81Å; H183-D205 PolarHBondContact ND1-OD2 3.4Å; T184-D205 PolarHBondContact N-OD2 2.91Å; T184-D205 VanDerWaalsContact OG1-CB 3.25Å; T184-D205 WeakPolarHBondContact OG1-CB 3.41Å; A203-D205 PolarHBondContact O-N 3.03Å; D205-T207 VanDerWaalsContact CG-OG1 3.29Å; D205-T207 PolarHBondContact O-N 3.26Å; D205-T207 VanDerWaalsContact O-N 3.17Å; D205-T207 WeakPolarHBondContact OD1-CA 3.17Å; D205-T207 WeakPolarHBondContact OD1-CB 3.32Å; D205-T207 PolarHBondContact OD1-N 2.87Å; D205-T207 PolarHBondContact OD1-OG1 2.92Å
206	A	98.3	Very high	97.8	Very high	20 Å²	20	38.4 Å²	38.4	17%	0.165	18%	0.184	C	C	.	.	S	Bend	trans	58.7	18.4	-175.7	0	0	0	0	0	114.3	A203 C204 H225 S227	A203-A206 PolarHBondContact O-N 2.89Å; C204-A206 PolarHBondContact O-N 3.15Å; A206-H225 HydrophobicContact CB-CB 4.33Å; A206-S227 WeakPolarHBondContact CA-O 3.33Å; A206-S227 VanDerWaalsContact CB-O 3.24Å; A206-S227 WeakPolarHBondContact CB-O 3.4Å
207	T	98.4	Very high	97.8	Very high	24 Å²	24	37.1 Å²	37.1	15%	0.147	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	148.6	177.1	76	0	0	0	0	112.6	H183 A203 D205 T221 F222 I229	H183-T207 PolarHBondContact CE1-O 3.32Å; A203-T207 PolarHBondContact N-O 3.46Å; D205-T207 VanDerWaalsContact CG-OG1 3.29Å; D205-T207 PolarHBondContact O-N 3.26Å; D205-T207 VanDerWaalsContact O-N 3.17Å; D205-T207 WeakPolarHBondContact OD1-CA 3.17Å; D205-T207 WeakPolarHBondContact OD1-CB 3.32Å; D205-T207 PolarHBondContact OD1-N 2.87Å; D205-T207 PolarHBondContact OD1-OG1 2.92Å; T207-T221 HydrophobicContact CG2-CG2 4.09Å; T207-F222 VanDerWaalsContact CA-O 3.32Å; T207-F222 WeakPolarHBondContact CA-O 3.37Å; T207-F222 WeakPolarHBondContact CB-O 3.3Å; T207-I229 VanDerWaalsContact C-CD1 3.45Å
208	A	98.7	Very high	97.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.4	165.4	0	0	0	0	0	109.8	S201 T221 F222 I229 I232 I241 T243	S201-A208 CarbonylContact O-C 3.57Å; S201-A208 WeakPolarHBondContact O-CA 3.25Å; A208-T221 CarbonylContact O-C 3.48Å; A208-T221 WeakPolarHBondContact O-CA 3.39Å; A208-F222 HydrophobicContact CB-CB 4.29Å; A208-F222 HydrophobicContact CB-CD2 4.45Å; A208-F222 PolarHBondContact N-O 3.24Å; A208-F222 PolarHBondContact O-N 3.32Å; A208-I229 HydrophobicContact CB-CD1 4.12Å; A208-I232 HydrophobicContact CB-CD1 3.71Å; A208-I241 HydrophobicContact CB-CD1 4.33Å; A208-T243 HydrophobicContact CB-CG2 4.15Å
209	K	98.8	Very high	97.9	Very high	24 Å²	24	36.9 Å²	36.9	10%	0.104	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137	-179.1	-69.3	178.9	-172.1	-79.5	0	111.1	G182 I200 S201 W211 Q220 T221	G182-K209 WeakPolarHBondContact O-CE 3.14Å; G182-K209 PolarHBondContact O-NZ 2.62Å; I200-K209 CarbonylContact C-O 3.55Å; I200-K209 WeakPolarHBondContact CA-O 3.24Å; S201-K209 PolarHBondContact N-O 3.36Å; S201-K209 PolarHBondContact O-N 2.97Å; K209-W211 HydrophobicContact CB-CZ2 3.66Å; K209-W211 HydrophobicContact CD-CH2 4.08Å; K209-W211 HydrophobicContact CD-CZ2 3.58Å; K209-W211 HydrophobicContact CG-CZ2 4.24Å; K209-W211 VanDerWaalsContact O-CD1 3.32Å; K209-W211 PolarHBondContact O-NE1 3.17Å; K209-Q220 WeakPolarHBondContact CA-O 3.33Å; K209-T221 HydrophobicContact CG-CG2 4.12Å; K209-T221 PolarHBondContact NZ-OG1 2.84Å
210	L	98.7	Very high	97.9	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.3	173.9	-178.6	72.8	0	0	0	109.5	L198 I200 C218 R219 Q220 F222 F234 L255	L198-L210 HydrophobicContact CB-CD1 4.02Å; L198-L210 HydrophobicContact CD1-CD1 4.15Å; L198-L210 HydrophobicContact CD1-CD2 4.32Å; I200-L210 HydrophobicContact CG2-CB 4.04Å; I200-L210 HydrophobicContact CG2-CD1 3.44Å; I200-L210 VanDerWaalsContact CG2-CD1 3.44Å; I200-L210 HydrophobicContact CG2-CG 4.37Å; L210-C218 CarbonylContact O-C 3.45Å; L210-C218 WeakPolarHBondContact O-CA 3.27Å; L210-R219 HydrophobicContact CD2-CB 4.14Å; L210-R219 HydrophobicContact CG-CB 4.39Å; L210-R219 PolarHBondContact O-N 3.37Å; L210-Q220 HydrophobicContact CB-CB 4.17Å; L210-Q220 PolarHBondContact N-O 3.45Å; L210-F222 HydrophobicContact CB-CE2 4.17Å; L210-F234 HydrophobicContact CD1-CZ 4.18Å; L210-L255 HydrophobicContact CD1-CD1 4.41Å; L210-L255 HydrophobicContact CD1-CD2 4.41Å; L210-L255 HydrophobicContact CD2-CD1 4.27Å; L210-L255 HydrophobicContact CD2-CD2 4.18Å
211	W	98.7	Very high	97.9	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.8	-174.8	-53.3	92.8	0	0	0	110.9	F180 L181 L198 F199 S201 K209 T217 C218	F180-W211 HydrophobicContact CB-CD2 4.08Å; F180-W211 HydrophobicContact CB-CE3 3.78Å; F180-W211 HydrophobicContact CB-CH2 4.29Å; F180-W211 HydrophobicContact CB-CZ3 3.88Å; F180-W211 HydrophobicContact CD1-CB 4.1Å; F180-W211 HydrophobicContact CD1-CD2 4.17Å; F180-W211 AromaticContact CD1-CE3 3.76Å; F180-W211 HydrophobicContact CD1-CE3 3.76Å; F180-W211 HydrophobicContact CD1-CG 4.33Å; F180-W211 HydrophobicContact CE1-CB 4.3Å; F180-W211 HydrophobicContact CG-CD2 4.44Å; F180-W211 HydrophobicContact CG-CE3 4.21Å; L181-W211 WeakPolarHBondContact O-CH2 3.47Å; L198-W211 VanDerWaalsContact CA-O 3.27Å; L198-W211 WeakPolarHBondContact CA-O 3.32Å; F199-W211 HydrophobicContact CD1-CB 3.71Å; F199-W211 HydrophobicContact CD1-CG 4.45Å; F199-W211 HydrophobicContact CD2-CB 4.42Å; F199-W211 AromaticContact CD2-CD1 3.77Å; F199-W211 HydrophobicContact CD2-CG 4.39Å; F199-W211 HydrophobicContact CE1-CB 3.26Å; F199-W211 AromaticContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE1-CG 3.83Å; F199-W211 HydrophobicContact CE2-CB 4.04Å; F199-W211 AromaticContact CE2-CD1 3.25Å; F199-W211 AromaticContact CE2-CG 3.74Å; F199-W211 HydrophobicContact CE2-CG 3.74Å; F199-W211 AromaticContact CE2-NE1 3.9Å; F199-W211 HydrophobicContact CG-CB 4.27Å; F199-W211 HydrophobicContact CZ-CB 3.44Å; F199-W211 VanDerWaalsContact CZ-CB 3.44Å; F199-W211 AromaticContact CZ-CD1 3.47Å; F199-W211 VanDerWaalsContact CZ-CD1 3.47Å; F199-W211 HydrophobicContact CZ-CD2 4.22Å; F199-W211 AromaticContact CZ-CG 3.42Å; F199-W211 HydrophobicContact CZ-CG 3.42Å; F199-W211 VanDerWaalsContact CZ-CG 3.42Å; F199-W211 PolarHBondContact N-O 3.44Å; F199-W211 VanDerWaalsContact N-O 3.09Å; F199-W211 PolarHBondContact O-N 3.11Å; S201-W211 PolarHBondContact OG-NE1 3.36Å; K209-W211 HydrophobicContact CB-CZ2 3.66Å; K209-W211 HydrophobicContact CD-CH2 4.08Å; K209-W211 HydrophobicContact CD-CZ2 3.58Å; K209-W211 HydrophobicContact CG-CZ2 4.24Å; K209-W211 VanDerWaalsContact O-CD1 3.32Å; K209-W211 PolarHBondContact O-NE1 3.17Å; W211-T217 WeakPolarHBondContact CA-O 3.15Å; W211-C218 HydrophobicContact CD2-CB 4.38Å; W211-C218 HydrophobicContact CE3-CB 3.66Å; W211-C218 HydrophobicContact CH2-CB 4Å; W211-C218 HydrophobicContact CZ3-CB 3.46Å; W211-C218 VanDerWaalsContact CZ3-CB 3.46Å
212	D	98.3	Very high	97.9	Very high	21 Å²	21	41.4 Å²	41.4	11%	0.112	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.9	169.4	-169.5	-57.7	0	0	0	109.9	L198 R214 E215 G216 T217 R219	L198-D212 HydrophobicContact CD2-CB 4.11Å; D212-R214 VanDerWaalsContact C-N 3.26Å; D212-R214 PolarHBondContact O-N 2.91Å; D212-R214 PolarHBondContact OD1-N 2.74Å; D212-E215 HydrophobicContact CB-CB 4.08Å; D212-E215 PolarHBondContact OD1-N 3.47Å; D212-G216 WeakPolarHBondContact O-CA 3.31Å; D212-G216 PolarHBondContact O-N 2.96Å; D212-T217 PolarHBondContact N-O 3.03Å; D212-R219 HydrophobicContact CB-CG 4.2Å; D212-R219 IonicContact OD2-CZ 3.43Å; D212-R219 IonicContact OD2-NE 2.89Å; D212-R219 PolarHBondContact OD2-NE 2.78Å; D212-R219 IonicContact OD2-NH2 3.98Å; D212-R219 PolarHBondContact OD2-NH2 2.87Å
213	V	97.1	Very high	97.8	Very high	16 Å²	16	44.6 Å²	44.6	10%	0.097	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-36.2	-176.4	174.3	0	0	0	0	111.4	L152 L168 K197 F199	L152-V213 HydrophobicContact CD1-CG1 3.63Å; L152-V213 HydrophobicContact CD1-CG2 4.43Å; L168-V213 HydrophobicContact CD1-CG1 4.34Å; L168-V213 HydrophobicContact CD2-CG1 3.92Å; K197-V213 VanDerWaalsContact O-CB 3.32Å; K197-V213 WeakPolarHBondContact O-CB 3.15Å; K197-V213 VanDerWaalsContact O-CG2 3.31Å; K197-V213 WeakPolarHBondContact O-CG2 3.4Å; K197-V213 PolarHBondContact O-N 2.72Å; F199-V213 HydrophobicContact CD1-CG2 3.78Å; F199-V213 HydrophobicContact CE1-CG2 4.47Å
214	R	96.1	Very high	97.6	Very high	234 Å²	234	46.1 Å²	46.1	88%	0.883	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-43.5	-174.9	-179.1	-179	176.2	-175.2	-1.4	111.6	D212	D212-R214 VanDerWaalsContact C-N 3.26Å; D212-R214 PolarHBondContact O-N 2.91Å; D212-R214 PolarHBondContact OD1-N 2.74Å
215	E	96.4	Very high	97.6	Very high	110 Å²	110	45.1 Å²	45.1	51%	0.514	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-22.7	-178.7	-68.6	-174.8	-165.3	0	0	112.8	D212 T217 R219	D212-E215 HydrophobicContact CB-CB 4.08Å; D212-E215 PolarHBondContact OD1-N 3.47Å; E215-T217 VanDerWaalsContact C-N 3.28Å; E215-T217 HydrophobicContact CB-CG2 4.45Å; E215-R219 IonicContact OE1-CZ 3.73Å; E215-R219 IonicContact OE1-NH1 2.76Å; E215-R219 IonicContact OE1-NH2 3.69Å; E215-R219 PolarHBondContact OE1-NH2 2.75Å; E215-R219 IonicContact OE2-CZ 3.79Å; E215-R219 IonicContact OE2-NE 3.51Å; E215-R219 IonicContact OE2-NH1 3.23Å; E215-R219 PolarHBondContact OE2-NH1 2.91Å; E215-R219 IonicContact OE2-NH2 3.73Å; E215-R219 PolarHBondContact OE2-NH2 3.32Å
216	G	95.8	Very high	97.6	Very high	20 Å²	20	51.9 Å²	51.9	21%	0.206	27%	0.268	C	S	.	.			trans	76.3	16	-178.6	0	0	0	0	0	113.8	D212	D212-G216 WeakPolarHBondContact O-CA 3.31Å; D212-G216 PolarHBondContact O-N 2.96Å
217	T	95.1	Very high	97.6	Very high	61 Å²	61	53 Å²	53	37%	0.374	27%	0.274	S	S	.	.			trans	-116.6	149.3	-170.5	58.5	0	0	0	0	112.5	W211 D212 E215	W211-T217 WeakPolarHBondContact CA-O 3.15Å; D212-T217 PolarHBondContact N-O 3.03Å; E215-T217 VanDerWaalsContact C-N 3.28Å; E215-T217 HydrophobicContact CB-CG2 4.45Å
218	C	98	Very high	97.6	Very high	51 Å²	51	54.2 Å²	54.2	35%	0.345	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122	168.9	-172.3	0	0	0	0	108.9	L210 W211 Q220	L210-C218 CarbonylContact O-C 3.45Å; L210-C218 WeakPolarHBondContact O-CA 3.27Å; W211-C218 HydrophobicContact CD2-CB 4.38Å; W211-C218 HydrophobicContact CE3-CB 3.66Å; W211-C218 HydrophobicContact CH2-CB 4Å; W211-C218 HydrophobicContact CZ3-CB 3.46Å; W211-C218 VanDerWaalsContact CZ3-CB 3.46Å; C218-Q220 PolarHBondContact SG-O 2.96Å; C218-Q220 VanDerWaalsContact SG-O 3.33Å
219	R	97.9	Very high	97.6	Very high	118 Å²	118	54.3 Å²	54.3	45%	0.445	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-43.6	176.4	-63	-65.5	-158.6	-178.6	2.3	112	L210 D212 E215	L210-R219 HydrophobicContact CD2-CB 4.14Å; L210-R219 HydrophobicContact CG-CB 4.39Å; L210-R219 PolarHBondContact O-N 3.37Å; D212-R219 HydrophobicContact CB-CG 4.2Å; D212-R219 IonicContact OD2-CZ 3.43Å; D212-R219 IonicContact OD2-NE 2.89Å; D212-R219 PolarHBondContact OD2-NE 2.78Å; D212-R219 IonicContact OD2-NH2 3.98Å; D212-R219 PolarHBondContact OD2-NH2 2.87Å; E215-R219 IonicContact OE1-CZ 3.73Å; E215-R219 IonicContact OE1-NH1 2.76Å; E215-R219 IonicContact OE1-NH2 3.69Å; E215-R219 PolarHBondContact OE1-NH2 2.75Å; E215-R219 IonicContact OE2-CZ 3.79Å; E215-R219 IonicContact OE2-NE 3.51Å; E215-R219 IonicContact OE2-NH1 3.23Å; E215-R219 PolarHBondContact OE2-NH1 2.91Å; E215-R219 IonicContact OE2-NH2 3.73Å; E215-R219 PolarHBondContact OE2-NH2 3.32Å
