A0A077ZCH3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZCH3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 296 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	I	41.8	Very low	49.9	Very low	105 Å²	105	78.1 Å²	78.1	54%	0.538	37%	0.372	S	S	.	.				0	120.6	0	-63.1	172.6	0	0	0	108	L3 F9	I1-L3 HydrophobicContact CG2-CD2 3.85Å; I1-L3 HydrophobicContact CG2-CG 4.01Å; I1-F9 HydrophobicContact CB-CE2 4.49Å; I1-F9 HydrophobicContact CD1-CE2 4.44Å; I1-F9 HydrophobicContact CG1-CE2 4.29Å; I1-F9 HydrophobicContact CG2-CD2 3.9Å; I1-F9 HydrophobicContact CG2-CE2 3.5Å; I1-F9 HydrophobicContact CG2-CZ 4.49Å
2	I	49.4	Very low	51.3	Low	54 Å²	54	72.8 Å²	72.8	28%	0.277	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.2	173.7	-55.1	175.1	0	0	0	107.7	I10 L133	I2-I10 HydrophobicContact CG2-CD1 4.2Å; I2-I10 PolarHBondContact O-N 3.46Å; I2-L133 HydrophobicContact CD1-CD1 4.03Å; I2-L133 HydrophobicContact CG2-CD1 3.74Å
3	L	46.2	Very low	52.5	Low	108 Å²	108	67.5 Å²	67.5	57%	0.565	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	118.4	176.4	-63.4	176.6	0	0	0	108.9	I1 F9	I1-L3 HydrophobicContact CG2-CD2 3.85Å; I1-L3 HydrophobicContact CG2-CG 4.01Å; L3-F9 HydrophobicContact CD2-CD2 3.97Å
4	G	46.9	Very low	53.5	Low	15 Å²	15	63.2 Å²	63.2	16%	0.155	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	170.4	172.3	0	0	0	0	0	112	R6 D7 C8	G4-R6 PolarHBondContact O-N 2.82Å; G4-D7 PolarHBondContact O-N 2.99Å; G4-C8 PolarHBondContact N-O 2.88Å; G4-C8 PolarHBondContact O-N 2.92Å
5	K	40.4	Very low	54.5	Low	183 Å²	183	59.5 Å²	59.5	80%	0.796	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	139	173.7	-157	173.8	-175.3	177.5	0	109.6
6	R	46.2	Very low	55.5	Low	200 Å²	200	55.8 Å²	55.8	76%	0.755	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	37.6	-173.5	-50.7	175.9	175.5	144.2	-2.8	114.4	G4 C8	G4-R6 PolarHBondContact O-N 2.82Å; R6-C8 PolarHBondContact O-N 3.22Å; R6-C8 VanDerWaalsContact O-N 3.13Å
7	D	49.8	Very low	56.3	Low	75 Å²	75	52.6 Å²	52.6	40%	0.401	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	32.5	177	-57.4	-42.2	0	0	0	113.7	G4 F9 F294	G4-D7 PolarHBondContact O-N 2.99Å; D7-F9 PolarHBondContact O-N 3.12Å; D7-F9 VanDerWaalsContact O-N 3.12Å; D7-F294 WeakPolarHBondContact OD2-CE2 3.31Å; D7-F294 WeakPolarHBondContact OD2-CZ 2.9Å
8	C	49.2	Very low	57	Low	33 Å²	33	50.3 Å²	50.3	22%	0.223	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	107.8	175.6	-173.6	0	0	0	0	108.9	G4 R6 I10 T135	G4-C8 PolarHBondContact N-O 2.88Å; G4-C8 PolarHBondContact O-N 2.92Å; R6-C8 PolarHBondContact O-N 3.22Å; R6-C8 VanDerWaalsContact O-N 3.13Å; C8-I10 PolarHBondContact O-N 3Å; C8-T135 HydrophobicContact CB-CG2 4.22Å
9	F	56.7	Low	57.7	Low	80 Å²	80	48 Å²	48	35%	0.351	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.6	176.9	-176	-92.1	0	0	0	110.3	I1 L3 D7 T11	I1-F9 HydrophobicContact CB-CE2 4.49Å; I1-F9 HydrophobicContact CD1-CE2 4.44Å; I1-F9 HydrophobicContact CG1-CE2 4.29Å; I1-F9 HydrophobicContact CG2-CD2 3.9Å; I1-F9 HydrophobicContact CG2-CE2 3.5Å; I1-F9 HydrophobicContact CG2-CZ 4.49Å; L3-F9 HydrophobicContact CD2-CD2 3.97Å; D7-F9 PolarHBondContact O-N 3.12Å; D7-F9 VanDerWaalsContact O-N 3.12Å; F9-T11 HydrophobicContact CD1-CG2 4.38Å; F9-T11 HydrophobicContact CE1-CG2 4.14Å
10	I	58	Low	58.3	Low	4 Å²	4	45.7 Å²	45.7	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.6	174.9	-64	147.1	0	0	0	107.8	I2 C8 D14 L133 I138	I2-I10 HydrophobicContact CG2-CD1 4.2Å; I2-I10 PolarHBondContact O-N 3.46Å; C8-I10 PolarHBondContact O-N 3Å; I10-D14 HydrophobicContact CG2-CB 4.17Å; I10-L133 HydrophobicContact CD1-CB 3.66Å; I10-L133 HydrophobicContact CD1-CD1 4.06Å; I10-L133 HydrophobicContact CD1-CD2 3.95Å; I10-L133 HydrophobicContact CD1-CG 4.11Å; I10-L133 HydrophobicContact CG2-CD2 4.22Å; I10-I138 HydrophobicContact CD1-CD1 4.41Å; I10-I138 HydrophobicContact CG1-CD1 4.16Å
11	T	64.2	Low	58.9	Low	2 Å²	2	46.9 Å²	46.9	1%	0.012	23%	0.23	C	C	.	.			trans	-66.2	155.2	177.7	75.9	0	0	0	0	110	F9 S13 D14 S15 D271	F9-T11 HydrophobicContact CD1-CG2 4.38Å; F9-T11 HydrophobicContact CE1-CG2 4.14Å; T11-S13 PolarHBondContact O-N 3.35Å; T11-S13 PolarHBondContact OG1-N 3.46Å; T11-D14 WeakPolarHBondContact CG2-OD2 3.16Å; T11-D14 PolarHBondContact O-N 3.24Å; T11-D14 WeakPolarHBondContact OG1-CB 3.49Å; T11-D14 PolarHBondContact OG1-N 3.27Å; T11-D14 PolarHBondContact OG1-OD2 3.49Å; T11-S15 PolarHBondContact O-N 2.72Å; T11-S15 PolarHBondContact O-OG 3.32Å; T11-D271 WeakPolarHBondContact CG2-OD2 3.46Å
12	A	67	Low	60.2	Low	14 Å²	14	42.6 Å²	42.6	12%	0.116	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-26	175.4	0	0	0	0	0	113	S15 H16 C90	A12-S15 WeakPolarHBondContact CA-OG 3.41Å; A12-S15 PolarHBondContact O-OG 3.31Å; A12-H16 WeakPolarHBondContact O-CB 3.28Å; A12-H16 PolarHBondContact O-N 3.48Å; A12-C90 HydrophobicContact CB-CB 4.02Å; A12-C90 WeakPolarHBondContact CB-O 3.45Å
13	S	66.5	Low	61.1	Low	4 Å²	4	40 Å²	40	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-70.4	-46.3	174.3	-51.2	0	0	0	0	110.9	T11 H16 A17 T44 A45 A47	T11-S13 PolarHBondContact O-N 3.35Å; T11-S13 PolarHBondContact OG1-N 3.46Å; S13-H16 PolarHBondContact O-N 3.34Å; S13-A17 PolarHBondContact O-N 3.32Å; S13-T44 WeakPolarHBondContact OG-CG2 3.4Å; S13-A45 VanDerWaalsContact CB-CB 3.49Å; S13-A45 WeakPolarHBondContact OG-CB 3.08Å; S13-A45 PolarHBondContact OG-N 2.89Å; S13-A47 WeakPolarHBondContact O-CB 3.12Å
14	D	66.8	Low	62.1	Low	8 Å²	8	39.6 Å²	39.6	4%	0.043	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-38.5	179	-62.6	-41.8	0	0	0	111.2	I10 T11 H16 A17 V18 L145 S146	I10-D14 HydrophobicContact CG2-CB 4.17Å; T11-D14 WeakPolarHBondContact CG2-OD2 3.16Å; T11-D14 PolarHBondContact O-N 3.24Å; T11-D14 WeakPolarHBondContact OG1-CB 3.49Å; T11-D14 PolarHBondContact OG1-N 3.27Å; T11-D14 PolarHBondContact OG1-OD2 3.49Å; D14-H16 VanDerWaalsContact C-N 3.29Å; D14-H16 PolarHBondContact O-N 3.41Å; D14-A17 PolarHBondContact O-N 3Å; D14-A17 VanDerWaalsContact O-N 3.17Å; D14-V18 WeakPolarHBondContact O-CG2 3.46Å; D14-V18 PolarHBondContact O-N 2.99Å; D14-L145 WeakPolarHBondContact OD2-CD2 3.5Å; D14-S146 WeakPolarHBondContact OD1-CB 3.33Å; D14-S146 PolarHBondContact OD1-N 2.97Å; D14-S146 PolarHBondContact OD2-N 2.85Å
15	S	67.6	Low	63.1	Low	8 Å²	8	41.8 Å²	41.8	6%	0.056	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-40.2	174.8	68.7	0	0	0	0	111.6	T11 A12 V18 L19	T11-S15 PolarHBondContact O-N 2.72Å; T11-S15 PolarHBondContact O-OG 3.32Å; A12-S15 WeakPolarHBondContact CA-OG 3.41Å; A12-S15 PolarHBondContact O-OG 3.31Å; S15-V18 PolarHBondContact O-N 2.78Å; S15-L19 WeakPolarHBondContact O-CB 3.37Å; S15-L19 WeakPolarHBondContact O-CG 3.43Å; S15-L19 PolarHBondContact O-N 3Å
16	H	70.6	Confident	64.2	Low	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-42.4	174.5	-173.9	-158.6	0	0	0	111.5	A12 S13 D14 L19 A20 A39 V48 I81 V93	A12-H16 WeakPolarHBondContact O-CB 3.28Å; A12-H16 PolarHBondContact O-N 3.48Å; S13-H16 PolarHBondContact O-N 3.34Å; D14-H16 VanDerWaalsContact C-N 3.29Å; D14-H16 PolarHBondContact O-N 3.41Å; H16-L19 PolarHBondContact O-N 2.69Å; H16-A20 WeakPolarHBondContact O-CB 3.33Å; H16-A20 PolarHBondContact O-N 3.38Å; H16-A39 PolarHBondContact CE1-O 3.01Å; H16-V48 HydrophobicContact CB-CG2 3.98Å; H16-V48 WeakPolarHBondContact ND1-CG2 3.44Å; H16-I81 WeakPolarHBondContact NE2-CG2 3.49Å; H16-I81 PolarHBondContact NE2-O 3.47Å; H16-V93 HydrophobicContact CB-CG2 3.93Å
17	A	69.5	Low	65.1	Low	1 Å²	1	30 Å²	30	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-65.1	-40.9	176.6	0	0	0	0	0	113.1	S13 D14 A20 D21 A47 V48 Q51	S13-A17 PolarHBondContact O-N 3.32Å; D14-A17 PolarHBondContact O-N 3Å; D14-A17 VanDerWaalsContact O-N 3.17Å; A17-A20 WeakPolarHBondContact O-CB 3.34Å; A17-A20 PolarHBondContact O-N 2.74Å; A17-D21 PolarHBondContact O-N 2.77Å; A17-A47 VanDerWaalsContact CB-C 3.44Å; A17-A47 HydrophobicContact CB-CB 3.53Å; A17-A47 WeakPolarHBondContact CB-O 3.3Å; A17-V48 HydrophobicContact CB-CG2 4.03Å; A17-Q51 HydrophobicContact CB-CG 4.32Å
18	V	68.8	Low	65.7	Low	12 Å²	12	31.6 Å²	31.6	7%	0.073	17%	0.172	C	C	.	.	H	α-helix	trans	-67	-40.9	177.3	172.6	0	0	0	0	111.1	D14 S15 A20 D21 S22 I132 L133	D14-V18 WeakPolarHBondContact O-CG2 3.46Å; D14-V18 PolarHBondContact O-N 2.99Å; S15-V18 PolarHBondContact O-N 2.78Å; V18-A20 VanDerWaalsContact C-N 3.28Å; V18-A20 PolarHBondContact O-N 2.83Å; V18-D21 PolarHBondContact O-N 2.87Å; V18-S22 VanDerWaalsContact O-CB 3.3Å; V18-S22 WeakPolarHBondContact O-CB 3.48Å; V18-S22 PolarHBondContact O-N 3.36Å; V18-S22 PolarHBondContact O-OG 2.92Å; V18-S22 VanDerWaalsContact O-OG 3.12Å; V18-I132 HydrophobicContact CG1-CG2 3.47Å; V18-I132 VanDerWaalsContact CG1-CG2 3.47Å; V18-L133 HydrophobicContact CB-CD2 3.82Å; V18-L133 HydrophobicContact CG1-CD2 3.57Å; V18-L133 HydrophobicContact CG1-CG 4.29Å; V18-L133 HydrophobicContact CG2-CD2 3.83Å
19	L	70.1	Confident	66.4	Low	6 Å²	6	30.8 Å²	30.8	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-39.2	173.2	-81	171.9	0	0	0	111.9	S15 H16 S22 I23 F26 V93 F95 T105 L129	S15-L19 WeakPolarHBondContact O-CB 3.37Å; S15-L19 WeakPolarHBondContact O-CG 3.43Å; S15-L19 PolarHBondContact O-N 3Å; H16-L19 PolarHBondContact O-N 2.69Å; L19-S22 PolarHBondContact O-N 2.94Å; L19-I23 PolarHBondContact O-N 3.28Å; L19-I23 VanDerWaalsContact O-N 3.12Å; L19-F26 HydrophobicContact CD2-CE2 3.95Å; L19-F26 HydrophobicContact CD2-CZ 3.68Å; L19-V93 HydrophobicContact CD1-CB 3.9Å; L19-V93 HydrophobicContact CD1-CG1 3.9Å; L19-V93 HydrophobicContact CD1-CG2 4.02Å; L19-F95 HydrophobicContact CD1-CZ 4.43Å; L19-T105 HydrophobicContact CD1-CG2 4.36Å; L19-L129 HydrophobicContact CD2-CD2 3.75Å; L19-L129 HydrophobicContact CG-CD2 4.19Å
20	A	70.3	Confident	66.9	Low	1 Å²	1	33.5 Å²	33.5	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-63.2	-46.3	176.2	0	0	0	0	0	112.2	H16 A17 V18 S22 I23 F38 V48	H16-A20 WeakPolarHBondContact O-CB 3.33Å; H16-A20 PolarHBondContact O-N 3.38Å; A17-A20 WeakPolarHBondContact O-CB 3.34Å; A17-A20 PolarHBondContact O-N 2.74Å; V18-A20 VanDerWaalsContact C-N 3.28Å; V18-A20 PolarHBondContact O-N 2.83Å; A20-S22 VanDerWaalsContact C-N 3.32Å; A20-S22 PolarHBondContact O-N 3.49Å; A20-I23 WeakPolarHBondContact O-CB 3.38Å; A20-I23 WeakPolarHBondContact O-CG2 3.43Å; A20-I23 PolarHBondContact O-N 3.45Å; A20-F38 VanDerWaalsContact CA-CE1 3.41Å; A20-F38 HydrophobicContact CB-CD1 3.77Å; A20-F38 HydrophobicContact CB-CE1 3.16Å; A20-F38 HydrophobicContact CB-CE2 4.15Å; A20-F38 HydrophobicContact CB-CG 4.49Å; A20-F38 HydrophobicContact CB-CZ 3.41Å; A20-F38 VanDerWaalsContact CB-CZ 3.41Å; A20-V48 HydrophobicContact CB-CG1 4.27Å
21	D	70.4	Confident	67.1	Low	71 Å²	71	40.1 Å²	40.1	38%	0.38	21%	0.212	S	C	.	.	H	α-helix	trans	-67.1	-34.2	178.4	-171.3	45.5	0	0	0	112.3	A17 V18 Q51	A17-D21 PolarHBondContact O-N 2.77Å; V18-D21 PolarHBondContact O-N 2.87Å; D21-Q51 HydrophobicContact CB-CG 4.31Å
22	S	70.3	Confident	67.1	Low	15 Å²	15	41.5 Å²	41.5	11%	0.105	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	9.8	-178.6	-59.1	0	0	0	0	114	V18 L19 A20 D24 T25 I132	V18-S22 VanDerWaalsContact O-CB 3.3Å; V18-S22 WeakPolarHBondContact O-CB 3.48Å; V18-S22 PolarHBondContact O-N 3.36Å; V18-S22 PolarHBondContact O-OG 2.92Å; V18-S22 VanDerWaalsContact O-OG 3.12Å; L19-S22 PolarHBondContact O-N 2.94Å; A20-S22 VanDerWaalsContact C-N 3.32Å; A20-S22 PolarHBondContact O-N 3.49Å; S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.47Å; S22-T25 WeakPolarHBondContact O-CB 3.32Å; S22-T25 WeakPolarHBondContact O-CG2 3.33Å; S22-T25 PolarHBondContact O-N 2.85Å; S22-T25 PolarHBondContact O-OG1 3.35Å; S22-I132 WeakPolarHBondContact OG-CG2 3.36Å
23	I	67.9	Low	66.7	Low	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-61	-35.9	-168.1	-160.8	177.4	0	0	0	113	L19 A20 T25 F26 F29 V35 F38 Y57 I81	L19-I23 PolarHBondContact O-N 3.28Å; L19-I23 VanDerWaalsContact O-N 3.12Å; A20-I23 WeakPolarHBondContact O-CB 3.38Å; A20-I23 WeakPolarHBondContact O-CG2 3.43Å; A20-I23 PolarHBondContact O-N 3.45Å; I23-T25 PolarHBondContact O-N 3.3Å; I23-T25 VanDerWaalsContact O-N 3.12Å; I23-F26 WeakPolarHBondContact O-CD2 3.3Å; I23-F26 PolarHBondContact O-N 3.4Å; I23-F29 HydrophobicContact CD1-CD1 4.38Å; I23-F29 HydrophobicContact CD1-CD2 4.27Å; I23-F29 HydrophobicContact CD1-CG 4.14Å; I23-F29 HydrophobicContact CG1-CB 3.91Å; I23-F29 HydrophobicContact CG1-CD1 4.36Å; I23-F29 HydrophobicContact CG1-CD2 3.49Å; I23-F29 VanDerWaalsContact CG1-CD2 3.49Å; I23-F29 HydrophobicContact CG1-CE2 4.2Å; I23-F29 HydrophobicContact CG1-CG 3.66Å; I23-V35 HydrophobicContact CD1-CB 4.5Å; I23-V35 HydrophobicContact CD1-CG1 3.51Å; I23-F38 HydrophobicContact CD1-CE1 4.3Å; I23-F38 HydrophobicContact CD1-CZ 4.17Å; I23-Y57 HydrophobicContact CG2-CE1 4.4Å; I23-Y57 WeakPolarHBondContact CG2-OH 3.17Å; I23-I81 HydrophobicContact CD1-CD1 3.31Å; I23-I81 HydrophobicContact CD1-CG1 4.41Å; I23-I81 HydrophobicContact CG1-CD1 4Å
24	D	67.4	Low	66.3	Low	98 Å²	98	48.4 Å²	48.4	52%	0.524	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-68.6	-9.4	178.8	-71.7	-13.7	0	0	0	113.1	S22 K30	S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.47Å; D24-K30 WeakPolarHBondContact O-CD 3.35Å; D24-K30 WeakPolarHBondContact O-CE 3.4Å; D24-K30 WeakPolarHBondContact O-CG 3.29Å
25	T	68	Low	65.8	Low	61 Å²	61	48.8 Å²	48.8	37%	0.374	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-80.2	-25	176.4	67.1	0	0	0	0	112.4	S22 I23 F128	S22-T25 WeakPolarHBondContact O-CB 3.32Å; S22-T25 WeakPolarHBondContact O-CG2 3.33Å; S22-T25 PolarHBondContact O-N 2.85Å; S22-T25 PolarHBondContact O-OG1 3.35Å; I23-T25 PolarHBondContact O-N 3.3Å; I23-T25 VanDerWaalsContact O-N 3.12Å; T25-F128 HydrophobicContact CG2-CZ 4.45Å; T25-F128 VanDerWaalsContact OG1-CE1 3.22Å; T25-F128 WeakPolarHBondContact OG1-CE1 3Å
26	F	64.1	Low	65.4	Low	43 Å²	43	53.2 Å²	53.2	19%	0.189	28%	0.284	C	S	.	.	S	Bend	trans	-80.4	123.8	179.9	-59.1	-82.5	0	0	0	110.6	L19 I23 Y28 F29 K30 F128	L19-F26 HydrophobicContact CD2-CE2 3.95Å; L19-F26 HydrophobicContact CD2-CZ 3.68Å; I23-F26 WeakPolarHBondContact O-CD2 3.3Å; I23-F26 PolarHBondContact O-N 3.4Å; F26-Y28 PolarHBondContact O-N 3.36Å; F26-F29 HydrophobicContact CB-CD2 3.67Å; F26-F29 HydrophobicContact CB-CE2 4.29Å; F26-F29 AromaticContact CD2-CD2 3.97Å; F26-F29 HydrophobicContact CD2-CD2 3.97Å; F26-F29 HydrophobicContact CD2-CE2 4.32Å; F26-F29 HydrophobicContact CG-CD2 4.09Å; F26-F29 HydrophobicContact CG-CE2 4.39Å; F26-F29 PolarHBondContact O-N 2.92Å; F26-K30 PolarHBondContact O-N 3.21Å; F26-F128 AromaticContact CE1-CD1 3.97Å; F26-F128 HydrophobicContact CE1-CD1 3.97Å; F26-F128 HydrophobicContact CE1-CE1 4.29Å; F26-F128 HydrophobicContact CZ-CD1 4.29Å; F26-F128 HydrophobicContact CZ-CE1 4.42Å
27	S	63.9	Low	65.3	Low	92 Å²	92	53.6 Å²	53.6	64%	0.643	29%	0.286	S	S	*	.	H	α-helix	trans	-55.1	-30	179.2	-51.3	0	0	0	0	113.6
28	Y	62.3	Low	65.3	Low	109 Å²	109	53.6 Å²	53.6	43%	0.427	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-44.8	174.9	-178.6	-97.2	0	0	0	111.8	F26 L32 R79	F26-Y28 PolarHBondContact O-N 3.36Å; Y28-L32 HydrophobicContact CD1-CD1 3.74Å; Y28-L32 HydrophobicContact CE1-CD1 3.49Å; Y28-L32 VanDerWaalsContact CE1-CD1 3.49Å; Y28-L32 HydrophobicContact CG-CD1 4.41Å; Y28-L32 WeakPolarHBondContact O-CD1 3.14Å; Y28-L32 VanDerWaalsContact O-CG 3.24Å; Y28-L32 WeakPolarHBondContact O-CG 3.33Å; Y28-R79 PolarHBondContact OH-NH1 3.45Å
29	F	64.8	Low	65.3	Low	16 Å²	16	53 Å²	53	7%	0.07	28%	0.282	C	S	.	.	H	α-helix	trans	-82.8	-29.3	-177.9	-60.6	-58.8	0	0	0	113.1	I23 F26 N31 L32 V35 F95	I23-F29 HydrophobicContact CD1-CD1 4.38Å; I23-F29 HydrophobicContact CD1-CD2 4.27Å; I23-F29 HydrophobicContact CD1-CG 4.14Å; I23-F29 HydrophobicContact CG1-CB 3.91Å; I23-F29 HydrophobicContact CG1-CD1 4.36Å; I23-F29 HydrophobicContact CG1-CD2 3.49Å; I23-F29 VanDerWaalsContact CG1-CD2 3.49Å; I23-F29 HydrophobicContact CG1-CE2 4.2Å; I23-F29 HydrophobicContact CG1-CG 3.66Å; F26-F29 HydrophobicContact CB-CD2 3.67Å; F26-F29 HydrophobicContact CB-CE2 4.29Å; F26-F29 AromaticContact CD2-CD2 3.97Å; F26-F29 HydrophobicContact CD2-CD2 3.97Å; F26-F29 HydrophobicContact CD2-CE2 4.32Å; F26-F29 HydrophobicContact CG-CD2 4.09Å; F26-F29 HydrophobicContact CG-CE2 4.39Å; F26-F29 PolarHBondContact O-N 2.92Å; F29-N31 PolarHBondContact O-N 2.88Å; F29-N31 VanDerWaalsContact O-N 3.11Å; F29-L32 HydrophobicContact CD1-CD1 4.05Å; F29-L32 PolarHBondContact O-N 2.95Å; F29-V35 HydrophobicContact CD1-CG2 3.69Å; F29-V35 HydrophobicContact CE1-CG2 4.45Å; F29-F95 HydrophobicContact CE1-CD1 4.08Å; F29-F95 AromaticContact CE2-CD1 3.89Å; F29-F95 HydrophobicContact CE2-CD1 3.89Å; F29-F95 AromaticContact CE2-CE1 3.59Å; F29-F95 HydrophobicContact CE2-CE1 3.59Å; F29-F95 HydrophobicContact CE2-CZ 4.39Å; F29-F95 AromaticContact CZ-CD1 3.23Å; F29-F95 HydrophobicContact CZ-CD1 3.23Å; F29-F95 AromaticContact CZ-CE1 3.45Å; F29-F95 HydrophobicContact CZ-CE1 3.45Å; F29-F95 VanDerWaalsContact CZ-CE1 3.45Å; F29-F95 HydrophobicContact CZ-CG 4.11Å; F29-F95 HydrophobicContact CZ-CZ 4.47Å
30	K	66.4	Low	65.3	Low	137 Å²	137	52.8 Å²	52.8	60%	0.596	28%	0.281	S	S	*	.	H	α-helix	trans	-52.1	-36.6	176.2	-81.2	-171	177.2	-178.8	0	114.2	D24 F26	D24-K30 WeakPolarHBondContact O-CD 3.35Å; D24-K30 WeakPolarHBondContact O-CE 3.4Å; D24-K30 WeakPolarHBondContact O-CG 3.29Å; F26-K30 PolarHBondContact O-N 3.21Å
31	N	63.4	Low	65.1	Low	143 Å²	143	52.7 Å²	52.7	77%	0.765	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-1	-175.9	-63.9	-25.5	0	0	0	112.9	F29	F29-N31 PolarHBondContact O-N 2.88Å; F29-N31 VanDerWaalsContact O-N 3.11Å
32	L	62.6	Low	64.8	Low	31 Å²	31	50.1 Å²	50.1	16%	0.162	27%	0.266	C	S	.	.			trans	-100.3	96.5	-179.5	-64.5	172	0	0	0	108.3	Y28 F29 D34 V35 R79	Y28-L32 HydrophobicContact CD1-CD1 3.74Å; Y28-L32 HydrophobicContact CE1-CD1 3.49Å; Y28-L32 VanDerWaalsContact CE1-CD1 3.49Å; Y28-L32 HydrophobicContact CG-CD1 4.41Å; Y28-L32 WeakPolarHBondContact O-CD1 3.14Å; Y28-L32 VanDerWaalsContact O-CG 3.24Å; Y28-L32 WeakPolarHBondContact O-CG 3.33Å; F29-L32 HydrophobicContact CD1-CD1 4.05Å; F29-L32 PolarHBondContact O-N 2.95Å; L32-D34 WeakPolarHBondContact CA-OD1 3.14Å; L32-D34 WeakPolarHBondContact CB-OD1 3.5Å; L32-D34 PolarHBondContact O-N 3.31Å; L32-V35 HydrophobicContact CB-CG2 3.77Å; L32-V35 HydrophobicContact CD1-CG2 4.21Å; L32-R79 VanDerWaalsContact CD1-NH1 3.3Å; L32-R79 VanDerWaalsContact CD2-NH2 3.27Å
33	S	59.2	Low	64.3	Low	115 Å²	115	52.2 Å²	52.2	80%	0.804	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-4	176.2	50.6	0	0	0	0	114.3
34	D	58.6	Low	64.2	Low	49 Å²	49	52.3 Å²	52.3	26%	0.262	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	4	-163.2	56.5	-43.9	0	0	0	114.4	L32 K36 R79	L32-D34 WeakPolarHBondContact CA-OD1 3.14Å; L32-D34 WeakPolarHBondContact CB-OD1 3.5Å; L32-D34 PolarHBondContact O-N 3.31Å; D34-K36 VanDerWaalsContact C-N 3.34Å; D34-K36 PolarHBondContact O-N 3.42Å; D34-R79 IonicContact OD2-NE 3.49Å; D34-R79 PolarHBondContact OD2-NE 3.25Å
35	V	55.2	Low	64.2	Low	16 Å²	16	47.6 Å²	47.6	10%	0.097	25%	0.248	C	C	.	.			trans	-75.2	93.9	168.4	-173	0	0	0	0	107.9	I23 F29 L32 Y57 R79	I23-V35 HydrophobicContact CD1-CB 4.5Å; I23-V35 HydrophobicContact CD1-CG1 3.51Å; F29-V35 HydrophobicContact CD1-CG2 3.69Å; F29-V35 HydrophobicContact CE1-CG2 4.45Å; L32-V35 HydrophobicContact CB-CG2 3.77Å; L32-V35 HydrophobicContact CD1-CG2 4.21Å; V35-Y57 WeakPolarHBondContact O-CD1 3.37Å; V35-Y57 WeakPolarHBondContact O-CE1 3.4Å; V35-R79 HydrophobicContact CG2-CB 4.21Å
36	K	59.9	Low	64.3	Low	101 Å²	101	45 Å²	45	44%	0.439	23%	0.232	S	C	.	.			trans	-111.7	-15.1	-172.8	-72.3	-168.8	177.2	-175.2	0	114.1	D34 Y57 A58 Y78	D34-K36 VanDerWaalsContact C-N 3.34Å; D34-K36 PolarHBondContact O-N 3.42Å; K36-Y57 CarbonylContact O-C 3.56Å; K36-Y57 WeakPolarHBondContact O-CA 3.11Å; K36-Y57 WeakPolarHBondContact O-CB 3.14Å; K36-A58 PolarHBondContact O-N 3.11Å; K36-Y78 HydrophobicContact CB-CD1 4.38Å; K36-Y78 HydrophobicContact CD-CE1 4.36Å
