A0A3Q0KMS5_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KMS5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 333 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	22.2	Very low	29.5	Very low	213 Å²	213	93.4 Å²	93.4	100%	1.049	49%	0.485	S	S	*	.				0	90.6	0	-163.7	162.4	74.4	0	0	108.3	L3	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 HydrophobicContact CE-CD1 3.46Å; M1-L3 VanDerWaalsContact CE-CD1 3.46Å; M1-L3 HydrophobicContact CG-CD1 3.75Å; M1-L3 HydrophobicContact CG-CG 4.29Å; M1-L3 PolarHBondContact O-N 3.19Å; M1-L3 VanDerWaalsContact O-N 3.15Å; M1-L3 HydrophobicContact SD-CD1 3.91Å
2	L	21.8	Very low	30.1	Very low	172 Å²	172	86.3 Å²	86.3	90%	0.901	45%	0.45	S	S	*	.			trans	-80.4	84.2	172.9	-130.9	89.9	0	0	0	106	I4	L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 2.99Å
3	L	22.7	Very low	30.9	Very low	87 Å²	87	83.2 Å²	83.2	46%	0.455	43%	0.432	S	S	.	.			trans	-72.3	97.6	173.4	-100.5	138.3	0	0	0	107.6	M1 C5 G35	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 HydrophobicContact CE-CD1 3.46Å; M1-L3 VanDerWaalsContact CE-CD1 3.46Å; M1-L3 HydrophobicContact CG-CD1 3.75Å; M1-L3 HydrophobicContact CG-CG 4.29Å; M1-L3 PolarHBondContact O-N 3.19Å; M1-L3 VanDerWaalsContact O-N 3.15Å; M1-L3 HydrophobicContact SD-CD1 3.91Å; L3-C5 PolarHBondContact O-N 3.31Å; L3-C5 VanDerWaalsContact O-N 3.13Å; L3-G35 WeakPolarHBondContact CB-O 3.29Å; L3-G35 WeakPolarHBondContact CD1-O 3.32Å
4	I	23.8	Very low	31.6	Very low	113 Å²	113	78.1 Å²	78.1	58%	0.579	41%	0.405	S	S	*	.			trans	-48.9	111.1	174.8	-57.4	172.6	0	0	0	107.9	L2 N6	L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 2.99Å; I4-N6 HydrophobicContact CG2-CB 3.5Å; I4-N6 WeakPolarHBondContact CG2-ND2 3.14Å; I4-N6 PolarHBondContact O-N 2.75Å
5	C	26.8	Very low	31.9	Very low	32 Å²	32	76.9 Å²	76.9	22%	0.216	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-65.2	12.8	172.8	-69.5	0	0	0	0	113.6	L3 N7 A8 F142	L3-C5 PolarHBondContact O-N 3.31Å; L3-C5 VanDerWaalsContact O-N 3.13Å; C5-N7 PolarHBondContact O-N 2.82Å; C5-N7 VanDerWaalsContact O-N 3.1Å; C5-A8 PolarHBondContact O-N 3.38Å; C5-F142 HydrophobicContact CB-CE1 3.5Å; C5-F142 HydrophobicContact CB-CZ 3.5Å; C5-F142 VanDerWaalsContact CB-CZ 3.5Å; C5-F142 WeakPolarHBondContact O-CE1 3.46Å
6	N	27.7	Very low	32	Very low	133 Å²	133	74.8 Å²	74.8	71%	0.711	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-60.2	-25.9	-175.1	-81.3	-4.5	0	0	0	112.8	I4	I4-N6 HydrophobicContact CG2-CB 3.5Å; I4-N6 WeakPolarHBondContact CG2-ND2 3.14Å; I4-N6 PolarHBondContact O-N 2.75Å