220	Q	98	Very high	97.6	Very high	46 Å²	46	54.5 Å²	54.5	22%	0.215	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.4	-173.7	-70.3	175.6	-44.8	0	0	111.4	K209 L210 C218 F222 L255 D258	K209-Q220 WeakPolarHBondContact CA-O 3.33Å; L210-Q220 HydrophobicContact CB-CB 4.17Å; L210-Q220 PolarHBondContact N-O 3.45Å; C218-Q220 PolarHBondContact SG-O 2.96Å; C218-Q220 VanDerWaalsContact SG-O 3.33Å; Q220-F222 HydrophobicContact CB-CE2 4.03Å; Q220-F222 HydrophobicContact CB-CZ 3.98Å; Q220-L255 PolarHBondContact NE2-O 3.3Å; Q220-L255 PolarHBondContact OE1-O 3.17Å; Q220-D258 PolarHBondContact NE2-OD1 3.1Å
221	T	98.4	Very high	97.6	Very high	46 Å²	46	54.5 Å²	54.5	28%	0.282	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.3	171	-62.3	0	0	0	0	108.9	R22 T207 A208 K209	R22-T221 PolarHBondContact NH2-O 2.67Å; T207-T221 HydrophobicContact CG2-CG2 4.09Å; A208-T221 CarbonylContact O-C 3.48Å; A208-T221 WeakPolarHBondContact O-CA 3.39Å; K209-T221 HydrophobicContact CG-CG2 4.12Å; K209-T221 PolarHBondContact NZ-OG1 2.84Å
222	F	98.4	Very high	97.6	Very high	3 Å²	3	55 Å²	55	1%	0.013	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.1	176.2	-54.8	-82.2	0	0	0	109.2	T207 A208 L210 Q220 I241 F253 L255	T207-F222 VanDerWaalsContact CA-O 3.32Å; T207-F222 WeakPolarHBondContact CA-O 3.37Å; T207-F222 WeakPolarHBondContact CB-O 3.3Å; A208-F222 HydrophobicContact CB-CB 4.29Å; A208-F222 HydrophobicContact CB-CD2 4.45Å; A208-F222 PolarHBondContact N-O 3.24Å; A208-F222 PolarHBondContact O-N 3.32Å; L210-F222 HydrophobicContact CB-CE2 4.17Å; Q220-F222 HydrophobicContact CB-CE2 4.03Å; Q220-F222 HydrophobicContact CB-CZ 3.98Å; F222-I241 HydrophobicContact CD2-CD1 3.78Å; F222-I241 HydrophobicContact CE2-CD1 3.96Å; F222-I241 HydrophobicContact CG-CD1 4.36Å; F222-F253 HydrophobicContact CB-CD1 3.89Å; F222-F253 HydrophobicContact CB-CE1 4.05Å; F222-F253 HydrophobicContact CB-CG 4.22Å; F222-F253 HydrophobicContact CB-CZ 4.5Å; F222-F253 HydrophobicContact CD1-CB 3.92Å; F222-F253 AromaticContact CD1-CD1 3.86Å; F222-F253 HydrophobicContact CD1-CD1 3.86Å; F222-F253 HydrophobicContact CD1-CG 4.12Å; F222-F253 HydrophobicContact CE1-CB 4.29Å; F222-F253 HydrophobicContact CG-CB 4.36Å; F222-F253 HydrophobicContact CG-CD1 4.19Å; F222-F253 HydrophobicContact CG-CG 4.3Å; F222-L255 HydrophobicContact CE1-CD2 4.42Å; F222-L255 HydrophobicContact CE2-CD2 3.86Å; F222-L255 HydrophobicContact CZ-CD2 3.45Å; F222-L255 VanDerWaalsContact CZ-CD2 3.45Å
223	S	96.6	Very high	97.6	Very high	67 Å²	67	54.8 Å²	54.8	47%	0.469	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	149.2	176.4	58.4	0	0	0	0	108.7	R22	R22-S223 PolarHBondContact NH1-OG 3.42Å
224	G	96.1	Very high	97.7	Very high	32 Å²	32	55 Å²	55	33%	0.33	29%	0.286	S	S	.	.			trans	166.6	-36.5	176	0	0	0	0	0	112.3	R251	G224-R251 PolarHBondContact O-NH1 3.13Å; G224-R251 PolarHBondContact O-NH2 3.44Å
225	H	98.3	Very high	97.8	Very high	16 Å²	16	46 Å²	46	7%	0.074	25%	0.253	C	S	.	.			trans	-62.6	151.1	175.4	-79	-66.4	0	0	0	112.7	A206 I229 T243 S245 D247 T249 R251	A206-H225 HydrophobicContact CB-CB 4.33Å; H225-I229 HydrophobicContact CB-CG1 4.28Å; H225-T243 WeakPolarHBondContact NE2-CB 3.49Å; H225-T243 PolarHBondContact NE2-OG1 2.87Å; H225-S245 VanDerWaalsContact CE1-CB 3.42Å; H225-S245 WeakPolarHBondContact CE1-CB 3.45Å; H225-S245 WeakPolarHBondContact ND1-CB 3.48Å; H225-D247 WeakPolarHBondContact CA-OD2 3.13Å; H225-D247 IonicContact CE1-OD1 3.07Å; H225-D247 IonicContact CE1-OD2 3.96Å; H225-D247 IonicContact CG-OD2 2.75Å; H225-D247 IonicContact ND1-OD1 2.71Å; H225-D247 PolarHBondContact ND1-OD1 2.59Å; H225-D247 IonicContact ND1-OD2 3.63Å; H225-D247 PolarHBondContact ND1-OD2 2.9Å; H225-T249 PolarHBondContact CE1-O 2.76Å; H225-T249 PolarHBondContact CE1-OG1 3.16Å; H225-T249 PolarHBondContact ND1-OG1 2.88Å; H225-R251 PolarHBondContact ND1-NE 3.15Å
226	E	98	Very high	97.8	Very high	171 Å²	171	43 Å²	43	80%	0.799	24%	0.243	S	C	*	.	S	Bend	trans	-97.4	-9.1	178.8	-60.5	-175.4	177.8	0	0	112.6	D247	E226-D247 HydrophobicContact CB-CB 4.07Å; E226-D247 PolarHBondContact N-OD2 2.94Å
227	S	98.4	Very high	97.8	Very high	43 Å²	43	46.1 Å²	46.1	30%	0.301	26%	0.255	S	S	.	.	S	Bend	trans	-150.1	-170.2	-178	-162.6	0	0	0	0	111.3	A206 S245	A206-S227 WeakPolarHBondContact CA-O 3.33Å; A206-S227 VanDerWaalsContact CB-O 3.24Å; A206-S227 WeakPolarHBondContact CB-O 3.4Å; S227-S245 PolarHBondContact O-OG 3.12Å
228	D	98.6	Very high	97.8	Very high	51 Å²	51	44 Å²	44	27%	0.273	25%	0.245	S	C	.	.			trans	-59.9	138.7	-171	-62.9	-0.1	0	0	0	111.6	C204 S245 D246	C204-D228 WeakPolarHBondContact CA-OD1 3.5Å; C204-D228 HydrophobicContact CB-CB 4.33Å; C204-D228 VanDerWaalsContact SG-CG 3.53Å; C204-D228 PolarHBondContact SG-OD2 3.26Å; D228-S245 CarbonylContact O-C 3.51Å; D228-S245 WeakPolarHBondContact O-CA 3.17Å; D228-S245 WeakPolarHBondContact O-CB 3.38Å; D228-S245 PolarHBondContact O-OG 2.91Å; D228-D246 PolarHBondContact O-N 3.32Å
229	I	98.8	Very high	97.8	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	98.6	173.9	-57.5	-178.1	0	0	0	108.8	M188 G202 A203 T207 A208 H225 T243	M188-I229 WeakPolarHBondContact CB-O 3.45Å; G202-I229 CarbonylContact C-O 3.55Å; A203-I229 PolarHBondContact O-N 2.98Å; T207-I229 VanDerWaalsContact C-CD1 3.45Å; A208-I229 HydrophobicContact CB-CD1 4.12Å; H225-I229 HydrophobicContact CB-CG1 4.28Å; I229-T243 HydrophobicContact CD1-CG2 4.33Å; I229-T243 HydrophobicContact CG2-CG2 3.97Å
230	N	98.6	Very high	97.8	Very high	28 Å²	28	40 Å²	40	15%	0.15	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-31.8	-178.3	-65.2	-43.3	0	0	0	113.4	S189 G244 D246 I273	S189-N230 VanDerWaalsContact CB-O 3.29Å; S189-N230 WeakPolarHBondContact CB-O 3.36Å; S189-N230 PolarHBondContact OG-O 3.05Å; N230-G244 PolarHBondContact N-O 3.3Å; N230-D246 PolarHBondContact ND2-OD1 3.43Å; N230-I273 VanDerWaalsContact CB-O 3.26Å; N230-I273 WeakPolarHBondContact CB-O 3.34Å; N230-I273 PolarHBondContact ND2-O 2.5Å
231	A	98.4	Very high	97.8	Very high	7 Å²	7	37.8 Å²	37.8	6%	0.058	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	145.1	-172	0	0	0	0	0	112.2	S189 T243 G244 S275 V276	S189-A231 WeakPolarHBondContact OG-CA 3.22Å; A231-T243 CarbonylContact O-C 3.5Å; A231-T243 VanDerWaalsContact O-CA 3.31Å; A231-T243 WeakPolarHBondContact O-CA 3.39Å; A231-G244 PolarHBondContact N-O 3.22Å; A231-G244 PolarHBondContact O-N 3.45Å; A231-S275 VanDerWaalsContact CB-CA 3.45Å; A231-V276 HydrophobicContact CB-CG1 4.43Å; A231-V276 HydrophobicContact CB-CG2 3.9Å
232	I	98.6	Very high	97.8	Very high	12 Å²	12	35.6 Å²	35.6	6%	0.062	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	143.8	179.4	-161.4	165.1	0	0	0	110.8	S189 I200 A208 I241 C242 T243	S189-I232 WeakPolarHBondContact OG-CG2 3.42Å; S189-I232 PolarHBondContact OG-N 3.4Å; I200-I232 HydrophobicContact CB-CD1 3.81Å; I200-I232 HydrophobicContact CD1-CB 3.99Å; I200-I232 HydrophobicContact CD1-CD1 3.58Å; I200-I232 HydrophobicContact CD1-CG1 3.44Å; I200-I232 VanDerWaalsContact CD1-CG1 3.44Å; I200-I232 HydrophobicContact CD1-CG2 3.43Å; I200-I232 VanDerWaalsContact CD1-CG2 3.43Å; I200-I232 HydrophobicContact CG1-CD1 3.67Å; I200-I232 HydrophobicContact CG1-CG1 3.88Å; A208-I232 HydrophobicContact CB-CD1 3.71Å; I232-I241 HydrophobicContact CD1-CD1 4.2Å; I232-C242 CarbonylContact C-O 3.58Å; I232-C242 WeakPolarHBondContact CA-O 3.36Å; I232-T243 HydrophobicContact CB-CG2 4.5Å; I232-T243 HydrophobicContact CD1-CG2 3.79Å; I232-T243 HydrophobicContact CG1-CG2 3.8Å
233	C	98.3	Very high	97.9	Very high	16 Å²	16	35.4 Å²	35.4	11%	0.108	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	152.1	174.4	67.1	0	0	0	0	111.5	I241 C242 V276	C233-I241 CarbonylContact O-C 3.59Å; C233-I241 VanDerWaalsContact O-CA 3.3Å; C233-I241 WeakPolarHBondContact O-CA 3.42Å; C233-C242 PolarHBondContact N-O 3.44Å; C233-C242 PolarHBondContact O-N 3.24Å; C233-V276 HydrophobicContact CB-CG2 4.31Å
234	F	98.4	Very high	98	Very high	22 Å²	22	32.2 Å²	32.2	10%	0.096	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	144	168.8	-85.3	-83.8	0	0	0	110.9	A191 V192 I200 L210 I241 L255	A191-F234 HydrophobicContact CB-CD2 4.18Å; A191-F234 WeakPolarHBondContact O-CE2 3.47Å; V192-F234 VanDerWaalsContact C-CD2 3.43Å; V192-F234 VanDerWaalsContact C-CE2 3.46Å; V192-F234 VanDerWaalsContact O-CD2 3.32Å; V192-F234 WeakPolarHBondContact O-CD2 3.38Å; I200-F234 HydrophobicContact CB-CE2 4.39Å; I200-F234 HydrophobicContact CB-CZ 4.4Å; I200-F234 HydrophobicContact CD1-CD2 4.22Å; I200-F234 HydrophobicContact CD1-CE2 4.05Å; I200-F234 HydrophobicContact CG1-CD2 4.02Å; I200-F234 HydrophobicContact CG1-CE2 3.58Å; I200-F234 HydrophobicContact CG1-CZ 3.89Å; I200-F234 HydrophobicContact CG2-CE2 4.43Å; I200-F234 HydrophobicContact CG2-CZ 3.95Å; L210-F234 HydrophobicContact CD1-CZ 4.18Å; F234-I241 HydrophobicContact CD1-CG2 3.73Å; F234-I241 HydrophobicContact CE1-CG2 3.81Å; F234-I241 HydrophobicContact CG-CG2 4.28Å; F234-I241 HydrophobicContact CZ-CG2 4.43Å; F234-L255 HydrophobicContact CE1-CD1 4.31Å
235	F	98.1	Very high	98.1	Very high	44 Å²	44	30.7 Å²	30.7	19%	0.193	17%	0.165	C	C	.	.			trans	-64.4	148.7	160.7	-170.5	-91	0	0	0	109.7	N237 G238 A240 F278 G282	F235-N237 HydrophobicContact CD1-CB 4.17Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.49Å; F235-N237 HydrophobicContact CE1-CB 4.41Å; F235-N237 PolarHBondContact O-N 3.39Å; F235-G238 PolarHBondContact O-N 2.89Å; F235-A240 HydrophobicContact CB-CB 3.79Å; F235-A240 VanDerWaalsContact CB-O 3.31Å; F235-A240 WeakPolarHBondContact CB-O 3.3Å; F235-A240 HydrophobicContact CG-CB 4.35Å; F235-A240 PolarHBondContact N-O 3.42Å; F235-F278 HydrophobicContact CB-CD2 4.43Å; F235-F278 HydrophobicContact CB-CE2 4.1Å; F235-F278 HydrophobicContact CB-CZ 4.45Å; F235-F278 AromaticContact CD2-CD1 3.9Å; F235-F278 HydrophobicContact CD2-CD1 3.9Å; F235-F278 HydrophobicContact CD2-CD2 4.31Å; F235-F278 AromaticContact CD2-CE1 3.54Å; F235-F278 HydrophobicContact CD2-CE1 3.54Å; F235-F278 HydrophobicContact CD2-CE2 4Å; F235-F278 HydrophobicContact CD2-CG 4.25Å; F235-F278 AromaticContact CD2-CZ 3.62Å; F235-F278 HydrophobicContact CD2-CZ 3.62Å; F235-F278 HydrophobicContact CE2-CD1 4.18Å; F235-F278 AromaticContact CE2-CE1 3.95Å; F235-F278 HydrophobicContact CE2-CE1 3.95Å; F235-F278 HydrophobicContact CE2-CZ 4.44Å; F235-G282 VanDerWaalsContact CE2-CA 3.5Å; F235-G282 WeakPolarHBondContact CE2-O 3.47Å
236	P	96.3	Very high	98.1	Very high	46 Å²	46	32.9 Å²	32.9	30%	0.299	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.5	-172.6	-31	36.7	0	0	0	117	F278	P236-F278 HydrophobicContact CG-CB 4.22Å