37	D	67.9	Low	64.5	Low	8 Å²	8	43 Å²	43	4%	0.043	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	144.7	-165	-55.3	-67.9	0	0	0	112.8	A58 T59 W80	D37-A58 WeakPolarHBondContact OD1-CB 3.42Å; D37-T59 WeakPolarHBondContact CA-O 3.46Å; D37-T59 WeakPolarHBondContact CB-O 3.34Å; D37-T59 WeakPolarHBondContact OD1-CA 3.18Å; D37-T59 WeakPolarHBondContact OD1-CB 3.47Å; D37-T59 PolarHBondContact OD1-N 2.93Å; D37-T59 PolarHBondContact OD1-OG1 3.41Å; D37-W80 HydrophobicContact CB-CD2 4.24Å; D37-W80 HydrophobicContact CB-CE3 3.66Å; D37-W80 HydrophobicContact CB-CH2 3.36Å; D37-W80 HydrophobicContact CB-CZ2 3.98Å; D37-W80 HydrophobicContact CB-CZ3 3.19Å
38	F	70.4	Confident	64.9	Low	1 Å²	1	38.7 Å²	38.7	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	156	175.5	-66.5	-88.3	0	0	0	109.6	A20 I23 V48 V52 Y57 T59 I60 C61 W80 I81	A20-F38 VanDerWaalsContact CA-CE1 3.41Å; A20-F38 HydrophobicContact CB-CD1 3.77Å; A20-F38 HydrophobicContact CB-CE1 3.16Å; A20-F38 HydrophobicContact CB-CE2 4.15Å; A20-F38 HydrophobicContact CB-CG 4.49Å; A20-F38 HydrophobicContact CB-CZ 3.41Å; A20-F38 VanDerWaalsContact CB-CZ 3.41Å; I23-F38 HydrophobicContact CD1-CE1 4.3Å; I23-F38 HydrophobicContact CD1-CZ 4.17Å; F38-V48 HydrophobicContact CB-CG1 3.84Å; F38-V48 HydrophobicContact CD1-CG1 4.25Å; F38-V48 HydrophobicContact CD2-CG1 4.47Å; F38-V48 HydrophobicContact CG-CG1 3.95Å; F38-V52 HydrophobicContact CD2-CG2 3.64Å; F38-V52 HydrophobicContact CE2-CG2 4.22Å; F38-Y57 HydrophobicContact CD2-CG 4.29Å; F38-Y57 AromaticContact CE2-CD1 3.95Å; F38-Y57 HydrophobicContact CE2-CD1 3.95Å; F38-Y57 AromaticContact CE2-CD2 3.62Å; F38-Y57 HydrophobicContact CE2-CD2 3.62Å; F38-Y57 HydrophobicContact CE2-CE1 4.34Å; F38-Y57 HydrophobicContact CE2-CE2 4Å; F38-Y57 AromaticContact CE2-CG 3.6Å; F38-Y57 HydrophobicContact CE2-CG 3.6Å; F38-Y57 HydrophobicContact CZ-CD2 4.42Å; F38-Y57 HydrophobicContact CZ-CE2 4.36Å; F38-T59 PolarHBondContact N-O 3.4Å; F38-T59 VanDerWaalsContact N-O 3.15Å; F38-I60 HydrophobicContact CB-CG1 4.3Å; F38-I60 CarbonylContact O-C 3.48Å; F38-I60 VanDerWaalsContact O-CA 3.27Å; F38-I60 WeakPolarHBondContact O-CA 3.33Å; F38-C61 PolarHBondContact O-N 3.21Å; F38-W80 WeakPolarHBondContact O-CZ3 3.41Å; F38-I81 HydrophobicContact CD1-CB 3.89Å; F38-I81 HydrophobicContact CD1-CD1 4.24Å; F38-I81 HydrophobicContact CD1-CG1 4.3Å; F38-I81 HydrophobicContact CE1-CB 4.2Å; F38-I81 HydrophobicContact CE1-CD1 3.66Å; F38-I81 HydrophobicContact CE1-CG1 4.19Å
39	A	67.7	Low	65.3	Low	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.1	174.4	0	0	0	0	0	110.5	H16 C61 F63 L74 W80 I81 V82 P83	H16-A39 PolarHBondContact CE1-O 3.01Å; A39-C61 CarbonylContact C-O 3.57Å; A39-C61 WeakPolarHBondContact CA-O 3.3Å; A39-C61 HydrophobicContact CB-CB 4.09Å; A39-F63 HydrophobicContact CB-CD1 4.18Å; A39-F63 HydrophobicContact CB-CE1 4.03Å; A39-L74 HydrophobicContact CB-CD2 4.1Å; A39-W80 HydrophobicContact CB-CE3 3.78Å; A39-W80 HydrophobicContact CB-CZ3 4.35Å; A39-I81 PolarHBondContact N-O 2.98Å; A39-V82 HydrophobicContact CB-CG2 3.96Å; A39-V82 WeakPolarHBondContact O-CA 3.27Å; A39-P83 WeakPolarHBondContact O-CD 3.46Å
40	Q	70	Confident	65.3	Low	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151.6	176.1	67.3	-179.8	8.6	0	0	111.6	T44 A45 D49 I60 C61 H62 F63 P83	Q40-T44 HydrophobicContact CB-CG2 4.43Å; Q40-A45 PolarHBondContact OE1-O 2.97Å; Q40-D49 PolarHBondContact NE2-OD1 3.3Å; Q40-D49 PolarHBondContact NE2-OD2 3.22Å; Q40-I60 HydrophobicContact CG-CG2 4Å; Q40-C61 PolarHBondContact N-O 3.11Å; Q40-H62 PolarHBondContact NE2-NE2 3.45Å; Q40-H62 VanDerWaalsContact O-CA 3.27Å; Q40-H62 WeakPolarHBondContact O-CA 3.46Å; Q40-F63 VanDerWaalsContact C-CD1 3.48Å; Q40-F63 VanDerWaalsContact CA-CE1 3.45Å; Q40-F63 VanDerWaalsContact O-CD1 3.24Å; Q40-F63 WeakPolarHBondContact O-CD1 3.5Å; Q40-F63 WeakPolarHBondContact O-CE1 3.25Å; Q40-F63 PolarHBondContact O-N 3.19Å; Q40-P83 HydrophobicContact CB-CG 4.14Å
41	S	66.2	Low	65.2	Low	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	151.8	172.1	83	0	0	0	0	109	R43 T44 F63 W85	S41-R43 PolarHBondContact O-N 3.28Å; S41-R43 PolarHBondContact OG-N 2.86Å; S41-T44 WeakPolarHBondContact O-CB 3.15Å; S41-T44 PolarHBondContact O-N 2.81Å; S41-T44 PolarHBondContact OG-N 2.7Å; S41-T44 VanDerWaalsContact OG-N 3.11Å; S41-T44 PolarHBondContact OG-OG1 3.46Å; S41-F63 CarbonylContact C-O 3.5Å; S41-F63 VanDerWaalsContact CA-O 3.3Å; S41-F63 WeakPolarHBondContact CA-O 3.41Å; S41-F63 VanDerWaalsContact N-CZ 3.27Å; S41-W85 PolarHBondContact OG-NE1 2.79Å; S41-W85 VanDerWaalsContact OG-NE1 3.1Å
42	L	64.1	Low	65	Low	16 Å²	16	24.5 Å²	24.5	8%	0.084	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-27.4	169.8	-96.1	92.3	0	0	0	112.4	H62 F63 F197 R209 M219 Q236	L42-H62 HydrophobicContact CD1-CB 3.98Å; L42-F63 WeakPolarHBondContact CD1-O 3.37Å; L42-F63 PolarHBondContact N-O 3.36Å; L42-F197 HydrophobicContact CD1-CD1 3.69Å; L42-F197 HydrophobicContact CD1-CE1 3.27Å; L42-F197 HydrophobicContact CD1-CE2 4.49Å; L42-F197 HydrophobicContact CD1-CG 4.44Å; L42-F197 HydrophobicContact CD1-CZ 3.7Å; L42-F197 HydrophobicContact CD2-CD1 3.98Å; L42-F197 HydrophobicContact CD2-CE1 4.44Å; L42-F197 HydrophobicContact CD2-CG 4.41Å; L42-F197 HydrophobicContact CG-CD1 4.49Å; L42-F197 HydrophobicContact CG-CE1 4.47Å; L42-R209 HydrophobicContact CD2-CG 4.08Å; L42-M219 HydrophobicContact CD2-SD 4.4Å; L42-Q236 PolarHBondContact O-NE2 2.96Å; L42-Q236 PolarHBondContact O-OE1 3.44Å
43	R	60.8	Low	64.6	Low	60 Å²	60	31.8 Å²	31.8	23%	0.226	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.6	-179.3	-72	-153.5	-73.6	-130.8	4.2	115	S41 S65 W85 S148 F223 Q236	S41-R43 PolarHBondContact O-N 3.28Å; S41-R43 PolarHBondContact OG-N 2.86Å; R43-S65 PolarHBondContact NE-OG 3.23Å; R43-S65 PolarHBondContact NH1-OG 3.48Å; R43-S65 PolarHBondContact NH2-OG 2.97Å; R43-W85 HydrophobicContact CB-CH2 3.86Å; R43-W85 HydrophobicContact CB-CZ2 3.42Å; R43-W85 VanDerWaalsContact CB-CZ2 3.42Å; R43-W85 HydrophobicContact CG-CH2 4.44Å; R43-W85 HydrophobicContact CG-CZ2 4.42Å; R43-S148 PolarHBondContact O-OG 2.86Å; R43-F223 VanDerWaalsContact NH1-CZ 3.33Å; R43-Q236 VanDerWaalsContact CA-NE2 3.31Å; R43-Q236 VanDerWaalsContact CA-OE1 3.31Å; R43-Q236 PolarHBondContact O-NE2 3.03Å
44	T	65.3	Low	64	Low	2 Å²	2	34 Å²	34	1%	0.012	15%	0.153	C	C	.	.	S	Bend	trans	-75.5	149	177.2	-52	0	0	0	0	109.2	S13 Q40 S41 P83 R217	S13-T44 WeakPolarHBondContact OG-CG2 3.4Å; Q40-T44 HydrophobicContact CB-CG2 4.43Å; S41-T44 WeakPolarHBondContact O-CB 3.15Å; S41-T44 PolarHBondContact O-N 2.81Å; S41-T44 PolarHBondContact OG-N 2.7Å; S41-T44 VanDerWaalsContact OG-N 3.11Å; S41-T44 PolarHBondContact OG-OG1 3.46Å; T44-P83 HydrophobicContact CG2-CG 4.2Å; T44-R217 PolarHBondContact O-NH2 3.48Å
45	A	67	Low	63.3	Low	0 Å²	0	34 Å²	34	0%	0	16%	0.155	C	C	.	.			trans	-66.8	157.6	174.4	0	0	0	0	0	110.8	S13 Q40 A47 S146 R217 T238	S13-A45 VanDerWaalsContact CB-CB 3.49Å; S13-A45 WeakPolarHBondContact OG-CB 3.08Å; S13-A45 PolarHBondContact OG-N 2.89Å; Q40-A45 PolarHBondContact OE1-O 2.97Å; A45-A47 PolarHBondContact O-N 3.04Å; A45-S146 WeakPolarHBondContact CB-O 3.41Å; A45-R217 VanDerWaalsContact C-NH2 3.27Å; A45-T238 HydrophobicContact CB-CG2 4.2Å
46	A	69.5	Low	63.1	Low	7 Å²	7	45.1 Å²	45.1	6%	0.058	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	20.7	-175	0	0	0	0	0	114.3	V48 D49 R217	A46-V48 VanDerWaalsContact C-N 3.3Å; A46-V48 PolarHBondContact O-N 2.85Å; A46-D49 WeakPolarHBondContact CA-OD2 3.43Å; A46-D49 HydrophobicContact CB-CB 4.32Å; A46-D49 VanDerWaalsContact CB-OD2 3.27Å; A46-D49 WeakPolarHBondContact CB-OD2 3.38Å; A46-D49 WeakPolarHBondContact O-CB 3.33Å; A46-D49 PolarHBondContact O-N 3.31Å; A46-D49 VanDerWaalsContact O-N 3.09Å; A46-R217 HydrophobicContact CB-CG 4.38Å; A46-R217 VanDerWaalsContact CB-NE 3.33Å; A46-R217 VanDerWaalsContact N-NH2 3.13Å
47	A	69.7	Low	62.9	Low	1 Å²	1	42 Å²	42	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-42.4	-169.2	0	0	0	0	0	111	S13 A17 A45 D49 R50	S13-A47 WeakPolarHBondContact O-CB 3.12Å; A17-A47 VanDerWaalsContact CB-C 3.44Å; A17-A47 HydrophobicContact CB-CB 3.53Å; A17-A47 WeakPolarHBondContact CB-O 3.3Å; A45-A47 PolarHBondContact O-N 3.04Å; A47-D49 VanDerWaalsContact C-N 3.35Å; A47-R50 PolarHBondContact O-N 2.98Å
48	V	71.7	Confident	62.1	Low	1 Å²	1	45 Å²	45	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-72.7	-29.3	178.2	178.8	0	0	0	0	111.7	H16 A17 A20 F38 A46 R50 Q51 V52 I60	H16-V48 HydrophobicContact CB-CG2 3.98Å; H16-V48 WeakPolarHBondContact ND1-CG2 3.44Å; A17-V48 HydrophobicContact CB-CG2 4.03Å; A20-V48 HydrophobicContact CB-CG1 4.27Å; F38-V48 HydrophobicContact CB-CG1 3.84Å; F38-V48 HydrophobicContact CD1-CG1 4.25Å; F38-V48 HydrophobicContact CD2-CG1 4.47Å; F38-V48 HydrophobicContact CG-CG1 3.95Å; A46-V48 VanDerWaalsContact C-N 3.3Å; A46-V48 PolarHBondContact O-N 2.85Å; V48-R50 PolarHBondContact O-N 3.02Å; V48-Q51 PolarHBondContact O-N 3.18Å; V48-V52 PolarHBondContact O-N 3.49Å; V48-I60 HydrophobicContact CG1-CD1 4Å
49	D	70	Confident	61.7	Low	23 Å²	23	48.3 Å²	48.3	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-58	-36.7	177.5	-58.2	-63	0	0	0	111.5	Q40 A46 A47 Q51 V52 Y53 I60 H62 R217	Q40-D49 PolarHBondContact NE2-OD1 3.3Å; Q40-D49 PolarHBondContact NE2-OD2 3.22Å; A46-D49 WeakPolarHBondContact CA-OD2 3.43Å; A46-D49 HydrophobicContact CB-CB 4.32Å; A46-D49 VanDerWaalsContact CB-OD2 3.27Å; A46-D49 WeakPolarHBondContact CB-OD2 3.38Å; A46-D49 WeakPolarHBondContact O-CB 3.33Å; A46-D49 PolarHBondContact O-N 3.31Å; A46-D49 VanDerWaalsContact O-N 3.09Å; A47-D49 VanDerWaalsContact C-N 3.35Å; D49-Q51 VanDerWaalsContact C-N 3.3Å; D49-Q51 PolarHBondContact O-N 3.49Å; D49-V52 PolarHBondContact O-N 2.92Å; D49-Y53 WeakPolarHBondContact O-CD2 3.41Å; D49-Y53 PolarHBondContact O-N 3.32Å; D49-I60 HydrophobicContact CB-CD1 4.05Å; D49-I60 WeakPolarHBondContact OD1-CD1 3.4Å; D49-H62 IonicContact OD1-CE1 3.55Å; D49-H62 PolarHBondContact OD1-CE1 2.85Å; D49-H62 IonicContact OD1-NE2 2.73Å; D49-H62 IonicContact OD2-NE2 2.82Å; D49-R217 IonicContact OD2-CZ 2.79Å; D49-R217 IonicContact OD2-NH1 3.85Å; D49-R217 PolarHBondContact OD2-NH1 3.35Å; D49-R217 IonicContact OD2-NH2 3.38Å
50	R	65.9	Low	61.6	Low	43 Å²	43	49.6 Å²	49.6	16%	0.162	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-40	174.1	-67.5	-176.6	-176.6	167.5	4.6	112.8	A47 V48 Y53 H54 D144 I215 N240	A47-R50 PolarHBondContact O-N 2.98Å; V48-R50 PolarHBondContact O-N 3.02Å; R50-Y53 PolarHBondContact O-N 3.38Å; R50-H54 PolarHBondContact O-CD2 2.98Å; R50-H54 PolarHBondContact O-N 3.09Å; R50-D144 PolarHBondContact NH1-O 3.46Å; R50-I215 HydrophobicContact CG-CD1 3.57Å; R50-N240 PolarHBondContact NH1-ND2 3.39Å; R50-N240 PolarHBondContact NH1-OD1 3.19Å; R50-N240 PolarHBondContact NH2-ND2 3.1Å; R50-N240 PolarHBondContact NH2-OD1 2.74Å
51	Q	64	Low	61.4	Low	15 Å²	15	50.9 Å²	50.9	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-72.3	-36.1	-175.1	-55.9	-56.7	-9.5	0	0	111.4	A17 D21 V48 D49 Y53 H54 V55	A17-Q51 HydrophobicContact CB-CG 4.32Å; D21-Q51 HydrophobicContact CB-CG 4.31Å; V48-Q51 PolarHBondContact O-N 3.18Å; D49-Q51 VanDerWaalsContact C-N 3.3Å; D49-Q51 PolarHBondContact O-N 3.49Å; Q51-Y53 VanDerWaalsContact C-N 3.34Å; Q51-Y53 PolarHBondContact O-N 3.03Å; Q51-H54 PolarHBondContact O-N 2.87Å; Q51-H54 VanDerWaalsContact O-N 3.13Å; Q51-V55 WeakPolarHBondContact O-CB 3.02Å; Q51-V55 VanDerWaalsContact O-CG2 3.29Å; Q51-V55 WeakPolarHBondContact O-CG2 3.47Å; Q51-V55 PolarHBondContact O-N 2.54Å
52	V	59.9	Low	61.5	Low	25 Å²	25	52.2 Å²	52.2	15%	0.152	25%	0.249	C	C	.	.	H	α-helix	trans	-71.3	-28.5	177.6	176.1	0	0	0	0	112.6	F38 V48 D49 H54 V55 I60	F38-V52 HydrophobicContact CD2-CG2 3.64Å; F38-V52 HydrophobicContact CE2-CG2 4.22Å; V48-V52 PolarHBondContact O-N 3.49Å; D49-V52 PolarHBondContact O-N 2.92Å; V52-H54 VanDerWaalsContact C-N 3.26Å; V52-H54 PolarHBondContact O-N 2.92Å; V52-V55 VanDerWaalsContact O-O 3.11Å; V52-I60 HydrophobicContact CB-CD1 3.7Å; V52-I60 HydrophobicContact CB-CG1 3.9Å; V52-I60 HydrophobicContact CG1-CD1 4.4Å; V52-I60 HydrophobicContact CG1-CG1 4.16Å; V52-I60 HydrophobicContact CG2-CD1 3.5Å; V52-I60 HydrophobicContact CG2-CG1 3.48Å; V52-I60 VanDerWaalsContact CG2-CG1 3.48Å
53	Y	52.8	Low	61.4	Low	184 Å²	184	51.7 Å²	51.7	72%	0.722	25%	0.246	S	C	*	.	H	α-helix	trans	-69.2	-24.5	171	-76.9	-68.9	0	0	0	113.3	D49 R50 Q51	D49-Y53 WeakPolarHBondContact O-CD2 3.41Å; D49-Y53 PolarHBondContact O-N 3.32Å; R50-Y53 PolarHBondContact O-N 3.38Å; Q51-Y53 VanDerWaalsContact C-N 3.34Å; Q51-Y53 PolarHBondContact O-N 3.03Å
54	H	47.2	Very low	61.2	Low	163 Å²	163	49 Å²	49	76%	0.755	24%	0.236	S	C	*	.	H	α-helix	trans	-98.3	-20.3	-178.2	-80.8	-65.6	0	0	0	114.4	R50 Q51 V52	R50-H54 PolarHBondContact O-CD2 2.98Å; R50-H54 PolarHBondContact O-N 3.09Å; Q51-H54 PolarHBondContact O-N 2.87Å; Q51-H54 VanDerWaalsContact O-N 3.13Å; V52-H54 VanDerWaalsContact C-N 3.26Å; V52-H54 PolarHBondContact O-N 2.92Å
55	V	44.6	Very low	60.8	Low	49 Å²	49	49.3 Å²	49.3	30%	0.297	24%	0.239	S	C	.	.	S	Bend	trans	-130.4	151.7	-169.2	-157.6	0	0	0	0	111.2	Q51 V52 Y57	Q51-V55 WeakPolarHBondContact O-CB 3.02Å; Q51-V55 VanDerWaalsContact O-CG2 3.29Å; Q51-V55 WeakPolarHBondContact O-CG2 3.47Å; Q51-V55 PolarHBondContact O-N 2.54Å; V52-V55 VanDerWaalsContact O-O 3.11Å; V55-Y57 HydrophobicContact CB-CD2 3.85Å; V55-Y57 HydrophobicContact CB-CE2 3.78Å; V55-Y57 HydrophobicContact CG1-CD2 4.02Å; V55-Y57 HydrophobicContact CG1-CE2 3.49Å; V55-Y57 VanDerWaalsContact CG1-CE2 3.49Å; V55-Y57 PolarHBondContact O-N 3.2Å
56	R	51.5	Low	59.8	Low	249 Å²	249	53.8 Å²	53.8	94%	0.94	27%	0.266	S	S	*	.	S	Bend	trans	-54.5	19.3	-166.8	-60.4	-179.7	-178	-170.7	1.5	118.6
57	Y	55.5	Low	58.6	Low	34 Å²	34	55.4 Å²	55.4	13%	0.133	27%	0.272	C	S	.	.			trans	-91.4	147.4	-175.9	-56.8	-73	0	0	0	110.8	I23 V35 K36 F38 V55	I23-Y57 HydrophobicContact CG2-CE1 4.4Å; I23-Y57 WeakPolarHBondContact CG2-OH 3.17Å; V35-Y57 WeakPolarHBondContact O-CD1 3.37Å; V35-Y57 WeakPolarHBondContact O-CE1 3.4Å; K36-Y57 CarbonylContact O-C 3.56Å; K36-Y57 WeakPolarHBondContact O-CA 3.11Å; K36-Y57 WeakPolarHBondContact O-CB 3.14Å; F38-Y57 HydrophobicContact CD2-CG 4.29Å; F38-Y57 AromaticContact CE2-CD1 3.95Å; F38-Y57 HydrophobicContact CE2-CD1 3.95Å; F38-Y57 AromaticContact CE2-CD2 3.62Å; F38-Y57 HydrophobicContact CE2-CD2 3.62Å; F38-Y57 HydrophobicContact CE2-CE1 4.34Å; F38-Y57 HydrophobicContact CE2-CE2 4Å; F38-Y57 AromaticContact CE2-CG 3.6Å; F38-Y57 HydrophobicContact CE2-CG 3.6Å; F38-Y57 HydrophobicContact CZ-CD2 4.42Å; F38-Y57 HydrophobicContact CZ-CE2 4.36Å; V55-Y57 HydrophobicContact CB-CD2 3.85Å; V55-Y57 HydrophobicContact CB-CE2 3.78Å; V55-Y57 HydrophobicContact CG1-CD2 4.02Å; V55-Y57 HydrophobicContact CG1-CE2 3.49Å; V55-Y57 VanDerWaalsContact CG1-CE2 3.49Å; V55-Y57 PolarHBondContact O-N 3.2Å
58	A	50.8	Low	57.5	Low	73 Å²	73	62.3 Å²	62.3	60%	0.603	30%	0.304	S	S	*	.			trans	-85.2	-38.6	-167.3	0	0	0	0	0	112.7	K36 D37	K36-A58 PolarHBondContact O-N 3.11Å; D37-A58 WeakPolarHBondContact OD1-CB 3.42Å
59	T	60.6	Low	56.5	Low	70 Å²	70	62.7 Å²	62.7	43%	0.429	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	146.2	-169.2	-30.5	0	0	0	0	113.4	D37 F38	D37-T59 WeakPolarHBondContact CA-O 3.46Å; D37-T59 WeakPolarHBondContact CB-O 3.34Å; D37-T59 WeakPolarHBondContact OD1-CA 3.18Å; D37-T59 WeakPolarHBondContact OD1-CB 3.47Å; D37-T59 PolarHBondContact OD1-N 2.93Å; D37-T59 PolarHBondContact OD1-OG1 3.41Å; F38-T59 PolarHBondContact N-O 3.4Å; F38-T59 VanDerWaalsContact N-O 3.15Å
60	I	67.5	Low	55.4	Low	27 Å²	27	67.1 Å²	67.1	14%	0.138	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.1	160.5	-63.7	175.6	0	0	0	109.6	F38 Q40 V48 D49 V52	F38-I60 HydrophobicContact CB-CG1 4.3Å; F38-I60 CarbonylContact O-C 3.48Å; F38-I60 VanDerWaalsContact O-CA 3.27Å; F38-I60 WeakPolarHBondContact O-CA 3.33Å; Q40-I60 HydrophobicContact CG-CG2 4Å; V48-I60 HydrophobicContact CG1-CD1 4Å; D49-I60 HydrophobicContact CB-CD1 4.05Å; D49-I60 WeakPolarHBondContact OD1-CD1 3.4Å; V52-I60 HydrophobicContact CB-CD1 3.7Å; V52-I60 HydrophobicContact CB-CG1 3.9Å; V52-I60 HydrophobicContact CG1-CD1 4.4Å; V52-I60 HydrophobicContact CG1-CG1 4.16Å; V52-I60 HydrophobicContact CG2-CD1 3.5Å; V52-I60 HydrophobicContact CG2-CG1 3.48Å; V52-I60 VanDerWaalsContact CG2-CG1 3.48Å
61	C	65.4	Low	54.6	Low	26 Å²	26	67.3 Å²	67.3	18%	0.176	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.9	172	-77.6	0	0	0	0	111	F38 A39 Q40 L74 W80	F38-C61 PolarHBondContact O-N 3.21Å; A39-C61 CarbonylContact C-O 3.57Å; A39-C61 WeakPolarHBondContact CA-O 3.3Å; A39-C61 HydrophobicContact CB-CB 4.09Å; Q40-C61 PolarHBondContact N-O 3.11Å; C61-L74 HydrophobicContact CB-CD2 4.47Å; C61-W80 HydrophobicContact CB-CE3 4.44Å; C61-W80 HydrophobicContact CB-CH2 4.12Å; C61-W80 HydrophobicContact CB-CZ3 3.65Å; C61-W80 WeakPolarHBondContact SG-CH2 3.38Å; C61-W80 WeakPolarHBondContact SG-CZ3 3.21Å
62	H	67.1	Low	54.2	Low	28 Å²	28	72.8 Å²	72.8	13%	0.13	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.1	172.5	-70.5	90.8	0	0	0	110.3	Q40 L42 D49 F197 R217	Q40-H62 PolarHBondContact NE2-NE2 3.45Å; Q40-H62 VanDerWaalsContact O-CA 3.27Å; Q40-H62 WeakPolarHBondContact O-CA 3.46Å; L42-H62 HydrophobicContact CD1-CB 3.98Å; D49-H62 IonicContact OD1-CE1 3.55Å; D49-H62 PolarHBondContact OD1-CE1 2.85Å; D49-H62 IonicContact OD1-NE2 2.73Å; D49-H62 IonicContact OD2-NE2 2.82Å; H62-F197 WeakPolarHBondContact O-CZ 3.44Å; H62-R217 PolarHBondContact NE2-NH1 3.22Å
63	F	63	Low	53.8	Low	6 Å²	6	73.6 Å²	73.6	3%	0.026	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	166.5	178.4	60.5	-91.8	0	0	0	112.6	A39 Q40 S41 L42 V69 V82 Y199	A39-F63 HydrophobicContact CB-CD1 4.18Å; A39-F63 HydrophobicContact CB-CE1 4.03Å; Q40-F63 VanDerWaalsContact C-CD1 3.48Å; Q40-F63 VanDerWaalsContact CA-CE1 3.45Å; Q40-F63 VanDerWaalsContact O-CD1 3.24Å; Q40-F63 WeakPolarHBondContact O-CD1 3.5Å; Q40-F63 WeakPolarHBondContact O-CE1 3.25Å; Q40-F63 PolarHBondContact O-N 3.19Å; S41-F63 CarbonylContact C-O 3.5Å; S41-F63 VanDerWaalsContact CA-O 3.3Å; S41-F63 WeakPolarHBondContact CA-O 3.41Å; S41-F63 VanDerWaalsContact N-CZ 3.27Å; L42-F63 WeakPolarHBondContact CD1-O 3.37Å; L42-F63 PolarHBondContact N-O 3.36Å; F63-V69 HydrophobicContact CD1-CG2 3.84Å; F63-V69 HydrophobicContact CD2-CG2 3.45Å; F63-V69 VanDerWaalsContact CD2-CG2 3.45Å; F63-V69 HydrophobicContact CE1-CG2 3.72Å; F63-V69 HydrophobicContact CE2-CG2 3.35Å; F63-V69 HydrophobicContact CG-CG2 3.72Å; F63-V69 HydrophobicContact CZ-CG2 3.5Å; F63-V69 VanDerWaalsContact CZ-CG2 3.5Å; F63-V82 HydrophobicContact CE1-CG1 3.62Å; F63-V82 HydrophobicContact CE2-CG1 4.37Å; F63-V82 HydrophobicContact CZ-CG1 3.39Å; F63-Y199 HydrophobicContact CB-CE2 4.13Å
64	T	57.1	Low	54	Low	2 Å²	2	65.1 Å²	65.1	1%	0.012	33%	0.331	C	S	.	.			trans	-83.5	144	-177.2	70.7	0	0	0	0	110.9	T66 Q67 F197 D205	T64-T66 PolarHBondContact O-N 2.73Å; T64-Q67 PolarHBondContact O-N 3.05Å; T64-F197 HydrophobicContact CG2-CE1 4.24Å; T64-D205 VanDerWaalsContact CB-OD2 3.31Å; T64-D205 WeakPolarHBondContact CB-OD2 3.28Å; T64-D205 HydrophobicContact CG2-CB 3.69Å; T64-D205 PolarHBondContact OG1-OD2 3.49Å; T64-D205 VanDerWaalsContact OG1-OD2 3.05Å
65	S	55.3	Low	54.2	Low	10 Å²	10	61.1 Å²	61.1	7%	0.07	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-5.7	-168	56.7	0	0	0	0	116.6	R43	R43-S65 PolarHBondContact NE-OG 3.23Å; R43-S65 PolarHBondContact NH1-OG 3.48Å; R43-S65 PolarHBondContact NH2-OG 2.97Å
66	T	46	Very low	54.4	Low	93 Å²	93	61.3 Å²	61.3	57%	0.571	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-2	-173.5	39.7	0	0	0	0	112.9	T64 D205	T64-T66 PolarHBondContact O-N 2.73Å; T66-D205 PolarHBondContact OG1-OD2 2.97Å
67	Q	46.2	Very low	54.1	Low	41 Å²	41	53.5 Å²	53.5	19%	0.192	32%	0.32	C	S	.	.	S	Bend	trans	-104.6	129.2	-179.8	-68.9	-174.8	-18.3	0	0	110.8	T64 V69 M73	T64-Q67 PolarHBondContact O-N 3.05Å; Q67-V69 PolarHBondContact O-N 3.47Å; Q67-V69 VanDerWaalsContact O-N 3.15Å; Q67-M73 HydrophobicContact CB-CE 4.46Å; Q67-M73 PolarHBondContact OE1-SD 3.12Å
68	E	46.2	Very low	53.9	Low	147 Å²	147	56.5 Å²	56.5	69%	0.687	33%	0.332	S	S	*	.			trans	-53.6	116.2	145	-90.2	-177.2	155.1	0	0	106.3	K70 M73	E68-K70 PolarHBondContact O-N 3.1Å; E68-M73 WeakPolarHBondContact O-CE 3.39Å