7	N	29.5	Very low	32.3	Very low	130 Å²	130	73 Å²	73	70%	0.695	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-111.1	5.2	-175.8	-69	-5.6	0	0	0	114	C5 L9 M33	C5-N7 PolarHBondContact O-N 2.82Å; C5-N7 VanDerWaalsContact O-N 3.1Å; N7-L9 VanDerWaalsContact C-N 3.27Å; N7-L9 PolarHBondContact O-N 3.03Å; N7-M33 VanDerWaalsContact C-CE 3.42Å; N7-M33 HydrophobicContact CB-CE 3.84Å; N7-M33 HydrophobicContact CB-SD 4.34Å; N7-M33 WeakPolarHBondContact O-CE 3.48Å
8	A	36.3	Very low	33.1	Very low	6 Å²	6	71.6 Å²	71.6	5%	0.05	38%	0.375	C	S	.	.	S	Bend	trans	-68.8	-27.4	-174.3	0	0	0	0	0	113.3	C5 Q31 M33 T36	C5-A8 PolarHBondContact O-N 3.38Å; A8-Q31 CarbonylContact O-C 3.31Å; A8-M33 HydrophobicContact CB-CE 4.31Å; A8-T36 HydrophobicContact CB-CG2 3.59Å
9	L	36.9	Very low	33.6	Very low	33 Å²	33	73.7 Å²	73.7	17%	0.173	39%	0.386	C	S	.	.			trans	-122.4	102.5	-166.7	-167.8	83.1	0	0	0	111	N7 I11 V30 I119 F142	N7-L9 VanDerWaalsContact C-N 3.27Å; N7-L9 PolarHBondContact O-N 3.03Å; L9-I11 HydrophobicContact CD2-CD1 4.04Å; L9-I11 HydrophobicContact CD2-CG1 4.12Å; L9-I11 HydrophobicContact CG-CG1 4.26Å; L9-V30 HydrophobicContact CD1-CB 3.92Å; L9-V30 HydrophobicContact CD1-CG1 3.25Å; L9-V30 HydrophobicContact CD1-CG2 4.11Å; L9-I119 HydrophobicContact CD1-CD1 3.96Å; L9-I119 HydrophobicContact CD2-CB 3.76Å; L9-I119 HydrophobicContact CD2-CD1 3.72Å; L9-I119 HydrophobicContact CD2-CG1 3.83Å; L9-I119 HydrophobicContact CD2-CG2 4.37Å; L9-I119 HydrophobicContact CG-CD1 4.32Å; L9-F142 HydrophobicContact CB-CG 4.41Å; L9-F142 HydrophobicContact CD2-CB 3.54Å; L9-F142 HydrophobicContact CD2-CD2 4.38Å; L9-F142 HydrophobicContact CD2-CG 4.05Å
10	H	39.2	Very low	34.3	Very low	89 Å²	89	75 Å²	75	41%	0.412	39%	0.392	S	S	.	.			trans	-95.5	97.4	175.9	-171.8	-88.6	0	0	0	110.9	S12 V29	H10-S12 PolarHBondContact ND1-OG 3.35Å; H10-S12 PolarHBondContact O-N 3.11Å; H10-V29 CarbonylContact C-O 3.52Å; H10-V29 CarbonylContact O-C 3.53Å; H10-V29 WeakPolarHBondContact O-CB 3.23Å
11	I	37.6	Very low	35.3	Very low	19 Å²	19	76.2 Å²	76.2	10%	0.097	39%	0.392	C	S	.	.			trans	-84.9	97.6	171.3	-52.6	-179.3	0	0	0	108.1	L9 H13 T28 A117 I119	L9-I11 HydrophobicContact CD2-CD1 4.04Å; L9-I11 HydrophobicContact CD2-CG1 4.12Å; L9-I11 HydrophobicContact CG-CG1 4.26Å; I11-H13 WeakPolarHBondContact CG2-CE1 3.4Å; I11-H13 WeakPolarHBondContact CG2-NE2 3.35Å; I11-H13 PolarHBondContact O-CE1 3.18Å; I11-H13 PolarHBondContact O-ND1 3.42Å; I11-T28 HydrophobicContact CG2-CG2 4.15Å; I11-A117 HydrophobicContact CD1-CB 4.23Å; I11-I119 HydrophobicContact CD1-CD1 4.37Å; I11-I119 HydrophobicContact CD1-CG1 4.49Å
12	S	36.8	Very low	37.5	Very low	9 Å²	9	68.1 Å²	68.1	6%	0.063	35%	0.353	C	S	.	.			trans	-85.3	135.4	170.1	21.3	0	0	0	0	110.6	H10 Q27 V29	H10-S12 PolarHBondContact ND1-OG 3.35Å; H10-S12 PolarHBondContact O-N 3.11Å; S12-Q27 CarbonylContact O-C 3.57Å; S12-V29 WeakPolarHBondContact OG-CG2 3.41Å