237	N	95.9	Very high	98.1	Very high	87 Å²	87	26.2 Å²	26.2	47%	0.465	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.1	177.1	74.9	-3.8	0	0	0	114	F235 E239	F235-N237 HydrophobicContact CD1-CB 4.17Å; F235-N237 WeakPolarHBondContact CD1-OD1 3.49Å; F235-N237 HydrophobicContact CE1-CB 4.41Å; F235-N237 PolarHBondContact O-N 3.39Å; N237-E239 VanDerWaalsContact C-N 3.32Å; N237-E239 PolarHBondContact O-N 2.87Å; N237-E239 WeakPolarHBondContact OD1-CB 3.43Å; N237-E239 PolarHBondContact OD1-N 2.91Å
238	G	96.6	Very high	98.1	Very high	16 Å²	16	24.6 Å²	24.6	17%	0.165	14%	0.137	C	C	.	.	S	Bend	trans	79.5	0.3	-177.6	0	0	0	0	0	116.1	F235 L255	F235-G238 PolarHBondContact O-N 2.89Å; G238-L255 WeakPolarHBondContact O-CD1 3.43Å
239	E	97.4	Very high	98.1	Very high	77 Å²	77	23 Å²	23	36%	0.36	13%	0.129	S	C	.	.	S	Bend	trans	-94.6	-7.4	-177.3	-58.4	-169.6	150.6	0	0	113.8	N237 L255 R256	N237-E239 VanDerWaalsContact C-N 3.32Å; N237-E239 PolarHBondContact O-N 2.87Å; N237-E239 WeakPolarHBondContact OD1-CB 3.43Å; N237-E239 PolarHBondContact OD1-N 2.91Å; E239-L255 WeakPolarHBondContact O-CB 3.28Å; E239-L255 WeakPolarHBondContact O-CG 3.46Å; E239-L255 PolarHBondContact O-N 3.33Å; E239-R256 IonicContact OE1-CZ 3.49Å; E239-R256 IonicContact OE1-NH1 2.76Å; E239-R256 PolarHBondContact OE1-NH1 2.91Å; E239-R256 IonicContact OE2-CZ 2.81Å; E239-R256 VanDerWaalsContact OE2-CZ 3.23Å; E239-R256 IonicContact OE2-NH1 3.96Å; E239-R256 PolarHBondContact OE2-NH1 3.02Å; E239-R256 IonicContact OE2-NH2 3.63Å; E239-R256 PolarHBondContact OE2-NH2 2.88Å
240	A	98.1	Very high	98.1	Very high	7 Å²	7	22.9 Å²	22.9	6%	0.058	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	161.5	-179.7	0	0	0	0	0	110.8	F235 L252 F253	F235-A240 HydrophobicContact CB-CB 3.79Å; F235-A240 VanDerWaalsContact CB-O 3.31Å; F235-A240 WeakPolarHBondContact CB-O 3.3Å; F235-A240 HydrophobicContact CG-CB 4.35Å; F235-A240 PolarHBondContact N-O 3.42Å; A240-L252 HydrophobicContact CB-CD1 3.9Å; A240-F253 CarbonylContact C-O 3.54Å; A240-F253 WeakPolarHBondContact CA-O 3.3Å; A240-F253 VanDerWaalsContact CB-O 3.23Å; A240-F253 WeakPolarHBondContact CB-O 3.42Å
241	I	98.4	Very high	98.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.2	179.5	64.8	175.4	0	0	0	110.6	I200 A208 F222 I232 C233 F234 L252 F253 L255	I200-I241 HydrophobicContact CG1-CB 4.47Å; I200-I241 HydrophobicContact CG1-CG2 3.84Å; I200-I241 HydrophobicContact CG2-CD1 4.13Å; I200-I241 HydrophobicContact CG2-CG2 4.05Å; A208-I241 HydrophobicContact CB-CD1 4.33Å; F222-I241 HydrophobicContact CD2-CD1 3.78Å; F222-I241 HydrophobicContact CE2-CD1 3.96Å; F222-I241 HydrophobicContact CG-CD1 4.36Å; I232-I241 HydrophobicContact CD1-CD1 4.2Å; C233-I241 CarbonylContact O-C 3.59Å; C233-I241 VanDerWaalsContact O-CA 3.3Å; C233-I241 WeakPolarHBondContact O-CA 3.42Å; F234-I241 HydrophobicContact CD1-CG2 3.73Å; F234-I241 HydrophobicContact CE1-CG2 3.81Å; F234-I241 HydrophobicContact CG-CG2 4.28Å; F234-I241 HydrophobicContact CZ-CG2 4.43Å; I241-L252 CarbonylContact O-C 3.53Å; I241-L252 WeakPolarHBondContact O-CA 3.39Å; I241-L252 VanDerWaalsContact O-CD1 3.24Å; I241-L252 WeakPolarHBondContact O-CD1 3.26Å; I241-F253 HydrophobicContact CD1-CB 4.34Å; I241-F253 HydrophobicContact CG1-CB 3.78Å; I241-F253 HydrophobicContact CG1-CD2 4.35Å; I241-F253 HydrophobicContact CG1-CG 4.5Å; I241-F253 PolarHBondContact N-O 3.14Å; I241-F253 PolarHBondContact O-N 2.52Å; I241-L255 HydrophobicContact CG2-CD2 4.21Å
242	C	98.6	Very high	98.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	134.2	170.3	-176.1	0	0	0	0	110.6	I232 C233 R251 F278	I232-C242 CarbonylContact C-O 3.58Å; I232-C242 WeakPolarHBondContact CA-O 3.36Å; C233-C242 PolarHBondContact N-O 3.44Å; C233-C242 PolarHBondContact O-N 3.24Å; C242-R251 CarbonylContact C-O 3.59Å; C242-R251 WeakPolarHBondContact CA-O 3.1Å; C242-R251 PolarHBondContact SG-O 3.28Å; C242-F278 HydrophobicContact CB-CD2 4.4Å; C242-F278 HydrophobicContact CB-CE2 3.35Å; C242-F278 HydrophobicContact CB-CZ 3.57Å
243	T	98.8	Very high	98.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	151.2	177.4	49.9	0	0	0	0	110.2	A208 H225 I229 A231 I232 C250 R251 F253	A208-T243 HydrophobicContact CB-CG2 4.15Å; H225-T243 WeakPolarHBondContact NE2-CB 3.49Å; H225-T243 PolarHBondContact NE2-OG1 2.87Å; I229-T243 HydrophobicContact CD1-CG2 4.33Å; I229-T243 HydrophobicContact CG2-CG2 3.97Å; A231-T243 CarbonylContact O-C 3.5Å; A231-T243 VanDerWaalsContact O-CA 3.31Å; A231-T243 WeakPolarHBondContact O-CA 3.39Å; I232-T243 HydrophobicContact CB-CG2 4.5Å; I232-T243 HydrophobicContact CD1-CG2 3.79Å; I232-T243 HydrophobicContact CG1-CG2 3.8Å; T243-C250 CarbonylContact O-C 3.47Å; T243-C250 WeakPolarHBondContact O-CA 3.46Å; T243-C250 WeakPolarHBondContact O-CB 3.39Å; T243-R251 PolarHBondContact N-O 3.31Å; T243-R251 PolarHBondContact O-N 2.78Å; T243-R251 PolarHBondContact OG1-O 3.43Å; T243-F253 HydrophobicContact CG2-CD2 4.47Å; T243-F253 HydrophobicContact CG2-CE2 4.3Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.37Å
244	G	98.7	Very high	98.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.7	168.9	0	0	0	0	0	110	N230 A231	N230-G244 PolarHBondContact N-O 3.3Å; A231-G244 PolarHBondContact N-O 3.22Å; A231-G244 PolarHBondContact O-N 3.45Å
245	S	98.8	Very high	98.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	164.3	-170.1	175.8	0	0	0	0	113.1	H225 S227 D228 D247 A248 T249 I273	H225-S245 VanDerWaalsContact CE1-CB 3.42Å; H225-S245 WeakPolarHBondContact CE1-CB 3.45Å; H225-S245 WeakPolarHBondContact ND1-CB 3.48Å; S227-S245 PolarHBondContact O-OG 3.12Å; D228-S245 CarbonylContact O-C 3.51Å; D228-S245 WeakPolarHBondContact O-CA 3.17Å; D228-S245 WeakPolarHBondContact O-CB 3.38Å; D228-S245 PolarHBondContact O-OG 2.91Å; S245-D247 WeakPolarHBondContact CB-OD1 3.45Å; S245-D247 PolarHBondContact O-N 3.39Å; S245-D247 PolarHBondContact OG-N 3.29Å; S245-A248 PolarHBondContact O-N 2.9Å; S245-T249 PolarHBondContact N-O 3.16Å; S245-I273 PolarHBondContact O-N 3.05Å
246	D	98.6	Very high	98	Very high	62 Å²	62	28.7 Å²	28.7	33%	0.332	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-11.4	167.6	-80.5	-18.5	0	0	0	113.7	D228 N230 A248	D228-D246 PolarHBondContact O-N 3.32Å; N230-D246 PolarHBondContact ND2-OD1 3.43Å; D246-A248 PolarHBondContact O-N 3.36Å; D246-A248 VanDerWaalsContact O-N 3.11Å
247	D	98.2	Very high	98.1	Very high	31 Å²	31	28 Å²	28	17%	0.166	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	9.5	169.3	74.4	9.4	0	0	0	114	H225 E226 S245 T249 R251	H225-D247 WeakPolarHBondContact CA-OD2 3.13Å; H225-D247 IonicContact CE1-OD1 3.07Å; H225-D247 IonicContact CE1-OD2 3.96Å; H225-D247 IonicContact CG-OD2 2.75Å; H225-D247 IonicContact ND1-OD1 2.71Å; H225-D247 PolarHBondContact ND1-OD1 2.59Å; H225-D247 IonicContact ND1-OD2 3.63Å; H225-D247 PolarHBondContact ND1-OD2 2.9Å; E226-D247 HydrophobicContact CB-CB 4.07Å; E226-D247 PolarHBondContact N-OD2 2.94Å; S245-D247 WeakPolarHBondContact CB-OD1 3.45Å; S245-D247 PolarHBondContact O-N 3.39Å; S245-D247 PolarHBondContact OG-N 3.29Å; D247-T249 VanDerWaalsContact CG-OG1 3.3Å; D247-T249 PolarHBondContact O-N 2.79Å; D247-T249 WeakPolarHBondContact OD1-CA 3.45Å; D247-T249 WeakPolarHBondContact OD1-CB 3.27Å; D247-T249 PolarHBondContact OD1-N 2.89Å; D247-T249 PolarHBondContact OD1-OG1 3.47Å; D247-T249 PolarHBondContact OD2-OG1 2.83Å; D247-R251 IonicContact OD2-NH2 3.23Å
248	A	98.1	Very high	98.2	Very high	9 Å²	9	25.6 Å²	25.6	7%	0.074	13%	0.131	C	C	.	.	S	Bend	trans	62.9	11.8	-178	0	0	0	0	0	115.1	S245 D246 I269 C271	S245-A248 PolarHBondContact O-N 2.9Å; D246-A248 PolarHBondContact O-N 3.36Å; D246-A248 VanDerWaalsContact O-N 3.11Å; A248-I269 HydrophobicContact CB-CG2 4.45Å; A248-I269 WeakPolarHBondContact CB-O 3.36Å; A248-C271 WeakPolarHBondContact CA-O 3.31Å; A248-C271 VanDerWaalsContact CB-O 3.28Å; A248-C271 WeakPolarHBondContact CB-O 3.44Å
249	T	98.4	Very high	98.1	Very high	17 Å²	17	26.8 Å²	26.8	10%	0.104	13%	0.132	C	C	.	.			trans	-109.6	142.8	177.4	76.1	0	0	0	0	112.5	H225 S245 D247 R251 V263 I273	H225-T249 PolarHBondContact CE1-O 2.76Å; H225-T249 PolarHBondContact CE1-OG1 3.16Å; H225-T249 PolarHBondContact ND1-OG1 2.88Å; S245-T249 PolarHBondContact N-O 3.16Å; D247-T249 VanDerWaalsContact CG-OG1 3.3Å; D247-T249 PolarHBondContact O-N 2.79Å; D247-T249 WeakPolarHBondContact OD1-CA 3.45Å; D247-T249 WeakPolarHBondContact OD1-CB 3.27Å; D247-T249 PolarHBondContact OD1-N 2.89Å; D247-T249 PolarHBondContact OD1-OG1 3.47Å; D247-T249 PolarHBondContact OD2-OG1 2.83Å; T249-R251 PolarHBondContact OG1-NE 3.3Å; T249-V263 HydrophobicContact CG2-CG1 4.09Å; T249-I273 WeakPolarHBondContact O-CD1 3.27Å
250	C	98.6	Very high	98.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	147.5	156.2	-57.4	0	0	0	0	108.8	T243 Y264 I273	T243-C250 CarbonylContact O-C 3.47Å; T243-C250 WeakPolarHBondContact O-CA 3.46Å; T243-C250 WeakPolarHBondContact O-CB 3.39Å; C250-Y264 HydrophobicContact CB-CD2 3.74Å; C250-Y264 HydrophobicContact CB-CG 4.29Å; C250-Y264 PolarHBondContact N-O 2.89Å; C250-Y264 WeakPolarHBondContact O-CD2 3.14Å; C250-Y264 PolarHBondContact O-N 2.89Å; C250-I273 HydrophobicContact CB-CD1 4.49Å; C250-I273 WeakPolarHBondContact SG-CD1 3.27Å
251	R	98.7	Very high	98.1	Very high	24 Å²	24	29.5 Å²	29.5	9%	0.091	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	144.3	175.4	-62.8	-179.7	-175.3	-139	13.5	110.3	G224 H225 C242 T243 D247 T249 F253 E260 V263	G224-R251 PolarHBondContact O-NH1 3.13Å; G224-R251 PolarHBondContact O-NH2 3.44Å; H225-R251 PolarHBondContact ND1-NE 3.15Å; C242-R251 CarbonylContact C-O 3.59Å; C242-R251 WeakPolarHBondContact CA-O 3.1Å; C242-R251 PolarHBondContact SG-O 3.28Å; T243-R251 PolarHBondContact N-O 3.31Å; T243-R251 PolarHBondContact O-N 2.78Å; T243-R251 PolarHBondContact OG1-O 3.43Å; D247-R251 IonicContact OD2-NH2 3.23Å; T249-R251 PolarHBondContact OG1-NE 3.3Å; R251-F253 HydrophobicContact CB-CD2 4.22Å; R251-F253 HydrophobicContact CB-CE2 3.52Å; R251-F253 HydrophobicContact CB-CZ 3.98Å; R251-E260 WeakPolarHBondContact CD-OE2 3.4Å; R251-E260 IonicContact CZ-OE2 3.93Å; R251-E260 IonicContact NE-OE2 3.48Å; R251-E260 IonicContact NH1-OE1 3.96Å; R251-E260 IonicContact NH1-OE2 2.78Å; R251-E260 PolarHBondContact NH1-OE2 2.91Å; R251-V263 HydrophobicContact CG-CG1 4.25Å; R251-V263 HydrophobicContact CG-CG2 4.18Å
252	L	98.6	Very high	98	Very high	11 Å²	11	30.5 Å²	30.5	6%	0.058	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.2	171.8	178	59.3	0	0	0	108.5	A240 I241 E260 L261 I262 Y264 F278	A240-L252 HydrophobicContact CB-CD1 3.9Å; I241-L252 CarbonylContact O-C 3.53Å; I241-L252 WeakPolarHBondContact O-CA 3.39Å; I241-L252 VanDerWaalsContact O-CD1 3.24Å; I241-L252 WeakPolarHBondContact O-CD1 3.26Å; L252-E260 CarbonylContact O-C 3.6Å; L252-E260 WeakPolarHBondContact O-CA 3.39Å; L252-L261 PolarHBondContact O-N 3Å; L252-I262 HydrophobicContact CB-CG2 3.7Å; L252-I262 HydrophobicContact CD2-CG2 3.96Å; L252-I262 HydrophobicContact CG-CG2 4.4Å; L252-I262 PolarHBondContact N-O 2.85Å; L252-Y264 HydrophobicContact CB-CE2 4.02Å; L252-F278 HydrophobicContact CD1-CZ 3.89Å