69	V	49.5	Very low	54.1	Low	9 Å²	9	55.9 Å²	55.9	6%	0.055	31%	0.314	C	S	.	.			trans	-63.7	104.3	174.1	179.9	0	0	0	0	106.5	F63 Q67 L74 V82 Y96	F63-V69 HydrophobicContact CD1-CG2 3.84Å; F63-V69 HydrophobicContact CD2-CG2 3.45Å; F63-V69 VanDerWaalsContact CD2-CG2 3.45Å; F63-V69 HydrophobicContact CE1-CG2 3.72Å; F63-V69 HydrophobicContact CE2-CG2 3.35Å; F63-V69 HydrophobicContact CG-CG2 3.72Å; F63-V69 HydrophobicContact CZ-CG2 3.5Å; F63-V69 VanDerWaalsContact CZ-CG2 3.5Å; Q67-V69 PolarHBondContact O-N 3.47Å; Q67-V69 VanDerWaalsContact O-N 3.15Å; V69-L74 HydrophobicContact CG1-CD1 3.59Å; V69-L74 HydrophobicContact CG1-CD2 3.85Å; V69-L74 HydrophobicContact CG1-CG 3.68Å; V69-V82 HydrophobicContact CB-CG1 4.1Å; V69-V82 HydrophobicContact CG1-CG2 4.38Å; V69-V82 HydrophobicContact CG2-CG1 3.66Å; V69-Y96 WeakPolarHBondContact O-CE1 3.36Å
70	K	47.1	Very low	53.9	Low	116 Å²	116	52.9 Å²	52.9	50%	0.504	30%	0.295	S	S	.	.			trans	-80.3	140.8	173.5	-60	-175.1	-179.8	-178.2	0	108.1	E68 D72 M73	E68-K70 PolarHBondContact O-N 3.1Å; K70-D72 WeakPolarHBondContact CB-OD1 3.37Å; K70-D72 PolarHBondContact O-N 3.29Å; K70-D72 VanDerWaalsContact O-N 3.11Å; K70-M73 HydrophobicContact CB-CE 3.62Å; K70-M73 HydrophobicContact CB-CG 4.24Å; K70-M73 HydrophobicContact CD-CE 3.93Å; K70-M73 HydrophobicContact CG-CE 3.52Å; K70-M73 WeakPolarHBondContact O-CB 3.04Å; K70-M73 PolarHBondContact O-N 3.13Å
71	P	50.2	Low	53.4	Low	46 Å²	46	51.7 Å²	51.7	30%	0.299	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-55.4	-32.3	-174.5	-22.1	29.2	0	0	0	114	M73 L74 Y96	P71-M73 VanDerWaalsContact C-N 3.26Å; P71-M73 PolarHBondContact O-N 3.43Å; P71-L74 PolarHBondContact O-N 3.02Å; P71-Y96 HydrophobicContact CG-CD1 4.3Å
72	D	54.9	Low	53.1	Low	130 Å²	130	50.5 Å²	50.5	70%	0.695	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-71.2	-16.8	177.2	57.6	-40.8	0	0	0	113.8	K70 L74	K70-D72 WeakPolarHBondContact CB-OD1 3.37Å; K70-D72 PolarHBondContact O-N 3.29Å; K70-D72 VanDerWaalsContact O-N 3.11Å; D72-L74 VanDerWaalsContact C-N 3.33Å
73	M	50.9	Low	52.3	Low	42 Å²	42	49.3 Å²	49.3	21%	0.207	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-82.3	-12.4	175.1	-63.3	-160.2	-114.1	0	0	113.2	Q67 E68 K70 P71 Y199	Q67-M73 HydrophobicContact CB-CE 4.46Å; Q67-M73 PolarHBondContact OE1-SD 3.12Å; E68-M73 WeakPolarHBondContact O-CE 3.39Å; K70-M73 HydrophobicContact CB-CE 3.62Å; K70-M73 HydrophobicContact CB-CG 4.24Å; K70-M73 HydrophobicContact CD-CE 3.93Å; K70-M73 HydrophobicContact CG-CE 3.52Å; K70-M73 WeakPolarHBondContact O-CB 3.04Å; K70-M73 PolarHBondContact O-N 3.13Å; P71-M73 VanDerWaalsContact C-N 3.26Å; P71-M73 PolarHBondContact O-N 3.43Å; M73-Y199 PolarHBondContact O-OH 3.44Å
74	L	57.4	Low	51.6	Low	7 Å²	7	50.4 Å²	50.4	4%	0.037	28%	0.283	C	S	.	.	S	Bend	trans	-95.8	132.2	178.5	-62.3	170.2	0	0	0	109.3	A39 C61 V69 P71 D72 G76 W80 V82	A39-L74 HydrophobicContact CB-CD2 4.1Å; C61-L74 HydrophobicContact CB-CD2 4.47Å; V69-L74 HydrophobicContact CG1-CD1 3.59Å; V69-L74 HydrophobicContact CG1-CD2 3.85Å; V69-L74 HydrophobicContact CG1-CG 3.68Å; P71-L74 PolarHBondContact O-N 3.02Å; D72-L74 VanDerWaalsContact C-N 3.33Å; L74-G76 PolarHBondContact O-N 3.47Å; L74-W80 HydrophobicContact CB-CD2 4.16Å; L74-W80 HydrophobicContact CB-CG 4.29Å; L74-W80 HydrophobicContact CB-CZ2 4.1Å; L74-W80 HydrophobicContact CD1-CB 3.67Å; L74-W80 HydrophobicContact CD1-CD2 3.85Å; L74-W80 HydrophobicContact CD1-CG 3.35Å; L74-W80 HydrophobicContact CD2-CD2 4.19Å; L74-W80 HydrophobicContact CD2-CE3 4.34Å; L74-W80 HydrophobicContact CG-CD2 4.29Å; L74-W80 HydrophobicContact CG-CG 4.26Å; L74-V82 HydrophobicContact CD1-CG2 4.49Å
75	P	50.9	Low	51	Low	79 Å²	79	52.7 Å²	52.7	51%	0.513	29%	0.292	S	S	.	.	S	Bend	trans	-67.2	121.3	-173.4	24.3	-31.5	0	0	0	110.8	Y78 W80	P75-Y78 WeakPolarHBondContact O-CD2 3.39Å; P75-W80 HydrophobicContact CG-CH2 4.16Å; P75-W80 HydrophobicContact CG-CZ2 4.07Å
76	G	49.8	Very low	50	Low	52 Å²	52	58.4 Å²	58.4	54%	0.536	32%	0.315	S	S	.	.	S	Bend	trans	81.3	170.3	169.1	0	0	0	0	0	116.1	L74 Y78	L74-G76 PolarHBondContact O-N 3.47Å; G76-Y78 PolarHBondContact O-N 2.86Å
77	A	45.7	Very low	49.2	Very low	85 Å²	85	61.5 Å²	61.5	70%	0.702	33%	0.328	S	S	*	.	S	Bend	trans	-68.4	25.4	-175.2	0	0	0	0	0	115
78	Y	50.3	Low	48.5	Very low	97 Å²	97	61.3 Å²	61.3	38%	0.38	34%	0.338	S	S	.	.			trans	-86.9	160	-171.4	-55.7	-77.2	0	0	0	111.8	K36 P75 G76 W80	K36-Y78 HydrophobicContact CB-CD1 4.38Å; K36-Y78 HydrophobicContact CD-CE1 4.36Å; P75-Y78 WeakPolarHBondContact O-CD2 3.39Å; G76-Y78 PolarHBondContact O-N 2.86Å; Y78-W80 PolarHBondContact O-NE1 2.88Å
79	R	54.5	Low	47.8	Very low	61 Å²	61	55.8 Å²	55.8	23%	0.23	32%	0.315	C	S	.	.			trans	-103.2	129.1	176.8	-57.4	-177.8	-172.6	-134.6	2.5	108.3	Y28 L32 D34 V35 Y96 T97	Y28-R79 PolarHBondContact OH-NH1 3.45Å; L32-R79 VanDerWaalsContact CD1-NH1 3.3Å; L32-R79 VanDerWaalsContact CD2-NH2 3.27Å; D34-R79 IonicContact OD2-NE 3.49Å; D34-R79 PolarHBondContact OD2-NE 3.25Å; V35-R79 HydrophobicContact CG2-CB 4.21Å; R79-Y96 CarbonylContact C-O 3.6Å; R79-Y96 VanDerWaalsContact CA-O 3.3Å; R79-Y96 WeakPolarHBondContact CA-O 3.4Å; R79-T97 HydrophobicContact CB-CG2 4.26Å; R79-T97 HydrophobicContact CG-CG2 3.78Å
80	W	56.4	Low	47.6	Very low	7 Å²	7	55.7 Å²	55.7	3%	0.027	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.7	-167.8	-59.4	88.6	0	0	0	110.9	D37 F38 A39 C61 L74 P75 Y78 V82 F95 Y96	D37-W80 HydrophobicContact CB-CD2 4.24Å; D37-W80 HydrophobicContact CB-CE3 3.66Å; D37-W80 HydrophobicContact CB-CH2 3.36Å; D37-W80 HydrophobicContact CB-CZ2 3.98Å; D37-W80 HydrophobicContact CB-CZ3 3.19Å; F38-W80 WeakPolarHBondContact O-CZ3 3.41Å; A39-W80 HydrophobicContact CB-CE3 3.78Å; A39-W80 HydrophobicContact CB-CZ3 4.35Å; C61-W80 HydrophobicContact CB-CE3 4.44Å; C61-W80 HydrophobicContact CB-CH2 4.12Å; C61-W80 HydrophobicContact CB-CZ3 3.65Å; C61-W80 WeakPolarHBondContact SG-CH2 3.38Å; C61-W80 WeakPolarHBondContact SG-CZ3 3.21Å; L74-W80 HydrophobicContact CB-CD2 4.16Å; L74-W80 HydrophobicContact CB-CG 4.29Å; L74-W80 HydrophobicContact CB-CZ2 4.1Å; L74-W80 HydrophobicContact CD1-CB 3.67Å; L74-W80 HydrophobicContact CD1-CD2 3.85Å; L74-W80 HydrophobicContact CD1-CG 3.35Å; L74-W80 HydrophobicContact CD2-CD2 4.19Å; L74-W80 HydrophobicContact CD2-CE3 4.34Å; L74-W80 HydrophobicContact CG-CD2 4.29Å; L74-W80 HydrophobicContact CG-CG 4.26Å; P75-W80 HydrophobicContact CG-CH2 4.16Å; P75-W80 HydrophobicContact CG-CZ2 4.07Å; Y78-W80 PolarHBondContact O-NE1 2.88Å; W80-V82 HydrophobicContact CB-CG2 4.18Å; W80-F95 CarbonylContact O-C 3.56Å; W80-F95 WeakPolarHBondContact O-CA 3.46Å; W80-Y96 PolarHBondContact N-O 3.16Å; W80-Y96 PolarHBondContact O-N 2.82Å
81	I	58.4	Low	47.3	Very low	1 Å²	1	52.4 Å²	52.4	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.1	167.5	-53.9	-178.2	0	0	0	106.9	H16 I23 F38 A39 V93 F95	H16-I81 WeakPolarHBondContact NE2-CG2 3.49Å; H16-I81 PolarHBondContact NE2-O 3.47Å; I23-I81 HydrophobicContact CD1-CD1 3.31Å; I23-I81 HydrophobicContact CD1-CG1 4.41Å; I23-I81 HydrophobicContact CG1-CD1 4Å; F38-I81 HydrophobicContact CD1-CB 3.89Å; F38-I81 HydrophobicContact CD1-CD1 4.24Å; F38-I81 HydrophobicContact CD1-CG1 4.3Å; F38-I81 HydrophobicContact CE1-CB 4.2Å; F38-I81 HydrophobicContact CE1-CD1 3.66Å; F38-I81 HydrophobicContact CE1-CG1 4.19Å; A39-I81 PolarHBondContact N-O 2.98Å; I81-V93 HydrophobicContact CG2-CG1 3.26Å; I81-F95 HydrophobicContact CB-CD1 4.31Å; I81-F95 HydrophobicContact CB-CE1 4.38Å; I81-F95 HydrophobicContact CD1-CD1 3.74Å; I81-F95 HydrophobicContact CD1-CE1 3.35Å; I81-F95 HydrophobicContact CD1-CZ 4.43Å; I81-F95 HydrophobicContact CG1-CD1 3.47Å; I81-F95 VanDerWaalsContact CG1-CD1 3.47Å; I81-F95 HydrophobicContact CG1-CE1 3.6Å; I81-F95 HydrophobicContact CG2-CD1 4.18Å; I81-F95 HydrophobicContact CG2-CE1 3.94Å; I81-F95 HydrophobicContact CG2-CZ 4.36Å
82	V	57.6	Low	47.1	Very low	2 Å²	2	51.6 Å²	51.6	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.5	-167.8	-177.7	0	0	0	0	108.5	A39 F63 V69 L74 W80 C84 V93 A94 Y96	A39-V82 HydrophobicContact CB-CG2 3.96Å; A39-V82 WeakPolarHBondContact O-CA 3.27Å; F63-V82 HydrophobicContact CE1-CG1 3.62Å; F63-V82 HydrophobicContact CE2-CG1 4.37Å; F63-V82 HydrophobicContact CZ-CG1 3.39Å; V69-V82 HydrophobicContact CB-CG1 4.1Å; V69-V82 HydrophobicContact CG1-CG2 4.38Å; V69-V82 HydrophobicContact CG2-CG1 3.66Å; L74-V82 HydrophobicContact CD1-CG2 4.49Å; W80-V82 HydrophobicContact CB-CG2 4.18Å; V82-C84 PolarHBondContact O-N 3.31Å; V82-V93 CarbonylContact O-C 3.55Å; V82-A94 PolarHBondContact N-O 2.72Å; V82-A94 PolarHBondContact O-N 2.75Å; V82-A94 VanDerWaalsContact O-O 3.07Å; V82-Y96 HydrophobicContact CB-CD2 3.73Å; V82-Y96 HydrophobicContact CB-CE2 3.71Å; V82-Y96 HydrophobicContact CG1-CE2 4.11Å; V82-Y96 HydrophobicContact CG2-CD2 3.39Å; V82-Y96 HydrophobicContact CG2-CE2 3.82Å; V82-Y96 HydrophobicContact CG2-CG 4.34Å
83	P	51.5	Low	46.8	Very low	2 Å²	2	45.5 Å²	45.5	1%	0.013	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	122.2	167.9	28.4	-28.1	0	0	0	109.4	A39 Q40 T44 D92	A39-P83 WeakPolarHBondContact O-CD 3.46Å; Q40-P83 HydrophobicContact CB-CG 4.14Å; T44-P83 HydrophobicContact CG2-CG 4.2Å; P83-D92 CarbonylContact C-O 3.58Å; P83-D92 WeakPolarHBondContact CA-O 3.42Å
84	C	48.3	Very low	46.9	Very low	29 Å²	29	43.5 Å²	43.5	20%	0.196	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	126.8	174.8	-94.5	0	0	0	0	110.9	V82 D92 A94	V82-C84 PolarHBondContact O-N 3.31Å; C84-D92 HydrophobicContact CB-CB 4.1Å; C84-D92 PolarHBondContact N-O 3.11Å; C84-A94 HydrophobicContact CB-CB 4.46Å; C84-A94 WeakPolarHBondContact SG-CB 3.42Å
85	W	43.5	Very low	46.7	Very low	51 Å²	51	43.7 Å²	43.7	19%	0.193	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	112.9	169.4	-88.1	65.1	0	0	0	108.9	S41 R43 G88 C90	S41-W85 PolarHBondContact OG-NE1 2.79Å; S41-W85 VanDerWaalsContact OG-NE1 3.1Å; R43-W85 HydrophobicContact CB-CH2 3.86Å; R43-W85 HydrophobicContact CB-CZ2 3.42Å; R43-W85 VanDerWaalsContact CB-CZ2 3.42Å; R43-W85 HydrophobicContact CG-CH2 4.44Å; R43-W85 HydrophobicContact CG-CZ2 4.42Å; W85-G88 WeakPolarHBondContact CZ3-O 3.42Å; W85-C90 VanDerWaalsContact CD1-SG 3.53Å; W85-C90 HydrophobicContact CZ2-CB 4.31Å; W85-C90 PolarHBondContact NE1-SG 3.15Å
86	F	34.9	Very low	46.7	Very low	130 Å²	130	40.9 Å²	40.9	57%	0.57	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.7	171.6	-136.7	-96.8	0	0	0	108.7	G88 C89	F86-G88 VanDerWaalsContact C-N 3.31Å; F86-G88 PolarHBondContact O-N 3.26Å; F86-C89 PolarHBondContact N-O 2.83Å; F86-C89 PolarHBondContact O-N 2.84Å
87	N	28.5	Very low	46.8	Very low	157 Å²	157	39 Å²	39	84%	0.84	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	41	178.7	-74.7	-25	0	0	0	115.9	C89	N87-C89 VanDerWaalsContact C-N 3.28Å; N87-C89 PolarHBondContact O-N 2.93Å
88	G	31.8	Very low	46.7	Very low	38 Å²	38	37.7 Å²	37.7	39%	0.392	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-1.1	173.8	0	0	0	0	0	115.4	W85 F86	W85-G88 WeakPolarHBondContact CZ3-O 3.42Å; F86-G88 VanDerWaalsContact C-N 3.31Å; F86-G88 PolarHBondContact O-N 3.26Å
89	C	30.9	Very low	46.4	Very low	31 Å²	31	42.3 Å²	42.3	21%	0.209	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.2	167.2	-76.4	0	0	0	0	109.8	F86 N87 T91 G272	F86-C89 PolarHBondContact N-O 2.83Å; F86-C89 PolarHBondContact O-N 2.84Å; N87-C89 VanDerWaalsContact C-N 3.28Å; N87-C89 PolarHBondContact O-N 2.93Å; C89-T91 HydrophobicContact CB-CG2 3.76Å; C89-T91 PolarHBondContact O-N 3.36Å; C89-G272 PolarHBondContact SG-O 2.78Å
90	C	45.2	Very low	46	Very low	7 Å²	7	40.1 Å²	40.1	5%	0.047	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	94	168.2	-146.8	0	0	0	0	105.7	A12 W85	A12-C90 HydrophobicContact CB-CB 4.02Å; A12-C90 WeakPolarHBondContact CB-O 3.45Å; W85-C90 VanDerWaalsContact CD1-SG 3.53Å; W85-C90 HydrophobicContact CZ2-CB 4.31Å; W85-C90 PolarHBondContact NE1-SG 3.15Å
91	T	42	Very low	45.6	Very low	47 Å²	47	44.5 Å²	44.5	29%	0.288	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-21.9	-175.9	49.3	0	0	0	0	114.3	C89	C89-T91 HydrophobicContact CB-CG2 3.76Å; C89-T91 PolarHBondContact O-N 3.36Å
92	D	45	Very low	45.1	Very low	29 Å²	29	49.1 Å²	49.1	16%	0.155	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.3	-163.1	-58.1	-57.5	0	0	0	112.6	P83 C84 T105 G107	P83-D92 CarbonylContact C-O 3.58Å; P83-D92 WeakPolarHBondContact CA-O 3.42Å; C84-D92 HydrophobicContact CB-CB 4.1Å; C84-D92 PolarHBondContact N-O 3.11Å; D92-T105 WeakPolarHBondContact CB-O 3.41Å; D92-G107 WeakPolarHBondContact OD1-CA 3.38Å; D92-G107 PolarHBondContact OD1-N 3.27Å
93	V	49.6	Very low	44.4	Very low	2 Å²	2	52 Å²	52	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.9	172.2	-179.9	0	0	0	0	108.3	H16 L19 I81 V82 F95 T105	H16-V93 HydrophobicContact CB-CG2 3.93Å; L19-V93 HydrophobicContact CD1-CB 3.9Å; L19-V93 HydrophobicContact CD1-CG1 3.9Å; L19-V93 HydrophobicContact CD1-CG2 4.02Å; I81-V93 HydrophobicContact CG2-CG1 3.26Å; V82-V93 CarbonylContact O-C 3.55Å; V93-F95 HydrophobicContact CG1-CE2 4.48Å; V93-T105 PolarHBondContact N-OG1 3.05Å; V93-T105 PolarHBondContact O-N 2.9Å; V93-T105 PolarHBondContact O-OG1 2.9Å; V93-T105 VanDerWaalsContact O-OG1 3.07Å
94	A	52.4	Low	44.1	Very low	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	144.4	177.6	0	0	0	0	0	111.6	V82 C84 Y96 M101 L103	V82-A94 PolarHBondContact N-O 2.72Å; V82-A94 PolarHBondContact O-N 2.75Å; V82-A94 VanDerWaalsContact O-O 3.07Å; C84-A94 HydrophobicContact CB-CB 4.46Å; C84-A94 WeakPolarHBondContact SG-CB 3.42Å; A94-Y96 HydrophobicContact CB-CD2 4.3Å; A94-Y96 HydrophobicContact CB-CE2 3.65Å; A94-M101 HydrophobicContact CB-CG 4.27Å; A94-M101 HydrophobicContact CB-SD 3.88Å; A94-L103 CarbonylContact C-O 3.55Å; A94-L103 WeakPolarHBondContact CA-O 3.43Å
95	F	53.6	Low	43.9	Very low	11 Å²	11	53.7 Å²	53.7	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.9	-178.9	-60.5	-97.9	0	0	0	108.3	L19 F29 W80 I81 V93 M101 Q102 L103 T105	L19-F95 HydrophobicContact CD1-CZ 4.43Å; F29-F95 HydrophobicContact CE1-CD1 4.08Å; F29-F95 AromaticContact CE2-CD1 3.89Å; F29-F95 HydrophobicContact CE2-CD1 3.89Å; F29-F95 AromaticContact CE2-CE1 3.59Å; F29-F95 HydrophobicContact CE2-CE1 3.59Å; F29-F95 HydrophobicContact CE2-CZ 4.39Å; F29-F95 AromaticContact CZ-CD1 3.23Å; F29-F95 HydrophobicContact CZ-CD1 3.23Å; F29-F95 AromaticContact CZ-CE1 3.45Å; F29-F95 HydrophobicContact CZ-CE1 3.45Å; F29-F95 VanDerWaalsContact CZ-CE1 3.45Å; F29-F95 HydrophobicContact CZ-CG 4.11Å; F29-F95 HydrophobicContact CZ-CZ 4.47Å; W80-F95 CarbonylContact O-C 3.56Å; W80-F95 WeakPolarHBondContact O-CA 3.46Å; I81-F95 HydrophobicContact CB-CD1 4.31Å; I81-F95 HydrophobicContact CB-CE1 4.38Å; I81-F95 HydrophobicContact CD1-CD1 3.74Å; I81-F95 HydrophobicContact CD1-CE1 3.35Å; I81-F95 HydrophobicContact CD1-CZ 4.43Å; I81-F95 HydrophobicContact CG1-CD1 3.47Å; I81-F95 VanDerWaalsContact CG1-CD1 3.47Å; I81-F95 HydrophobicContact CG1-CE1 3.6Å; I81-F95 HydrophobicContact CG2-CD1 4.18Å; I81-F95 HydrophobicContact CG2-CE1 3.94Å; I81-F95 HydrophobicContact CG2-CZ 4.36Å; V93-F95 HydrophobicContact CG1-CE2 4.48Å; F95-M101 CarbonylContact O-C 3.56Å; F95-M101 WeakPolarHBondContact O-CA 3.26Å; F95-Q102 PolarHBondContact O-N 3.35Å; F95-L103 HydrophobicContact CB-CB 4.04Å; F95-L103 HydrophobicContact CD2-CB 3.74Å; F95-L103 HydrophobicContact CD2-CD2 3.86Å; F95-L103 HydrophobicContact CD2-CG 4.13Å; F95-L103 WeakPolarHBondContact CD2-O 3.25Å; F95-L103 HydrophobicContact CE2-CD2 3.93Å; F95-L103 HydrophobicContact CG-CB 4.17Å; F95-L103 PolarHBondContact N-O 3.48Å; F95-T105 HydrophobicContact CE2-CG2 4.1Å
96	Y	52	Low	43.7	Very low	20 Å²	20	55.6 Å²	55.6	8%	0.078	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.9	178	-68.6	-95.4	0	0	0	109.9	V69 P71 R79 W80 V82 A94 M101	V69-Y96 WeakPolarHBondContact O-CE1 3.36Å; P71-Y96 HydrophobicContact CG-CD1 4.3Å; R79-Y96 CarbonylContact C-O 3.6Å; R79-Y96 VanDerWaalsContact CA-O 3.3Å; R79-Y96 WeakPolarHBondContact CA-O 3.4Å; W80-Y96 PolarHBondContact N-O 3.16Å; W80-Y96 PolarHBondContact O-N 2.82Å; V82-Y96 HydrophobicContact CB-CD2 3.73Å; V82-Y96 HydrophobicContact CB-CE2 3.71Å; V82-Y96 HydrophobicContact CG1-CE2 4.11Å; V82-Y96 HydrophobicContact CG2-CD2 3.39Å; V82-Y96 HydrophobicContact CG2-CE2 3.82Å; V82-Y96 HydrophobicContact CG2-CG 4.34Å; A94-Y96 HydrophobicContact CB-CD2 4.3Å; A94-Y96 HydrophobicContact CB-CE2 3.65Å; Y96-M101 HydrophobicContact CD1-CB 3.94Å; Y96-M101 HydrophobicContact CE1-CB 3.75Å; Y96-M101 HydrophobicContact CE1-CG 4.26Å
97	T	50	Low	43.7	Very low	13 Å²	13	50.6 Å²	50.6	8%	0.08	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	168.6	169	65.6	0	0	0	0	108.5	R79 K99 G100 Q102	R79-T97 HydrophobicContact CB-CG2 4.26Å; R79-T97 HydrophobicContact CG-CG2 3.78Å; T97-K99 PolarHBondContact O-N 3.4Å; T97-K99 PolarHBondContact OG1-N 3.15Å; T97-G100 PolarHBondContact N-O 2.78Å; T97-G100 PolarHBondContact O-N 3.2Å; T97-G100 PolarHBondContact OG1-O 2.8Å; T97-G100 VanDerWaalsContact OG1-O 3.09Å; T97-Q102 HydrophobicContact CG2-CB 4.27Å; T97-Q102 HydrophobicContact CG2-CG 3.48Å; T97-Q102 VanDerWaalsContact CG2-CG 3.48Å; T97-Q102 VanDerWaalsContact OG1-CG 3.31Å; T97-Q102 WeakPolarHBondContact OG1-CG 3.33Å
98	G	44.8	Very low	43.6	Very low	56 Å²	56	51.6 Å²	51.6	58%	0.577	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-4.9	170.2	0	0	0	0	0	115.1
99	K	44.4	Very low	43.3	Very low	195 Å²	195	53.4 Å²	53.4	85%	0.848	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	4.1	173.4	-64.6	-170.9	177.6	-175.3	0	114.7	T97	T97-K99 PolarHBondContact O-N 3.4Å; T97-K99 PolarHBondContact OG1-N 3.15Å
100	G	45	Very low	43.1	Very low	15 Å²	15	58.8 Å²	58.8	16%	0.155	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	116.5	177.6	-173.8	0	0	0	0	0	114.5	T97 Q102	T97-G100 PolarHBondContact N-O 2.78Å; T97-G100 PolarHBondContact O-N 3.2Å; T97-G100 PolarHBondContact OG1-O 2.8Å; T97-G100 VanDerWaalsContact OG1-O 3.09Å; G100-Q102 PolarHBondContact O-N 3.39Å
101	M	47.4	Very low	42.1	Very low	98 Å²	98	65 Å²	65	48%	0.483	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	121.9	171.8	-171.3	176.2	67.1	0	0	109.4	A94 F95 Y96	A94-M101 HydrophobicContact CB-CG 4.27Å; A94-M101 HydrophobicContact CB-SD 3.88Å; F95-M101 CarbonylContact O-C 3.56Å; F95-M101 WeakPolarHBondContact O-CA 3.26Å; Y96-M101 HydrophobicContact CD1-CB 3.94Å; Y96-M101 HydrophobicContact CE1-CB 3.75Å; Y96-M101 HydrophobicContact CE1-CG 4.26Å
102	Q	47.8	Very low	41.3	Very low	99 Å²	99	68.3 Å²	68.3	46%	0.463	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-26.2	-177.7	-67.6	-66.7	-58.1	0	0	112.7	F95 T97 G100	F95-Q102 PolarHBondContact O-N 3.35Å; T97-Q102 HydrophobicContact CG2-CB 4.27Å; T97-Q102 HydrophobicContact CG2-CG 3.48Å; T97-Q102 VanDerWaalsContact CG2-CG 3.48Å; T97-Q102 VanDerWaalsContact OG1-CG 3.31Å; T97-Q102 WeakPolarHBondContact OG1-CG 3.33Å; G100-Q102 PolarHBondContact O-N 3.39Å
103	L	44.1	Very low	40.3	Very low	61 Å²	61	70.7 Å²	70.7	32%	0.319	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	133	-177.6	-163.4	76.2	0	0	0	108.9	A94 F95	A94-L103 CarbonylContact C-O 3.55Å; A94-L103 WeakPolarHBondContact CA-O 3.43Å; F95-L103 HydrophobicContact CB-CB 4.04Å; F95-L103 HydrophobicContact CD2-CB 3.74Å; F95-L103 HydrophobicContact CD2-CD2 3.86Å; F95-L103 HydrophobicContact CD2-CG 4.13Å; F95-L103 WeakPolarHBondContact CD2-O 3.25Å; F95-L103 HydrophobicContact CE2-CD2 3.93Å; F95-L103 HydrophobicContact CG-CB 4.17Å; F95-L103 PolarHBondContact N-O 3.48Å
104	S	45.7	Very low	39.1	Very low	32 Å²	32	79.2 Å²	79.2	22%	0.224	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	133.1	164	61.2	0	0	0	0	107.9	L106	S104-L106 VanDerWaalsContact C-N 3.27Å; S104-L106 PolarHBondContact O-N 2.71Å
105	T	43.6	Very low	37.8	Very low	35 Å²	35	82.9 Å²	82.9	22%	0.215	49%	0.491	C	S	.	.			trans	-71.7	93.5	164.6	60.6	0	0	0	0	106.3	L19 D92 V93 F95 G107	L19-T105 HydrophobicContact CD1-CG2 4.36Å; D92-T105 WeakPolarHBondContact CB-O 3.41Å; V93-T105 PolarHBondContact N-OG1 3.05Å; V93-T105 PolarHBondContact O-N 2.9Å; V93-T105 PolarHBondContact O-OG1 2.9Å; V93-T105 VanDerWaalsContact O-OG1 3.07Å; F95-T105 HydrophobicContact CE2-CG2 4.1Å; T105-G107 PolarHBondContact O-N 2.93Å
106	L	38.7	Very low	36.5	Very low	92 Å²	92	91.4 Å²	91.4	48%	0.482	53%	0.532	S	S	.	.			trans	-60.6	99	172.1	-92.7	142.2	0	0	0	109.1	S104 V118	S104-L106 VanDerWaalsContact C-N 3.27Å; S104-L106 PolarHBondContact O-N 2.71Å; L106-V118 HydrophobicContact CD1-CG1 3.82Å