13	H	40.7	Very low	39.8	Very low	45 Å²	45	60.7 Å²	60.7	21%	0.208	31%	0.314	C	S	.	.			trans	-114.5	140.6	-170.4	-63.5	72.4	0	0	0	110.8	I11 L26 L146	I11-H13 WeakPolarHBondContact CG2-CE1 3.4Å; I11-H13 WeakPolarHBondContact CG2-NE2 3.35Å; I11-H13 PolarHBondContact O-CE1 3.18Å; I11-H13 PolarHBondContact O-ND1 3.42Å; H13-L26 WeakPolarHBondContact CD2-CD1 3.16Å; H13-L146 WeakPolarHBondContact CE1-CD2 3.44Å; H13-L146 WeakPolarHBondContact NE2-CD1 3.35Å; H13-L146 WeakPolarHBondContact NE2-CD2 3.31Å; H13-L146 WeakPolarHBondContact NE2-CG 3.21Å
14	F	41.1	Very low	42.1	Very low	12 Å²	12	57 Å²	57	5%	0.053	30%	0.296	C	S	.	.			trans	-134.9	142.1	170.2	-56.4	-77.7	0	0	0	107.4	Q27 I283 L285 L293	F14-Q27 HydrophobicContact CD2-CB 3.68Å; F14-Q27 HydrophobicContact CD2-CG 4.16Å; F14-Q27 HydrophobicContact CE2-CB 4.35Å; F14-Q27 HydrophobicContact CE2-CG 4.4Å; F14-Q27 VanDerWaalsContact CE2-OE1 3.3Å; F14-I283 HydrophobicContact CB-CG2 4.17Å; F14-I283 HydrophobicContact CD1-CB 3.56Å; F14-I283 HydrophobicContact CD1-CG2 3.56Å; F14-I283 HydrophobicContact CE1-CB 3.99Å; F14-I283 HydrophobicContact CE1-CG2 4.27Å; F14-I283 HydrophobicContact CG-CG2 4.07Å; F14-L285 HydrophobicContact CE1-CD2 3.57Å; F14-L285 HydrophobicContact CE1-CG 3.96Å; F14-L285 HydrophobicContact CZ-CD2 3.67Å; F14-L293 HydrophobicContact CZ-CD2 4.2Å
15	L	35.5	Very low	44.2	Very low	61 Å²	61	54.6 Å²	54.6	32%	0.319	28%	0.28	S	S	.	.			trans	-104.3	123.7	170	-68.8	168.8	0	0	0	105.8	V24 V148 E149	L15-V24 HydrophobicContact CD2-CG1 3.43Å; L15-V24 VanDerWaalsContact CD2-CG1 3.43Å; L15-V148 HydrophobicContact CD2-CG1 3.86Å; L15-E149 HydrophobicContact CD1-CB 3.91Å
16	L	33.1	Very low	46.4	Very low	42 Å²	42	53.3 Å²	53.3	22%	0.22	27%	0.271	C	S	.	.			trans	-172.7	112.2	165.9	-96.7	141.7	0	0	0	113.3	Y25 P281 W282 I283	L16-Y25 WeakPolarHBondContact O-CB 2.82Å; L16-Y25 WeakPolarHBondContact O-CD2 3.34Å; L16-P281 HydrophobicContact CB-CB 4.22Å; L16-P281 VanDerWaalsContact CD1-C 3.47Å; L16-P281 HydrophobicContact CD1-CB 3.31Å; L16-P281 HydrophobicContact CD1-CG 4.13Å; L16-P281 HydrophobicContact CD2-CB 3.17Å; L16-P281 HydrophobicContact CG-CB 3.56Å; L16-W282 WeakPolarHBondContact CD1-O 3.11Å; L16-W282 WeakPolarHBondContact CG-O 3.25Å; L16-I283 HydrophobicContact CD1-CG2 3.52Å
17	N	37.2	Very low	48.2	Very low	45 Å²	45	47.6 Å²	47.6	24%	0.241	24%	0.24	C	C	.	.				-168.2	104.6	129.8	-171.9	-11.3	0	0	0	109.1	I19 Y25	N17-I19 PolarHBondContact OD1-N 3.27Å; N17-Y25 HydrophobicContact CB-CD2 3.31Å; N17-Y25 HydrophobicContact CB-CE2 3.1Å; N17-Y25 WeakPolarHBondContact ND2-CE2 3.28Å; N17-Y25 PolarHBondContact ND2-OH 3.4Å