253	F	98.6	Very high	98	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.009	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.9	175.7	-62	-94.1	0	0	0	110.1	F222 A240 I241 T243 R251 Q259 E260	F222-F253 HydrophobicContact CB-CD1 3.89Å; F222-F253 HydrophobicContact CB-CE1 4.05Å; F222-F253 HydrophobicContact CB-CG 4.22Å; F222-F253 HydrophobicContact CB-CZ 4.5Å; F222-F253 HydrophobicContact CD1-CB 3.92Å; F222-F253 AromaticContact CD1-CD1 3.86Å; F222-F253 HydrophobicContact CD1-CD1 3.86Å; F222-F253 HydrophobicContact CD1-CG 4.12Å; F222-F253 HydrophobicContact CE1-CB 4.29Å; F222-F253 HydrophobicContact CG-CB 4.36Å; F222-F253 HydrophobicContact CG-CD1 4.19Å; F222-F253 HydrophobicContact CG-CG 4.3Å; A240-F253 CarbonylContact C-O 3.54Å; A240-F253 WeakPolarHBondContact CA-O 3.3Å; A240-F253 VanDerWaalsContact CB-O 3.23Å; A240-F253 WeakPolarHBondContact CB-O 3.42Å; I241-F253 HydrophobicContact CD1-CB 4.34Å; I241-F253 HydrophobicContact CG1-CB 3.78Å; I241-F253 HydrophobicContact CG1-CD2 4.35Å; I241-F253 HydrophobicContact CG1-CG 4.5Å; I241-F253 PolarHBondContact N-O 3.14Å; I241-F253 PolarHBondContact O-N 2.52Å; T243-F253 HydrophobicContact CG2-CD2 4.47Å; T243-F253 HydrophobicContact CG2-CE2 4.3Å; T243-F253 WeakPolarHBondContact OG1-CE2 3.37Å; R251-F253 HydrophobicContact CB-CD2 4.22Å; R251-F253 HydrophobicContact CB-CE2 3.52Å; R251-F253 HydrophobicContact CB-CZ 3.98Å; F253-Q259 WeakPolarHBondContact CA-O 3.25Å; F253-E260 HydrophobicContact CD1-CB 3.77Å; F253-E260 HydrophobicContact CE1-CB 3.57Å; F253-E260 HydrophobicContact CZ-CB 4.17Å
254	D	98.2	Very high	98	Very high	21 Å²	21	32.6 Å²	32.6	11%	0.112	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.2	172	179.6	-75	0	0	0	110.1	R256 A257 D258 Q259 L261	D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 2.73Å; D254-R256 WeakPolarHBondContact OD1-CA 3.26Å; D254-R256 WeakPolarHBondContact OD1-CB 3.21Å; D254-R256 PolarHBondContact OD1-N 2.87Å; D254-R256 IonicContact OD1-NE 2.81Å; D254-R256 IonicContact OD2-NH2 3.33Å; D254-A257 HydrophobicContact CB-CB 3.94Å; D254-A257 PolarHBondContact OD1-N 2.88Å; D254-D258 PolarHBondContact O-N 2.87Å; D254-Q259 PolarHBondContact N-O 2.74Å; D254-L261 HydrophobicContact CB-CD1 3.72Å; D254-L261 HydrophobicContact CB-CD2 3.99Å; D254-L261 HydrophobicContact CB-CG 3.82Å
255	L	97.8	Very high	97.9	Very high	20 Å²	20	35.7 Å²	35.7	11%	0.105	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-29.9	-175.1	-58.3	-174.7	0	0	0	112.4	L210 Q220 F222 F234 G238 E239 I241	L210-L255 HydrophobicContact CD1-CD1 4.41Å; L210-L255 HydrophobicContact CD1-CD2 4.41Å; L210-L255 HydrophobicContact CD2-CD1 4.27Å; L210-L255 HydrophobicContact CD2-CD2 4.18Å; Q220-L255 PolarHBondContact NE2-O 3.3Å; Q220-L255 PolarHBondContact OE1-O 3.17Å; F222-L255 HydrophobicContact CE1-CD2 4.42Å; F222-L255 HydrophobicContact CE2-CD2 3.86Å; F222-L255 HydrophobicContact CZ-CD2 3.45Å; F222-L255 VanDerWaalsContact CZ-CD2 3.45Å; F234-L255 HydrophobicContact CE1-CD1 4.31Å; G238-L255 WeakPolarHBondContact O-CD1 3.43Å; E239-L255 WeakPolarHBondContact O-CB 3.28Å; E239-L255 WeakPolarHBondContact O-CG 3.46Å; E239-L255 PolarHBondContact O-N 3.33Å; I241-L255 HydrophobicContact CG2-CD2 4.21Å
256	R	97.6	Very high	97.7	Very high	172 Å²	172	39.8 Å²	39.8	65%	0.649	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-35.5	179.9	-58.5	175.7	-64.1	-151.2	-14.8	111.7	E239 D254	E239-R256 IonicContact OE1-CZ 3.49Å; E239-R256 IonicContact OE1-NH1 2.76Å; E239-R256 PolarHBondContact OE1-NH1 2.91Å; E239-R256 IonicContact OE2-CZ 2.81Å; E239-R256 VanDerWaalsContact OE2-CZ 3.23Å; E239-R256 IonicContact OE2-NH1 3.96Å; E239-R256 PolarHBondContact OE2-NH1 3.02Å; E239-R256 IonicContact OE2-NH2 3.63Å; E239-R256 PolarHBondContact OE2-NH2 2.88Å; D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 2.73Å; D254-R256 WeakPolarHBondContact OD1-CA 3.26Å; D254-R256 WeakPolarHBondContact OD1-CB 3.21Å; D254-R256 PolarHBondContact OD1-N 2.87Å; D254-R256 IonicContact OD1-NE 2.81Å; D254-R256 IonicContact OD2-NH2 3.33Å
257	A	97	Very high	97.3	Very high	33 Å²	33	46 Å²	46	27%	0.273	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.7	175	0	0	0	0	0	112.2	D254 Q259 L261	D254-A257 HydrophobicContact CB-CB 3.94Å; D254-A257 PolarHBondContact OD1-N 2.88Å; A257-Q259 HydrophobicContact CB-CG 4.01Å; A257-Q259 WeakPolarHBondContact O-CG 3.43Å; A257-Q259 PolarHBondContact O-N 3.37Å; A257-L261 HydrophobicContact CB-CD2 4.45Å
258	D	97.8	Very high	97	Very high	36 Å²	36	48.4 Å²	48.4	19%	0.193	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	27.5	-176.6	-168.1	59	0	0	0	113	R22 Q220 D254	R22-D258 WeakPolarHBondContact CD-O 3.37Å; R22-D258 VanDerWaalsContact CZ-O 3.23Å; R22-D258 IonicContact CZ-OD2 2.81Å; R22-D258 VanDerWaalsContact CZ-OD2 3.23Å; R22-D258 PolarHBondContact NE-O 3.44Å; R22-D258 IonicContact NE-OD2 3.41Å; R22-D258 PolarHBondContact NE-OD2 3.43Å; R22-D258 PolarHBondContact NH2-O 2.95Å; R22-D258 IonicContact NH2-OD1 3.94Å; R22-D258 IonicContact NH2-OD2 3.28Å; R22-D258 PolarHBondContact NH2-OD2 3.25Å; Q220-D258 PolarHBondContact NE2-OD1 3.1Å; D254-D258 PolarHBondContact O-N 2.87Å
259	Q	96	Very high	96.7	Very high	41 Å²	41	48.7 Å²	48.7	19%	0.192	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	170.8	-176.3	66.4	-172	-22.1	0	0	112.4	R22 F253 D254 A257	R22-Q259 PolarHBondContact O-OE1 3.46Å; F253-Q259 WeakPolarHBondContact CA-O 3.25Å; D254-Q259 PolarHBondContact N-O 2.74Å; A257-Q259 HydrophobicContact CB-CG 4.01Å; A257-Q259 WeakPolarHBondContact O-CG 3.43Å; A257-Q259 PolarHBondContact O-N 3.37Å
260	E	97.4	Very high	96.5	Very high	79 Å²	79	55.3 Å²	55.3	37%	0.369	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	139.7	176.1	90.4	-174.9	158.9	0	0	110.7	R251 L252 F253 V263	R251-E260 WeakPolarHBondContact CD-OE2 3.4Å; R251-E260 IonicContact CZ-OE2 3.93Å; R251-E260 IonicContact NE-OE2 3.48Å; R251-E260 IonicContact NH1-OE1 3.96Å; R251-E260 IonicContact NH1-OE2 2.78Å; R251-E260 PolarHBondContact NH1-OE2 2.91Å; L252-E260 CarbonylContact O-C 3.6Å; L252-E260 WeakPolarHBondContact O-CA 3.39Å; F253-E260 HydrophobicContact CD1-CB 3.77Å; F253-E260 HydrophobicContact CE1-CB 3.57Å; F253-E260 HydrophobicContact CZ-CB 4.17Å; E260-V263 WeakPolarHBondContact OE2-CG2 3.4Å
261	L	97.1	Very high	96.4	Very high	62 Å²	62	56.6 Å²	56.6	33%	0.325	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-40.4	175	-65.6	-171.1	0	0	0	112.4	L252 D254 A257	L252-L261 PolarHBondContact O-N 3Å; D254-L261 HydrophobicContact CB-CD1 3.72Å; D254-L261 HydrophobicContact CB-CD2 3.99Å; D254-L261 HydrophobicContact CB-CG 3.82Å; A257-L261 HydrophobicContact CB-CD2 4.45Å
262	I	97.6	Very high	96.3	Very high	20 Å²	20	55.8 Å²	55.8	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	146.8	-175.1	-167.4	164.6	0	0	0	111.1	L30 L252 Y264 A302	L30-I262 HydrophobicContact CD2-CB 4.03Å; L30-I262 HydrophobicContact CD2-CD1 4.17Å; L30-I262 HydrophobicContact CD2-CG2 3.79Å; L252-I262 HydrophobicContact CB-CG2 3.7Å; L252-I262 HydrophobicContact CD2-CG2 3.96Å; L252-I262 HydrophobicContact CG-CG2 4.4Å; L252-I262 PolarHBondContact N-O 2.85Å; I262-Y264 HydrophobicContact CG2-CE1 4.28Å; I262-Y264 HydrophobicContact CG2-CE2 3.99Å; I262-Y264 WeakPolarHBondContact CG2-OH 3.23Å; I262-A302 HydrophobicContact CD1-CB 3.56Å; I262-A302 HydrophobicContact CG1-CB 3.81Å
263	V	98.2	Very high	96.3	Very high	45 Å²	45	55.3 Å²	55.3	27%	0.273	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.7	176.4	-175.4	0	0	0	0	108.9	T249 R251 E260 A302	T249-V263 HydrophobicContact CG2-CG1 4.09Å; R251-V263 HydrophobicContact CG-CG1 4.25Å; R251-V263 HydrophobicContact CG-CG2 4.18Å; E260-V263 WeakPolarHBondContact OE2-CG2 3.4Å; V263-A302 WeakPolarHBondContact O-CB 3.33Å
264	Y	98	Very high	96.3	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109.2	174	-47.5	-88.2	0	0	0	108.5	C250 L252 I262 V285 W297 S299 A302	C250-Y264 HydrophobicContact CB-CD2 3.74Å; C250-Y264 HydrophobicContact CB-CG 4.29Å; C250-Y264 PolarHBondContact N-O 2.89Å; C250-Y264 WeakPolarHBondContact O-CD2 3.14Å; C250-Y264 PolarHBondContact O-N 2.89Å; L252-Y264 HydrophobicContact CB-CE2 4.02Å; I262-Y264 HydrophobicContact CG2-CE1 4.28Å; I262-Y264 HydrophobicContact CG2-CE2 3.99Å; I262-Y264 WeakPolarHBondContact CG2-OH 3.23Å; Y264-V285 HydrophobicContact CE2-CG2 4.33Å; Y264-W297 HydrophobicContact CD1-CB 3.89Å; Y264-W297 HydrophobicContact CD1-CE3 4.5Å; Y264-W297 HydrophobicContact CD1-CG 4.28Å; Y264-W297 HydrophobicContact CE1-CB 4.43Å; Y264-S299 VanDerWaalsContact OH-CA 3.29Å; Y264-S299 WeakPolarHBondContact OH-CA 3.19Å; Y264-S299 PolarHBondContact OH-O 3.14Å; Y264-A302 HydrophobicContact CD1-CB 3.86Å; Y264-A302 HydrophobicContact CE1-CB 4.22Å
265	S	96.4	Very high	96.3	Very high	65 Å²	65	55.5 Å²	55.5	46%	0.455	29%	0.291	S	S	.	.			trans	-148.5	162.3	179.1	64.3	0	0	0	0	110.2
266	H	94.5	Very high	96.4	Very high	85 Å²	85	55.1 Å²	55.1	39%	0.394	29%	0.29	S	S	.	.			trans	-149.7	138.7	174.1	-172.3	-83.2	0	0	0	108.4	S268 I269 W297	H266-S268 PolarHBondContact CE1-OG 3.41Å; H266-S268 PolarHBondContact ND1-N 3.17Å; H266-S268 PolarHBondContact ND1-OG 3.2Å; H266-S268 PolarHBondContact O-N 2.84Å; H266-I269 HydrophobicContact CB-CD1 3.85Å; H266-I269 HydrophobicContact CB-CG1 4.07Å; H266-I269 PolarHBondContact O-N 2.83Å; H266-W297 HydrophobicContact CB-CH2 3.89Å
267	E	90.4	Very high	96.4	Very high	194 Å²	194	47.6 Å²	47.6	91%	0.907	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.9	-171.9	-62.4	-177.9	169.7	0	0	114	I269	E267-I269 VanDerWaalsContact C-N 3.31Å
268	S	91.4	Very high	96.5	Very high	81 Å²	81	46.8 Å²	46.8	57%	0.566	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.3	177.5	73.5	0	0	0	0	114.4	H266	H266-S268 PolarHBondContact CE1-OG 3.41Å; H266-S268 PolarHBondContact ND1-N 3.17Å; H266-S268 PolarHBondContact ND1-OG 3.2Å; H266-S268 PolarHBondContact O-N 2.84Å
269	I	93.3	Very high	96.5	Very high	15 Å²	15	45.9 Å²	45.9	8%	0.077	25%	0.251	C	S	.	.			trans	-102.4	107.3	-175.6	-56.2	176.6	0	0	0	107.5	A248 H266 E267 Y289 W297	A248-I269 HydrophobicContact CB-CG2 4.45Å; A248-I269 WeakPolarHBondContact CB-O 3.36Å; H266-I269 HydrophobicContact CB-CD1 3.85Å; H266-I269 HydrophobicContact CB-CG1 4.07Å; H266-I269 PolarHBondContact O-N 2.83Å; E267-I269 VanDerWaalsContact C-N 3.31Å; I269-Y289 HydrophobicContact CG2-CD1 3.73Å; I269-Y289 HydrophobicContact CG2-CE1 3.5Å; I269-W297 HydrophobicContact CD1-CH2 4.07Å; I269-W297 HydrophobicContact CD1-CZ2 3.81Å
270	I	94.3	Very high	96.5	Very high	155 Å²	155	51.2 Å²	51.2	80%	0.795	27%	0.269	S	S	*	.			trans	-118.2	7.1	179.9	60.9	169.2	0	0	0	112.4
271	C	95.9	Very high	96.5	Very high	28 Å²	28	51.6 Å²	51.6	19%	0.189	28%	0.281	C	S	.	.	S	Bend	trans	-103.4	151.5	-175.4	65.6	0	0	0	0	111	A248 D290	A248-C271 WeakPolarHBondContact CA-O 3.31Å; A248-C271 VanDerWaalsContact CB-O 3.28Å; A248-C271 WeakPolarHBondContact CB-O 3.44Å; C271-D290 HydrophobicContact CB-CB 4.12Å
272	G	96.9	Very high	96.5	Very high	7 Å²	7	48.7 Å²	48.7	7%	0.072	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-65.8	151.4	-178	0	0	0	0	0	113.2	D290	G272-D290 PolarHBondContact O-N 2.98Å; G272-D290 VanDerWaalsContact O-N 3.09Å