107	G	35.3	Very low	35.2	Very low	24 Å²	24	98.1 Å²	98.1	25%	0.247	57%	0.569	C	S	.	*			trans	-61.6	132.1	143.6	0	0	0	0	0	107.5	D92 T105 A109	D92-G107 WeakPolarHBondContact OD1-CA 3.38Å; D92-G107 PolarHBondContact OD1-N 3.27Å; T105-G107 PolarHBondContact O-N 2.93Å; G107-A109 VanDerWaalsContact C-N 3.32Å; G107-A109 PolarHBondContact O-N 2.64Å
108	L	26	Very low	34.3	Very low	178 Å²	178	99.2 Å²	99.2	93%	0.932	58%	0.575	S	S	*	*	S	Bend	trans	-52.4	92.2	176.2	-77.9	150.3	0	0	0	111
109	A	26.6	Very low	33.4	Very low	77 Å²	77	106.2 Å²	106.2	64%	0.636	58%	0.584	S	S	*	*			trans	-146.1	88.8	160.9	0	0	0	0	0	106.6	G107 T111	G107-A109 VanDerWaalsContact C-N 3.32Å; G107-A109 PolarHBondContact O-N 2.64Å; A109-T111 PolarHBondContact O-N 3.44Å
110	D	25.5	Very low	32.6	Very low	144 Å²	144	103.8 Å²	103.8	77%	0.77	58%	0.579	S	S	*	*			trans	-49.9	124.8	169.9	-73.3	-46.8	0	0	0	110.5
111	T	24.5	Very low	31.8	Very low	136 Å²	136	104.5 Å²	104.5	83%	0.834	59%	0.587	S	S	*	*			trans	156	79.1	136.7	45.8	0	0	0	0	111.6	A109	A109-T111 PolarHBondContact O-N 3.44Å
112	C	25.1	Very low	31.2	Very low	117 Å²	117	101.8 Å²	101.8	79%	0.791	58%	0.579	S	S	*	*			trans	-154.7	118.9	143.5	-149.3	0	0	0	0	110.3	Q114	C112-Q114 VanDerWaalsContact C-N 3.27Å; C112-Q114 PolarHBondContact O-N 3.08Å
113	G	24.2	Very low	30.2	Very low	80 Å²	80	103.7 Å²	103.7	83%	0.825	59%	0.592	S	S	*	*			trans	-75.3	54.6	-166.7	0	0	0	0	0	116
114	Q	25.5	Very low	29.5	Very low	180 Å²	180	107 Å²	107	84%	0.841	61%	0.61	S	S	*	*			trans	-133.9	82.5	165.4	-69.3	-153	-9.9	0	0	110.3	C112	C112-Q114 VanDerWaalsContact C-N 3.27Å; C112-Q114 PolarHBondContact O-N 3.08Å
115	T	25.2	Very low	29	Very low	77 Å²	77	106.3 Å²	106.3	47%	0.472	61%	0.607	S	S	.	*			trans	-136.3	96.8	173.4	44.4	0	0	0	0	110.3	V118	T115-V118 HydrophobicContact CG2-CB 4.21Å; T115-V118 HydrophobicContact CG2-CG2 4.26Å
116	Q	24.4	Very low	28.5	Very low	191 Å²	191	109.3 Å²	109.3	89%	0.893	63%	0.625	S	S	*	*	S	Bend	trans	-113.5	-22	156.3	-85.1	-174.3	-15.6	0	0	113.3
117	D	26.1	Very low	28.3	Very low	161 Å²	161	109.9 Å²	109.9	86%	0.861	63%	0.633	S	S	*	*	S	Bend	trans	-112.6	-2.1	-177.5	-75.4	-36.7	0	0	0	116.8
118	V	31.6	Very low	28.5	Very low	35 Å²	35	113 Å²	113	21%	0.212	64%	0.639	C	S	.	*	S	Bend	trans	-86	-12.7	-171.9	-175.1	0	0	0	0	113.9	L106 T115 I120	L106-V118 HydrophobicContact CD1-CG1 3.82Å; T115-V118 HydrophobicContact CG2-CB 4.21Å; T115-V118 HydrophobicContact CG2-CG2 4.26Å; V118-I120 PolarHBondContact O-N 3.24Å
119	R	24.7	Very low	29.2	Very low	203 Å²	203	105.2 Å²	105.2	77%	0.766	60%	0.599	S	S	*	*	H	α-helix	trans	-74	-23.5	-168	-77	-172.4	175.4	-142.8	-1.7	115.8
120	I	27.5	Very low	29.6	Very low	145 Å²	145	105.4 Å²	105.4	74%	0.744	60%	0.595	S	S	*	*	H	α-helix	trans	-85.5	-29.4	-174.3	-62.3	175.5	0	0	0	112.1	V118	V118-I120 PolarHBondContact O-N 3.24Å
121	G	28.4	Very low	30.1	Very low	30 Å²	30	100.6 Å²	100.6	31%	0.309	58%	0.58	S	S	.	*	H	α-helix	trans	-77.2	-30.7	177.6	0	0	0	0	0	114.4	L123 G125	G121-L123 PolarHBondContact O-N 3.34Å; G121-G125 PolarHBondContact O-N 3.39Å
122	A	34	Very low	31	Very low	40 Å²	40	95.1 Å²	95.1	33%	0.331	55%	0.545	S	S	.	.	H	α-helix	trans	-67.2	-37.1	-174.1	0	0	0	0	0	113.5	V126	A122-V126 WeakPolarHBondContact O-CG2 3.44Å; A122-V126 PolarHBondContact O-N 2.76Å
123	L	28.6	Very low	31.9	Very low	140 Å²	140	89.6 Å²	89.6	73%	0.733	51%	0.508	S	S	*	.	H	α-helix	trans	-72.1	-41.7	179.8	-107.6	109.4	0	0	0	112.8	G121 T127	G121-L123 PolarHBondContact O-N 3.34Å; L123-T127 PolarHBondContact O-OG1 3.49Å; L123-T127 VanDerWaalsContact O-OG1 3.1Å
124	L	29.3	Very low	32.6	Very low	131 Å²	131	87.9 Å²	87.9	69%	0.686	48%	0.483	S	S	*	.	H	α-helix	trans	-70	-35.9	177.6	-78.7	162.3	0	0	0	111.9	F128	L124-F128 VanDerWaalsContact O-CB 3.23Å; L124-F128 WeakPolarHBondContact O-CB 3.49Å; L124-F128 PolarHBondContact O-N 3.18Å
125	G	34.8	Very low	33.1	Very low	17 Å²	17	82.5 Å²	82.5	18%	0.175	46%	0.463	C	S	.	.	H	α-helix	trans	-65.8	-43	177.8	0	0	0	0	0	113.4	G121 L129	G121-G125 PolarHBondContact O-N 3.39Å; G125-L129 WeakPolarHBondContact O-CB 3.48Å; G125-L129 WeakPolarHBondContact O-CD1 3.15Å; G125-L129 WeakPolarHBondContact O-CG 3.44Å; G125-L129 PolarHBondContact O-N 2.72Å
126	V	33.4	Very low	33.4	Very low	97 Å²	97	85.6 Å²	85.6	59%	0.588	47%	0.472	S	S	*	.	H	α-helix	trans	-72.1	-40.4	-173.9	174.3	0	0	0	0	112.6	A122 S130	A122-V126 WeakPolarHBondContact O-CG2 3.44Å; A122-V126 PolarHBondContact O-N 2.76Å; V126-S130 PolarHBondContact O-N 2.92Å; V126-S130 VanDerWaalsContact O-N 3.15Å
127	T	33.2	Very low	33.9	Very low	104 Å²	104	79.4 Å²	79.4	64%	0.638	45%	0.447	S	S	*	.	H	α-helix	trans	-68.7	-40.8	178.2	-31.2	0	0	0	0	111.3	L123 S130 G131	L123-T127 PolarHBondContact O-OG1 3.49Å; L123-T127 VanDerWaalsContact O-OG1 3.1Å; T127-S130 PolarHBondContact O-N 3.26Å; T127-S130 PolarHBondContact O-OG 2.94Å; T127-G131 PolarHBondContact O-N 3.09Å
128	F	40.2	Very low	34.5	Very low	89 Å²	89	72.8 Å²	72.8	39%	0.39	41%	0.412	S	S	.	.	H	α-helix	trans	-71.8	-40	179.8	-168.2	-109.8	0	0	0	112.5	T25 F26 L124 S130 G131 I132	T25-F128 HydrophobicContact CG2-CZ 4.45Å; T25-F128 VanDerWaalsContact OG1-CE1 3.22Å; T25-F128 WeakPolarHBondContact OG1-CE1 3Å; F26-F128 AromaticContact CE1-CD1 3.97Å; F26-F128 HydrophobicContact CE1-CD1 3.97Å; F26-F128 HydrophobicContact CE1-CE1 4.29Å; F26-F128 HydrophobicContact CZ-CD1 4.29Å; F26-F128 HydrophobicContact CZ-CE1 4.42Å; L124-F128 VanDerWaalsContact O-CB 3.23Å; L124-F128 WeakPolarHBondContact O-CB 3.49Å; L124-F128 PolarHBondContact O-N 3.18Å; F128-S130 VanDerWaalsContact C-N 3.31Å; F128-S130 PolarHBondContact O-N 3.04Å; F128-G131 WeakPolarHBondContact O-CA 3.34Å; F128-G131 PolarHBondContact O-N 2.82Å; F128-I132 HydrophobicContact CD1-CD1 3.52Å; F128-I132 HydrophobicContact CD1-CG1 4.29Å; F128-I132 HydrophobicContact CE1-CD1 3.06Å; F128-I132 HydrophobicContact CE1-CG1 4.01Å; F128-I132 HydrophobicContact CG-CD1 4.42Å; F128-I132 HydrophobicContact CZ-CD1 3.62Å; F128-I132 HydrophobicContact CZ-CG1 4.21Å; F128-I132 PolarHBondContact O-N 2.86Å
129	L	39.8	Very low	34.5	Very low	15 Å²	15	75.4 Å²	75.4	8%	0.079	43%	0.431	C	S	.	.	H	α-helix	trans	-60.5	-38.5	172.6	-84.1	164.2	0	0	0	111.9	L19 G125 G131 I132 L133	L19-L129 HydrophobicContact CD2-CD2 3.75Å; L19-L129 HydrophobicContact CG-CD2 4.19Å; G125-L129 WeakPolarHBondContact O-CB 3.48Å; G125-L129 WeakPolarHBondContact O-CD1 3.15Å; G125-L129 WeakPolarHBondContact O-CG 3.44Å; G125-L129 PolarHBondContact O-N 2.72Å; L129-G131 PolarHBondContact O-N 2.91Å; L129-I132 PolarHBondContact O-N 3.27Å; L129-L133 HydrophobicContact CB-CD1 4.18Å; L129-L133 HydrophobicContact CD2-CD1 3.73Å; L129-L133 HydrophobicContact CD2-CG 4.37Å; L129-L133 WeakPolarHBondContact O-CA 3.37Å; L129-L133 WeakPolarHBondContact O-CB 3.39Å; L129-L133 VanDerWaalsContact O-CG 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.32Å; L129-L133 PolarHBondContact O-N 3.39Å
130	S	35.8	Very low	34.9	Very low	81 Å²	81	74 Å²	74	57%	0.566	43%	0.433	S	S	*	.	H	α-helix	trans	-64.5	-28.8	175.4	86.9	0	0	0	0	113.1	V126 T127 F128 S134	V126-S130 PolarHBondContact O-N 2.92Å; V126-S130 VanDerWaalsContact O-N 3.15Å; T127-S130 PolarHBondContact O-N 3.26Å; T127-S130 PolarHBondContact O-OG 2.94Å; F128-S130 VanDerWaalsContact C-N 3.31Å; F128-S130 PolarHBondContact O-N 3.04Å; S130-S134 PolarHBondContact O-N 3.39Å
131	G	35.7	Very low	35.2	Very low	43 Å²	43	69 Å²	69	44%	0.443	41%	0.411	S	S	.	.	H	α-helix	trans	-77	-47.7	176.3	0	0	0	0	0	112.6	T127 F128 L129 S134	T127-G131 PolarHBondContact O-N 3.09Å; F128-G131 WeakPolarHBondContact O-CA 3.34Å; F128-G131 PolarHBondContact O-N 2.82Å; L129-G131 PolarHBondContact O-N 2.91Å; G131-S134 WeakPolarHBondContact O-CB 3.23Å; G131-S134 PolarHBondContact O-N 2.89Å; G131-S134 PolarHBondContact O-OG 3.28Å
132	I	43.3	Very low	35.4	Very low	21 Å²	21	70.3 Å²	70.3	11%	0.108	42%	0.424	C	S	.	.	H	α-helix	trans	-66.2	-42.3	176.4	-67.1	176.7	0	0	0	110.9	V18 S22 F128 L129 S134 T137	V18-I132 HydrophobicContact CG1-CG2 3.47Å; V18-I132 VanDerWaalsContact CG1-CG2 3.47Å; S22-I132 WeakPolarHBondContact OG-CG2 3.36Å; F128-I132 HydrophobicContact CD1-CD1 3.52Å; F128-I132 HydrophobicContact CD1-CG1 4.29Å; F128-I132 HydrophobicContact CE1-CD1 3.06Å; F128-I132 HydrophobicContact CE1-CG1 4.01Å; F128-I132 HydrophobicContact CG-CD1 4.42Å; F128-I132 HydrophobicContact CZ-CD1 3.62Å; F128-I132 HydrophobicContact CZ-CG1 4.21Å; F128-I132 PolarHBondContact O-N 2.86Å; L129-I132 PolarHBondContact O-N 3.27Å; I132-S134 PolarHBondContact O-N 3.5Å; I132-T137 WeakPolarHBondContact O-CB 3.47Å; I132-T137 PolarHBondContact O-OG1 2.89Å
133	L	43.4	Very low	35.8	Very low	2 Å²	2	69.1 Å²	69.1	1%	0.01	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	11.2	-178.4	-65.2	165.2	0	0	0	113.4	I2 I10 V18 L129 I138	I2-L133 HydrophobicContact CD1-CD1 4.03Å; I2-L133 HydrophobicContact CG2-CD1 3.74Å; I10-L133 HydrophobicContact CD1-CB 3.66Å; I10-L133 HydrophobicContact CD1-CD1 4.06Å; I10-L133 HydrophobicContact CD1-CD2 3.95Å; I10-L133 HydrophobicContact CD1-CG 4.11Å; I10-L133 HydrophobicContact CG2-CD2 4.22Å; V18-L133 HydrophobicContact CB-CD2 3.82Å; V18-L133 HydrophobicContact CG1-CD2 3.57Å; V18-L133 HydrophobicContact CG1-CG 4.29Å; V18-L133 HydrophobicContact CG2-CD2 3.83Å; L129-L133 HydrophobicContact CB-CD1 4.18Å; L129-L133 HydrophobicContact CD2-CD1 3.73Å; L129-L133 HydrophobicContact CD2-CG 4.37Å; L129-L133 WeakPolarHBondContact O-CA 3.37Å; L129-L133 WeakPolarHBondContact O-CB 3.39Å; L129-L133 VanDerWaalsContact O-CG 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.32Å; L129-L133 PolarHBondContact O-N 3.39Å; L133-I138 HydrophobicContact CD2-CD1 4.49Å
134	S	39.9	Very low	36.5	Very low	43 Å²	43	67.5 Å²	67.5	30%	0.301	41%	0.405	S	S	.	.	S	Bend	trans	-58.9	142.3	165.3	70.6	0	0	0	0	109.1	S130 G131 I132 E136 T137	S130-S134 PolarHBondContact O-N 3.39Å; G131-S134 WeakPolarHBondContact O-CB 3.23Å; G131-S134 PolarHBondContact O-N 2.89Å; G131-S134 PolarHBondContact O-OG 3.28Å; I132-S134 PolarHBondContact O-N 3.5Å; S134-E136 PolarHBondContact O-N 3.35Å; S134-T137 PolarHBondContact O-N 2.83Å; S134-T137 VanDerWaalsContact O-N 3.08Å; S134-T137 PolarHBondContact O-OG1 2.89Å
135	T	35.7	Very low	37.6	Very low	68 Å²	68	64.7 Å²	64.7	42%	0.417	39%	0.391	S	S	.	.	H	α-helix	trans	-52.3	-21	-170.6	39.1	0	0	0	0	114.9	C8 S139	C8-T135 HydrophobicContact CB-CG2 4.22Å; T135-S139 PolarHBondContact O-N 3.46Å; T135-S139 PolarHBondContact O-OG 2.86Å
136	E	31.4	Very low	38.8	Very low	142 Å²	142	64.2 Å²	64.2	66%	0.664	39%	0.385	S	S	*	.	H	α-helix	trans	-74.2	-33.8	-178.9	-71.4	177.1	173.7	0	0	113.4	S134 S139 H140	S134-E136 PolarHBondContact O-N 3.35Å; E136-S139 VanDerWaalsContact C-OG 3.32Å; E136-S139 WeakPolarHBondContact CA-OG 3.33Å; E136-S139 PolarHBondContact O-OG 3.07Å; E136-H140 PolarHBondContact O-N 3.15Å
137	T	34.9	Very low	40.2	Very low	60 Å²	60	59.8 Å²	59.8	37%	0.368	36%	0.358	S	S	.	.	H	α-helix	trans	-78.1	-33.5	-179	-20.1	0	0	0	0	112.2	I132 S134 S139 H140 S141	I132-T137 WeakPolarHBondContact O-CB 3.47Å; I132-T137 PolarHBondContact O-OG1 2.89Å; S134-T137 PolarHBondContact O-N 2.83Å; S134-T137 VanDerWaalsContact O-N 3.08Å; S134-T137 PolarHBondContact O-OG1 2.89Å; T137-S139 VanDerWaalsContact C-N 3.31Å; T137-S139 PolarHBondContact O-N 3.12Å; T137-H140 PolarHBondContact O-N 3.31Å; T137-S141 PolarHBondContact O-N 2.84Å; T137-S141 VanDerWaalsContact O-N 3.16Å; T137-S141 PolarHBondContact O-OG 3.01Å
138	I	38.7	Very low	41.9	Very low	23 Å²	23	55 Å²	55	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-38.7	174.8	-59.5	175.8	0	0	0	110	I10 L133 H140 S141 T143	I10-I138 HydrophobicContact CD1-CD1 4.41Å; I10-I138 HydrophobicContact CG1-CD1 4.16Å; L133-I138 HydrophobicContact CD2-CD1 4.49Å; I138-H140 VanDerWaalsContact C-N 3.35Å; I138-H140 PolarHBondContact O-N 3.5Å; I138-S141 PolarHBondContact O-OG 3.48Å; I138-T143 WeakPolarHBondContact CG2-OG1 3.33Å; I138-T143 PolarHBondContact O-OG1 3.34Å; I138-T143 VanDerWaalsContact O-OG1 3.04Å
139	S	31.8	Very low	43.5	Very low	89 Å²	89	51 Å²	51	62%	0.622	31%	0.311	S	S	*	.	H	α-helix	trans	-68.6	-29.9	173.5	45.2	0	0	0	0	113.9	T135 E136 T137	T135-S139 PolarHBondContact O-N 3.46Å; T135-S139 PolarHBondContact O-OG 2.86Å; E136-S139 VanDerWaalsContact C-OG 3.32Å; E136-S139 WeakPolarHBondContact CA-OG 3.33Å; E136-S139 PolarHBondContact O-OG 3.07Å; T137-S139 VanDerWaalsContact C-N 3.31Å; T137-S139 PolarHBondContact O-N 3.12Å
140	H	32.5	Very low	45	Very low	174 Å²	174	51 Å²	51	81%	0.806	31%	0.311	S	S	*	.	H	α-helix	trans	-80.2	-27.3	-178.6	-99.2	-38.7	0	0	0	114.2	E136 T137 I138 G142	E136-H140 PolarHBondContact O-N 3.15Å; T137-H140 PolarHBondContact O-N 3.31Å; I138-H140 VanDerWaalsContact C-N 3.35Å; I138-H140 PolarHBondContact O-N 3.5Å; H140-G142 VanDerWaalsContact C-N 3.25Å; H140-G142 PolarHBondContact O-N 3.29Å
141	S	34.7	Very low	47	Very low	40 Å²	40	48 Å²	48	28%	0.28	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	3.2	176.6	58.5	0	0	0	0	114	T137 I138 T143	T137-S141 PolarHBondContact O-N 2.84Å; T137-S141 VanDerWaalsContact O-N 3.16Å; T137-S141 PolarHBondContact O-OG 3.01Å; I138-S141 PolarHBondContact O-OG 3.48Å; S141-T143 PolarHBondContact O-N 2.69Å; S141-T143 VanDerWaalsContact O-N 3.15Å; S141-T143 WeakPolarHBondContact OG-CG2 3.29Å; S141-T143 PolarHBondContact OG-OG1 2.78Å
142	G	32.9	Very low	48.9	Very low	57 Å²	57	47.1 Å²	47.1	59%	0.588	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	19.1	-174.4	0	0	0	0	0	113.2	H140 D144	H140-G142 VanDerWaalsContact C-N 3.25Å; H140-G142 PolarHBondContact O-N 3.29Å; G142-D144 PolarHBondContact O-N 3.4Å
143	T	41	Very low	50.7	Low	15 Å²	15	46.1 Å²	46.1	9%	0.092	27%	0.268	C	S	.	.			trans	-80.4	74	178.6	49.2	0	0	0	0	109.4	I138 S141 L145	I138-T143 WeakPolarHBondContact CG2-OG1 3.33Å; I138-T143 PolarHBondContact O-OG1 3.34Å; I138-T143 VanDerWaalsContact O-OG1 3.04Å; S141-T143 PolarHBondContact O-N 2.69Å; S141-T143 VanDerWaalsContact O-N 3.15Å; S141-T143 WeakPolarHBondContact OG-CG2 3.29Å; S141-T143 PolarHBondContact OG-OG1 2.78Å; T143-L145 PolarHBondContact O-N 2.91Å; T143-L145 VanDerWaalsContact O-N 3.11Å
144	D	44.9	Very low	52.4	Low	106 Å²	106	48.5 Å²	48.5	57%	0.567	28%	0.279	S	S	*	.			trans	-49.7	119.6	152.7	-92.2	-14	0	0	0	107.3	R50 G142 S146 N240	R50-D144 PolarHBondContact NH1-O 3.46Å; G142-D144 PolarHBondContact O-N 3.4Å; D144-S146 PolarHBondContact O-N 2.84Å; D144-S146 VanDerWaalsContact O-N 3.11Å; D144-N240 HydrophobicContact CB-CB 3.74Å; D144-N240 WeakPolarHBondContact CB-ND2 3.34Å; D144-N240 PolarHBondContact O-OD1 3.23Å; D144-N240 PolarHBondContact OD2-ND2 2.84Å
145	L	50.9	Low	54.2	Low	73 Å²	73	52.5 Å²	52.5	38%	0.382	30%	0.297	S	S	.	.			trans	-44.9	114.5	-174.5	-71.4	161.1	0	0	0	111.2	D14 T143 A147 N240	D14-L145 WeakPolarHBondContact OD2-CD2 3.5Å; T143-L145 PolarHBondContact O-N 2.91Å; T143-L145 VanDerWaalsContact O-N 3.11Å; L145-A147 PolarHBondContact O-N 2.95Å; L145-N240 WeakPolarHBondContact O-CA 3.47Å
146	S	59.8	Low	56.2	Low	7 Å²	7	49.9 Å²	49.9	5%	0.049	28%	0.282	C	S	.	.			trans	-86.4	96.1	-176.9	-68.9	0	0	0	0	109.6	D14 A45 D144 N240	D14-S146 WeakPolarHBondContact OD1-CB 3.33Å; D14-S146 PolarHBondContact OD1-N 2.97Å; D14-S146 PolarHBondContact OD2-N 2.85Å; A45-S146 WeakPolarHBondContact CB-O 3.41Å; D144-S146 PolarHBondContact O-N 2.84Å; D144-S146 VanDerWaalsContact O-N 3.11Å; S146-N240 PolarHBondContact OG-OD1 2.83Å
147	A	63.7	Low	58.5	Low	4 Å²	4	50.8 Å²	50.8	3%	0.033	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	137.3	174.8	0	0	0	0	0	111.4	L145 F149 K239	L145-A147 PolarHBondContact O-N 2.95Å; A147-F149 HydrophobicContact CB-CD2 4.4Å; A147-F149 HydrophobicContact CB-CE2 3.62Å; A147-F149 HydrophobicContact CB-CZ 3.99Å; A147-K239 PolarHBondContact O-N 2.85Å
148	S	68.6	Low	60.4	Low	3 Å²	3	50 Å²	50	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.2	166.8	176.5	0	0	0	0	109.9	R43 Q236 T237 R270 D271	R43-S148 PolarHBondContact O-OG 2.86Å; S148-Q236 WeakPolarHBondContact OG-CG 3.41Å; S148-Q236 PolarHBondContact OG-NE2 2.8Å; S148-T237 WeakPolarHBondContact CA-O 3.39Å; S148-R270 CarbonylContact O-C 3.52Å; S148-R270 WeakPolarHBondContact O-CA 3.32Å; S148-D271 WeakPolarHBondContact CB-OD1 3.34Å; S148-D271 PolarHBondContact N-OD1 2.76Å; S148-D271 PolarHBondContact O-N 2.99Å
149	F	73.3	Confident	62.4	Low	6 Å²	6	52.9 Å²	52.9	3%	0.026	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.2	172	-62.6	-88.3	0	0	0	109.9	A147 Y151 Q236 T237 L242 N269 R270	A147-F149 HydrophobicContact CB-CD2 4.4Å; A147-F149 HydrophobicContact CB-CE2 3.62Å; A147-F149 HydrophobicContact CB-CZ 3.99Å; F149-Y151 HydrophobicContact CB-CD2 4.42Å; F149-Y151 HydrophobicContact CB-CE2 3.65Å; F149-Q236 CarbonylContact O-C 3.57Å; F149-Q236 VanDerWaalsContact O-CA 3.23Å; F149-Q236 WeakPolarHBondContact O-CA 3.3Å; F149-T237 PolarHBondContact N-O 3.38Å; F149-T237 PolarHBondContact O-N 2.94Å; F149-L242 HydrophobicContact CE1-CD1 3.52Å; F149-L242 HydrophobicContact CE1-CG 3.88Å; F149-L242 HydrophobicContact CE2-CB 4.08Å; F149-L242 HydrophobicContact CE2-CD1 4.33Å; F149-L242 HydrophobicContact CE2-CG 3.94Å; F149-L242 HydrophobicContact CZ-CB 3.9Å; F149-L242 HydrophobicContact CZ-CD1 3.42Å; F149-L242 VanDerWaalsContact CZ-CD1 3.42Å; F149-L242 HydrophobicContact CZ-CG 3.52Å; F149-N269 CarbonylContact C-O 3.55Å; F149-N269 WeakPolarHBondContact CA-O 3.43Å; F149-R270 HydrophobicContact CD1-CB 4.04Å; F149-R270 HydrophobicContact CD1-CG 4.11Å; F149-R270 HydrophobicContact CE1-CB 3.87Å; F149-R270 HydrophobicContact CE1-CG 3.62Å; F149-R270 HydrophobicContact CZ-CG 4.03Å
150	T	72.7	Confident	64.9	Low	13 Å²	13	49.8 Å²	49.8	8%	0.08	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130	171.5	15	0	0	0	0	110.2	S234 M235 Q236 V268 N269	T150-S234 WeakPolarHBondContact CG2-OG 3.2Å; T150-M235 CarbonylContact C-O 3.59Å; T150-M235 WeakPolarHBondContact CA-O 3.39Å; T150-Q236 HydrophobicContact CG2-CB 3.97Å; T150-Q236 HydrophobicContact CG2-CG 4Å; T150-V268 CarbonylContact O-C 3.56Å; T150-V268 WeakPolarHBondContact O-CA 3.49Å; T150-N269 PolarHBondContact N-O 3.06Å; T150-N269 PolarHBondContact O-N 2.94Å; T150-N269 WeakPolarHBondContact OG1-CB 3.45Å; T150-N269 PolarHBondContact OG1-O 3Å
151	Y	77.9	Confident	67.2	Low	18 Å²	18	41.7 Å²	41.7	7%	0.071	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	108.2	177.5	-68.3	-94.6	0	0	0	108.5	F149 S234 M235 I247 F251 V268	F149-Y151 HydrophobicContact CB-CD2 4.42Å; F149-Y151 HydrophobicContact CB-CE2 3.65Å; Y151-S234 WeakPolarHBondContact O-CA 3.46Å; Y151-M235 HydrophobicContact CD2-CE 4.3Å; Y151-M235 PolarHBondContact N-O 3.33Å; Y151-M235 PolarHBondContact O-N 3.47Å; Y151-I247 HydrophobicContact CE1-CD1 4.46Å; Y151-I247 HydrophobicContact CE1-CG2 4.46Å; Y151-I247 HydrophobicContact CE2-CD1 3.89Å; Y151-I247 HydrophobicContact CE2-CG1 3.76Å; Y151-I247 WeakPolarHBondContact OH-CD1 3.32Å; Y151-F251 HydrophobicContact CD1-CZ 4.47Å; Y151-V268 HydrophobicContact CD1-CG1 4.29Å; Y151-V268 HydrophobicContact CD1-CG2 3.7Å; Y151-V268 HydrophobicContact CE1-CB 4.4Å; Y151-V268 HydrophobicContact CE1-CG1 3.82Å; Y151-V268 HydrophobicContact CE1-CG2 3.63Å
152	D	75.8	Confident	69.4	Low	26 Å²	26	45 Å²	45	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.7	-177.3	-59.4	-38.5	0	0	0	110.6	S234 T266 V267 N269	D152-S234 WeakPolarHBondContact OD1-CB 3.11Å; D152-S234 PolarHBondContact OD1-OG 3.47Å; D152-T266 WeakPolarHBondContact O-CB 3.46Å; D152-T266 PolarHBondContact O-N 3.39Å; D152-V267 HydrophobicContact CB-CB 4.22Å; D152-V267 PolarHBondContact N-O 3.33Å; D152-V267 PolarHBondContact O-N 2.72Å; D152-V267 VanDerWaalsContact O-N 3.15Å; D152-N269 PolarHBondContact OD2-ND2 2.94Å