273	I	98.6	Very high	96.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.9	174	-65.1	144.2	0	0	0	108.7	N230 S245 T249 C250 V276 A287 G288 Y289	N230-I273 VanDerWaalsContact CB-O 3.26Å; N230-I273 WeakPolarHBondContact CB-O 3.34Å; N230-I273 PolarHBondContact ND2-O 2.5Å; S245-I273 PolarHBondContact O-N 3.05Å; T249-I273 WeakPolarHBondContact O-CD1 3.27Å; C250-I273 HydrophobicContact CB-CD1 4.49Å; C250-I273 WeakPolarHBondContact SG-CD1 3.27Å; I273-V276 HydrophobicContact CG2-CG1 3.77Å; I273-A287 HydrophobicContact CG2-CB 4.29Å; I273-G288 WeakPolarHBondContact CA-O 3.34Å; I273-Y289 HydrophobicContact CD1-CE1 3.9Å; I273-Y289 HydrophobicContact CG1-CD1 3.67Å; I273-Y289 HydrophobicContact CG1-CE1 3.23Å; I273-Y289 HydrophobicContact CG1-CE2 4.42Å; I273-Y289 HydrophobicContact CG1-CG 4.44Å
274	T	98.6	Very high	96.5	Very high	18 Å²	18	50.1 Å²	50.1	11%	0.11	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-26.8	-176.9	64.6	0	0	0	0	113.4	G288 D290 R314 V315	T274-G288 PolarHBondContact N-O 3.31Å; T274-G288 PolarHBondContact OG1-O 3.28Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.04Å; T274-R314 VanDerWaalsContact CG2-NH2 3.26Å; T274-V315 VanDerWaalsContact CB-O 3.29Å; T274-V315 WeakPolarHBondContact CB-O 3.45Å; T274-V315 VanDerWaalsContact CG2-O 3.26Å; T274-V315 WeakPolarHBondContact CG2-O 3.29Å; T274-V315 PolarHBondContact OG1-O 2.86Å
275	S	98.3	Very high	96.6	Very high	9 Å²	9	50.1 Å²	50.1	6%	0.063	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	144.4	-170.5	51.4	0	0	0	0	110.6	A231 A287 G288 L318	A231-S275 VanDerWaalsContact CB-CA 3.45Å; S275-A287 CarbonylContact O-C 3.52Å; S275-A287 VanDerWaalsContact O-CA 3.31Å; S275-A287 WeakPolarHBondContact O-CA 3.46Å; S275-G288 PolarHBondContact O-N 3.22Å; S275-L318 WeakPolarHBondContact O-CD2 3.38Å; S275-L318 WeakPolarHBondContact OG-CD2 3.36Å; S275-L318 PolarHBondContact OG-N 2.94Å
276	V	98.6	Very high	96.7	Very high	13 Å²	13	47.2 Å²	47.2	8%	0.079	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.8	178.9	-65.1	0	0	0	0	110.5	A231 C233 I273 L286 A287	A231-V276 HydrophobicContact CB-CG1 4.43Å; A231-V276 HydrophobicContact CB-CG2 3.9Å; C233-V276 HydrophobicContact CB-CG2 4.31Å; I273-V276 HydrophobicContact CG2-CG1 3.77Å; V276-L286 CarbonylContact C-O 3.55Å; V276-L286 VanDerWaalsContact CA-O 3.31Å; V276-L286 WeakPolarHBondContact CA-O 3.32Å; V276-A287 HydrophobicContact CG1-CB 4.18Å
277	A	98.4	Very high	96.9	Very high	13 Å²	13	43.1 Å²	43.1	11%	0.107	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	150.6	170	0	0	0	0	0	111.9	L286 L318 V320	A277-L286 PolarHBondContact N-O 3.16Å; A277-L286 PolarHBondContact O-N 3.09Å; A277-L318 HydrophobicContact CB-CD1 3.29Å; A277-V320 HydrophobicContact CB-CG2 3.96Å
278	F	98.6	Very high	97.3	Very high	16 Å²	16	33.9 Å²	33.9	7%	0.07	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	148.9	171.5	-78.7	-77.4	0	0	0	112.3	F235 P236 C242 L252 L284 V285 V320	F235-F278 HydrophobicContact CB-CD2 4.43Å; F235-F278 HydrophobicContact CB-CE2 4.1Å; F235-F278 HydrophobicContact CB-CZ 4.45Å; F235-F278 AromaticContact CD2-CD1 3.9Å; F235-F278 HydrophobicContact CD2-CD1 3.9Å; F235-F278 HydrophobicContact CD2-CD2 4.31Å; F235-F278 AromaticContact CD2-CE1 3.54Å; F235-F278 HydrophobicContact CD2-CE1 3.54Å; F235-F278 HydrophobicContact CD2-CE2 4Å; F235-F278 HydrophobicContact CD2-CG 4.25Å; F235-F278 AromaticContact CD2-CZ 3.62Å; F235-F278 HydrophobicContact CD2-CZ 3.62Å; F235-F278 HydrophobicContact CE2-CD1 4.18Å; F235-F278 AromaticContact CE2-CE1 3.95Å; F235-F278 HydrophobicContact CE2-CE1 3.95Å; F235-F278 HydrophobicContact CE2-CZ 4.44Å; P236-F278 HydrophobicContact CG-CB 4.22Å; C242-F278 HydrophobicContact CB-CD2 4.4Å; C242-F278 HydrophobicContact CB-CE2 3.35Å; C242-F278 HydrophobicContact CB-CZ 3.57Å; L252-F278 HydrophobicContact CD1-CZ 3.89Å; F278-L284 WeakPolarHBondContact CA-O 3.48Å; F278-V285 HydrophobicContact CD1-CG2 3.79Å; F278-V285 HydrophobicContact CE1-CG2 3.28Å; F278-V285 HydrophobicContact CZ-CG2 3.87Å; F278-V320 WeakPolarHBondContact O-CG2 3.49Å
279	S	98.1	Very high	97.6	Very high	18 Å²	18	30 Å²	30	13%	0.126	16%	0.158	C	C	.	.			trans	-64.8	164.3	158.5	67.8	0	0	0	0	111.1	S281 G282 R283 L284	S279-S281 PolarHBondContact O-N 2.75Å; S279-S281 VanDerWaalsContact O-N 3.1Å; S279-S281 PolarHBondContact OG-OG 3.37Å; S279-G282 PolarHBondContact O-N 3.07Å; S279-R283 PolarHBondContact OG-N 2.73Å; S279-L284 PolarHBondContact N-O 2.82Å; S279-L284 PolarHBondContact OG-N 3.31Å; S279-L284 VanDerWaalsContact OG-N 3.12Å
280	R	96.9	Very high	97.8	Very high	152 Å²	152	31.6 Å²	31.6	57%	0.574	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-32	-177.2	-179.1	57	-178.2	89.9	-3.8	114.6	A322	R280-A322 VanDerWaalsContact CD-O 3.28Å; R280-A322 WeakPolarHBondContact CD-O 3.12Å; R280-A322 PolarHBondContact NE-O 3.28Å
281	S	97.2	Very high	97.9	Very high	88 Å²	88	27.1 Å²	27.1	62%	0.615	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-13.8	176.3	62.8	0	0	0	0	113.5	S279 R283	S279-S281 PolarHBondContact O-N 2.75Å; S279-S281 VanDerWaalsContact O-N 3.1Å; S279-S281 PolarHBondContact OG-OG 3.37Å; S281-R283 PolarHBondContact O-N 3.36Å; S281-R283 WeakPolarHBondContact OG-CB 3.33Å; S281-R283 PolarHBondContact OG-N 2.89Å
282	G	97.2	Very high	98	Very high	1 Å²	1	30 Å²	30	1%	0.01	15%	0.153	C	C	.	.	S	Bend	trans	76.8	0.9	-170.8	0	0	0	0	0	114.1	F235 S279 L284 S299	F235-G282 VanDerWaalsContact CE2-CA 3.5Å; F235-G282 WeakPolarHBondContact CE2-O 3.47Å; S279-G282 PolarHBondContact O-N 3.07Å; G282-L284 VanDerWaalsContact C-N 3.3Å; G282-L284 PolarHBondContact O-N 3.42Å; G282-S299 VanDerWaalsContact O-CB 3.25Å; G282-S299 WeakPolarHBondContact O-CB 3.45Å; G282-S299 PolarHBondContact O-OG 3Å
283	R	97.5	Very high	98	Very high	64 Å²	64	31.6 Å²	31.6	24%	0.242	16%	0.16	C	C	.	.	S	Bend	trans	-71.4	-24.7	-179.4	-174.5	57.5	-173.7	-89.1	-1.1	113.2	E38 V40 S279 S281 D298 S299	E38-R283 PolarHBondContact O-NH2 2.85Å; V40-R283 HydrophobicContact CG2-CG 3.73Å; V40-R283 VanDerWaalsContact CG2-CZ 3.41Å; S279-R283 PolarHBondContact OG-N 2.73Å; S281-R283 PolarHBondContact O-N 3.36Å; S281-R283 WeakPolarHBondContact OG-CB 3.33Å; S281-R283 PolarHBondContact OG-N 2.89Å; R283-D298 IonicContact CZ-OD1 3.63Å; R283-D298 IonicContact CZ-OD2 2.96Å; R283-D298 IonicContact NE-OD1 3.35Å; R283-D298 PolarHBondContact NE-OD1 2.85Å; R283-D298 IonicContact NE-OD2 3.58Å; R283-D298 PolarHBondContact NE-OD2 3.32Å; R283-D298 IonicContact NH2-OD1 3.57Å; R283-D298 IonicContact NH2-OD2 2.75Å; R283-D298 PolarHBondContact NH2-OD2 2.88Å; R283-S299 WeakPolarHBondContact CA-OG 3.46Å; R283-S299 PolarHBondContact O-N 2.92Å; R283-S299 PolarHBondContact O-OG 2.74Å
284	L	98.3	Very high	98	Very high	30 Å²	30	31.7 Å²	31.7	16%	0.157	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.2	179.4	-49.5	175.8	0	0	0	109.9	V40 I43 F278 S279 G282 L286 I296 W297 V305	V40-L284 HydrophobicContact CG2-CD2 4.41Å; I43-L284 HydrophobicContact CD1-CD1 3.41Å; I43-L284 VanDerWaalsContact CD1-CD1 3.41Å; I43-L284 HydrophobicContact CD1-CD2 3.37Å; I43-L284 HydrophobicContact CD1-CG 4.03Å; F278-L284 WeakPolarHBondContact CA-O 3.48Å; S279-L284 PolarHBondContact N-O 2.82Å; S279-L284 PolarHBondContact OG-N 3.31Å; S279-L284 VanDerWaalsContact OG-N 3.12Å; G282-L284 VanDerWaalsContact C-N 3.3Å; G282-L284 PolarHBondContact O-N 3.42Å; L284-L286 HydrophobicContact CB-CD1 4.32Å; L284-I296 HydrophobicContact CB-CG2 4.07Å; L284-I296 HydrophobicContact CD1-CG2 4.2Å; L284-I296 HydrophobicContact CD2-CG2 4.19Å; L284-I296 HydrophobicContact CG-CG2 4.38Å; L284-W297 VanDerWaalsContact CA-O 3.32Å; L284-W297 WeakPolarHBondContact CA-O 3.14Å; L284-V305 HydrophobicContact CD2-CG2 4.27Å
285	V	98.5	Very high	98	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.7	164.5	178.2	0	0	0	0	107.2	Y264 F278 W297	Y264-V285 HydrophobicContact CE2-CG2 4.33Å; F278-V285 HydrophobicContact CD1-CG2 3.79Å; F278-V285 HydrophobicContact CE1-CG2 3.28Å; F278-V285 HydrophobicContact CZ-CG2 3.87Å; V285-W297 HydrophobicContact CB-CB 4.23Å; V285-W297 PolarHBondContact N-O 2.79Å; V285-W297 PolarHBondContact O-N 3.03Å
286	L	98.7	Very high	98	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.9	172.5	-62.2	96.1	0	0	0	108	V276 A277 L284 I296 L308 L318 V320 V327	V276-L286 CarbonylContact C-O 3.55Å; V276-L286 VanDerWaalsContact CA-O 3.31Å; V276-L286 WeakPolarHBondContact CA-O 3.32Å; A277-L286 PolarHBondContact N-O 3.16Å; A277-L286 PolarHBondContact O-N 3.09Å; L284-L286 HydrophobicContact CB-CD1 4.32Å; L286-I296 HydrophobicContact CD2-CG1 4.25Å; L286-I296 HydrophobicContact CG-CG1 4.41Å; L286-L308 HydrophobicContact CD2-CD1 4.3Å; L286-L318 HydrophobicContact CB-CD1 4.17Å; L286-V320 HydrophobicContact CD1-CG2 3.97Å; L286-V327 HydrophobicContact CD2-CB 4.31Å; L286-V327 HydrophobicContact CD2-CG1 3.75Å; L286-V327 HydrophobicContact CD2-CG2 3.76Å
287	A	98.7	Very high	98	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.8	-179	0	0	0	0	0	110.1	I273 S275 V276 Y289 C294 N295	I273-A287 HydrophobicContact CG2-CB 4.29Å; S275-A287 CarbonylContact O-C 3.52Å; S275-A287 VanDerWaalsContact O-CA 3.31Å; S275-A287 WeakPolarHBondContact O-CA 3.46Å; V276-A287 HydrophobicContact CG1-CB 4.18Å; A287-Y289 HydrophobicContact CB-CD2 4.39Å; A287-Y289 HydrophobicContact CB-CE2 3.52Å; A287-Y289 WeakPolarHBondContact O-CD2 3.1Å; A287-Y289 WeakPolarHBondContact O-CE2 3.4Å; A287-C294 CarbonylContact O-C 3.56Å; A287-C294 WeakPolarHBondContact O-CA 3.45Å; A287-C294 PolarHBondContact O-SG 2.87Å; A287-N295 PolarHBondContact N-O 3.26Å; A287-N295 PolarHBondContact O-N 3.32Å
288	G	98.5	Very high	98	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	136	176.1	0	0	0	0	0	110.2	I273 T274 S275	I273-G288 WeakPolarHBondContact CA-O 3.34Å; T274-G288 PolarHBondContact N-O 3.31Å; T274-G288 PolarHBondContact OG1-O 3.28Å; S275-G288 PolarHBondContact O-N 3.22Å
289	Y	98.4	Very high	97.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	161.3	-172	-70.7	-98.3	0	0	0	111.9	I269 I273 A287 D291 F292 N293 N295 W297 V315	I269-Y289 HydrophobicContact CG2-CD1 3.73Å; I269-Y289 HydrophobicContact CG2-CE1 3.5Å; I273-Y289 HydrophobicContact CD1-CE1 3.9Å; I273-Y289 HydrophobicContact CG1-CD1 3.67Å; I273-Y289 HydrophobicContact CG1-CE1 3.23Å; I273-Y289 HydrophobicContact CG1-CE2 4.42Å; I273-Y289 HydrophobicContact CG1-CG 4.44Å; A287-Y289 HydrophobicContact CB-CD2 4.39Å; A287-Y289 HydrophobicContact CB-CE2 3.52Å; A287-Y289 WeakPolarHBondContact O-CD2 3.1Å; A287-Y289 WeakPolarHBondContact O-CE2 3.4Å; Y289-D291 WeakPolarHBondContact CB-OD1 3.48Å; Y289-D291 PolarHBondContact O-N 2.86Å; Y289-F292 PolarHBondContact O-N 2.9Å; Y289-N293 PolarHBondContact N-O 3.28Å; Y289-N295 HydrophobicContact CD2-CB 4.34Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.3Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.47Å; Y289-N295 HydrophobicContact CE2-CB 3.71Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.45Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.4Å; Y289-W297 PolarHBondContact OH-NE1 2.96Å; Y289-W297 VanDerWaalsContact OH-NE1 3.13Å; Y289-V315 PolarHBondContact O-N 2.72Å
290	D	97.6	Very high	97.8	Very high	48 Å²	48	30.2 Å²	30.2	26%	0.257	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-16	175.2	-78.8	-11.6	0	0	0	114.1	C271 G272 T274 F292 R314	C271-D290 HydrophobicContact CB-CB 4.12Å; G272-D290 PolarHBondContact O-N 2.98Å; G272-D290 VanDerWaalsContact O-N 3.09Å; T274-D290 WeakPolarHBondContact CG2-OD1 3.04Å; D290-F292 WeakPolarHBondContact O-CD1 3.36Å; D290-F292 WeakPolarHBondContact O-CE1 3.48Å; D290-F292 PolarHBondContact O-N 2.8Å; D290-R314 IonicContact OD1-CZ 2.75Å; D290-R314 IonicContact OD1-NE 3.55Å; D290-R314 PolarHBondContact OD1-NE 3.06Å; D290-R314 IonicContact OD1-NH2 3.09Å; D290-R314 PolarHBondContact OD1-NH2 2.93Å; D290-R314 IonicContact OD2-NH2 3.54Å; D290-R314 PolarHBondContact OD2-NH2 3.23Å
291	D	96.9	Very high	97.8	Very high	60 Å²	60	25.2 Å²	25.2	32%	0.321	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	12.6	173.2	78.1	-17.5	0	0	0	114.2	Y289 N293	Y289-D291 WeakPolarHBondContact CB-OD1 3.48Å; Y289-D291 PolarHBondContact O-N 2.86Å; D291-N293 PolarHBondContact O-N 2.64Å; D291-N293 PolarHBondContact O-ND2 2.96Å; D291-N293 WeakPolarHBondContact OD1-CB 3.32Å; D291-N293 PolarHBondContact OD1-N 3.08Å; D291-N293 PolarHBondContact OD2-ND2 3.43Å; D291-N293 VanDerWaalsContact OD2-ND2 3.16Å
292	F	97.8	Very high	97.7	Very high	89 Å²	89	22.1 Å²	22.1	39%	0.39	11%	0.111	S	C	.	.	S	Bend	trans	77.2	-2.7	176.6	-37.9	-23.2	0	0	0	114.1	Y289 D290 N313 R314 V315	Y289-F292 PolarHBondContact O-N 2.9Å; D290-F292 WeakPolarHBondContact O-CD1 3.36Å; D290-F292 WeakPolarHBondContact O-CE1 3.48Å; D290-F292 PolarHBondContact O-N 2.8Å; F292-N313 WeakPolarHBondContact CB-O 3.24Å; F292-R314 HydrophobicContact CD1-CB 4.36Å; F292-V315 WeakPolarHBondContact O-CG2 3.28Å
293	N	97.5	Very high	97.7	Very high	41 Å²	41	27 Å²	27	22%	0.219	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	161.4	179.5	-60	-57.5	0	0	0	111.6	Y289 D291 I307 S309	Y289-N293 PolarHBondContact N-O 3.28Å; D291-N293 PolarHBondContact O-N 2.64Å; D291-N293 PolarHBondContact O-ND2 2.96Å; D291-N293 WeakPolarHBondContact OD1-CB 3.32Å; D291-N293 PolarHBondContact OD1-N 3.08Å; D291-N293 PolarHBondContact OD2-ND2 3.43Å; D291-N293 VanDerWaalsContact OD2-ND2 3.16Å; N293-I307 HydrophobicContact CB-CG2 4.08Å; N293-S309 WeakPolarHBondContact OD1-CB 3.23Å
294	C	98.1	Very high	97.6	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.007	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.9	162.2	166.4	0	0	0	0	108.8	A287 I307 L308 T329	A287-C294 CarbonylContact O-C 3.56Å; A287-C294 WeakPolarHBondContact O-CA 3.45Å; A287-C294 PolarHBondContact O-SG 2.87Å; C294-I307 CarbonylContact O-C 3.54Å; C294-I307 WeakPolarHBondContact O-CA 3.49Å; C294-L308 HydrophobicContact CB-CB 4.06Å; C294-L308 HydrophobicContact CB-CD1 4.44Å; C294-L308 PolarHBondContact N-O 3.36Å; C294-L308 PolarHBondContact O-N 2.8Å; C294-T329 HydrophobicContact CB-CG2 4.49Å
295	N	98.2	Very high	97.6	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	142.5	177.9	-65	-60.7	0	0	0	109.9	A287 Y289 W297 R304	A287-N295 PolarHBondContact N-O 3.26Å; A287-N295 PolarHBondContact O-N 3.32Å; Y289-N295 HydrophobicContact CD2-CB 4.34Å; Y289-N295 VanDerWaalsContact CD2-ND2 3.3Å; Y289-N295 WeakPolarHBondContact CD2-ND2 3.47Å; Y289-N295 HydrophobicContact CE2-CB 3.71Å; Y289-N295 WeakPolarHBondContact CE2-ND2 3.45Å; N295-W297 HydrophobicContact CB-CZ2 4.34Å; N295-R304 HydrophobicContact CB-CG 4.37Å; N295-R304 VanDerWaalsContact OD1-CD 3.23Å; N295-R304 WeakPolarHBondContact OD1-CD 3.23Å
296	I	98.4	Very high	97.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.5	173.9	-50.3	175.6	0	0	0	107.6	I43 M45 L284 L286 R304 V305 G306 L308	I43-I296 HydrophobicContact CB-CD1 4.35Å; I43-I296 HydrophobicContact CD1-CG2 4.11Å; I43-I296 HydrophobicContact CG2-CD1 3.83Å; M45-I296 HydrophobicContact CG-CD1 4.11Å; M45-I296 HydrophobicContact SD-CD1 3.74Å; L284-I296 HydrophobicContact CB-CG2 4.07Å; L284-I296 HydrophobicContact CD1-CG2 4.2Å; L284-I296 HydrophobicContact CD2-CG2 4.19Å; L284-I296 HydrophobicContact CG-CG2 4.38Å; L286-I296 HydrophobicContact CD2-CG1 4.25Å; L286-I296 HydrophobicContact CG-CG1 4.41Å; I296-R304 CarbonylContact O-C 3.55Å; I296-V305 HydrophobicContact CB-CG2 4.29Å; I296-V305 HydrophobicContact CG2-CG2 3.87Å; I296-V305 WeakPolarHBondContact O-CG2 3.47Å; I296-V305 PolarHBondContact O-N 3.4Å; I296-G306 PolarHBondContact N-O 2.81Å; I296-G306 PolarHBondContact O-N 2.81Å; I296-L308 HydrophobicContact CD1-CD1 4.47Å; I296-L308 HydrophobicContact CD1-CD2 3.92Å; I296-L308 HydrophobicContact CD1-CG 4.04Å; I296-L308 HydrophobicContact CG1-CG 4.28Å
297	W	98.4	Very high	97.5	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.4	-179.3	-56.4	93.1	0	0	0	110.7	Y264 H266 I269 L284 V285 Y289 N295 S299 E303 R304	Y264-W297 HydrophobicContact CD1-CB 3.89Å; Y264-W297 HydrophobicContact CD1-CE3 4.5Å; Y264-W297 HydrophobicContact CD1-CG 4.28Å; Y264-W297 HydrophobicContact CE1-CB 4.43Å; H266-W297 HydrophobicContact CB-CH2 3.89Å; I269-W297 HydrophobicContact CD1-CH2 4.07Å; I269-W297 HydrophobicContact CD1-CZ2 3.81Å; L284-W297 VanDerWaalsContact CA-O 3.32Å; L284-W297 WeakPolarHBondContact CA-O 3.14Å; V285-W297 HydrophobicContact CB-CB 4.23Å; V285-W297 PolarHBondContact N-O 2.79Å; V285-W297 PolarHBondContact O-N 3.03Å; Y289-W297 WeakPolarHBondContact OH-CZ2 3.4Å; Y289-W297 PolarHBondContact OH-NE1 2.96Å; Y289-W297 VanDerWaalsContact OH-NE1 3.13Å; N295-W297 HydrophobicContact CB-CZ2 4.34Å; W297-S299 PolarHBondContact O-N 3.19Å; W297-E303 WeakPolarHBondContact CA-O 3.47Å; W297-R304 HydrophobicContact CD2-CB 4.42Å; W297-R304 HydrophobicContact CE3-CB 3.93Å; W297-R304 HydrophobicContact CH2-CB 4.32Å; W297-R304 HydrophobicContact CZ3-CB 3.89Å
298	D	97.9	Very high	97.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	115.1	164.1	-174.3	-24.6	0	0	0	108.9	V39 V40 R283 L300 K301 A302 E303 V305	V39-D298 HydrophobicContact CG1-CB 4.5Å; V40-D298 WeakPolarHBondContact CG2-OD2 3.37Å; V40-D298 PolarHBondContact N-OD2 3.1Å; R283-D298 IonicContact CZ-OD1 3.63Å; R283-D298 IonicContact CZ-OD2 2.96Å; R283-D298 IonicContact NE-OD1 3.35Å; R283-D298 PolarHBondContact NE-OD1 2.85Å; R283-D298 IonicContact NE-OD2 3.58Å; R283-D298 PolarHBondContact NE-OD2 3.32Å; R283-D298 IonicContact NH2-OD1 3.57Å; R283-D298 IonicContact NH2-OD2 2.75Å; R283-D298 PolarHBondContact NH2-OD2 2.88Å; D298-L300 PolarHBondContact O-N 3.29Å; D298-L300 VanDerWaalsContact O-N 3.16Å; D298-L300 PolarHBondContact OD1-N 3.36Å; D298-K301 HydrophobicContact CB-CB 4.11Å; D298-K301 PolarHBondContact O-N 3.07Å; D298-A302 PolarHBondContact O-N 2.58Å; D298-E303 PolarHBondContact N-O 2.88Å; D298-V305 HydrophobicContact CB-CG1 3.86Å
299	S	96.9	Very high	97.4	Very high	4 Å²	4	35.1 Å²	35.1	3%	0.028	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-24	-174.8	64.7	0	0	0	0	113.9	Y264 G282 R283 W297	Y264-S299 VanDerWaalsContact OH-CA 3.29Å; Y264-S299 WeakPolarHBondContact OH-CA 3.19Å; Y264-S299 PolarHBondContact OH-O 3.14Å; G282-S299 VanDerWaalsContact O-CB 3.25Å; G282-S299 WeakPolarHBondContact O-CB 3.45Å; G282-S299 PolarHBondContact O-OG 3Å; R283-S299 WeakPolarHBondContact CA-OG 3.46Å; R283-S299 PolarHBondContact O-N 2.92Å; R283-S299 PolarHBondContact O-OG 2.74Å; W297-S299 PolarHBondContact O-N 3.19Å
300	L	96.9	Very high	97.3	Very high	49 Å²	49	36.3 Å²	36.3	26%	0.257	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-27.4	-179.1	-59.7	-178.6	0	0	0	112.3	V34 V37 D298	V34-L300 HydrophobicContact CB-CB 4.4Å; V34-L300 HydrophobicContact CG1-CB 4.27Å; V34-L300 HydrophobicContact CG1-CD2 4.28Å; V34-L300 HydrophobicContact CG2-CB 4.25Å; V34-L300 WeakPolarHBondContact CG2-O 3.23Å; V37-L300 HydrophobicContact CG1-CD1 4.31Å; D298-L300 PolarHBondContact O-N 3.29Å; D298-L300 VanDerWaalsContact O-N 3.16Å; D298-L300 PolarHBondContact OD1-N 3.36Å
301	K	95.9	Very high	97.3	Very high	47 Å²	47	34.5 Å²	34.5	20%	0.204	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-12.5	-169.6	-65.1	-67.6	-170	173.7	0	114.2	V34 S35 V37 V39 D298 E303	V34-K301 HydrophobicContact CG2-CD 4.29Å; V34-K301 WeakPolarHBondContact O-CE 3.41Å; V34-K301 PolarHBondContact O-NZ 3.29Å; S35-K301 PolarHBondContact O-NZ 3.12Å; V37-K301 WeakPolarHBondContact O-CE 3.25Å; V37-K301 PolarHBondContact O-NZ 3.47Å; V39-K301 HydrophobicContact CB-CG 4.47Å; V39-K301 HydrophobicContact CG2-CB 4.24Å; V39-K301 HydrophobicContact CG2-CD 4.27Å; V39-K301 HydrophobicContact CG2-CG 3.9Å; D298-K301 HydrophobicContact CB-CB 4.11Å; D298-K301 PolarHBondContact O-N 3.07Å; K301-E303 HydrophobicContact CB-CB 4.37Å; K301-E303 HydrophobicContact CB-CG 4.25Å; K301-E303 PolarHBondContact O-N 3.24Å; K301-E303 VanDerWaalsContact O-N 3.14Å
302	A	95.8	Very high	97.3	Very high	24 Å²	24	38 Å²	38	20%	0.198	20%	0.202	C	C	.	.			trans	53.5	24.1	-169.9	0	0	0	0	0	114.5	I262 V263 Y264 D298	I262-A302 HydrophobicContact CD1-CB 3.56Å; I262-A302 HydrophobicContact CG1-CB 3.81Å; V263-A302 WeakPolarHBondContact O-CB 3.33Å; Y264-A302 HydrophobicContact CD1-CB 3.86Å; Y264-A302 HydrophobicContact CE1-CB 4.22Å; D298-A302 PolarHBondContact O-N 2.58Å
303	E	95.8	Very high	97.4	Very high	102 Å²	102	36.3 Å²	36.3	48%	0.477	20%	0.197	S	C	.	.			trans	-96.7	139.7	176.5	-70.4	-172.3	-161.8	0	0	110.6	V39 W297 D298 K301 V305	V39-E303 HydrophobicContact CG1-CB 4.14Å; V39-E303 WeakPolarHBondContact CG1-OE2 3.34Å; V39-E303 WeakPolarHBondContact CG2-OE2 3.36Å; W297-E303 WeakPolarHBondContact CA-O 3.47Å; D298-E303 PolarHBondContact N-O 2.88Å; K301-E303 HydrophobicContact CB-CB 4.37Å; K301-E303 HydrophobicContact CB-CG 4.25Å; K301-E303 PolarHBondContact O-N 3.24Å; K301-E303 VanDerWaalsContact O-N 3.14Å; E303-V305 PolarHBondContact O-N 2.86Å
304	R	96.7	Very high	97.4	Very high	96 Å²	96	37.1 Å²	37.1	36%	0.362	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	111.3	173.3	-175.5	178.6	63.7	176.9	-4.8	109.6	N295 I296 W297	N295-R304 HydrophobicContact CB-CG 4.37Å; N295-R304 VanDerWaalsContact OD1-CD 3.23Å; N295-R304 WeakPolarHBondContact OD1-CD 3.23Å; I296-R304 CarbonylContact O-C 3.55Å; W297-R304 HydrophobicContact CD2-CB 4.42Å; W297-R304 HydrophobicContact CE3-CB 3.93Å; W297-R304 HydrophobicContact CH2-CB 4.32Å; W297-R304 HydrophobicContact CZ3-CB 3.89Å
305	V	97.5	Very high	97.4	Very high	11 Å²	11	37.1 Å²	37.1	7%	0.067	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-14.2	-177.1	-62.7	0	0	0	0	113.5	V39 V40 R42 I43 L284 I296 D298 E303	V39-V305 HydrophobicContact CG1-CG1 3.85Å; V40-V305 HydrophobicContact CB-CG1 4.33Å; V40-V305 VanDerWaalsContact O-CG1 3.25Å; V40-V305 WeakPolarHBondContact O-CG1 3.22Å; R42-V305 CarbonylContact C-O 3.57Å; R42-V305 WeakPolarHBondContact CA-O 3.39Å; I43-V305 HydrophobicContact CD1-CG2 3.81Å; I43-V305 HydrophobicContact CG1-CB 4.44Å; I43-V305 HydrophobicContact CG1-CG2 4.03Å; I43-V305 PolarHBondContact N-O 2.76Å; L284-V305 HydrophobicContact CD2-CG2 4.27Å; I296-V305 HydrophobicContact CB-CG2 4.29Å; I296-V305 HydrophobicContact CG2-CG2 3.87Å; I296-V305 WeakPolarHBondContact O-CG2 3.47Å; I296-V305 PolarHBondContact O-N 3.4Å; D298-V305 HydrophobicContact CB-CG1 3.86Å; E303-V305 PolarHBondContact O-N 2.86Å