153	F	81.2	Confident	71.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	98.4	175.3	-69.7	-99.8	0	0	0	109.3	C156 F232 A233 F251 I256 V260 E264	F153-C156 PolarHBondContact O-SG 3.5Å; F153-F232 VanDerWaalsContact O-CA 3.31Å; F153-F232 WeakPolarHBondContact O-CA 3.1Å; F153-A233 HydrophobicContact CB-CB 4.34Å; F153-A233 PolarHBondContact N-O 2.96Å; F153-A233 PolarHBondContact O-N 3.35Å; F153-F251 AromaticContact CE2-CE1 3.86Å; F153-F251 HydrophobicContact CE2-CE1 3.86Å; F153-F251 HydrophobicContact CE2-CZ 4.37Å; F153-F251 HydrophobicContact CZ-CD1 4.48Å; F153-F251 AromaticContact CZ-CE1 3.64Å; F153-F251 HydrophobicContact CZ-CE1 3.64Å; F153-F251 AromaticContact CZ-CZ 3.86Å; F153-F251 HydrophobicContact CZ-CZ 3.86Å; F153-I256 HydrophobicContact CD1-CD1 3.83Å; F153-I256 HydrophobicContact CD1-CG1 4.49Å; F153-I256 HydrophobicContact CD2-CD1 3.51Å; F153-I256 HydrophobicContact CE1-CD1 3.75Å; F153-I256 HydrophobicContact CE1-CG1 4.38Å; F153-I256 HydrophobicContact CE2-CD1 3.44Å; F153-I256 VanDerWaalsContact CE2-CD1 3.44Å; F153-I256 HydrophobicContact CG-CD1 3.71Å; F153-I256 HydrophobicContact CZ-CD1 3.57Å; F153-V260 HydrophobicContact CD1-CG1 4.33Å; F153-E264 WeakPolarHBondContact CE1-O 3.3Å
154	Q	77.9	Confident	74.2	Confident	52 Å²	52	42.8 Å²	42.8	24%	0.243	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	166.5	179	-46.2	-171.2	-8.8	0	0	111.7	C156 F232 R262 T266 V267	Q154-C156 VanDerWaalsContact C-N 3.28Å; Q154-C156 PolarHBondContact O-N 2.8Å; Q154-C156 PolarHBondContact O-SG 2.87Å; Q154-F232 HydrophobicContact CB-CD1 4.18Å; Q154-F232 HydrophobicContact CB-CE1 3.94Å; Q154-F232 HydrophobicContact CG-CD1 3.48Å; Q154-F232 VanDerWaalsContact CG-CD1 3.48Å; Q154-F232 HydrophobicContact CG-CE1 3.26Å; Q154-F232 HydrophobicContact CG-CZ 4.21Å; Q154-R262 PolarHBondContact O-NH2 3.04Å; Q154-T266 HydrophobicContact CB-CG2 3.97Å; Q154-T266 HydrophobicContact CG-CG2 3.76Å; Q154-T266 PolarHBondContact N-OG1 3.21Å; Q154-T266 VanDerWaalsContact N-OG1 3.11Å; Q154-V267 VanDerWaalsContact NE2-CG2 3.29Å
155	N	77.3	Confident	76.1	Confident	127 Å²	127	38.7 Å²	38.7	68%	0.679	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	57.3	35.2	177.8	-56.9	-41.2	0	0	0	114.4	P230	N155-P230 HydrophobicContact CB-CB 4.14Å; N155-P230 WeakPolarHBondContact OD1-CB 3.25Å; N155-P230 WeakPolarHBondContact OD1-CG 3.47Å
156	C	77.5	Confident	77.8	Confident	13 Å²	13	37.7 Å²	37.7	9%	0.088	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	146.5	179.1	-53.7	0	0	0	0	112	F153 Q154 C161 Q231 V260	F153-C156 PolarHBondContact O-SG 3.5Å; Q154-C156 VanDerWaalsContact C-N 3.28Å; Q154-C156 PolarHBondContact O-N 2.8Å; Q154-C156 PolarHBondContact O-SG 2.87Å; C156-C161 WeakPolarHBondContact CB-SG 3.32Å; C156-Q231 HydrophobicContact CB-CB 4.49Å; C156-Q231 PolarHBondContact N-O 2.92Å; C156-V260 HydrophobicContact CB-CG1 4.33Å; C156-V260 HydrophobicContact CB-CG2 4.47Å; C156-V260 WeakPolarHBondContact SG-CG1 3.44Å
157	H	79.9	Confident	79.3	Confident	161 Å²	161	39.5 Å²	39.5	75%	0.745	23%	0.233	S	C	*	.			trans	-68.3	137.5	176.3	-106.1	-51.1	0	0	0	111.9	A159 A160 C161	H157-A159 PolarHBondContact O-N 3.07Å; H157-A160 HydrophobicContact CB-CB 4.15Å; H157-A160 PolarHBondContact O-N 3.06Å; H157-A160 VanDerWaalsContact O-N 3.12Å; H157-C161 PolarHBondContact O-N 2.98Å
158	A	75.6	Confident	80.6	Confident	43 Å²	43	39.4 Å²	39.4	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-58.8	-50.9	-172.6	0	0	0	0	0	115.1	A160 C161 H162 Q231	A158-A160 PolarHBondContact O-N 2.62Å; A158-C161 PolarHBondContact O-N 3.42Å; A158-H162 PolarHBondContact O-N 3.32Å; A158-H162 VanDerWaalsContact O-N 3.1Å; A158-Q231 VanDerWaalsContact CA-NE2 3.27Å; A158-Q231 VanDerWaalsContact CA-OE1 3.27Å; A158-Q231 HydrophobicContact CB-CG 4.31Å; A158-Q231 PolarHBondContact O-OE1 3Å
159	A	81.2	Confident	81.6	Confident	83 Å²	83	42.6 Å²	42.6	69%	0.686	25%	0.247	S	C	*	.	H	α-helix	trans	-62.1	-35.2	178.8	0	0	0	0	0	111.9	H157 G163	H157-A159 PolarHBondContact O-N 3.07Å; A159-G163 PolarHBondContact O-N 2.9Å
160	A	84.1	Confident	82.5	Confident	25 Å²	25	48.5 Å²	48.5	21%	0.207	27%	0.274	C	S	.	.	H	α-helix	trans	-71	-44.1	-179.1	0	0	0	0	0	112.1	H157 A158 G163 M164 F259	H157-A160 HydrophobicContact CB-CB 4.15Å; H157-A160 PolarHBondContact O-N 3.06Å; H157-A160 VanDerWaalsContact O-N 3.12Å; A158-A160 PolarHBondContact O-N 2.62Å; A160-G163 PolarHBondContact O-N 3.43Å; A160-M164 WeakPolarHBondContact O-CB 3.47Å; A160-M164 PolarHBondContact O-N 2.91Å; A160-F259 HydrophobicContact CB-CB 4.45Å; A160-F259 VanDerWaalsContact CB-O 3.28Å; A160-F259 WeakPolarHBondContact CB-O 3.2Å; A160-F259 VanDerWaalsContact O-CD1 3.3Å; A160-F259 WeakPolarHBondContact O-CD1 3.37Å
161	C	80.7	Confident	83.5	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.02	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-43.3	174.5	-73	0	0	0	0	112.1	C156 H157 A158 M164 I165 Q231	C156-C161 WeakPolarHBondContact CB-SG 3.32Å; H157-C161 PolarHBondContact O-N 2.98Å; A158-C161 PolarHBondContact O-N 3.42Å; C161-M164 WeakPolarHBondContact O-CB 3.31Å; C161-M164 PolarHBondContact O-N 3.3Å; C161-I165 WeakPolarHBondContact O-CG1 3.29Å; C161-I165 PolarHBondContact O-N 2.89Å; C161-Q231 HydrophobicContact CB-CB 4.49Å
162	H	80.4	Confident	84.1	Confident	111 Å²	111	49.7 Å²	49.7	51%	0.514	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-42.8	175.1	-73.7	157.6	0	0	0	112	A158 M164 I165 S166	A158-H162 PolarHBondContact O-N 3.32Å; A158-H162 VanDerWaalsContact O-N 3.1Å; H162-M164 VanDerWaalsContact C-N 3.31Å; H162-M164 PolarHBondContact O-N 3.27Å; H162-I165 PolarHBondContact O-N 3.11Å; H162-S166 VanDerWaalsContact O-CB 3.25Å; H162-S166 WeakPolarHBondContact O-CB 3.25Å; H162-S166 PolarHBondContact O-N 3.1Å
163	G	85.5	Confident	84.8	Confident	24 Å²	24	52.1 Å²	52.1	25%	0.247	30%	0.299	C	S	.	.	H	α-helix	trans	-59.1	-42.2	174.6	0	0	0	0	0	112.4	A159 A160 T167 F259	A159-G163 PolarHBondContact O-N 2.9Å; A160-G163 PolarHBondContact O-N 3.43Å; G163-T167 WeakPolarHBondContact O-CB 3.14Å; G163-T167 PolarHBondContact O-N 3.43Å; G163-T167 PolarHBondContact O-OG1 3.36Å; G163-F259 VanDerWaalsContact C-CE1 3.44Å
164	M	88.3	Confident	85.4	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-53.6	176.8	-170.6	-167.4	71.5	0	0	111.6	A160 C161 H162 S166 T167 L168 A233 S254 I256 F259	A160-M164 WeakPolarHBondContact O-CB 3.47Å; A160-M164 PolarHBondContact O-N 2.91Å; C161-M164 WeakPolarHBondContact O-CB 3.31Å; C161-M164 PolarHBondContact O-N 3.3Å; H162-M164 VanDerWaalsContact C-N 3.31Å; H162-M164 PolarHBondContact O-N 3.27Å; M164-S166 PolarHBondContact O-N 3.4Å; M164-T167 PolarHBondContact O-N 3.36Å; M164-L168 WeakPolarHBondContact O-CB 3.02Å; M164-L168 PolarHBondContact O-N 3.34Å; M164-A233 HydrophobicContact CE-CB 3.78Å; M164-S254 WeakPolarHBondContact CG-O 3.39Å; M164-I256 HydrophobicContact SD-CB 4.06Å; M164-I256 HydrophobicContact SD-CD1 4.18Å; M164-I256 HydrophobicContact SD-CG1 3.83Å; M164-F259 HydrophobicContact CB-CB 3.87Å; M164-F259 HydrophobicContact CB-CD1 4.06Å; M164-F259 HydrophobicContact CB-CD2 3.61Å; M164-F259 HydrophobicContact CB-CE2 4.11Å; M164-F259 HydrophobicContact CB-CG 3.57Å; M164-F259 HydrophobicContact CG-CB 4.25Å; M164-F259 HydrophobicContact CG-CD2 3.64Å; M164-F259 HydrophobicContact CG-CE2 4.2Å; M164-F259 HydrophobicContact CG-CG 4.05Å
165	I	85.6	Confident	85.9	Confident	19 Å²	19	58.4 Å²	58.4	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-63.6	-42.3	-179.1	-66.9	-64.4	0	0	0	110.9	C161 H162 T167 L168 E169 L208 F220 P222	C161-I165 WeakPolarHBondContact O-CG1 3.29Å; C161-I165 PolarHBondContact O-N 2.89Å; H162-I165 PolarHBondContact O-N 3.11Å; I165-T167 PolarHBondContact O-N 3.05Å; I165-L168 PolarHBondContact O-N 3.12Å; I165-E169 VanDerWaalsContact O-CB 3.3Å; I165-E169 WeakPolarHBondContact O-CB 3.4Å; I165-E169 PolarHBondContact O-N 3.35Å; I165-L208 HydrophobicContact CG2-CD1 4.09Å; I165-L208 HydrophobicContact CG2-CG 4.43Å; I165-F220 HydrophobicContact CD1-CB 4.11Å; I165-P222 HydrophobicContact CG1-CB 4.05Å; I165-P222 HydrophobicContact CG1-CG 4.05Å; I165-P222 HydrophobicContact CG2-CG 4.23Å
166	S	86.7	Confident	86.6	Confident	52 Å²	52	55.3 Å²	55.3	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-42.9	178.8	-174.6	0	0	0	0	112.3	H162 M164 L168 E169 Q170	H162-S166 VanDerWaalsContact O-CB 3.25Å; H162-S166 WeakPolarHBondContact O-CB 3.25Å; H162-S166 PolarHBondContact O-N 3.1Å; M164-S166 PolarHBondContact O-N 3.4Å; S166-L168 VanDerWaalsContact C-N 3.35Å; S166-E169 PolarHBondContact O-N 3.43Å; S166-Q170 WeakPolarHBondContact O-CG 3.49Å; S166-Q170 PolarHBondContact O-N 3.43Å
167	T	90.7	Very high	87.4	Confident	46 Å²	46	54.8 Å²	54.8	28%	0.282	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-43.1	176.8	-55.4	0	0	0	0	111	G163 M164 I165 Q170 T171	G163-T167 WeakPolarHBondContact O-CB 3.14Å; G163-T167 PolarHBondContact O-N 3.43Å; G163-T167 PolarHBondContact O-OG1 3.36Å; M164-T167 PolarHBondContact O-N 3.36Å; I165-T167 PolarHBondContact O-N 3.05Å; T167-Q170 PolarHBondContact O-N 3.13Å; T167-T171 PolarHBondContact O-N 3.45Å; T167-T171 PolarHBondContact O-OG1 3.47Å
168	L	91.5	Very high	87.9	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-65.3	-43.3	177.6	-176.1	59.9	0	0	0	111.2	M164 I165 S166 Q170 T171 I172 L208 F220 L253	M164-L168 WeakPolarHBondContact O-CB 3.02Å; M164-L168 PolarHBondContact O-N 3.34Å; I165-L168 PolarHBondContact O-N 3.12Å; S166-L168 VanDerWaalsContact C-N 3.35Å; L168-Q170 PolarHBondContact O-N 3.41Å; L168-T171 WeakPolarHBondContact O-CB 3.39Å; L168-T171 PolarHBondContact O-N 3.42Å; L168-T171 VanDerWaalsContact O-N 3.12Å; L168-I172 HydrophobicContact CD1-CG2 3.8Å; L168-I172 HydrophobicContact CG-CG2 4.25Å; L168-I172 WeakPolarHBondContact O-CG1 3.08Å; L168-I172 WeakPolarHBondContact O-CG2 3.12Å; L168-I172 PolarHBondContact O-N 2.96Å; L168-L208 HydrophobicContact CB-CD1 3.86Å; L168-L208 HydrophobicContact CD2-CD1 3.89Å; L168-L208 HydrophobicContact CG-CD1 3.73Å; L168-F220 HydrophobicContact CD2-CB 3.98Å; L168-F220 HydrophobicContact CD2-CD1 3.71Å; L168-F220 HydrophobicContact CD2-CD2 3.54Å; L168-F220 HydrophobicContact CD2-CE1 3.98Å; L168-F220 HydrophobicContact CD2-CE2 3.84Å; L168-F220 HydrophobicContact CD2-CG 3.46Å; L168-F220 VanDerWaalsContact CD2-CG 3.46Å; L168-F220 HydrophobicContact CD2-CZ 4.03Å; L168-L253 HydrophobicContact CD1-CB 4.35Å; L168-L253 WeakPolarHBondContact CD1-O 3.27Å
169	E	90.2	Very high	88.6	Confident	69 Å²	69	50.1 Å²	50.1	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-49.4	176.9	-175.3	169.1	-147.9	0	0	111.2	I165 S166 T171 I172 T173 S196 L208	I165-E169 VanDerWaalsContact O-CB 3.3Å; I165-E169 WeakPolarHBondContact O-CB 3.4Å; I165-E169 PolarHBondContact O-N 3.35Å; S166-E169 PolarHBondContact O-N 3.43Å; E169-T171 PolarHBondContact O-N 3.3Å; E169-I172 PolarHBondContact O-N 3.26Å; E169-T173 HydrophobicContact CG-CG2 4.17Å; E169-T173 VanDerWaalsContact O-CB 3.32Å; E169-T173 WeakPolarHBondContact O-CB 3.5Å; E169-T173 VanDerWaalsContact O-CG2 3.27Å; E169-T173 WeakPolarHBondContact O-CG2 3.5Å; E169-T173 PolarHBondContact O-N 2.96Å; E169-T173 PolarHBondContact O-OG1 3.39Å; E169-S196 WeakPolarHBondContact OE1-CB 3.02Å; E169-S196 PolarHBondContact OE1-OG 3.04Å; E169-L208 HydrophobicContact CB-CD1 3.95Å; E169-L208 HydrophobicContact CB-CD2 3.78Å; E169-L208 HydrophobicContact CG-CD2 3.78Å
170	Q	91.5	Very high	89.2	Confident	130 Å²	130	51.7 Å²	51.7	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-58.9	-38	176.2	-70.8	174	20	0	0	112.2	S166 T167 L168 N174	S166-Q170 WeakPolarHBondContact O-CG 3.49Å; S166-Q170 PolarHBondContact O-N 3.43Å; T167-Q170 PolarHBondContact O-N 3.13Å; L168-Q170 PolarHBondContact O-N 3.41Å; Q170-N174 PolarHBondContact O-N 3.5Å
171	T	93.5	Very high	89.6	Confident	52 Å²	52	53.7 Å²	53.7	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-68.6	-48.5	179.6	-58.7	0	0	0	0	111.4	T167 L168 E169 N174 F177	T167-T171 PolarHBondContact O-N 3.45Å; T167-T171 PolarHBondContact O-OG1 3.47Å; L168-T171 WeakPolarHBondContact O-CB 3.39Å; L168-T171 PolarHBondContact O-N 3.42Å; L168-T171 VanDerWaalsContact O-N 3.12Å; E169-T171 PolarHBondContact O-N 3.3Å; T171-N174 WeakPolarHBondContact O-CB 3.4Å; T171-F177 HydrophobicContact CG2-CD2 4.05Å; T171-F177 HydrophobicContact CG2-CE2 4.07Å; T171-F177 WeakPolarHBondContact O-CB 3.41Å
172	I	91.5	Very high	90.1	Very high	4 Å²	4	56 Å²	56	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-80.1	-25.8	-172.6	73	172	0	0	0	113.5	L168 E169 N174 F177 A194 L208 I210	L168-I172 HydrophobicContact CD1-CG2 3.8Å; L168-I172 HydrophobicContact CG-CG2 4.25Å; L168-I172 WeakPolarHBondContact O-CG1 3.08Å; L168-I172 WeakPolarHBondContact O-CG2 3.12Å; L168-I172 PolarHBondContact O-N 2.96Å; E169-I172 PolarHBondContact O-N 3.26Å; I172-N174 VanDerWaalsContact C-N 3.29Å; I172-F177 HydrophobicContact CB-CD1 3.97Å; I172-F177 HydrophobicContact CB-CE1 3.93Å; I172-F177 HydrophobicContact CB-CG 4.46Å; I172-F177 HydrophobicContact CB-CZ 4.42Å; I172-F177 HydrophobicContact CG2-CD1 4.22Å; I172-F177 HydrophobicContact CG2-CE1 3.74Å; I172-F177 HydrophobicContact CG2-CE2 4.25Å; I172-F177 HydrophobicContact CG2-CZ 3.77Å; I172-A194 HydrophobicContact CB-CB 3.84Å; I172-A194 HydrophobicContact CD1-CB 4.34Å; I172-A194 HydrophobicContact CG1-CB 4.36Å; I172-L208 HydrophobicContact CD1-CB 3.64Å; I172-L208 HydrophobicContact CD1-CD1 4.21Å; I172-L208 HydrophobicContact CD1-CD2 4.06Å; I172-L208 HydrophobicContact CD1-CG 4.17Å; I172-I210 HydrophobicContact CD1-CG1 4.37Å; I172-I210 HydrophobicContact CG2-CD1 3.8Å; I172-I210 HydrophobicContact CG2-CG1 4.12Å
173	T	90.1	Very high	90.4	Very high	77 Å²	77	55.3 Å²	55.3	47%	0.472	34%	0.342	S	S	.	.	H	α-helix	trans	-83.2	-8.9	177.6	56.8	0	0	0	0	112.6	E169 A175	E169-T173 HydrophobicContact CG-CG2 4.17Å; E169-T173 VanDerWaalsContact O-CB 3.32Å; E169-T173 WeakPolarHBondContact O-CB 3.5Å; E169-T173 VanDerWaalsContact O-CG2 3.27Å; E169-T173 WeakPolarHBondContact O-CG2 3.5Å; E169-T173 PolarHBondContact O-N 2.96Å; E169-T173 PolarHBondContact O-OG1 3.39Å; T173-A175 PolarHBondContact O-N 3.24Å
174	N	93.2	Very high	90.2	Very high	84 Å²	84	55.3 Å²	55.3	45%	0.449	34%	0.34	S	S	.	.	S	Bend	trans	-64.7	132.6	172.8	-169.5	-60.9	0	0	0	110.5	Q170 T171 I172 S176 F177	Q170-N174 PolarHBondContact O-N 3.5Å; T171-N174 WeakPolarHBondContact O-CB 3.4Å; I172-N174 VanDerWaalsContact C-N 3.29Å; N174-S176 PolarHBondContact O-N 3.09Å; N174-S176 WeakPolarHBondContact OD1-CB 3.35Å; N174-S176 PolarHBondContact OD1-N 3.34Å; N174-S176 PolarHBondContact OD1-OG 2.96Å; N174-F177 WeakPolarHBondContact O-CB 3.27Å; N174-F177 PolarHBondContact O-N 3.06Å
175	A	89.4	Confident	89.8	Confident	100 Å²	100	62.1 Å²	62.1	83%	0.826	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.6	-179.8	0	0	0	0	0	113.7	T173 F177	T173-A175 PolarHBondContact O-N 3.24Å; A175-F177 VanDerWaalsContact C-N 3.25Å; A175-F177 PolarHBondContact O-N 3.32Å
176	S	91.7	Very high	89.6	Confident	63 Å²	63	71.2 Å²	71.2	44%	0.441	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.6	177.2	71.9	0	0	0	0	114.6	N174 R180	N174-S176 PolarHBondContact O-N 3.09Å; N174-S176 WeakPolarHBondContact OD1-CB 3.35Å; N174-S176 PolarHBondContact OD1-N 3.34Å; N174-S176 PolarHBondContact OD1-OG 2.96Å; S176-R180 WeakPolarHBondContact O-CG 3.3Å; S176-R180 PolarHBondContact O-NE 3.49Å; S176-R180 PolarHBondContact OG-NH2 3.41Å
177	F	93.4	Very high	89.2	Confident	1 Å²	1	72 Å²	72	0%	0.004	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-38.6	-179.7	-169.3	-101.5	0	0	0	112.3	T171 I172 N174 A175 R180 F182 V191 A194 I210 L253	T171-F177 HydrophobicContact CG2-CD2 4.05Å; T171-F177 HydrophobicContact CG2-CE2 4.07Å; T171-F177 WeakPolarHBondContact O-CB 3.41Å; I172-F177 HydrophobicContact CB-CD1 3.97Å; I172-F177 HydrophobicContact CB-CE1 3.93Å; I172-F177 HydrophobicContact CB-CG 4.46Å; I172-F177 HydrophobicContact CB-CZ 4.42Å; I172-F177 HydrophobicContact CG2-CD1 4.22Å; I172-F177 HydrophobicContact CG2-CE1 3.74Å; I172-F177 HydrophobicContact CG2-CE2 4.25Å; I172-F177 HydrophobicContact CG2-CZ 3.77Å; N174-F177 WeakPolarHBondContact O-CB 3.27Å; N174-F177 PolarHBondContact O-N 3.06Å; A175-F177 VanDerWaalsContact C-N 3.25Å; A175-F177 PolarHBondContact O-N 3.32Å; F177-R180 WeakPolarHBondContact O-CB 3.15Å; F177-R180 WeakPolarHBondContact O-CG 3.41Å; F177-R180 PolarHBondContact O-N 2.81Å; F177-F182 HydrophobicContact CE2-CE2 4.38Å; F177-F182 HydrophobicContact CE2-CZ 4.01Å; F177-F182 HydrophobicContact CZ-CE2 4.26Å; F177-F182 HydrophobicContact CZ-CZ 4.29Å; F177-V191 HydrophobicContact CD1-CG1 3.92Å; F177-V191 HydrophobicContact CD1-CG2 4.47Å; F177-V191 HydrophobicContact CE1-CB 4.41Å; F177-V191 HydrophobicContact CE1-CG1 3.86Å; F177-V191 HydrophobicContact CE1-CG2 3.85Å; F177-V191 HydrophobicContact CZ-CG2 4.17Å; F177-A194 HydrophobicContact CD1-CB 3.85Å; F177-A194 HydrophobicContact CE1-CB 3.95Å; F177-I210 HydrophobicContact CE1-CD1 4.17Å; F177-I210 HydrophobicContact CE1-CG1 4.36Å; F177-I210 HydrophobicContact CE1-CG2 4Å; F177-I210 HydrophobicContact CZ-CD1 4.14Å; F177-L253 HydrophobicContact CE2-CD2 3.87Å; F177-L253 HydrophobicContact CZ-CD2 3.97Å
178	A	90.3	Very high	89	Confident	53 Å²	53	73 Å²	73	44%	0.438	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	138.6	172.7	0	0	0	0	0	110.4	R180	A178-R180 VanDerWaalsContact C-N 3.29Å; A178-R180 PolarHBondContact O-N 2.94Å
179	G	91.3	Very high	88.7	Confident	53 Å²	53	73 Å²	73	55%	0.546	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	-10.2	-174.5	0	0	0	0	0	115	V191	G179-V191 WeakPolarHBondContact CA-O 3.47Å; G179-V191 PolarHBondContact N-O 2.92Å
180	R	93.8	Very high	88.6	Confident	116 Å²	116	71 Å²	71	44%	0.438	41%	0.407	S	S	.	.			trans	-65.2	142.1	174	-70.1	-170.5	-176.4	-164.5	1.4	111	S176 F177 A178 F182 T190 V191	S176-R180 WeakPolarHBondContact O-CG 3.3Å; S176-R180 PolarHBondContact O-NE 3.49Å; S176-R180 PolarHBondContact OG-NH2 3.41Å; F177-R180 WeakPolarHBondContact O-CB 3.15Å; F177-R180 WeakPolarHBondContact O-CG 3.41Å; F177-R180 PolarHBondContact O-N 2.81Å; A178-R180 VanDerWaalsContact C-N 3.29Å; A178-R180 PolarHBondContact O-N 2.94Å; R180-F182 HydrophobicContact CB-CE2 4.03Å; R180-F182 HydrophobicContact CB-CZ 4.23Å; R180-T190 WeakPolarHBondContact O-CA 3.41Å; R180-V191 PolarHBondContact O-N 3.33Å
181	S	92.1	Very high	88.6	Confident	68 Å²	68	64.9 Å²	64.9	48%	0.476	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132	178.7	-63.1	0	0	0	0	110.8	F189 T190	S181-F189 CarbonylContact C-O 3.54Å; S181-F189 WeakPolarHBondContact CA-O 3.27Å; S181-T190 WeakPolarHBondContact OG-CB 3.32Å; S181-T190 WeakPolarHBondContact OG-CG2 3.35Å; S181-T190 PolarHBondContact OG-OG1 3.48Å
182	F	90.7	Very high	88.4	Confident	51 Å²	51	68.7 Å²	68.7	22%	0.224	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.5	177.7	-59.1	-87.6	0	0	0	108.6	F177 R180 T188 F189 V191 I249 L253	F177-F182 HydrophobicContact CE2-CE2 4.38Å; F177-F182 HydrophobicContact CE2-CZ 4.01Å; F177-F182 HydrophobicContact CZ-CE2 4.26Å; F177-F182 HydrophobicContact CZ-CZ 4.29Å; R180-F182 HydrophobicContact CB-CE2 4.03Å; R180-F182 HydrophobicContact CB-CZ 4.23Å; F182-T188 CarbonylContact O-C 3.59Å; F182-T188 WeakPolarHBondContact O-CA 3.37Å; F182-F189 HydrophobicContact CD2-CD1 4.15Å; F182-F189 PolarHBondContact N-O 2.86Å; F182-F189 PolarHBondContact O-N 3.34Å; F182-V191 HydrophobicContact CD2-CG2 4.29Å; F182-V191 HydrophobicContact CE2-CG2 3.83Å; F182-I249 HydrophobicContact CB-CD1 3.8Å; F182-I249 HydrophobicContact CB-CG1 3.92Å; F182-I249 HydrophobicContact CB-CG2 3.79Å; F182-I249 HydrophobicContact CD1-CG2 4.42Å; F182-I249 HydrophobicContact CD2-CG2 4.37Å; F182-I249 HydrophobicContact CG-CG2 3.94Å; F182-L253 HydrophobicContact CE1-CD2 3.74Å; F182-L253 HydrophobicContact CE1-CG 4.35Å; F182-L253 HydrophobicContact CE2-CD1 4.47Å; F182-L253 HydrophobicContact CE2-CD2 4.28Å; F182-L253 HydrophobicContact CZ-CD2 3.57Å; F182-L253 HydrophobicContact CZ-CG 4.39Å
183	T	86.4	Confident	88.3	Confident	96 Å²	96	71.1 Å²	71.1	59%	0.589	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	125.4	-179.2	-57.8	0	0	0	0	110.2	Q187 T188	T183-Q187 CarbonylContact C-O 3.58Å; T183-Q187 VanDerWaalsContact CA-O 3.28Å; T183-Q187 WeakPolarHBondContact CA-O 3.31Å; T183-T188 PolarHBondContact OG1-OG1 3.44Å
184	A	81.9	Confident	88.2	Confident	25 Å²	25	68.3 Å²	68.3	21%	0.207	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	133.6	174.7	0	0	0	0	0	109.5	K186 Q187 P245 I249	A184-K186 VanDerWaalsContact C-N 3.25Å; A184-K186 PolarHBondContact O-N 3.17Å; A184-K186 VanDerWaalsContact O-N 3.12Å; A184-Q187 PolarHBondContact N-O 2.85Å; A184-Q187 PolarHBondContact O-N 3.03Å; A184-P245 HydrophobicContact CB-CB 3.8Å; A184-P245 WeakPolarHBondContact O-CB 3.1Å; A184-I249 HydrophobicContact CB-CD1 4.09Å; A184-I249 HydrophobicContact CB-CG1 4.05Å