306	G	97.3	Very high	97.4	Very high	6 Å²	6	37.8 Å²	37.8	6%	0.062	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	164	179.6	0	0	0	0	0	113.5	I296	I296-G306 PolarHBondContact N-O 2.81Å; I296-G306 PolarHBondContact O-N 2.81Å
307	I	97.6	Very high	97.4	Very high	74 Å²	74	38.3 Å²	38.3	38%	0.379	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.4	175.5	-53.3	176.1	0	0	0	107.9	N293 C294	N293-I307 HydrophobicContact CB-CG2 4.08Å; C294-I307 CarbonylContact O-C 3.54Å; C294-I307 WeakPolarHBondContact O-CA 3.49Å
308	L	98	Very high	97.4	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	88.6	170.4	-54.1	-176	0	0	0	108.3	M45 L286 C294 I296 W339	M45-L308 HydrophobicContact CB-CD2 3.66Å; M45-L308 HydrophobicContact CG-CD2 3.96Å; M45-L308 HydrophobicContact SD-CD1 4.31Å; M45-L308 HydrophobicContact SD-CD2 4.03Å; L286-L308 HydrophobicContact CD2-CD1 4.3Å; C294-L308 HydrophobicContact CB-CB 4.06Å; C294-L308 HydrophobicContact CB-CD1 4.44Å; C294-L308 PolarHBondContact N-O 3.36Å; C294-L308 PolarHBondContact O-N 2.8Å; I296-L308 HydrophobicContact CD1-CD1 4.47Å; I296-L308 HydrophobicContact CD1-CD2 3.92Å; I296-L308 HydrophobicContact CD1-CG 4.04Å; I296-L308 HydrophobicContact CG1-CG 4.28Å; L308-W339 HydrophobicContact CB-CD2 4.37Å; L308-W339 HydrophobicContact CB-CE3 4.37Å; L308-W339 HydrophobicContact CB-CH2 4.21Å; L308-W339 HydrophobicContact CB-CZ2 4.22Å; L308-W339 HydrophobicContact CB-CZ3 4.28Å; L308-W339 HydrophobicContact CD1-CB 4.44Å; L308-W339 HydrophobicContact CD1-CD2 4.15Å; L308-W339 HydrophobicContact CD1-CG 4.03Å; L308-W339 HydrophobicContact CD2-CD2 4.18Å; L308-W339 HydrophobicContact CD2-CE3 3.88Å; L308-W339 HydrophobicContact CD2-CZ3 4.34Å; L308-W339 HydrophobicContact CG-CD2 4.48Å
309	S	96.9	Very high	97.4	Very high	81 Å²	81	39.4 Å²	39.4	57%	0.566	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	110.4	175.7	59.1	0	0	0	0	109.4	N293	N293-S309 WeakPolarHBondContact OD1-CB 3.23Å
310	G	96.6	Very high	97.5	Very high	24 Å²	24	40.6 Å²	40.6	25%	0.247	22%	0.221	C	C	.	.			trans	-168.8	4.8	175.9	0	0	0	0	0	115.5	K337	G310-K337 WeakPolarHBondContact O-CE 3.47Å; G310-K337 PolarHBondContact O-NZ 3.44Å
311	H	98.3	Very high	97.6	Very high	11 Å²	11	38.6 Å²	38.6	5%	0.051	21%	0.211	C	C	.	.			trans	-103.7	150	173.7	-74.4	-71.7	0	0	0	110.1	T329 S331 D333 F335	H311-T329 PolarHBondContact NE2-OG1 2.92Å; H311-S331 VanDerWaalsContact CG-CB 3.46Å; H311-S331 WeakPolarHBondContact ND1-CB 3.26Å; H311-D333 WeakPolarHBondContact CA-OD2 3.18Å; H311-D333 WeakPolarHBondContact CB-OD2 3.2Å; H311-D333 IonicContact CE1-OD1 2.84Å; H311-D333 IonicContact CE1-OD2 3.93Å; H311-D333 IonicContact CG-OD2 2.87Å; H311-D333 IonicContact ND1-OD1 2.76Å; H311-D333 PolarHBondContact ND1-OD1 3.43Å; H311-D333 IonicContact ND1-OD2 3.37Å; H311-D333 PolarHBondContact ND1-OD2 3.14Å; H311-F335 PolarHBondContact CE1-O 2.8Å
312	D	97.8	Very high	97.5	Very high	132 Å²	132	39.2 Å²	39.2	71%	0.706	23%	0.225	S	C	*	.	S	Bend	trans	-97.6	6.5	-179.9	-60	-42.5	0	0	0	112.1	D333	D312-D333 HydrophobicContact CB-CB 4.39Å; D312-D333 PolarHBondContact N-OD2 2.78Å
313	N	98.4	Very high	97.5	Very high	54 Å²	54	41.2 Å²	41.2	29%	0.289	23%	0.232	S	C	.	.	S	Bend	trans	-156.7	173.4	179.3	-150.2	-41.1	0	0	0	109.8	F292 V315 S331 W332 D333	F292-N313 WeakPolarHBondContact CB-O 3.24Å; N313-V315 PolarHBondContact O-N 2.98Å; N313-S331 PolarHBondContact O-OG 3.31Å; N313-W332 HydrophobicContact CB-CB 3.91Å; N313-D333 HydrophobicContact CB-CB 4.11Å
314	R	97.9	Very high	97.5	Very high	59 Å²	59	38.1 Å²	38.1	22%	0.223	23%	0.227	C	C	.	.			trans	-51.2	134.8	-174.8	70.3	-176.3	-67.1	-155.7	12.1	112	T274 D290 F292 S316 S331 W332	T274-R314 VanDerWaalsContact CG2-NH2 3.26Å; D290-R314 IonicContact OD1-CZ 2.75Å; D290-R314 IonicContact OD1-NE 3.55Å; D290-R314 PolarHBondContact OD1-NE 3.06Å; D290-R314 IonicContact OD1-NH2 3.09Å; D290-R314 PolarHBondContact OD1-NH2 2.93Å; D290-R314 IonicContact OD2-NH2 3.54Å; D290-R314 PolarHBondContact OD2-NH2 3.23Å; F292-R314 HydrophobicContact CD1-CB 4.36Å; R314-S316 PolarHBondContact O-N 3.47Å; R314-S331 VanDerWaalsContact O-CA 3.3Å; R314-S331 WeakPolarHBondContact O-CA 3.46Å; R314-S331 WeakPolarHBondContact O-CB 3.41Å; R314-S331 PolarHBondContact O-OG 3.06Å; R314-W332 VanDerWaalsContact CD-CE2 3.47Å; R314-W332 HydrophobicContact CG-CB 4.04Å; R314-W332 HydrophobicContact CG-CD2 3.38Å; R314-W332 HydrophobicContact CG-CE3 3.57Å; R314-W332 HydrophobicContact CG-CG 3.57Å; R314-W332 HydrophobicContact CG-CZ2 4.49Å; R314-W332 HydrophobicContact CG-CZ3 4.19Å; R314-W332 PolarHBondContact O-N 2.97Å; R314-W332 VanDerWaalsContact O-N 3.12Å
315	V	98.7	Very high	97.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	117.3	169.8	179.6	0	0	0	0	105.5	T274 Y289 F292 N313 T329	T274-V315 VanDerWaalsContact CB-O 3.29Å; T274-V315 WeakPolarHBondContact CB-O 3.45Å; T274-V315 VanDerWaalsContact CG2-O 3.26Å; T274-V315 WeakPolarHBondContact CG2-O 3.29Å; T274-V315 PolarHBondContact OG1-O 2.86Å; Y289-V315 PolarHBondContact O-N 2.72Å; F292-V315 WeakPolarHBondContact O-CG2 3.28Å; N313-V315 PolarHBondContact O-N 2.98Å; V315-T329 HydrophobicContact CG1-CG2 4.47Å
316	S	98.4	Very high	97.4	Very high	15 Å²	15	39.4 Å²	39.4	11%	0.105	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-26.7	-175.4	54	0	0	0	0	112.7	I58 R314 G330	I58-S316 VanDerWaalsContact O-CB 3.28Å; I58-S316 WeakPolarHBondContact O-CB 3.25Å; I58-S316 PolarHBondContact O-OG 3.08Å; R314-S316 PolarHBondContact O-N 3.47Å; S316-G330 PolarHBondContact N-O 2.95Å; S316-G330 PolarHBondContact OG-O 2.75Å
317	C	98.4	Very high	97.4	Very high	10 Å²	10	39.4 Å²	39.4	7%	0.068	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151	-178.4	56.4	0	0	0	0	110.6	M61 T329 G330	M61-C317 HydrophobicContact CG-CB 4.13Å; M61-C317 VanDerWaalsContact CG-SG 3.58Å; C317-T329 WeakPolarHBondContact O-CA 3.24Å; C317-G330 PolarHBondContact N-O 3.34Å; C317-G330 PolarHBondContact O-N 3.39Å
318	L	98.3	Very high	97.5	Very high	16 Å²	16	35.9 Å²	35.9	8%	0.084	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	156.7	172.6	73.1	88.8	0	0	0	110.2	S275 A277 L286 A328 T329	S275-L318 WeakPolarHBondContact O-CD2 3.38Å; S275-L318 WeakPolarHBondContact OG-CD2 3.36Å; S275-L318 PolarHBondContact OG-N 2.94Å; A277-L318 HydrophobicContact CB-CD1 3.29Å; L286-L318 HydrophobicContact CB-CD1 4.17Å; L318-A328 CarbonylContact C-O 3.57Å; L318-A328 WeakPolarHBondContact CA-O 3.22Å; L318-T329 HydrophobicContact CB-CG2 4.18Å
319	G	98.1	Very high	97.5	Very high	10 Å²	10	35.9 Å²	35.9	10%	0.103	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	143	175.5	0	0	0	0	0	111.7	W63 V327 A328	W63-G319 PolarHBondContact NE1-O 3.08Å; G319-V327 CarbonylContact O-C 3.57Å; G319-V327 WeakPolarHBondContact O-CA 3.29Å; G319-A328 PolarHBondContact N-O 3Å; G319-A328 PolarHBondContact O-N 3.26Å
320	V	98.4	Very high	97.6	Very high	28 Å²	28	32 Å²	32	17%	0.17	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.5	173.4	-173.1	0	0	0	0	108.6	A277 F278 L286 V327	A277-V320 HydrophobicContact CB-CG2 3.96Å; F278-V320 WeakPolarHBondContact O-CG2 3.49Å; L286-V320 HydrophobicContact CD1-CG2 3.97Å; V320-V327 HydrophobicContact CG2-CG2 4.14Å
321	T	97.9	Very high	97.7	Very high	8 Å²	8	30.9 Å²	30.9	5%	0.049	18%	0.182	C	C	.	.			trans	-65.1	153.8	175.2	55.1	0	0	0	0	111.7	W63 D323 G324 M325 G326	W63-T321 HydrophobicContact CD2-CG2 3.7Å; W63-T321 HydrophobicContact CE3-CG2 3.77Å; W63-T321 HydrophobicContact CG-CG2 4.35Å; W63-T321 HydrophobicContact CH2-CG2 3.67Å; W63-T321 HydrophobicContact CZ2-CG2 3.61Å; W63-T321 HydrophobicContact CZ3-CG2 3.75Å; T321-D323 WeakPolarHBondContact CB-OD1 3.42Å; T321-D323 PolarHBondContact O-N 3.31Å; T321-D323 PolarHBondContact OG1-OD1 3.04Å; T321-G324 PolarHBondContact O-N 3.37Å; T321-G324 PolarHBondContact OG1-N 3.05Å; T321-M325 PolarHBondContact OG1-N 2.87Å; T321-G326 PolarHBondContact N-O 3.45Å; T321-G326 PolarHBondContact OG1-N 3.17Å; T321-G326 PolarHBondContact OG1-O 3.12Å
322	A	94.6	Very high	97.7	Very high	60 Å²	60	32.8 Å²	32.8	50%	0.496	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.9	-178.7	0	0	0	0	0	113	S67 R280	S67-A322 PolarHBondContact OG-N 2.93Å; R280-A322 VanDerWaalsContact CD-O 3.28Å; R280-A322 WeakPolarHBondContact CD-O 3.12Å; R280-A322 PolarHBondContact NE-O 3.28Å
323	D	96.1	Very high	97.8	Very high	66 Å²	66	27.5 Å²	27.5	35%	0.353	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10	172.6	65.1	5.9	0	0	0	113.9	S67 T321 M325	S67-D323 WeakPolarHBondContact CB-OD2 3.49Å; S67-D323 PolarHBondContact OG-N 2.79Å; T321-D323 WeakPolarHBondContact CB-OD1 3.42Å; T321-D323 PolarHBondContact O-N 3.31Å; T321-D323 PolarHBondContact OG1-OD1 3.04Å; D323-M325 VanDerWaalsContact C-N 3.3Å; D323-M325 HydrophobicContact CB-CG 4.36Å; D323-M325 PolarHBondContact O-N 3.12Å; D323-M325 WeakPolarHBondContact OD1-CB 3.14Å; D323-M325 PolarHBondContact OD1-N 3.15Å; D323-M325 WeakPolarHBondContact OD2-CG 3.45Å
324	G	96.2	Very high	97.8	Very high	36 Å²	36	26 Å²	26	37%	0.371	15%	0.154	S	C	.	.	S	Bend	trans	73.9	8.7	-176.2	0	0	0	0	0	115.8	T321	T321-G324 PolarHBondContact O-N 3.37Å; T321-G324 PolarHBondContact OG1-N 3.05Å
325	M	96.1	Very high	97.8	Very high	129 Å²	129	26.2 Å²	26.2	64%	0.635	16%	0.156	S	C	*	.	S	Bend	trans	-75.7	-20.9	-178.1	-70.8	-159.4	-178.9	0	0	114.9	T321 D323 N340	T321-M325 PolarHBondContact OG1-N 2.87Å; D323-M325 VanDerWaalsContact C-N 3.3Å; D323-M325 HydrophobicContact CB-CG 4.36Å; D323-M325 PolarHBondContact O-N 3.12Å; D323-M325 WeakPolarHBondContact OD1-CB 3.14Å; D323-M325 PolarHBondContact OD1-N 3.15Å; D323-M325 WeakPolarHBondContact OD2-CG 3.45Å; M325-N340 VanDerWaalsContact O-CB 3.26Å; M325-N340 WeakPolarHBondContact O-CB 3.31Å; M325-N340 PolarHBondContact O-ND2 2.71Å
326	G	95.5	Very high	97.8	Very high	6 Å²	6	26.1 Å²	26.1	6%	0.062	16%	0.156	C	C	.	.			trans	-148	150.7	-175.6	0	0	0	0	0	113.5	T321	T321-G326 PolarHBondContact N-O 3.45Å; T321-G326 PolarHBondContact OG1-N 3.17Å; T321-G326 PolarHBondContact OG1-O 3.12Å
327	V	98.3	Very high	97.8	Very high	6 Å²	6	27 Å²	27	4%	0.036	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.2	169.9	-177.3	0	0	0	0	107.7	M45 L286 G319 V320 I338 W339	M45-V327 HydrophobicContact CE-CG2 3.75Å; M45-V327 HydrophobicContact SD-CG2 4.35Å; L286-V327 HydrophobicContact CD2-CB 4.31Å; L286-V327 HydrophobicContact CD2-CG1 3.75Å; L286-V327 HydrophobicContact CD2-CG2 3.76Å; G319-V327 CarbonylContact O-C 3.57Å; G319-V327 WeakPolarHBondContact O-CA 3.29Å; V320-V327 HydrophobicContact CG2-CG2 4.14Å; V327-I338 CarbonylContact O-C 3.55Å; V327-I338 VanDerWaalsContact O-CA 3.31Å; V327-I338 WeakPolarHBondContact O-CA 3.25Å; V327-W339 HydrophobicContact CB-CB 4.36Å; V327-W339 PolarHBondContact N-O 2.8Å; V327-W339 PolarHBondContact O-N 3.47Å