185	E	79.9	Confident	87.9	Confident	144 Å²	144	66.4 Å²	66.4	67%	0.673	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	46.2	-177.6	-45.7	-178.4	164.5	0	0	114.3	Q187 P245	E185-Q187 PolarHBondContact O-N 3.4Å; E185-P245 HydrophobicContact CB-CG 3.79Å; E185-P245 HydrophobicContact CG-CG 4.01Å
186	K	81.2	Confident	87.7	Confident	209 Å²	209	63.4 Å²	63.4	91%	0.909	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	5	-178.4	-49.2	175.8	-179.8	177.9	0	115.9	A184	A184-K186 VanDerWaalsContact C-N 3.25Å; A184-K186 PolarHBondContact O-N 3.17Å; A184-K186 VanDerWaalsContact O-N 3.12Å
187	Q	79	Confident	86.9	Confident	69 Å²	69	61.7 Å²	61.7	32%	0.322	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.8	168	-66	-171.3	34.7	0	0	110	T183 A184 E185 P245	T183-Q187 CarbonylContact C-O 3.58Å; T183-Q187 VanDerWaalsContact CA-O 3.28Å; T183-Q187 WeakPolarHBondContact CA-O 3.31Å; A184-Q187 PolarHBondContact N-O 2.85Å; A184-Q187 PolarHBondContact O-N 3.03Å; E185-Q187 PolarHBondContact O-N 3.4Å; Q187-P245 HydrophobicContact CB-CB 4.36Å
188	T	85.4	Confident	85.6	Confident	68 Å²	68	65.7 Å²	65.7	42%	0.417	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.6	175.5	-57.8	0	0	0	0	109.7	F182 T183	F182-T188 CarbonylContact O-C 3.59Å; F182-T188 WeakPolarHBondContact O-CA 3.37Å; T183-T188 PolarHBondContact OG1-OG1 3.44Å
189	F	85.7	Confident	83.9	Confident	1 Å²	1	64.8 Å²	64.8	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	110.6	174.9	177.3	-98.1	0	0	0	108	S181 F182 V191 I210 L218 L246 I249	S181-F189 CarbonylContact C-O 3.54Å; S181-F189 WeakPolarHBondContact CA-O 3.27Å; F182-F189 HydrophobicContact CD2-CD1 4.15Å; F182-F189 PolarHBondContact N-O 2.86Å; F182-F189 PolarHBondContact O-N 3.34Å; F189-V191 HydrophobicContact CD1-CG2 4.4Å; F189-V191 HydrophobicContact CE1-CG2 4.01Å; F189-I210 HydrophobicContact CE1-CG2 3.92Å; F189-I210 HydrophobicContact CZ-CG2 4.06Å; F189-L218 HydrophobicContact CE1-CD1 4.16Å; F189-L218 HydrophobicContact CZ-CD1 4.13Å; F189-L218 HydrophobicContact CZ-CG 4.09Å; F189-L246 HydrophobicContact CB-CD1 4.32Å; F189-L246 HydrophobicContact CD2-CD1 3.47Å; F189-L246 VanDerWaalsContact CD2-CD1 3.47Å; F189-L246 HydrophobicContact CD2-CG 4.47Å; F189-L246 HydrophobicContact CE2-CD1 3.97Å; F189-L246 HydrophobicContact CG-CD1 4.1Å; F189-I249 HydrophobicContact CB-CD1 3.94Å; F189-I249 HydrophobicContact CD1-CG2 4.48Å
190	T	89.5	Confident	82	Confident	27 Å²	27	69.5 Å²	69.5	17%	0.166	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	117.1	-176.9	-58.5	0	0	0	0	109.4	R180 S181 F192 S212 I213	R180-T190 WeakPolarHBondContact O-CA 3.41Å; S181-T190 WeakPolarHBondContact OG-CB 3.32Å; S181-T190 WeakPolarHBondContact OG-CG2 3.35Å; S181-T190 PolarHBondContact OG-OG1 3.48Å; T190-F192 PolarHBondContact O-N 2.65Å; T190-S212 PolarHBondContact N-OG 2.68Å; T190-S212 CarbonylContact O-C 3.57Å; T190-S212 WeakPolarHBondContact O-CA 3.38Å; T190-S212 VanDerWaalsContact O-CB 3.3Å; T190-S212 WeakPolarHBondContact O-CB 3.47Å; T190-S212 PolarHBondContact O-OG 3.08Å; T190-I213 HydrophobicContact CG2-CD1 4.01Å; T190-I213 HydrophobicContact CG2-CG1 4.49Å; T190-I213 HydrophobicContact CG2-CG2 4.31Å; T190-I213 PolarHBondContact O-N 2.83Å
191	V	91.4	Very high	79.7	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.012	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	117.9	-176.7	-179.1	0	0	0	0	109.8	F177 G179 R180 F182 F189 A194 I210 F211	F177-V191 HydrophobicContact CD1-CG1 3.92Å; F177-V191 HydrophobicContact CD1-CG2 4.47Å; F177-V191 HydrophobicContact CE1-CB 4.41Å; F177-V191 HydrophobicContact CE1-CG1 3.86Å; F177-V191 HydrophobicContact CE1-CG2 3.85Å; F177-V191 HydrophobicContact CZ-CG2 4.17Å; G179-V191 WeakPolarHBondContact CA-O 3.47Å; G179-V191 PolarHBondContact N-O 2.92Å; R180-V191 PolarHBondContact O-N 3.33Å; F182-V191 HydrophobicContact CD2-CG2 4.29Å; F182-V191 HydrophobicContact CE2-CG2 3.83Å; F189-V191 HydrophobicContact CD1-CG2 4.4Å; F189-V191 HydrophobicContact CE1-CG2 4.01Å; V191-A194 HydrophobicContact CG1-CB 4.43Å; V191-I210 HydrophobicContact CB-CG2 4.43Å; V191-I210 HydrophobicContact CG1-CG2 3.86Å; V191-I210 HydrophobicContact CG2-CG2 3.83Å; V191-F211 CarbonylContact C-O 3.5Å
192	F	87.8	Confident	77.6	Confident	132 Å²	132	68 Å²	68	58%	0.579	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	-51.6	170.1	173.7	-116.1	0	0	0	110.6	T190 F211 I213	T190-F192 PolarHBondContact O-N 2.65Å; F192-F211 PolarHBondContact N-O 2.84Å; F192-I213 HydrophobicContact CB-CG2 4.06Å
193	T	89.4	Confident	75.4	Confident	54 Å²	54	71.4 Å²	71.4	33%	0.331	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	154.1	177.7	-171	0	0	0	0	110.6	F211	T193-F211 HydrophobicContact CG2-CB 3.96Å; T193-F211 HydrophobicContact CG2-CD2 3.72Å; T193-F211 HydrophobicContact CG2-CG 4.13Å; T193-F211 PolarHBondContact N-O 2.63Å; T193-F211 PolarHBondContact O-N 3.11Å
194	A	89	Confident	73.5	Confident	18 Å²	18	73.2 Å²	73.2	15%	0.149	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	145.4	172.1	0	0	0	0	0	110.4	I172 F177 V191 R209 I210	I172-A194 HydrophobicContact CB-CB 3.84Å; I172-A194 HydrophobicContact CD1-CB 4.34Å; I172-A194 HydrophobicContact CG1-CB 4.36Å; F177-A194 HydrophobicContact CD1-CB 3.85Å; F177-A194 HydrophobicContact CE1-CB 3.95Å; V191-A194 HydrophobicContact CG1-CB 4.43Å; A194-R209 CarbonylContact C-O 3.55Å; A194-R209 WeakPolarHBondContact CA-O 3.3Å; A194-R209 WeakPolarHBondContact CB-O 3.25Å; A194-I210 HydrophobicContact CB-CB 4.38Å; A194-I210 HydrophobicContact CB-CG1 4.11Å; A194-I210 HydrophobicContact CB-CG2 4.3Å
195	N	86.9	Confident	72.1	Confident	44 Å²	44	73.4 Å²	73.4	24%	0.235	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	159.6	-179.2	51.8	63.3	0	0	0	112.8	R209	N195-R209 PolarHBondContact N-O 3.22Å; N195-R209 PolarHBondContact O-N 2.87Å; N195-R209 PolarHBondContact OD1-NE 3.27Å; N195-R209 PolarHBondContact OD1-NH2 2.95Å
196	S	84.7	Confident	71.4	Confident	37 Å²	37	68.6 Å²	68.6	26%	0.259	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	106.5	161.5	-167.1	0	0	0	0	107.6	E169	E169-S196 WeakPolarHBondContact OE1-CB 3.02Å; E169-S196 PolarHBondContact OE1-OG 3.04Å
197	F	76.2	Confident	71.2	Confident	27 Å²	27	58.9 Å²	58.9	12%	0.118	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.1	179.3	178.9	-103.1	0	0	0	109.9	L42 H62 T64 Y199 S206 G207 R209	L42-F197 HydrophobicContact CD1-CD1 3.69Å; L42-F197 HydrophobicContact CD1-CE1 3.27Å; L42-F197 HydrophobicContact CD1-CE2 4.49Å; L42-F197 HydrophobicContact CD1-CG 4.44Å; L42-F197 HydrophobicContact CD1-CZ 3.7Å; L42-F197 HydrophobicContact CD2-CD1 3.98Å; L42-F197 HydrophobicContact CD2-CE1 4.44Å; L42-F197 HydrophobicContact CD2-CG 4.41Å; L42-F197 HydrophobicContact CG-CD1 4.49Å; L42-F197 HydrophobicContact CG-CE1 4.47Å; H62-F197 WeakPolarHBondContact O-CZ 3.44Å; T64-F197 HydrophobicContact CG2-CE1 4.24Å; F197-Y199 HydrophobicContact CE1-CD2 4.44Å; F197-Y199 AromaticContact CZ-CD2 3.97Å; F197-Y199 HydrophobicContact CZ-CD2 3.97Å; F197-S206 CarbonylContact O-C 3.58Å; F197-S206 WeakPolarHBondContact O-CA 3.29Å; F197-G207 WeakPolarHBondContact CA-O 3.36Å; F197-G207 VanDerWaalsContact CB-O 3.25Å; F197-G207 WeakPolarHBondContact CB-O 2.91Å; F197-G207 PolarHBondContact N-O 3.49Å; F197-G207 PolarHBondContact O-N 3.46Å; F197-R209 HydrophobicContact CB-CG 3.87Å; F197-R209 VanDerWaalsContact CD2-NH2 3.29Å
198	T	64.5	Low	71.4	Confident	85 Å²	85	55.8 Å²	55.8	52%	0.521	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.1	166.3	42.7	0	0	0	0	108.2
199	Y	55.5	Low	71.4	Confident	35 Å²	35	54 Å²	54	14%	0.137	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	137.1	171.7	-161.5	-101.2	0	0	0	108.9	F63 M73 F197 S201 L202	F63-Y199 HydrophobicContact CB-CE2 4.13Å; M73-Y199 PolarHBondContact O-OH 3.44Å; F197-Y199 HydrophobicContact CE1-CD2 4.44Å; F197-Y199 AromaticContact CZ-CD2 3.97Å; F197-Y199 HydrophobicContact CZ-CD2 3.97Å; Y199-S201 WeakPolarHBondContact CD1-OG 2.96Å; Y199-S201 PolarHBondContact O-N 3.15Å; Y199-L202 PolarHBondContact O-N 2.91Å; Y199-L202 VanDerWaalsContact O-N 3.17Å
200	V	50.4	Low	71.4	Confident	151 Å²	151	54 Å²	54	92%	0.915	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-9.4	-165.2	-158.1	0	0	0	0	113.8
201	S	46.4	Very low	71.2	Confident	70 Å²	70	54.5 Å²	54.5	49%	0.49	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-4.2	-178.5	61.9	0	0	0	0	116.3	Y199	Y199-S201 WeakPolarHBondContact CD1-OG 2.96Å; Y199-S201 PolarHBondContact O-N 3.15Å
202	L	46.9	Very low	70.8	Confident	84 Å²	84	54.7 Å²	54.7	44%	0.44	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	126.8	-179.9	-71.7	173	0	0	0	112.9	Y199 N204	Y199-L202 PolarHBondContact O-N 2.91Å; Y199-L202 VanDerWaalsContact O-N 3.17Å; L202-N204 PolarHBondContact O-N 3.19Å
203	T	44.7	Very low	70.5	Confident	122 Å²	122	53.8 Å²	53.8	75%	0.748	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	-11	178.9	50.3	0	0	0	0	114.5
204	N	47.2	Very low	69.8	Low	134 Å²	134	53.7 Å²	53.7	72%	0.717	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	-3.4	-163.2	-63.2	-7.4	0	0	0	115.1	L202	L202-N204 PolarHBondContact O-N 3.19Å
205	D	53.1	Low	69.1	Low	28 Å²	28	56 Å²	56	15%	0.15	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	40.8	-178.2	-90.9	13	0	0	0	111.9	T64 T66 R221	T64-D205 VanDerWaalsContact CB-OD2 3.31Å; T64-D205 WeakPolarHBondContact CB-OD2 3.28Å; T64-D205 HydrophobicContact CG2-CB 3.69Å; T64-D205 PolarHBondContact OG1-OD2 3.49Å; T64-D205 VanDerWaalsContact OG1-OD2 3.05Å; T66-D205 PolarHBondContact OG1-OD2 2.97Å; D205-R221 IonicContact OD1-CZ 3.99Å; D205-R221 IonicContact OD1-NH2 3.47Å; D205-R221 PolarHBondContact OD1-NH2 3.2Å; D205-R221 IonicContact OD2-CZ 2.65Å; D205-R221 IonicContact OD2-NH1 3.59Å; D205-R221 IonicContact OD2-NH2 3.67Å; D205-R221 PolarHBondContact OD2-NH2 3.45Å
206	S	63.7	Low	68.7	Low	44 Å²	44	54 Å²	54	31%	0.308	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	140.6	176.8	49.6	0	0	0	0	111.7	F197	F197-S206 CarbonylContact O-C 3.58Å; F197-S206 WeakPolarHBondContact O-CA 3.29Å
207	G	77.2	Confident	68.4	Low	5 Å²	5	52.6 Å²	52.6	5%	0.052	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.2	177.6	0	0	0	0	0	110.5	F197 F220	F197-G207 WeakPolarHBondContact CA-O 3.36Å; F197-G207 VanDerWaalsContact CB-O 3.25Å; F197-G207 WeakPolarHBondContact CB-O 2.91Å; F197-G207 PolarHBondContact N-O 3.49Å; F197-G207 PolarHBondContact O-N 3.46Å; G207-F220 CarbonylContact C-O 3.57Å; G207-F220 WeakPolarHBondContact CA-O 3.42Å
208	L	83.9	Confident	68.8	Low	4 Å²	4	51.3 Å²	51.3	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	131.8	175.4	-58.8	-175.6	0	0	0	109.1	I165 L168 E169 I172 M219 F220	I165-L208 HydrophobicContact CG2-CD1 4.09Å; I165-L208 HydrophobicContact CG2-CG 4.43Å; L168-L208 HydrophobicContact CB-CD1 3.86Å; L168-L208 HydrophobicContact CD2-CD1 3.89Å; L168-L208 HydrophobicContact CG-CD1 3.73Å; E169-L208 HydrophobicContact CB-CD1 3.95Å; E169-L208 HydrophobicContact CB-CD2 3.78Å; E169-L208 HydrophobicContact CG-CD2 3.78Å; I172-L208 HydrophobicContact CD1-CB 3.64Å; I172-L208 HydrophobicContact CD1-CD1 4.21Å; I172-L208 HydrophobicContact CD1-CD2 4.06Å; I172-L208 HydrophobicContact CD1-CG 4.17Å; L208-M219 CarbonylContact O-C 3.46Å; L208-M219 VanDerWaalsContact O-CA 3.29Å; L208-M219 WeakPolarHBondContact O-CA 3.15Å; L208-F220 HydrophobicContact CB-CB 4.22Å; L208-F220 PolarHBondContact N-O 3.33Å; L208-F220 PolarHBondContact O-N 3.45Å
209	R	85.1	Confident	69.6	Low	30 Å²	30	47.8 Å²	47.8	11%	0.113	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.5	-177.1	-49.2	-165.7	-67	-171.1	-8.1	110.4	L42 A194 N195 F197 F211 M219	L42-R209 HydrophobicContact CD2-CG 4.08Å; A194-R209 CarbonylContact C-O 3.55Å; A194-R209 WeakPolarHBondContact CA-O 3.3Å; A194-R209 WeakPolarHBondContact CB-O 3.25Å; N195-R209 PolarHBondContact N-O 3.22Å; N195-R209 PolarHBondContact O-N 2.87Å; N195-R209 PolarHBondContact OD1-NE 3.27Å; N195-R209 PolarHBondContact OD1-NH2 2.95Å; F197-R209 HydrophobicContact CB-CG 3.87Å; F197-R209 VanDerWaalsContact CD2-NH2 3.29Å; R209-F211 HydrophobicContact CB-CD2 4.34Å; R209-F211 HydrophobicContact CB-CE2 3.59Å; R209-F211 HydrophobicContact CB-CZ 4.11Å; R209-M219 HydrophobicContact CB-CE 4.15Å; R209-M219 HydrophobicContact CB-SD 3.41Å; R209-M219 WeakPolarHBondContact CB-SD 3.37Å; R209-M219 HydrophobicContact CG-CE 4.14Å; R209-M219 HydrophobicContact CG-SD 3.3Å; R209-M219 WeakPolarHBondContact CG-SD 3.39Å
210	I	86.9	Confident	70.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.2	173.5	-49	172.9	0	0	0	107.4	I172 F177 F189 V191 A194 R217 L218 F220 L253	I172-I210 HydrophobicContact CD1-CG1 4.37Å; I172-I210 HydrophobicContact CG2-CD1 3.8Å; I172-I210 HydrophobicContact CG2-CG1 4.12Å; F177-I210 HydrophobicContact CE1-CD1 4.17Å; F177-I210 HydrophobicContact CE1-CG1 4.36Å; F177-I210 HydrophobicContact CE1-CG2 4Å; F177-I210 HydrophobicContact CZ-CD1 4.14Å; F189-I210 HydrophobicContact CE1-CG2 3.92Å; F189-I210 HydrophobicContact CZ-CG2 4.06Å; V191-I210 HydrophobicContact CB-CG2 4.43Å; V191-I210 HydrophobicContact CG1-CG2 3.86Å; V191-I210 HydrophobicContact CG2-CG2 3.83Å; A194-I210 HydrophobicContact CB-CB 4.38Å; A194-I210 HydrophobicContact CB-CG1 4.11Å; A194-I210 HydrophobicContact CB-CG2 4.3Å; I210-R217 WeakPolarHBondContact O-CA 3.38Å; I210-L218 HydrophobicContact CB-CB 4.19Å; I210-L218 HydrophobicContact CD1-CB 4.44Å; I210-L218 HydrophobicContact CD1-CD1 4.43Å; I210-L218 PolarHBondContact N-O 2.91Å; I210-L218 PolarHBondContact O-N 2.71Å; I210-F220 HydrophobicContact CD1-CE2 4.07Å; I210-L253 HydrophobicContact CD1-CD1 4.07Å
211	F	83.8	Confident	72	Confident	38 Å²	38	40.7 Å²	40.7	17%	0.167	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.9	177.9	-59.7	-93.8	0	0	0	108.8	V191 F192 T193 R209 R217 M219	V191-F211 CarbonylContact C-O 3.5Å; F192-F211 PolarHBondContact N-O 2.84Å; T193-F211 HydrophobicContact CG2-CB 3.96Å; T193-F211 HydrophobicContact CG2-CD2 3.72Å; T193-F211 HydrophobicContact CG2-CG 4.13Å; T193-F211 PolarHBondContact N-O 2.63Å; T193-F211 PolarHBondContact O-N 3.11Å; R209-F211 HydrophobicContact CB-CD2 4.34Å; R209-F211 HydrophobicContact CB-CE2 3.59Å; R209-F211 HydrophobicContact CB-CZ 4.11Å; F211-R217 HydrophobicContact CD1-CG 4.08Å; F211-R217 HydrophobicContact CE1-CG 4.42Å; F211-M219 HydrophobicContact CE1-CE 4.04Å; F211-M219 HydrophobicContact CZ-CE 3.96Å
212	S	83.7	Confident	72.9	Confident	7 Å²	7	39 Å²	39	5%	0.049	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	158.9	175	165.3	0	0	0	0	111.8	T190 D214 I215 S216	T190-S212 PolarHBondContact N-OG 2.68Å; T190-S212 CarbonylContact O-C 3.57Å; T190-S212 WeakPolarHBondContact O-CA 3.38Å; T190-S212 VanDerWaalsContact O-CB 3.3Å; T190-S212 WeakPolarHBondContact O-CB 3.47Å; T190-S212 PolarHBondContact O-OG 3.08Å; S212-D214 WeakPolarHBondContact CB-OD1 3.46Å; S212-D214 PolarHBondContact O-N 2.86Å; S212-D214 PolarHBondContact OG-N 3.16Å; S212-D214 PolarHBondContact OG-OD1 3.18Å; S212-I215 PolarHBondContact O-N 2.83Å; S212-I215 VanDerWaalsContact O-N 3.09Å; S212-S216 PolarHBondContact N-O 2.88Å
213	I	82.5	Confident	73.7	Confident	112 Å²	112	37.2 Å²	37.2	57%	0.574	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.7	174.1	66.6	178.2	0	0	0	112.2	T190 F192 I215	T190-I213 HydrophobicContact CG2-CD1 4.01Å; T190-I213 HydrophobicContact CG2-CG1 4.49Å; T190-I213 HydrophobicContact CG2-CG2 4.31Å; T190-I213 PolarHBondContact O-N 2.83Å; F192-I213 HydrophobicContact CB-CG2 4.06Å; I213-I215 PolarHBondContact O-N 3.03Å
214	D	74.8	Confident	74	Confident	52 Å²	52	35.5 Å²	35.5	28%	0.278	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	21.5	177.5	80.5	-27.1	0	0	0	112	S212 S216 K239	S212-D214 WeakPolarHBondContact CB-OD1 3.46Å; S212-D214 PolarHBondContact O-N 2.86Å; S212-D214 PolarHBondContact OG-N 3.16Å; S212-D214 PolarHBondContact OG-OD1 3.18Å; D214-S216 PolarHBondContact O-N 3.36Å; D214-S216 WeakPolarHBondContact OD1-CB 3.43Å; D214-S216 PolarHBondContact OD1-N 3.05Å; D214-S216 PolarHBondContact OD1-OG 3.29Å; D214-S216 PolarHBondContact OD2-OG 3.21Å; D214-K239 WeakPolarHBondContact OD2-CE 3.17Å; D214-K239 IonicContact OD2-NZ 2.99Å; D214-K239 PolarHBondContact OD2-NZ 2.77Å
215	I	73.2	Confident	74.2	Confident	68 Å²	68	33.6 Å²	33.6	35%	0.349	18%	0.181	S	C	.	.	S	Bend	trans	55.5	6.3	-178.7	57.9	176.2	0	0	0	115.3	R50 S212 I213	R50-I215 HydrophobicContact CG-CD1 3.57Å; S212-I215 PolarHBondContact O-N 2.83Å; S212-I215 VanDerWaalsContact O-N 3.09Å; I213-I215 PolarHBondContact O-N 3.03Å
216	S	77.6	Confident	73.7	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.014	21%	0.206	C	C	.	.			trans	-69	146.6	170.3	-57.2	0	0	0	0	109.9	S212 D214 T238 K239	S212-S216 PolarHBondContact N-O 2.88Å; D214-S216 PolarHBondContact O-N 3.36Å; D214-S216 WeakPolarHBondContact OD1-CB 3.43Å; D214-S216 PolarHBondContact OD1-N 3.05Å; D214-S216 PolarHBondContact OD1-OG 3.29Å; D214-S216 PolarHBondContact OD2-OG 3.21Å; S216-T238 WeakPolarHBondContact CA-O 3.47Å; S216-K239 WeakPolarHBondContact OG-CD 3.3Å; S216-K239 WeakPolarHBondContact OG-CE 3.21Å
217	R	78.9	Confident	72.4	Confident	6 Å²	6	40.9 Å²	40.9	2%	0.023	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	139	-178	-38.4	-175.1	-70.6	-172.8	-0.2	111.1	T44 A45 A46 D49 H62 I210 F211 M219 T237 T238	T44-R217 PolarHBondContact O-NH2 3.48Å; A45-R217 VanDerWaalsContact C-NH2 3.27Å; A46-R217 HydrophobicContact CB-CG 4.38Å; A46-R217 VanDerWaalsContact CB-NE 3.33Å; A46-R217 VanDerWaalsContact N-NH2 3.13Å; D49-R217 IonicContact OD2-CZ 2.79Å; D49-R217 IonicContact OD2-NH1 3.85Å; D49-R217 PolarHBondContact OD2-NH1 3.35Å; D49-R217 IonicContact OD2-NH2 3.38Å; H62-R217 PolarHBondContact NE2-NH1 3.22Å; I210-R217 WeakPolarHBondContact O-CA 3.38Å; F211-R217 HydrophobicContact CD1-CG 4.08Å; F211-R217 HydrophobicContact CE1-CG 4.42Å; R217-M219 HydrophobicContact CB-CE 4.02Å; R217-T237 WeakPolarHBondContact O-CA 3.46Å; R217-T238 VanDerWaalsContact CB-OG1 3.25Å; R217-T238 WeakPolarHBondContact CB-OG1 3.24Å; R217-T238 VanDerWaalsContact CG-OG1 3.26Å; R217-T238 WeakPolarHBondContact CG-OG1 3.41Å; R217-T238 PolarHBondContact N-O 3.2Å; R217-T238 PolarHBondContact N-OG1 2.87Å; R217-T238 PolarHBondContact NE-OG1 3.03Å; R217-T238 PolarHBondContact O-N 3.43Å; R217-T238 VanDerWaalsContact O-N 3.15Å
218	L	84.7	Confident	70.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.5	166.2	-61.8	176.3	0	0	0	109.1	F189 I210 F220 Q236 T237 L246 I249 A250 L253	F189-L218 HydrophobicContact CE1-CD1 4.16Å; F189-L218 HydrophobicContact CZ-CD1 4.13Å; F189-L218 HydrophobicContact CZ-CG 4.09Å; I210-L218 HydrophobicContact CB-CB 4.19Å; I210-L218 HydrophobicContact CD1-CB 4.44Å; I210-L218 HydrophobicContact CD1-CD1 4.43Å; I210-L218 PolarHBondContact N-O 2.91Å; I210-L218 PolarHBondContact O-N 2.71Å; L218-F220 HydrophobicContact CB-CE2 3.98Å; L218-Q236 WeakPolarHBondContact CA-O 3.4Å; L218-T237 HydrophobicContact CD2-CG2 3.59Å; L218-L246 HydrophobicContact CD2-CD2 3.62Å; L218-L246 HydrophobicContact CD2-CG 3.98Å; L218-L246 HydrophobicContact CG-CD2 4.37Å; L218-I249 HydrophobicContact CD1-CG2 4.44Å; L218-A250 HydrophobicContact CD1-CB 3.75Å; L218-A250 HydrophobicContact CD2-CB 3.65Å; L218-A250 HydrophobicContact CG-CB 4.28Å; L218-L253 HydrophobicContact CD1-CD1 4.07Å
219	M	81	Confident	68.7	Low	12 Å²	12	55.3 Å²	55.3	6%	0.059	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.5	172.9	-49	-63.6	-176.1	0	0	109.7	L42 L208 R209 F211 R217 M235 Q236	L42-M219 HydrophobicContact CD2-SD 4.4Å; L208-M219 CarbonylContact O-C 3.46Å; L208-M219 VanDerWaalsContact O-CA 3.29Å; L208-M219 WeakPolarHBondContact O-CA 3.15Å; R209-M219 HydrophobicContact CB-CE 4.15Å; R209-M219 HydrophobicContact CB-SD 3.41Å; R209-M219 WeakPolarHBondContact CB-SD 3.37Å; R209-M219 HydrophobicContact CG-CE 4.14Å; R209-M219 HydrophobicContact CG-SD 3.3Å; R209-M219 WeakPolarHBondContact CG-SD 3.39Å; F211-M219 HydrophobicContact CE1-CE 4.04Å; F211-M219 HydrophobicContact CZ-CE 3.96Å; R217-M219 HydrophobicContact CB-CE 4.02Å; M219-M235 CarbonylContact O-C 3.54Å; M219-M235 WeakPolarHBondContact O-CA 3.23Å; M219-Q236 HydrophobicContact CB-CB 4.02Å; M219-Q236 HydrophobicContact CG-CB 4.44Å; M219-Q236 PolarHBondContact N-O 3.42Å; M219-Q236 PolarHBondContact O-N 3.41Å