328	A	98.6	Very high	97.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.7	167.6	0	0	0	0	0	109.9	M61 W63 L70 L318 G319 K337 I338	M61-A328 HydrophobicContact CE-CB 3.37Å; M61-A328 HydrophobicContact SD-CB 4.12Å; W63-A328 HydrophobicContact CZ2-CB 3.49Å; W63-A328 VanDerWaalsContact CZ2-CB 3.49Å; L70-A328 HydrophobicContact CD2-CB 4.28Å; L318-A328 CarbonylContact C-O 3.57Å; L318-A328 WeakPolarHBondContact CA-O 3.22Å; G319-A328 PolarHBondContact N-O 3Å; G319-A328 PolarHBondContact O-N 3.26Å; A328-K337 CarbonylContact C-O 3.58Å; A328-K337 VanDerWaalsContact CA-O 3.3Å; A328-K337 WeakPolarHBondContact CA-O 3.48Å; A328-I338 HydrophobicContact CB-CD1 3.61Å
329	T	98.8	Very high	97.8	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.9	166.5	57.4	0	0	0	0	108.9	C294 H311 V315 C317 L318 L336 K337 W339	C294-T329 HydrophobicContact CB-CG2 4.49Å; H311-T329 PolarHBondContact NE2-OG1 2.92Å; V315-T329 HydrophobicContact CG1-CG2 4.47Å; C317-T329 WeakPolarHBondContact O-CA 3.24Å; L318-T329 HydrophobicContact CB-CG2 4.18Å; T329-L336 CarbonylContact O-C 3.56Å; T329-L336 WeakPolarHBondContact O-CA 3.28Å; T329-K337 PolarHBondContact N-O 2.83Å; T329-K337 PolarHBondContact O-N 2.81Å; T329-W339 PolarHBondContact OG1-NE1 3.26Å
330	G	98.7	Very high	97.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.9	170.8	0	0	0	0	0	110.2	S316 C317	S316-G330 PolarHBondContact N-O 2.95Å; S316-G330 PolarHBondContact OG-O 2.75Å; C317-G330 PolarHBondContact N-O 3.34Å; C317-G330 PolarHBondContact O-N 3.39Å
331	S	98.8	Very high	97.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	163.8	-174.7	168	0	0	0	0	112.1	I58 H311 N313 R314 D333 S334 F335	I58-S331 WeakPolarHBondContact CB-O 3.42Å; I58-S331 PolarHBondContact N-O 2.85Å; H311-S331 VanDerWaalsContact CG-CB 3.46Å; H311-S331 WeakPolarHBondContact ND1-CB 3.26Å; N313-S331 PolarHBondContact O-OG 3.31Å; R314-S331 VanDerWaalsContact O-CA 3.3Å; R314-S331 WeakPolarHBondContact O-CA 3.46Å; R314-S331 WeakPolarHBondContact O-CB 3.41Å; R314-S331 PolarHBondContact O-OG 3.06Å; S331-D333 VanDerWaalsContact CB-OD1 3.3Å; S331-D333 WeakPolarHBondContact CB-OD1 3.32Å; S331-D333 PolarHBondContact O-N 2.98Å; S331-D333 PolarHBondContact OG-N 2.87Å; S331-D333 VanDerWaalsContact OG-N 3.16Å; S331-D333 PolarHBondContact OG-OD1 3.32Å; S331-S334 PolarHBondContact O-N 3.27Å; S331-F335 PolarHBondContact N-O 3.28Å
332	W	98.6	Very high	97.4	Very high	52 Å²	52	32.6 Å²	32.6	20%	0.197	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9	169.7	-77.2	13.9	0	0	0	114.1	K57 Y59 N313 R314 S334	K57-W332 HydrophobicContact CB-CB 4.21Å; K57-W332 HydrophobicContact CB-CD2 4.49Å; K57-W332 HydrophobicContact CB-CG 3.9Å; K57-W332 HydrophobicContact CD-CB 4.31Å; K57-W332 HydrophobicContact CD-CD2 3.67Å; K57-W332 HydrophobicContact CD-CE3 3.97Å; K57-W332 HydrophobicContact CD-CG 3.86Å; K57-W332 HydrophobicContact CG-CB 3.89Å; K57-W332 HydrophobicContact CG-CD2 4.19Å; K57-W332 HydrophobicContact CG-CG 3.83Å; Y59-W332 HydrophobicContact CE2-CZ2 4.29Å; Y59-W332 AromaticContact CE2-NE1 3.62Å; Y59-W332 AromaticContact CZ-CZ2 3.86Å; Y59-W332 AromaticContact CZ-NE1 3.94Å; Y59-W332 WeakPolarHBondContact OH-CZ2 3.26Å; N313-W332 HydrophobicContact CB-CB 3.91Å; R314-W332 VanDerWaalsContact CD-CE2 3.47Å; R314-W332 HydrophobicContact CG-CB 4.04Å; R314-W332 HydrophobicContact CG-CD2 3.38Å; R314-W332 HydrophobicContact CG-CE3 3.57Å; R314-W332 HydrophobicContact CG-CG 3.57Å; R314-W332 HydrophobicContact CG-CZ2 4.49Å; R314-W332 HydrophobicContact CG-CZ3 4.19Å; R314-W332 PolarHBondContact O-N 2.97Å; R314-W332 VanDerWaalsContact O-N 3.12Å; W332-S334 PolarHBondContact O-N 2.74Å
333	D	98.2	Very high	97.6	Very high	21 Å²	21	31.1 Å²	31.1	11%	0.112	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	3.5	170.3	72.1	5.6	0	0	0	114.2	H311 D312 N313 S331 F335	H311-D333 WeakPolarHBondContact CA-OD2 3.18Å; H311-D333 WeakPolarHBondContact CB-OD2 3.2Å; H311-D333 IonicContact CE1-OD1 2.84Å; H311-D333 IonicContact CE1-OD2 3.93Å; H311-D333 IonicContact CG-OD2 2.87Å; H311-D333 IonicContact ND1-OD1 2.76Å; H311-D333 PolarHBondContact ND1-OD1 3.43Å; H311-D333 IonicContact ND1-OD2 3.37Å; H311-D333 PolarHBondContact ND1-OD2 3.14Å; D312-D333 HydrophobicContact CB-CB 4.39Å; D312-D333 PolarHBondContact N-OD2 2.78Å; N313-D333 HydrophobicContact CB-CB 4.11Å; S331-D333 VanDerWaalsContact CB-OD1 3.3Å; S331-D333 WeakPolarHBondContact CB-OD1 3.32Å; S331-D333 PolarHBondContact O-N 2.98Å; S331-D333 PolarHBondContact OG-N 2.87Å; S331-D333 VanDerWaalsContact OG-N 3.16Å; S331-D333 PolarHBondContact OG-OD1 3.32Å; D333-F335 VanDerWaalsContact C-N 3.29Å; D333-F335 HydrophobicContact CB-CD2 4.21Å; D333-F335 VanDerWaalsContact O-CD2 3.22Å; D333-F335 WeakPolarHBondContact O-CD2 3.31Å; D333-F335 WeakPolarHBondContact O-CE2 3.27Å; D333-F335 PolarHBondContact O-N 3.37Å; D333-F335 WeakPolarHBondContact OD1-CB 3.4Å; D333-F335 PolarHBondContact OD1-N 2.82Å
334	S	98.2	Very high	97.7	Very high	23 Å²	23	29.1 Å²	29.1	16%	0.161	16%	0.156	C	C	.	.	S	Bend	trans	71.7	8.1	-178.7	76.2	0	0	0	0	116.2	A56 I58 S331 W332	A56-S334 WeakPolarHBondContact O-CA 3.38Å; A56-S334 WeakPolarHBondContact O-CB 3.36Å; I58-S334 WeakPolarHBondContact CD1-O 3.47Å; S331-S334 PolarHBondContact O-N 3.27Å; W332-S334 PolarHBondContact O-N 2.74Å
335	F	98.4	Very high	97.8	Very high	62 Å²	62	28.6 Å²	28.6	27%	0.272	14%	0.142	S	C	.	.			trans	-107.4	148.1	178	-58.9	-65.5	0	0	0	112.7	T50 R52 I58 H311 S331 D333	T50-F335 HydrophobicContact CG2-CB 4.27Å; T50-F335 HydrophobicContact CG2-CD1 4.13Å; T50-F335 HydrophobicContact CG2-CG 4.35Å; R52-F335 HydrophobicContact CB-CE1 4.4Å; R52-F335 HydrophobicContact CG-CD1 3.85Å; R52-F335 HydrophobicContact CG-CE1 3.77Å; I58-F335 VanDerWaalsContact CD1-C 3.5Å; I58-F335 WeakPolarHBondContact CD1-O 3.25Å; H311-F335 PolarHBondContact CE1-O 2.8Å; S331-F335 PolarHBondContact N-O 3.28Å; D333-F335 VanDerWaalsContact C-N 3.29Å; D333-F335 HydrophobicContact CB-CD2 4.21Å; D333-F335 VanDerWaalsContact O-CD2 3.22Å; D333-F335 WeakPolarHBondContact O-CD2 3.31Å; D333-F335 WeakPolarHBondContact O-CE2 3.27Å; D333-F335 PolarHBondContact O-N 3.37Å; D333-F335 WeakPolarHBondContact OD1-CB 3.4Å; D333-F335 PolarHBondContact OD1-N 2.82Å
336	L	98.6	Very high	97.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	140	157.8	-58.1	93	0	0	0	109.9	T50 L51 I58 M61 L70 W82 T329	T50-L336 CarbonylContact C-O 3.56Å; T50-L336 WeakPolarHBondContact CA-O 3.46Å; L51-L336 HydrophobicContact CB-CB 4.09Å; L51-L336 HydrophobicContact CB-CD1 4.42Å; L51-L336 HydrophobicContact CD1-CB 4.09Å; L51-L336 HydrophobicContact CG-CB 4.29Å; L51-L336 PolarHBondContact N-O 2.93Å; L51-L336 PolarHBondContact O-N 2.89Å; I58-L336 HydrophobicContact CD1-CD1 3.44Å; I58-L336 VanDerWaalsContact CD1-CD1 3.44Å; I58-L336 HydrophobicContact CD1-CG 3.87Å; I58-L336 HydrophobicContact CG1-CD1 4.44Å; M61-L336 HydrophobicContact CB-CD2 3.91Å; M61-L336 HydrophobicContact CG-CD2 4.36Å; L70-L336 HydrophobicContact CD1-CD2 3.88Å; W82-L336 HydrophobicContact CZ2-CD1 4.37Å; T329-L336 CarbonylContact O-C 3.56Å; T329-L336 WeakPolarHBondContact O-CA 3.28Å
337	K	98.6	Very high	98.1	Very high	33 Å²	33	23.1 Å²	23.1	14%	0.143	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.2	176.9	-67.3	-178.1	-170.6	-129.7	0	109.9	T47 R49 T50 G310 A328 T329 W339	T47-K337 HydrophobicContact CG2-CB 3.99Å; T47-K337 HydrophobicContact CG2-CD 4.28Å; T47-K337 HydrophobicContact CG2-CG 4.12Å; R49-K337 WeakPolarHBondContact O-CA 3.37Å; T50-K337 HydrophobicContact CG2-CG 4.42Å; G310-K337 WeakPolarHBondContact O-CE 3.47Å; G310-K337 PolarHBondContact O-NZ 3.44Å; A328-K337 CarbonylContact C-O 3.58Å; A328-K337 VanDerWaalsContact CA-O 3.3Å; A328-K337 WeakPolarHBondContact CA-O 3.48Å; T329-K337 PolarHBondContact N-O 2.83Å; T329-K337 PolarHBondContact O-N 2.81Å; K337-W339 HydrophobicContact CB-CZ2 3.95Å; K337-W339 HydrophobicContact CD-CH2 4.47Å; K337-W339 HydrophobicContact CD-CZ2 3.92Å; K337-W339 PolarHBondContact O-NE1 3.39Å
338	I	98.5	Very high	98.1	Very high	14 Å²	14	24.4 Å²	24.4	7%	0.072	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.7	173.9	-49.1	-58.2	0	0	0	108.6	T47 R48 R49 L51 W63 L70 T84 V327 A328	T47-I338 CarbonylContact C-O 3.57Å; T47-I338 WeakPolarHBondContact CA-O 3.39Å; R48-I338 PolarHBondContact N-O 3.22Å; R49-I338 HydrophobicContact CB-CB 4.04Å; R49-I338 HydrophobicContact CB-CG1 4.01Å; R49-I338 PolarHBondContact N-O 3.2Å; R49-I338 PolarHBondContact O-N 3.37Å; L51-I338 HydrophobicContact CD1-CD1 4.45Å; W63-I338 HydrophobicContact CH2-CD1 3.83Å; W63-I338 HydrophobicContact CZ2-CD1 3.83Å; L70-I338 HydrophobicContact CD2-CD1 3.98Å; T84-I338 HydrophobicContact CG2-CD1 4.17Å; V327-I338 CarbonylContact O-C 3.55Å; V327-I338 VanDerWaalsContact O-CA 3.31Å; V327-I338 WeakPolarHBondContact O-CA 3.25Å; A328-I338 HydrophobicContact CB-CD1 3.61Å
339	W	98.4	Very high	98	Very high	10 Å²	10	26.4 Å²	26.4	4%	0.038	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.2	-175.8	-47.7	83.4	0	0	0	110.5	M45 R46 T47 L308 V327 T329 K337	M45-W339 HydrophobicContact CB-CB 4.12Å; M45-W339 HydrophobicContact CE-CB 4.48Å; M45-W339 HydrophobicContact SD-CB 4.48Å; R46-W339 WeakPolarHBondContact O-CA 3.43Å; T47-W339 WeakPolarHBondContact OG1-CH2 3.47Å; T47-W339 WeakPolarHBondContact OG1-CZ3 3.24Å; L308-W339 HydrophobicContact CB-CD2 4.37Å; L308-W339 HydrophobicContact CB-CE3 4.37Å; L308-W339 HydrophobicContact CB-CH2 4.21Å; L308-W339 HydrophobicContact CB-CZ2 4.22Å; L308-W339 HydrophobicContact CB-CZ3 4.28Å; L308-W339 HydrophobicContact CD1-CB 4.44Å; L308-W339 HydrophobicContact CD1-CD2 4.15Å; L308-W339 HydrophobicContact CD1-CG 4.03Å; L308-W339 HydrophobicContact CD2-CD2 4.18Å; L308-W339 HydrophobicContact CD2-CE3 3.88Å; L308-W339 HydrophobicContact CD2-CZ3 4.34Å; L308-W339 HydrophobicContact CG-CD2 4.48Å; V327-W339 HydrophobicContact CB-CB 4.36Å; V327-W339 PolarHBondContact N-O 2.8Å; V327-W339 PolarHBondContact O-N 3.47Å; T329-W339 PolarHBondContact OG1-NE1 3.26Å; K337-W339 HydrophobicContact CB-CZ2 3.95Å; K337-W339 HydrophobicContact CD-CH2 4.47Å; K337-W339 HydrophobicContact CD-CZ2 3.92Å; K337-W339 PolarHBondContact O-NE1 3.39Å
340	N	92.3	Very high	97.9	Very high	101 Å²	101	28.7 Å²	28.7	54%	0.54	14%	0.14	S	C	.	.			trans	-159.2	0	162.7	74.4	10.3	0	0	0	113.4	R46 R48 M325	R46-N340 PolarHBondContact N-O 3.43Å; R46-N340 VanDerWaalsContact N-O 3.14Å; R46-N340 PolarHBondContact O-N 2.86Å; R48-N340 WeakPolarHBondContact CD-OD1 3.47Å; R48-N340 WeakPolarHBondContact CG-OD1 3.3Å; R48-N340 PolarHBondContact NE-O 3.01Å; R48-N340 PolarHBondContact NE-OD1 2.87Å; R48-N340 PolarHBondContact NH2-O 3.44Å; M325-N340 VanDerWaalsContact O-CB 3.26Å; M325-N340 WeakPolarHBondContact O-CB 3.31Å; M325-N340 PolarHBondContact O-ND2 2.71Å

Retrieved 340 of 340 residues in 543.4 ms (Link to these results)

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