220	F	82.3	Confident	66.6	Low	6 Å²	6	55.3 Å²	55.3	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.5	172.9	-58.4	-100	0	0	0	108.9	I165 L168 G207 L208 I210 L218 S234 M235 A250	I165-F220 HydrophobicContact CD1-CB 4.11Å; L168-F220 HydrophobicContact CD2-CB 3.98Å; L168-F220 HydrophobicContact CD2-CD1 3.71Å; L168-F220 HydrophobicContact CD2-CD2 3.54Å; L168-F220 HydrophobicContact CD2-CE1 3.98Å; L168-F220 HydrophobicContact CD2-CE2 3.84Å; L168-F220 HydrophobicContact CD2-CG 3.46Å; L168-F220 VanDerWaalsContact CD2-CG 3.46Å; L168-F220 HydrophobicContact CD2-CZ 4.03Å; G207-F220 CarbonylContact C-O 3.57Å; G207-F220 WeakPolarHBondContact CA-O 3.42Å; L208-F220 HydrophobicContact CB-CB 4.22Å; L208-F220 PolarHBondContact N-O 3.33Å; L208-F220 PolarHBondContact O-N 3.45Å; I210-F220 HydrophobicContact CD1-CE2 4.07Å; L218-F220 HydrophobicContact CB-CE2 3.98Å; F220-S234 WeakPolarHBondContact CA-O 3.38Å; F220-M235 HydrophobicContact CD1-CB 4.31Å; F220-M235 HydrophobicContact CD1-CG 3.9Å; F220-M235 HydrophobicContact CD1-SD 4.35Å; F220-M235 HydrophobicContact CE1-CB 4.34Å; F220-M235 HydrophobicContact CE1-CG 3.55Å; F220-M235 HydrophobicContact CE1-SD 3.52Å; F220-M235 VanDerWaalsContact CE1-SD 3.52Å; F220-M235 HydrophobicContact CZ-CG 4.05Å; F220-M235 HydrophobicContact CZ-SD 4.02Å; F220-A250 HydrophobicContact CE1-CB 4.44Å; F220-A250 HydrophobicContact CZ-CB 3.88Å
221	R	74.1	Confident	64.8	Low	31 Å²	31	56.4 Å²	56.4	12%	0.117	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.5	178.4	-173.8	162	164.5	169.4	-9.2	110.9	D205 F223 S234	D205-R221 IonicContact OD1-CZ 3.99Å; D205-R221 IonicContact OD1-NH2 3.47Å; D205-R221 PolarHBondContact OD1-NH2 3.2Å; D205-R221 IonicContact OD2-CZ 2.65Å; D205-R221 IonicContact OD2-NH1 3.59Å; D205-R221 IonicContact OD2-NH2 3.67Å; D205-R221 PolarHBondContact OD2-NH2 3.45Å; R221-F223 HydrophobicContact CB-CD2 4.17Å; R221-F223 HydrophobicContact CB-CE2 3.82Å; R221-F223 HydrophobicContact CG-CD2 3.76Å; R221-F223 HydrophobicContact CG-CE2 3.46Å; R221-F223 VanDerWaalsContact CG-CE2 3.46Å; R221-F223 HydrophobicContact CG-CG 4.45Å; R221-F223 HydrophobicContact CG-CZ 3.94Å; R221-F223 VanDerWaalsContact CZ-CE1 3.42Å; R221-F223 VanDerWaalsContact CZ-CZ 3.4Å; R221-F223 VanDerWaalsContact NH2-CE1 3.27Å; R221-S234 PolarHBondContact N-O 3.31Å; R221-S234 PolarHBondContact O-N 3.43Å
222	P	66.8	Low	63.3	Low	35 Å²	35	56.2 Å²	56.2	23%	0.227	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.8	161.3	28.6	-28	0	0	0	108.7	I165	I165-P222 HydrophobicContact CG1-CB 4.05Å; I165-P222 HydrophobicContact CG1-CG 4.05Å; I165-P222 HydrophobicContact CG2-CG 4.23Å
223	F	61.9	Low	61.8	Low	45 Å²	45	56.2 Å²	56.2	20%	0.197	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.5	165.7	-77.9	-88.6	0	0	0	109	R43 R221 F232	R43-F223 VanDerWaalsContact NH1-CZ 3.33Å; R221-F223 HydrophobicContact CB-CD2 4.17Å; R221-F223 HydrophobicContact CB-CE2 3.82Å; R221-F223 HydrophobicContact CG-CD2 3.76Å; R221-F223 HydrophobicContact CG-CE2 3.46Å; R221-F223 VanDerWaalsContact CG-CE2 3.46Å; R221-F223 HydrophobicContact CG-CG 4.45Å; R221-F223 HydrophobicContact CG-CZ 3.94Å; R221-F223 VanDerWaalsContact CZ-CE1 3.42Å; R221-F223 VanDerWaalsContact CZ-CZ 3.4Å; R221-F223 VanDerWaalsContact NH2-CE1 3.27Å; F223-F232 HydrophobicContact CB-CB 4.14Å; F223-F232 PolarHBondContact N-O 3.48Å; F223-F232 PolarHBondContact O-N 3.12Å
224	S	52.7	Low	60.4	Low	87 Å²	87	51.3 Å²	51.3	61%	0.608	28%	0.281	S	S	*	.			trans	-103.7	109.2	164.7	-175.7	0	0	0	0	107.3
225	I	49.7	Very low	59.5	Low	93 Å²	93	49 Å²	49	48%	0.477	27%	0.268	S	S	.	.			trans	-92.2	123.5	159.7	-28.3	177.4	0	0	0	103.7	F232	I225-F232 HydrophobicContact CD1-CD2 4.07Å; I225-F232 HydrophobicContact CD1-CE2 3.52Å; I225-F232 HydrophobicContact CD1-CZ 4.1Å; I225-F232 HydrophobicContact CG1-CD2 4.2Å; I225-F232 HydrophobicContact CG1-CE2 4Å
226	T	42.7	Very low	58.8	Low	110 Å²	110	46 Å²	46	68%	0.675	25%	0.253	S	S	*	.	S	Bend	trans	-30.2	137.8	-172.6	33.1	0	0	0	0	115	R229	T226-R229 PolarHBondContact O-N 3.47Å
227	P	36.4	Very low	57.9	Low	116 Å²	116	46.1 Å²	46.1	75%	0.753	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	145.4	177.7	-24.4	31.4	0	0	0	112.1
228	P	40.1	Very low	56.8	Low	128 Å²	128	46.2 Å²	46.2	83%	0.831	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	cis	-97	16.8	16.3	38.1	-34.1	0	0	0	113.5
229	R	43.4	Very low	55.5	Low	183 Å²	183	48 Å²	48	69%	0.691	26%	0.263	S	S	*	.	S	Bend	trans	-84.9	152.1	-168.4	-95.4	-176.6	-99.7	-109.9	1.3	113.3	T226	T226-R229 PolarHBondContact O-N 3.47Å
230	P	41.6	Very low	54.1	Low	30 Å²	30	49.4 Å²	49.4	20%	0.195	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-66.2	150.4	-161.1	25.8	-36.8	0	0	0	113.5	N155 F232	N155-P230 HydrophobicContact CB-CB 4.14Å; N155-P230 WeakPolarHBondContact OD1-CB 3.25Å; N155-P230 WeakPolarHBondContact OD1-CG 3.47Å; P230-F232 HydrophobicContact CG-CE2 3.9Å; P230-F232 HydrophobicContact CG-CZ 3.91Å; P230-F232 WeakPolarHBondContact O-CD2 3.36Å; P230-F232 WeakPolarHBondContact O-CE2 3.18Å
231	Q	49.6	Very low	52.4	Low	23 Å²	23	53.7 Å²	53.7	11%	0.107	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	138.9	173.1	-63.1	-154	-8.8	0	0	111.1	C156 A158 C161	C156-Q231 HydrophobicContact CB-CB 4.49Å; C156-Q231 PolarHBondContact N-O 2.92Å; A158-Q231 VanDerWaalsContact CA-NE2 3.27Å; A158-Q231 VanDerWaalsContact CA-OE1 3.27Å; A158-Q231 HydrophobicContact CB-CG 4.31Å; A158-Q231 PolarHBondContact O-OE1 3Å; C161-Q231 HydrophobicContact CB-CB 4.49Å
232	F	51.5	Low	51.3	Low	34 Å²	34	55.6 Å²	55.6	15%	0.149	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.7	179.3	-58.3	-109.4	0	0	0	108.1	F153 Q154 F223 I225 P230	F153-F232 VanDerWaalsContact O-CA 3.31Å; F153-F232 WeakPolarHBondContact O-CA 3.1Å; Q154-F232 HydrophobicContact CB-CD1 4.18Å; Q154-F232 HydrophobicContact CB-CE1 3.94Å; Q154-F232 HydrophobicContact CG-CD1 3.48Å; Q154-F232 VanDerWaalsContact CG-CD1 3.48Å; Q154-F232 HydrophobicContact CG-CE1 3.26Å; Q154-F232 HydrophobicContact CG-CZ 4.21Å; F223-F232 HydrophobicContact CB-CB 4.14Å; F223-F232 PolarHBondContact N-O 3.48Å; F223-F232 PolarHBondContact O-N 3.12Å; I225-F232 HydrophobicContact CD1-CD2 4.07Å; I225-F232 HydrophobicContact CD1-CE2 3.52Å; I225-F232 HydrophobicContact CD1-CZ 4.1Å; I225-F232 HydrophobicContact CG1-CD2 4.2Å; I225-F232 HydrophobicContact CG1-CE2 4Å; P230-F232 HydrophobicContact CG-CE2 3.9Å; P230-F232 HydrophobicContact CG-CZ 3.91Å; P230-F232 WeakPolarHBondContact O-CD2 3.36Å; P230-F232 WeakPolarHBondContact O-CE2 3.18Å
233	A	51.7	Low	51.1	Low	7 Å²	7	54.2 Å²	54.2	6%	0.058	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.9	158.3	0	0	0	0	0	106.9	F153 M164	F153-A233 HydrophobicContact CB-CB 4.34Å; F153-A233 PolarHBondContact N-O 2.96Å; F153-A233 PolarHBondContact O-N 3.35Å; M164-A233 HydrophobicContact CE-CB 3.78Å
234	S	54.1	Low	51.6	Low	9 Å²	9	59.1 Å²	59.1	6%	0.063	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.5	173.9	-163.8	0	0	0	0	108.8	T150 Y151 D152 F220 R221	T150-S234 WeakPolarHBondContact CG2-OG 3.2Å; Y151-S234 WeakPolarHBondContact O-CA 3.46Å; D152-S234 WeakPolarHBondContact OD1-CB 3.11Å; D152-S234 PolarHBondContact OD1-OG 3.47Å; F220-S234 WeakPolarHBondContact CA-O 3.38Å; R221-S234 PolarHBondContact N-O 3.31Å; R221-S234 PolarHBondContact O-N 3.43Å
235	M	54.6	Low	52.9	Low	3 Å²	3	55.3 Å²	55.3	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.2	174.4	-171.1	179.4	87.1	0	0	108.8	T150 Y151 M219 F220 I247 A250 F251	T150-M235 CarbonylContact C-O 3.59Å; T150-M235 WeakPolarHBondContact CA-O 3.39Å; Y151-M235 HydrophobicContact CD2-CE 4.3Å; Y151-M235 PolarHBondContact N-O 3.33Å; Y151-M235 PolarHBondContact O-N 3.47Å; M219-M235 CarbonylContact O-C 3.54Å; M219-M235 WeakPolarHBondContact O-CA 3.23Å; F220-M235 HydrophobicContact CD1-CB 4.31Å; F220-M235 HydrophobicContact CD1-CG 3.9Å; F220-M235 HydrophobicContact CD1-SD 4.35Å; F220-M235 HydrophobicContact CE1-CB 4.34Å; F220-M235 HydrophobicContact CE1-CG 3.55Å; F220-M235 HydrophobicContact CE1-SD 3.52Å; F220-M235 VanDerWaalsContact CE1-SD 3.52Å; F220-M235 HydrophobicContact CZ-CG 4.05Å; F220-M235 HydrophobicContact CZ-SD 4.02Å; M235-I247 HydrophobicContact CE-CB 4.48Å; M235-I247 HydrophobicContact CE-CG2 3.98Å; M235-A250 HydrophobicContact CE-CB 3.5Å; M235-A250 HydrophobicContact CG-CB 4.09Å; M235-A250 HydrophobicContact SD-CB 3.17Å; M235-A250 WeakPolarHBondContact SD-CB 3Å; M235-F251 HydrophobicContact CE-CD1 3.5Å; M235-F251 VanDerWaalsContact CE-CD1 3.5Å; M235-F251 HydrophobicContact CE-CE1 3.26Å; M235-F251 HydrophobicContact CE-CG 4.48Å; M235-F251 HydrophobicContact CE-CZ 4.1Å; M235-F251 HydrophobicContact SD-CD1 3.68Å; M235-F251 HydrophobicContact SD-CE1 3.85Å
236	Q	60.4	Low	54.4	Low	7 Å²	7	51 Å²	51	3%	0.033	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.4	-179	-168.9	-171.1	-14.5	0	0	110.9	L42 R43 S148 F149 T150 L218 M219	L42-Q236 PolarHBondContact O-NE2 2.96Å; L42-Q236 PolarHBondContact O-OE1 3.44Å; R43-Q236 VanDerWaalsContact CA-NE2 3.31Å; R43-Q236 VanDerWaalsContact CA-OE1 3.31Å; R43-Q236 PolarHBondContact O-NE2 3.03Å; S148-Q236 WeakPolarHBondContact OG-CG 3.41Å; S148-Q236 PolarHBondContact OG-NE2 2.8Å; F149-Q236 CarbonylContact O-C 3.57Å; F149-Q236 VanDerWaalsContact O-CA 3.23Å; F149-Q236 WeakPolarHBondContact O-CA 3.3Å; T150-Q236 HydrophobicContact CG2-CB 3.97Å; T150-Q236 HydrophobicContact CG2-CG 4Å; L218-Q236 WeakPolarHBondContact CA-O 3.4Å; M219-Q236 HydrophobicContact CB-CB 4.02Å; M219-Q236 HydrophobicContact CG-CB 4.44Å; M219-Q236 PolarHBondContact N-O 3.42Å; M219-Q236 PolarHBondContact O-N 3.41Å
237	T	57.9	Low	56.2	Low	4 Å²	4	46.5 Å²	46.5	3%	0.025	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140	173.3	68	0	0	0	0	109.6	S148 F149 R217 L218 L246 I247	S148-T237 WeakPolarHBondContact CA-O 3.39Å; F149-T237 PolarHBondContact N-O 3.38Å; F149-T237 PolarHBondContact O-N 2.94Å; R217-T237 WeakPolarHBondContact O-CA 3.46Å; L218-T237 HydrophobicContact CD2-CG2 3.59Å; T237-L246 HydrophobicContact CG2-CD2 4.07Å; T237-I247 HydrophobicContact CG2-CG1 4.18Å
238	T	55	Low	58.5	Low	7 Å²	7	42.7 Å²	42.7	4%	0.043	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111.9	171.6	54.4	0	0	0	0	107.7	A45 S216 R217	A45-T238 HydrophobicContact CB-CG2 4.2Å; S216-T238 WeakPolarHBondContact CA-O 3.47Å; R217-T238 VanDerWaalsContact CB-OG1 3.25Å; R217-T238 WeakPolarHBondContact CB-OG1 3.24Å; R217-T238 VanDerWaalsContact CG-OG1 3.26Å; R217-T238 WeakPolarHBondContact CG-OG1 3.41Å; R217-T238 PolarHBondContact N-O 3.2Å; R217-T238 PolarHBondContact N-OG1 2.87Å; R217-T238 PolarHBondContact NE-OG1 3.03Å; R217-T238 PolarHBondContact O-N 3.43Å; R217-T238 VanDerWaalsContact O-N 3.15Å
239	K	57.2	Low	60.8	Low	39 Å²	39	37.2 Å²	37.2	17%	0.17	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	149.4	172.6	-157.1	169.7	-165.7	168.1	0	109.5	A147 D214 S216 V241 S243 L246	A147-K239 PolarHBondContact O-N 2.85Å; D214-K239 WeakPolarHBondContact OD2-CE 3.17Å; D214-K239 IonicContact OD2-NZ 2.99Å; D214-K239 PolarHBondContact OD2-NZ 2.77Å; S216-K239 WeakPolarHBondContact OG-CD 3.3Å; S216-K239 WeakPolarHBondContact OG-CE 3.21Å; K239-V241 PolarHBondContact O-N 3.1Å; K239-S243 WeakPolarHBondContact CD-OG 2.76Å; K239-L246 HydrophobicContact CD-CD1 4.37Å
240	N	52	Low	62.9	Low	40 Å²	40	28.5 Å²	28.5	21%	0.214	16%	0.157	C	C	.	.	S	Bend	trans	-57.3	-17	-179.6	-73.7	-9	0	0	0	115	R50 D144 L145 S146	R50-N240 PolarHBondContact NH1-ND2 3.39Å; R50-N240 PolarHBondContact NH1-OD1 3.19Å; R50-N240 PolarHBondContact NH2-ND2 3.1Å; R50-N240 PolarHBondContact NH2-OD1 2.74Å; D144-N240 HydrophobicContact CB-CB 3.74Å; D144-N240 WeakPolarHBondContact CB-ND2 3.34Å; D144-N240 PolarHBondContact O-OD1 3.23Å; D144-N240 PolarHBondContact OD2-ND2 2.84Å; L145-N240 WeakPolarHBondContact O-CA 3.47Å; S146-N240 PolarHBondContact OG-OD1 2.83Å
241	V	47.6	Very low	65.2	Low	96 Å²	96	28.9 Å²	28.9	58%	0.582	16%	0.155	S	C	*	.	S	Bend	trans	-139.7	136.6	-178.6	-176.4	0	0	0	0	107	K239 S243	K239-V241 PolarHBondContact O-N 3.1Å; V241-S243 WeakPolarHBondContact O-CB 3.35Å; V241-S243 PolarHBondContact O-N 3.04Å; V241-S243 PolarHBondContact O-OG 2.85Å
242	L	51.4	Low	67	Low	72 Å²	72	31.3 Å²	31.3	38%	0.377	18%	0.179	S	C	.	.			trans	-52.9	85.3	173.4	-158	154.8	0	0	0	108.8	F149 K244	F149-L242 HydrophobicContact CE1-CD1 3.52Å; F149-L242 HydrophobicContact CE1-CG 3.88Å; F149-L242 HydrophobicContact CE2-CB 4.08Å; F149-L242 HydrophobicContact CE2-CD1 4.33Å; F149-L242 HydrophobicContact CE2-CG 3.94Å; F149-L242 HydrophobicContact CZ-CB 3.9Å; F149-L242 HydrophobicContact CZ-CD1 3.42Å; F149-L242 VanDerWaalsContact CZ-CD1 3.42Å; F149-L242 HydrophobicContact CZ-CG 3.52Å; L242-K244 PolarHBondContact O-N 2.99Å
243	S	62.5	Low	68.9	Low	6 Å²	6	30.8 Å²	30.8	4%	0.042	18%	0.178	C	C	.	.			trans	-99.2	92.8	-169.6	54.7	0	0	0	0	107.9	K239 V241 L246 I247	K239-S243 WeakPolarHBondContact CD-OG 2.76Å; V241-S243 WeakPolarHBondContact O-CB 3.35Å; V241-S243 PolarHBondContact O-N 3.04Å; V241-S243 PolarHBondContact O-OG 2.85Å; S243-L246 PolarHBondContact O-N 2.73Å; S243-L246 WeakPolarHBondContact OG-CB 2.94Å; S243-I247 PolarHBondContact O-N 2.88Å
244	K	72.2	Confident	70.7	Confident	148 Å²	148	30.6 Å²	30.6	64%	0.643	18%	0.176	S	C	*	.	H	α-helix	trans	-37.5	-38.3	160.2	-69.5	-179.7	178.4	178.5	0	112.7	L242 L246 I247 G248	L242-K244 PolarHBondContact O-N 2.99Å; K244-L246 PolarHBondContact O-N 3.31Å; K244-I247 PolarHBondContact O-N 3.47Å; K244-G248 PolarHBondContact O-N 2.65Å
245	P	80.1	Confident	72.5	Confident	7 Å²	7	33.8 Å²	33.8	5%	0.045	19%	0.19	C	C	.	.	H	α-helix	trans	-52.5	-49.5	171.7	-34.3	39.9	0	0	0	115.1	A184 E185 Q187 I247 G248 I249	A184-P245 HydrophobicContact CB-CB 3.8Å; A184-P245 WeakPolarHBondContact O-CB 3.1Å; E185-P245 HydrophobicContact CB-CG 3.79Å; E185-P245 HydrophobicContact CG-CG 4.01Å; Q187-P245 HydrophobicContact CB-CB 4.36Å; P245-I247 VanDerWaalsContact C-N 3.33Å; P245-I247 PolarHBondContact O-N 3.07Å; P245-G248 PolarHBondContact O-N 3Å; P245-I249 VanDerWaalsContact O-CG1 3.3Å; P245-I249 WeakPolarHBondContact O-CG1 3.34Å; P245-I249 PolarHBondContact O-N 2.73Å
246	L	80.3	Confident	74.1	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-68.3	-38.2	-175.5	-144.8	89.8	0	0	0	111.1	F189 L218 T237 K239 S243 K244 I249 A250	F189-L246 HydrophobicContact CB-CD1 4.32Å; F189-L246 HydrophobicContact CD2-CD1 3.47Å; F189-L246 VanDerWaalsContact CD2-CD1 3.47Å; F189-L246 HydrophobicContact CD2-CG 4.47Å; F189-L246 HydrophobicContact CE2-CD1 3.97Å; F189-L246 HydrophobicContact CG-CD1 4.1Å; L218-L246 HydrophobicContact CD2-CD2 3.62Å; L218-L246 HydrophobicContact CD2-CG 3.98Å; L218-L246 HydrophobicContact CG-CD2 4.37Å; T237-L246 HydrophobicContact CG2-CD2 4.07Å; K239-L246 HydrophobicContact CD-CD1 4.37Å; S243-L246 PolarHBondContact O-N 2.73Å; S243-L246 WeakPolarHBondContact OG-CB 2.94Å; K244-L246 PolarHBondContact O-N 3.31Å; L246-I249 PolarHBondContact O-N 2.73Å; L246-A250 VanDerWaalsContact O-CB 3.29Å; L246-A250 WeakPolarHBondContact O-CB 3.38Å; L246-A250 PolarHBondContact O-N 3.19Å
247	I	81.9	Confident	75.5	Confident	15 Å²	15	40.1 Å²	40.1	8%	0.077	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-44.6	175.6	-62.1	153	0	0	0	110	Y151 M235 T237 S243 K244 P245 I249 A250 F251	Y151-I247 HydrophobicContact CE1-CD1 4.46Å; Y151-I247 HydrophobicContact CE1-CG2 4.46Å; Y151-I247 HydrophobicContact CE2-CD1 3.89Å; Y151-I247 HydrophobicContact CE2-CG1 3.76Å; Y151-I247 WeakPolarHBondContact OH-CD1 3.32Å; M235-I247 HydrophobicContact CE-CB 4.48Å; M235-I247 HydrophobicContact CE-CG2 3.98Å; T237-I247 HydrophobicContact CG2-CG1 4.18Å; S243-I247 PolarHBondContact O-N 2.88Å; K244-I247 PolarHBondContact O-N 3.47Å; P245-I247 VanDerWaalsContact C-N 3.33Å; P245-I247 PolarHBondContact O-N 3.07Å; I247-I249 PolarHBondContact O-N 2.85Å; I247-A250 PolarHBondContact O-N 2.82Å; I247-F251 HydrophobicContact CG2-CD2 4.02Å; I247-F251 HydrophobicContact CG2-CE1 4.1Å; I247-F251 HydrophobicContact CG2-CE2 3.5Å; I247-F251 HydrophobicContact CG2-CZ 3.54Å; I247-F251 WeakPolarHBondContact O-CG 3.47Å; I247-F251 PolarHBondContact O-N 2.82Å
248	G	84.5	Confident	77	Confident	36 Å²	36	46.9 Å²	46.9	37%	0.371	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-44.2	175.4	0	0	0	0	0	112.6	K244 P245 A250 F251 A252	K244-G248 PolarHBondContact O-N 2.65Å; P245-G248 PolarHBondContact O-N 3Å; G248-A250 VanDerWaalsContact C-N 3.31Å; G248-A250 PolarHBondContact O-N 2.81Å; G248-F251 PolarHBondContact O-N 3.21Å; G248-A252 WeakPolarHBondContact O-CB 3.47Å; G248-A252 PolarHBondContact O-N 3.19Å
249	I	88	Confident	78.6	Confident	14 Å²	14	48.8 Å²	48.8	7%	0.072	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-44.4	174.8	-69.9	164.3	0	0	0	110.4	F182 A184 F189 L218 P245 L246 I247 A252 L253	F182-I249 HydrophobicContact CB-CD1 3.8Å; F182-I249 HydrophobicContact CB-CG1 3.92Å; F182-I249 HydrophobicContact CB-CG2 3.79Å; F182-I249 HydrophobicContact CD1-CG2 4.42Å; F182-I249 HydrophobicContact CD2-CG2 4.37Å; F182-I249 HydrophobicContact CG-CG2 3.94Å; A184-I249 HydrophobicContact CB-CD1 4.09Å; A184-I249 HydrophobicContact CB-CG1 4.05Å; F189-I249 HydrophobicContact CB-CD1 3.94Å; F189-I249 HydrophobicContact CD1-CG2 4.48Å; L218-I249 HydrophobicContact CD1-CG2 4.44Å; P245-I249 VanDerWaalsContact O-CG1 3.3Å; P245-I249 WeakPolarHBondContact O-CG1 3.34Å; P245-I249 PolarHBondContact O-N 2.73Å; L246-I249 PolarHBondContact O-N 2.73Å; I247-I249 PolarHBondContact O-N 2.85Å; I249-A252 PolarHBondContact O-N 3.19Å; I249-L253 HydrophobicContact CG2-CD1 3.7Å; I249-L253 HydrophobicContact CG2-CG 4.27Å; I249-L253 WeakPolarHBondContact O-CB 3.39Å; I249-L253 VanDerWaalsContact O-CG 3.32Å; I249-L253 WeakPolarHBondContact O-CG 3.22Å; I249-L253 PolarHBondContact O-N 3.18Å
250	A	87.6	Confident	79.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.7	-36	-177.5	0	0	0	0	0	112.6	L218 F220 M235 L246 I247 G248 S254	L218-A250 HydrophobicContact CD1-CB 3.75Å; L218-A250 HydrophobicContact CD2-CB 3.65Å; L218-A250 HydrophobicContact CG-CB 4.28Å; F220-A250 HydrophobicContact CE1-CB 4.44Å; F220-A250 HydrophobicContact CZ-CB 3.88Å; M235-A250 HydrophobicContact CE-CB 3.5Å; M235-A250 HydrophobicContact CG-CB 4.09Å; M235-A250 HydrophobicContact SD-CB 3.17Å; M235-A250 WeakPolarHBondContact SD-CB 3Å; L246-A250 VanDerWaalsContact O-CB 3.29Å; L246-A250 WeakPolarHBondContact O-CB 3.38Å; L246-A250 PolarHBondContact O-N 3.19Å; I247-A250 PolarHBondContact O-N 2.82Å; G248-A250 VanDerWaalsContact C-N 3.31Å; G248-A250 PolarHBondContact O-N 2.81Å; A250-S254 WeakPolarHBondContact O-CB 3.46Å; A250-S254 PolarHBondContact O-N 2.88Å; A250-S254 PolarHBondContact O-OG 2.87Å
251	F	88.6	Confident	81.4	Confident	38 Å²	38	49.3 Å²	49.3	17%	0.167	27%	0.274	C	S	.	.	H	α-helix	trans	-67	-38.5	170.9	-69	-15.3	0	0	0	113	Y151 F153 M235 I247 G248 S254 E255 I256 I263	Y151-F251 HydrophobicContact CD1-CZ 4.47Å; F153-F251 AromaticContact CE2-CE1 3.86Å; F153-F251 HydrophobicContact CE2-CE1 3.86Å; F153-F251 HydrophobicContact CE2-CZ 4.37Å; F153-F251 HydrophobicContact CZ-CD1 4.48Å; F153-F251 AromaticContact CZ-CE1 3.64Å; F153-F251 HydrophobicContact CZ-CE1 3.64Å; F153-F251 AromaticContact CZ-CZ 3.86Å; F153-F251 HydrophobicContact CZ-CZ 3.86Å; M235-F251 HydrophobicContact CE-CD1 3.5Å; M235-F251 VanDerWaalsContact CE-CD1 3.5Å; M235-F251 HydrophobicContact CE-CE1 3.26Å; M235-F251 HydrophobicContact CE-CG 4.48Å; M235-F251 HydrophobicContact CE-CZ 4.1Å; M235-F251 HydrophobicContact SD-CD1 3.68Å; M235-F251 HydrophobicContact SD-CE1 3.85Å; I247-F251 HydrophobicContact CG2-CD2 4.02Å; I247-F251 HydrophobicContact CG2-CE1 4.1Å; I247-F251 HydrophobicContact CG2-CE2 3.5Å; I247-F251 HydrophobicContact CG2-CZ 3.54Å; I247-F251 WeakPolarHBondContact O-CG 3.47Å; I247-F251 PolarHBondContact O-N 2.82Å; G248-F251 PolarHBondContact O-N 3.21Å; F251-S254 PolarHBondContact O-OG 2.58Å; F251-E255 PolarHBondContact O-N 3.12Å; F251-I256 HydrophobicContact CB-CG2 4.03Å; F251-I256 HydrophobicContact CD1-CG2 3.92Å; F251-I256 HydrophobicContact CG-CG2 4.1Å; F251-I256 PolarHBondContact O-N 2.96Å; F251-I263 HydrophobicContact CD2-CB 4.45Å; F251-I263 VanDerWaalsContact CE2-O 3.27Å; F251-I263 WeakPolarHBondContact CE2-O 3.43Å; F251-I263 WeakPolarHBondContact CZ-O 3.43Å
252	A	88.8	Confident	83.2	Confident	73 Å²	73	48.3 Å²	48.3	60%	0.603	26%	0.26	S	S	*	.	H	α-helix	trans	-66.8	-46.7	175.6	0	0	0	0	0	111.3	G248 I249 S254 E255	G248-A252 WeakPolarHBondContact O-CB 3.47Å; G248-A252 PolarHBondContact O-N 3.19Å; I249-A252 PolarHBondContact O-N 3.19Å; A252-S254 PolarHBondContact O-N 3.12Å; A252-E255 PolarHBondContact O-N 3.15Å
253	L	90.4	Very high	84.6	Confident	23 Å²	23	49 Å²	49	12%	0.12	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-42.6	179.2	-82	171.5	0	0	0	112.9	L168 F177 F182 I210 L218 I249 E255	L168-L253 HydrophobicContact CD1-CB 4.35Å; L168-L253 WeakPolarHBondContact CD1-O 3.27Å; F177-L253 HydrophobicContact CE2-CD2 3.87Å; F177-L253 HydrophobicContact CZ-CD2 3.97Å; F182-L253 HydrophobicContact CE1-CD2 3.74Å; F182-L253 HydrophobicContact CE1-CG 4.35Å; F182-L253 HydrophobicContact CE2-CD1 4.47Å; F182-L253 HydrophobicContact CE2-CD2 4.28Å; F182-L253 HydrophobicContact CZ-CD2 3.57Å; F182-L253 HydrophobicContact CZ-CG 4.39Å; I210-L253 HydrophobicContact CD1-CD1 4.07Å; L218-L253 HydrophobicContact CD1-CD1 4.07Å; I249-L253 HydrophobicContact CG2-CD1 3.7Å; I249-L253 HydrophobicContact CG2-CG 4.27Å; I249-L253 WeakPolarHBondContact O-CB 3.39Å; I249-L253 VanDerWaalsContact O-CG 3.32Å; I249-L253 WeakPolarHBondContact O-CG 3.22Å; I249-L253 PolarHBondContact O-N 3.18Å; L253-E255 VanDerWaalsContact C-N 3.27Å; L253-E255 PolarHBondContact O-N 3.03Å
254	S	89.7	Confident	85.5	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-78.2	-10.6	179.6	53.4	0	0	0	0	113.7	M164 A250 F251 A252 I256	M164-S254 WeakPolarHBondContact CG-O 3.39Å; A250-S254 WeakPolarHBondContact O-CB 3.46Å; A250-S254 PolarHBondContact O-N 2.88Å; A250-S254 PolarHBondContact O-OG 2.87Å; F251-S254 PolarHBondContact O-OG 2.58Å; A252-S254 PolarHBondContact O-N 3.12Å; S254-I256 PolarHBondContact O-N 2.88Å; S254-I256 VanDerWaalsContact O-N 3.1Å
255	E	91.4	Very high	85.9	Confident	77 Å²	77	50.3 Å²	50.3	36%	0.36	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	32.8	-168.6	-63.5	178.3	-120.9	0	0	112.2	F251 A252 L253 K257 K258 F259	F251-E255 PolarHBondContact O-N 3.12Å; A252-E255 PolarHBondContact O-N 3.15Å; L253-E255 VanDerWaalsContact C-N 3.27Å; L253-E255 PolarHBondContact O-N 3.03Å; E255-K257 PolarHBondContact O-N 3.35Å; E255-K258 HydrophobicContact CB-CB 4.33Å; E255-K258 HydrophobicContact CB-CD 4.35Å; E255-K258 VanDerWaalsContact O-CB 3.25Å; E255-K258 WeakPolarHBondContact O-CB 3.15Å; E255-K258 PolarHBondContact O-N 2.97Å; E255-K258 WeakPolarHBondContact OE2-CD 3.45Å; E255-K258 IonicContact OE2-NZ 3.71Å; E255-K258 PolarHBondContact OE2-NZ 3.48Å; E255-F259 HydrophobicContact CB-CD2 4.24Å; E255-F259 HydrophobicContact CB-CE2 4.03Å; E255-F259 WeakPolarHBondContact O-CD2 3.38Å
256	I	87.8	Confident	85.9	Confident	4 Å²	4	53 Å²	53	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-34.6	-166.3	-168.8	159.8	0	0	0	113.5	F153 M164 F251 S254 K258 F259 V260	F153-I256 HydrophobicContact CD1-CD1 3.83Å; F153-I256 HydrophobicContact CD1-CG1 4.49Å; F153-I256 HydrophobicContact CD2-CD1 3.51Å; F153-I256 HydrophobicContact CE1-CD1 3.75Å; F153-I256 HydrophobicContact CE1-CG1 4.38Å; F153-I256 HydrophobicContact CE2-CD1 3.44Å; F153-I256 VanDerWaalsContact CE2-CD1 3.44Å; F153-I256 HydrophobicContact CG-CD1 3.71Å; F153-I256 HydrophobicContact CZ-CD1 3.57Å; M164-I256 HydrophobicContact SD-CB 4.06Å; M164-I256 HydrophobicContact SD-CD1 4.18Å; M164-I256 HydrophobicContact SD-CG1 3.83Å; F251-I256 HydrophobicContact CB-CG2 4.03Å; F251-I256 HydrophobicContact CD1-CG2 3.92Å; F251-I256 HydrophobicContact CG-CG2 4.1Å; F251-I256 PolarHBondContact O-N 2.96Å; S254-I256 PolarHBondContact O-N 2.88Å; S254-I256 VanDerWaalsContact O-N 3.1Å; I256-K258 PolarHBondContact O-N 2.94Å; I256-F259 PolarHBondContact O-N 2.77Å; I256-V260 HydrophobicContact CD1-CG2 4.42Å; I256-V260 HydrophobicContact CG1-CB 4.13Å; I256-V260 HydrophobicContact CG1-CG2 3.75Å; I256-V260 WeakPolarHBondContact O-CB 3.03Å; I256-V260 PolarHBondContact O-N 2.7Å
257	K	90.1	Very high	85.5	Confident	138 Å²	138	54.4 Å²	54.4	60%	0.6	30%	0.299	S	S	*	.	H	α-helix	trans	-59	-35.9	177	-166.6	179.4	-178.9	-179.4	0	112.3	E255 G261 I263	E255-K257 PolarHBondContact O-N 3.35Å; K257-G261 CarbonylContact O-C 3.49Å; K257-G261 WeakPolarHBondContact O-CA 3.27Å; K257-G261 PolarHBondContact O-N 2.88Å; K257-I263 HydrophobicContact CB-CG2 3.68Å; K257-I263 HydrophobicContact CD-CG2 3.96Å; K257-I263 HydrophobicContact CG-CG2 3.91Å
258	K	90.3	Very high	85.1	Confident	147 Å²	147	54.6 Å²	54.6	64%	0.639	30%	0.301	S	S	*	.	H	α-helix	trans	-70.1	-40.3	179.7	178.4	-172.2	178.7	-172.9	0	111.6	E255 I256	E255-K258 HydrophobicContact CB-CB 4.33Å; E255-K258 HydrophobicContact CB-CD 4.35Å; E255-K258 VanDerWaalsContact O-CB 3.25Å; E255-K258 WeakPolarHBondContact O-CB 3.15Å; E255-K258 PolarHBondContact O-N 2.97Å; E255-K258 WeakPolarHBondContact OE2-CD 3.45Å; E255-K258 IonicContact OE2-NZ 3.71Å; E255-K258 PolarHBondContact OE2-NZ 3.48Å; I256-K258 PolarHBondContact O-N 2.94Å
259	F	87.6	Confident	84.4	Confident	46 Å²	46	53.7 Å²	53.7	20%	0.202	29%	0.288	C	S	.	.	H	α-helix	trans	-85.7	-45.5	-176	-68.9	-80	0	0	0	112.6	A160 G163 M164 E255 I256	A160-F259 HydrophobicContact CB-CB 4.45Å; A160-F259 VanDerWaalsContact CB-O 3.28Å; A160-F259 WeakPolarHBondContact CB-O 3.2Å; A160-F259 VanDerWaalsContact O-CD1 3.3Å; A160-F259 WeakPolarHBondContact O-CD1 3.37Å; G163-F259 VanDerWaalsContact C-CE1 3.44Å; M164-F259 HydrophobicContact CB-CB 3.87Å; M164-F259 HydrophobicContact CB-CD1 4.06Å; M164-F259 HydrophobicContact CB-CD2 3.61Å; M164-F259 HydrophobicContact CB-CE2 4.11Å; M164-F259 HydrophobicContact CB-CG 3.57Å; M164-F259 HydrophobicContact CG-CB 4.25Å; M164-F259 HydrophobicContact CG-CD2 3.64Å; M164-F259 HydrophobicContact CG-CE2 4.2Å; M164-F259 HydrophobicContact CG-CG 4.05Å; E255-F259 HydrophobicContact CB-CD2 4.24Å; E255-F259 HydrophobicContact CB-CE2 4.03Å; E255-F259 WeakPolarHBondContact O-CD2 3.38Å; I256-F259 PolarHBondContact O-N 2.77Å
260	V	84.8	Confident	83.5	Confident	30 Å²	30	57.5 Å²	57.5	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-94.6	-16.9	-174.8	-176	0	0	0	0	112.1	F153 C156 I256 R262	F153-V260 HydrophobicContact CD1-CG1 4.33Å; C156-V260 HydrophobicContact CB-CG1 4.33Å; C156-V260 HydrophobicContact CB-CG2 4.47Å; C156-V260 WeakPolarHBondContact SG-CG1 3.44Å; I256-V260 HydrophobicContact CD1-CG2 4.42Å; I256-V260 HydrophobicContact CG1-CB 4.13Å; I256-V260 HydrophobicContact CG1-CG2 3.75Å; I256-V260 WeakPolarHBondContact O-CB 3.03Å; I256-V260 PolarHBondContact O-N 2.7Å; V260-R262 VanDerWaalsContact C-N 3.29Å; V260-R262 HydrophobicContact CG1-CG 3.96Å; V260-R262 PolarHBondContact O-N 3.15Å
261	G	84.7	Confident	82.2	Confident	61 Å²	61	58.1 Å²	58.1	63%	0.629	30%	0.304	S	S	*	.	S	Bend	trans	83.7	-3.6	-178.8	0	0	0	0	0	114.7	K257	K257-G261 CarbonylContact O-C 3.49Å; K257-G261 WeakPolarHBondContact O-CA 3.27Å; K257-G261 PolarHBondContact O-N 2.88Å
262	R	84.3	Confident	80.3	Confident	75 Å²	75	56.7 Å²	56.7	28%	0.283	30%	0.301	S	S	.	.			trans	-145.5	160.3	-178.4	60.9	178.8	177.5	124.6	-1.8	112.2	Q154 V260 E264 T266	Q154-R262 PolarHBondContact O-NH2 3.04Å; V260-R262 VanDerWaalsContact C-N 3.29Å; V260-R262 HydrophobicContact CG1-CG 3.96Å; V260-R262 PolarHBondContact O-N 3.15Å; R262-E264 PolarHBondContact NH1-O 3.05Å; R262-T266 PolarHBondContact NH1-OG1 3.44Å; R262-T266 PolarHBondContact NH2-OG1 3.26Å
263	I	81.1	Confident	78	Confident	86 Å²	86	56.2 Å²	56.2	44%	0.441	29%	0.286	S	S	.	.	S	Bend	trans	-110.2	-14.7	175	58	174.5	0	0	0	112.6	F251 K257	F251-I263 HydrophobicContact CD2-CB 4.45Å; F251-I263 VanDerWaalsContact CE2-O 3.27Å; F251-I263 WeakPolarHBondContact CE2-O 3.43Å; F251-I263 WeakPolarHBondContact CZ-O 3.43Å; K257-I263 HydrophobicContact CB-CG2 3.68Å; K257-I263 HydrophobicContact CD-CG2 3.96Å; K257-I263 HydrophobicContact CG-CG2 3.91Å
264	E	81.8	Confident	75.2	Confident	155 Å²	155	62.9 Å²	62.9	72%	0.724	31%	0.31	S	S	*	.	S	Bend	trans	-81.4	121.5	176.2	-66.1	-176.7	176	0	0	109.3	F153 R262	F153-E264 WeakPolarHBondContact CE1-O 3.3Å; R262-E264 PolarHBondContact NH1-O 3.05Å
265	S	81.1	Confident	72.4	Confident	27 Å²	27	65.8 Å²	65.8	19%	0.189	33%	0.325	C	S	.	.			trans	-66.4	151.2	172.2	54.4	0	0	0	0	110.8	V268	S265-V268 WeakPolarHBondContact OG-CG2 3.31Å
266	T	79	Confident	69.2	Low	62 Å²	62	70.5 Å²	70.5	38%	0.38	35%	0.345	S	S	.	.	S	Bend	trans	-75.8	-39.5	173.2	-52.7	0	0	0	0	111.7	D152 Q154 R262	D152-T266 WeakPolarHBondContact O-CB 3.46Å; D152-T266 PolarHBondContact O-N 3.39Å; Q154-T266 HydrophobicContact CB-CG2 3.97Å; Q154-T266 HydrophobicContact CG-CG2 3.76Å; Q154-T266 PolarHBondContact N-OG1 3.21Å; Q154-T266 VanDerWaalsContact N-OG1 3.11Å; R262-T266 PolarHBondContact NH1-OG1 3.44Å; R262-T266 PolarHBondContact NH2-OG1 3.26Å
267	V	72.8	Confident	66.2	Low	33 Å²	33	79 Å²	79	20%	0.2	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136	-179.9	-178.9	0	0	0	0	108.3	D152 Q154 N269 Y274	D152-V267 HydrophobicContact CB-CB 4.22Å; D152-V267 PolarHBondContact N-O 3.33Å; D152-V267 PolarHBondContact O-N 2.72Å; D152-V267 VanDerWaalsContact O-N 3.15Å; Q154-V267 VanDerWaalsContact NE2-CG2 3.29Å; V267-N269 WeakPolarHBondContact CG1-OD1 3.3Å; V267-Y274 HydrophobicContact CG1-CD1 4.21Å
268	V	73.6	Confident	63.4	Low	19 Å²	19	78.5 Å²	78.5	12%	0.115	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.7	168.1	-174.8	0	0	0	0	106.9	T150 Y151 S265 D275	T150-V268 CarbonylContact O-C 3.56Å; T150-V268 WeakPolarHBondContact O-CA 3.49Å; Y151-V268 HydrophobicContact CD1-CG1 4.29Å; Y151-V268 HydrophobicContact CD1-CG2 3.7Å; Y151-V268 HydrophobicContact CE1-CB 4.4Å; Y151-V268 HydrophobicContact CE1-CG1 3.82Å; Y151-V268 HydrophobicContact CE1-CG2 3.63Å; S265-V268 WeakPolarHBondContact OG-CG2 3.31Å; V268-D275 PolarHBondContact O-N 3.35Å
269	N	68.5	Low	60.3	Low	17 Å²	17	76.6 Å²	76.6	9%	0.091	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.2	176	-69.1	-38.4	0	0	0	108.6	F149 T150 D152 V267 H273 Y274	F149-N269 CarbonylContact C-O 3.55Å; F149-N269 WeakPolarHBondContact CA-O 3.43Å; T150-N269 PolarHBondContact N-O 3.06Å; T150-N269 PolarHBondContact O-N 2.94Å; T150-N269 WeakPolarHBondContact OG1-CB 3.45Å; T150-N269 PolarHBondContact OG1-O 3Å; D152-N269 PolarHBondContact OD2-ND2 2.94Å; V267-N269 WeakPolarHBondContact CG1-OD1 3.3Å; N269-H273 WeakPolarHBondContact CA-O 3.49Å; N269-Y274 WeakPolarHBondContact OD1-CA 3.41Å; N269-Y274 VanDerWaalsContact OD1-CD1 3.29Å; N269-Y274 WeakPolarHBondContact OD1-CD1 3.47Å
270	R	68.7	Low	57.5	Low	94 Å²	94	84.1 Å²	84.1	36%	0.355	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.7	170.5	-177.4	-177.8	176	-173.7	0.5	108.3	S148 F149 G272 H273	S148-R270 CarbonylContact O-C 3.52Å; S148-R270 WeakPolarHBondContact O-CA 3.32Å; F149-R270 HydrophobicContact CD1-CB 4.04Å; F149-R270 HydrophobicContact CD1-CG 4.11Å; F149-R270 HydrophobicContact CE1-CB 3.87Å; F149-R270 HydrophobicContact CE1-CG 3.62Å; F149-R270 HydrophobicContact CZ-CG 4.03Å; R270-G272 PolarHBondContact O-N 3.11Å; R270-H273 PolarHBondContact N-O 2.98Å; R270-H273 WeakPolarHBondContact O-CB 3.38Å; R270-H273 PolarHBondContact O-N 2.97Å
271	D	60	Low	54.9	Low	12 Å²	12	85.6 Å²	85.6	6%	0.064	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	28.6	178	-59.3	-55	0	0	0	114.2	T11 S148 H273	T11-D271 WeakPolarHBondContact CG2-OD2 3.46Å; S148-D271 WeakPolarHBondContact CB-OD1 3.34Å; S148-D271 PolarHBondContact N-OD1 2.76Å; S148-D271 PolarHBondContact O-N 2.99Å; D271-H273 VanDerWaalsContact C-N 3.33Å
272	G	49.2	Very low	52.2	Low	9 Å²	9	86.4 Å²	86.4	9%	0.093	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-0.8	-176.4	0	0	0	0	0	114.9	C89 R270	C89-G272 PolarHBondContact SG-O 2.78Å; R270-G272 PolarHBondContact O-N 3.11Å
273	H	41.7	Very low	49.7	Very low	63 Å²	63	88.3 Å²	88.3	29%	0.292	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.3	168.7	-72.5	-77.9	0	0	0	110.6	N269 R270 D271 D275	N269-H273 WeakPolarHBondContact CA-O 3.49Å; R270-H273 PolarHBondContact N-O 2.98Å; R270-H273 WeakPolarHBondContact O-CB 3.38Å; R270-H273 PolarHBondContact O-N 2.97Å; D271-H273 VanDerWaalsContact C-N 3.33Å; H273-D275 PolarHBondContact O-N 2.84Å
274	Y	30.3	Very low	47.3	Very low	163 Å²	163	90.4 Å²	90.4	64%	0.639	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	117.8	175.3	-67.2	-83.8	0	0	0	110.4	V267 N269 F276	V267-Y274 HydrophobicContact CG1-CD1 4.21Å; N269-Y274 WeakPolarHBondContact OD1-CA 3.41Å; N269-Y274 VanDerWaalsContact OD1-CD1 3.29Å; N269-Y274 WeakPolarHBondContact OD1-CD1 3.47Å; Y274-F276 PolarHBondContact O-N 2.78Å
275	D	31.4	Very low	44.9	Very low	63 Å²	63	87.5 Å²	87.5	34%	0.337	42%	0.415	S	S	.	.			trans	-88.6	96.5	170	-157.9	-1.4	0	0	0	107.8	V268 H273 R277	V268-D275 PolarHBondContact O-N 3.35Å; H273-D275 PolarHBondContact O-N 2.84Å; D275-R277 VanDerWaalsContact C-N 3.28Å; D275-R277 PolarHBondContact O-N 2.83Å
276	F	23.8	Very low	42.6	Very low	176 Å²	176	92.8 Å²	92.8	77%	0.772	44%	0.435	S	S	*	.			trans	-66.8	91.7	173.9	-90	-88.9	0	0	0	109	Y274	Y274-F276 PolarHBondContact O-N 2.78Å
277	R	26	Very low	40.4	Very low	184 Å²	184	95.5 Å²	95.5	69%	0.694	44%	0.442	S	S	*	.			trans	61.3	118.7	172.3	-68.6	-179.4	178.6	174.4	1.2	114.6	D275 E279	D275-R277 VanDerWaalsContact C-N 3.28Å; D275-R277 PolarHBondContact O-N 2.83Å; R277-E279 PolarHBondContact O-N 2.85Å
278	L	29.6	Very low	38.4	Very low	127 Å²	127	97.4 Å²	97.4	67%	0.665	45%	0.45	S	S	*	.			trans	-60.2	60.7	150.6	-67.9	165.9	0	0	0	110.9
279	E	26.1	Very low	36.4	Very low	107 Å²	107	101.3 Å²	101.3	50%	0.5	47%	0.471	S	S	.	.			trans	-86	119.5	153.7	-86	-176.6	-170.5	0	0	106.9	R277 S281 N282	R277-E279 PolarHBondContact O-N 2.85Å; E279-S281 PolarHBondContact O-N 3.17Å; E279-N282 PolarHBondContact O-N 3.4Å
280	K	29.3	Very low	34.8	Very low	204 Å²	204	102.7 Å²	102.7	89%	0.887	48%	0.477	S	S	*	.	H	α-helix	trans	-44.2	-22.1	177.8	-101.1	177	170.4	-180	0	114.3
281	S	29.7	Very low	32.9	Very low	60 Å²	60	107.7 Å²	107.7	42%	0.42	50%	0.496	S	S	.	.	H	α-helix	trans	-73.7	-29.1	-180	41.6	0	0	0	0	114.6	E279 L285	E279-S281 PolarHBondContact O-N 3.17Å; S281-L285 PolarHBondContact O-N 2.89Å
282	N	28.4	Very low	31.6	Very low	78 Å²	78	113.8 Å²	113.8	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-83.6	-20.7	-173.2	-75.4	-16.7	0	0	0	114	E279 L285 F286	E279-N282 PolarHBondContact O-N 3.4Å; N282-L285 PolarHBondContact O-N 3.29Å; N282-F286 WeakPolarHBondContact O-CB 3.33Å; N282-F286 PolarHBondContact O-N 2.89Å
283	F	32.7	Very low	30.8	Very low	116 Å²	116	122.8 Å²	122.8	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-67.4	-44.1	173.5	-127.3	-94.6	0	0	0	110.8	F287	F283-F287 HydrophobicContact CD1-CD2 4.13Å; F283-F287 AromaticContact CD1-CE2 3.89Å; F283-F287 HydrophobicContact CD1-CE2 3.89Å; F283-F287 HydrophobicContact CE1-CD2 4.46Å; F283-F287 AromaticContact CE1-CE2 3.75Å; F283-F287 HydrophobicContact CE1-CE2 3.75Å; F283-F287 WeakPolarHBondContact O-CD2 3.37Å; F283-F287 PolarHBondContact O-N 3.49Å
284	E	30	Very low	30.4	Very low	130 Å²	130	125.8 Å²	125.8	61%	0.607	57%	0.568	S	S	*	*	H	α-helix	trans	-63.5	-43.2	174	-81.2	-75.9	155.6	0	0	111.2	F286 F287 L288	E284-F286 PolarHBondContact O-N 2.98Å; E284-F287 PolarHBondContact O-N 2.8Å; E284-L288 HydrophobicContact CB-CD1 4.19Å; E284-L288 WeakPolarHBondContact O-CB 3.18Å; E284-L288 WeakPolarHBondContact O-CD1 3.45Å; E284-L288 WeakPolarHBondContact O-CG 3.24Å; E284-L288 PolarHBondContact O-N 3.37Å
285	L	30.4	Very low	30.5	Very low	94 Å²	94	121.3 Å²	121.3	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-66.7	-36	-180	-88.2	158.4	0	0	0	114.3	S281 N282 L288 N289	S281-L285 PolarHBondContact O-N 2.89Å; N282-L285 PolarHBondContact O-N 3.29Å; L285-L288 PolarHBondContact O-N 3.09Å; L285-N289 WeakPolarHBondContact O-CB 3.05Å; L285-N289 PolarHBondContact O-N 3.31Å
286	F	33.5	Very low	30.6	Very low	138 Å²	138	129.8 Å²	129.8	61%	0.605	60%	0.601	S	S	*	*	H	α-helix	trans	-65.8	-40.2	175.4	-171.1	-99.1	0	0	0	111.3	N282 E284 I290	N282-F286 WeakPolarHBondContact O-CB 3.33Å; N282-F286 PolarHBondContact O-N 2.89Å; E284-F286 PolarHBondContact O-N 2.98Å; F286-I290 HydrophobicContact CD1-CD1 4.34Å; F286-I290 HydrophobicContact CE1-CD1 4.07Å; F286-I290 WeakPolarHBondContact O-CG1 3.41Å
287	F	32.6	Very low	30.9	Very low	119 Å²	119	127.5 Å²	127.5	52%	0.522	59%	0.593	S	S	.	*	H	α-helix	trans	-78.7	-29.8	175.3	-78.7	-76.8	0	0	0	113.8	F283 E284 I290 R291	F283-F287 HydrophobicContact CD1-CD2 4.13Å; F283-F287 AromaticContact CD1-CE2 3.89Å; F283-F287 HydrophobicContact CD1-CE2 3.89Å; F283-F287 HydrophobicContact CE1-CD2 4.46Å; F283-F287 AromaticContact CE1-CE2 3.75Å; F283-F287 HydrophobicContact CE1-CE2 3.75Å; F283-F287 WeakPolarHBondContact O-CD2 3.37Å; F283-F287 PolarHBondContact O-N 3.49Å; E284-F287 PolarHBondContact O-N 2.8Å; F287-I290 PolarHBondContact O-N 2.86Å; F287-R291 PolarHBondContact O-N 3.22Å
288	L	31.2	Very low	31.2	Very low	73 Å²	73	124.5 Å²	124.5	38%	0.382	59%	0.587	S	S	.	*	H	α-helix	trans	-70.8	-39.1	175.7	-92.3	152.9	0	0	0	112	E284 L285 I290 R291 H292	E284-L288 HydrophobicContact CB-CD1 4.19Å; E284-L288 WeakPolarHBondContact O-CB 3.18Å; E284-L288 WeakPolarHBondContact O-CD1 3.45Å; E284-L288 WeakPolarHBondContact O-CG 3.24Å; E284-L288 PolarHBondContact O-N 3.37Å; L285-L288 PolarHBondContact O-N 3.09Å; L288-I290 VanDerWaalsContact C-N 3.26Å; L288-I290 PolarHBondContact O-N 2.88Å; L288-R291 PolarHBondContact O-N 2.87Å; L288-H292 PolarHBondContact O-N 2.82Å
289	N	31.1	Very low	31.2	Very low	101 Å²	101	124.3 Å²	124.3	54%	0.54	58%	0.583	S	S	.	*	H	α-helix	trans	-66.7	-29.9	175.4	-109	-36.1	0	0	0	112.5	L285	L285-N289 WeakPolarHBondContact O-CB 3.05Å; L285-N289 PolarHBondContact O-N 3.31Å
290	I	34.2	Very low	31.6	Very low	45 Å²	45	125.4 Å²	125.4	23%	0.231	59%	0.588	C	S	.	*	H	α-helix	trans	-70.8	-47.8	171.5	-67.2	172.4	0	0	0	109.3	F286 F287 L288 H292 R293 F294	F286-I290 HydrophobicContact CD1-CD1 4.34Å; F286-I290 HydrophobicContact CE1-CD1 4.07Å; F286-I290 WeakPolarHBondContact O-CG1 3.41Å; F287-I290 PolarHBondContact O-N 2.86Å; L288-I290 VanDerWaalsContact C-N 3.26Å; L288-I290 PolarHBondContact O-N 2.88Å; I290-H292 PolarHBondContact O-N 3.36Å; I290-R293 PolarHBondContact O-N 3.11Å; I290-F294 HydrophobicContact CG2-CD2 4.2Å; I290-F294 HydrophobicContact CG2-CE2 4.03Å; I290-F294 WeakPolarHBondContact O-CD2 3.2Å
291	R	30	Very low	31.7	Very low	200 Å²	200	120.4 Å²	120.4	76%	0.755	57%	0.569	S	S	*	*	H	α-helix	trans	-60.1	-38.6	177.6	-86.4	-174.6	171.8	162	-1.1	114.1	F287 L288 R293 F294	F287-R291 PolarHBondContact O-N 3.22Å; L288-R291 PolarHBondContact O-N 2.87Å; R291-R293 VanDerWaalsContact C-N 3.34Å; R291-R293 PolarHBondContact O-N 3.44Å; R291-F294 PolarHBondContact O-N 2.88Å
292	H	32.5	Very low	31.8	Very low	139 Å²	139	124.5 Å²	124.5	64%	0.644	58%	0.579	S	S	*	*	H	α-helix	trans	-71.5	-24.6	-179.3	-105.8	-75.1	0	0	0	113.9	L288 I290 F294	L288-H292 PolarHBondContact O-N 2.82Å; I290-H292 PolarHBondContact O-N 3.36Å; H292-F294 VanDerWaalsContact C-N 3.3Å
293	R	32.6	Very low	32.1	Very low	199 Å²	199	127.8 Å²	127.8	75%	0.751	59%	0.591	S	S	*	*	H	α-helix	trans	-78.6	-11.9	175.4	-74.8	-170	-165.6	-143.8	4.5	114.2	I290 R291	I290-R293 PolarHBondContact O-N 3.11Å; R291-R293 VanDerWaalsContact C-N 3.34Å; R291-R293 PolarHBondContact O-N 3.44Å
294	F	33.6	Very low	32	Very low	126 Å²	126	128.7 Å²	128.7	55%	0.553	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	15.6	-180	-65.4	-70.2	0	0	0	113.4	D7 I290 R291 H292	D7-F294 WeakPolarHBondContact OD2-CE2 3.31Å; D7-F294 WeakPolarHBondContact OD2-CZ 2.9Å; I290-F294 HydrophobicContact CG2-CD2 4.2Å; I290-F294 HydrophobicContact CG2-CE2 4.03Å; I290-F294 WeakPolarHBondContact O-CD2 3.2Å; R291-F294 PolarHBondContact O-N 2.88Å; H292-F294 VanDerWaalsContact C-N 3.3Å
295	A	32.9	Very low	32.2	Very low	68 Å²	68	128.6 Å²	128.6	56%	0.562	60%	0.596	S	S	*	*			trans	-93.4	9.3	174.3	0	0	0	0	0	114
296	H	31.8	Very low	32.4	Very low	241 Å²	241	131.7 Å²	131.7	100%	1.116	61%	0.605	S	S	*	*			trans	-138.9	0	171.7	-73.5	-68.8	0	0	0	109.6

Retrieved 296 of 296 residues in 212.2 ms (Link to these results)

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