18	P	46.5	Very low	50.4	Low	48 Å²	48	41.4 Å²	41.4	31%	0.312	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	8.4	-175.5	36.3	-35.8	0	0	0	114.5	D173	P18-D173 HydrophobicContact CB-CB 3.43Å; P18-D173 VanDerWaalsContact CB-CB 3.43Å; P18-D173 HydrophobicContact CG-CB 3.29Å
19	I	43.9	Very low	52.3	Low	112 Å²	112	41.3 Å²	41.3	57%	0.574	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-25.5	171	-58	175.3	0	0	0	110.6	N17	N17-I19 PolarHBondContact OD1-N 3.27Å
20	L	46.9	Very low	54.3	Low	99 Å²	99	39.8 Å²	39.8	52%	0.518	20%	0.197	S	C	.	.	S	Bend	trans	-128.4	106.3	176.9	-64	168.6	0	0	0	108.2	D22 V23	L20-D22 PolarHBondContact O-N 2.73Å; L20-V23 HydrophobicContact CB-CB 4.2Å; L20-V23 HydrophobicContact CB-CG2 3.92Å; L20-V23 HydrophobicContact CD1-CG2 4.04Å; L20-V23 PolarHBondContact O-N 3.27Å
21	R	55.7	Low	56.2	Low	100 Å²	100	38.7 Å²	38.7	38%	0.377	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-26.5	176.3	-81.4	-169.4	-179.6	-116.4	-9.8	113.6	Y154	R21-Y154 PolarHBondContact NH2-O 3.3Å
22	D	68.6	Low	57.8	Low	44 Å²	44	38.4 Å²	38.4	24%	0.235	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	0.9	-176.1	-58	-16.7	0	0	0	112.7	L20 K101 F102	L20-D22 PolarHBondContact O-N 2.73Å; D22-K101 HydrophobicContact CB-CG 4.37Å; D22-K101 CarbonylContact O-C 3.5Å; D22-K101 VanDerWaalsContact O-C 3.31Å; D22-K101 WeakPolarHBondContact O-CA 3.43Å; D22-F102 PolarHBondContact O-N 2.84Å
23	V	69	Low	59.3	Low	15 Å²	15	41.2 Å²	41.2	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.7	-174.7	-170.5	0	0	0	0	112.5	L20 Y25 L100 K101	L20-V23 HydrophobicContact CB-CB 4.2Å; L20-V23 HydrophobicContact CB-CG2 3.92Å; L20-V23 HydrophobicContact CD1-CG2 4.04Å; L20-V23 PolarHBondContact O-N 3.27Å; V23-Y25 HydrophobicContact CB-CE2 4.37Å; V23-Y25 HydrophobicContact CG1-CD2 4.11Å; V23-Y25 HydrophobicContact CG1-CE2 3.52Å; V23-L100 CarbonylContact C-O 3.52Å; V23-L100 VanDerWaalsContact CA-O 3.25Å; V23-L100 WeakPolarHBondContact CA-O 3.44Å; V23-K101 HydrophobicContact CG2-CG 4.25Å
24	V	71.5	Confident	60.4	Low	10 Å²	10	45.3 Å²	45.3	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.8	172	175.5	0	0	0	0	109.3	L15 S99 L100 F102 V148 L150	L15-V24 HydrophobicContact CD2-CG1 3.43Å; L15-V24 VanDerWaalsContact CD2-CG1 3.43Å; V24-S99 CarbonylContact O-C 3.57Å; V24-L100 HydrophobicContact CB-CB 4.46Å; V24-L100 PolarHBondContact N-O 2.84Å; V24-L100 PolarHBondContact O-N 3.43Å; V24-F102 HydrophobicContact CB-CE2 3.89Å; V24-F102 HydrophobicContact CG2-CD2 4.25Å; V24-F102 HydrophobicContact CG2-CE2 3.56Å; V24-F102 HydrophobicContact CG2-CZ 4.32Å; V24-V148 HydrophobicContact CB-CG1 4.13Å; V24-V148 HydrophobicContact CG1-CG1 3.83Å; V24-V148 HydrophobicContact CG2-CG1 3.9Å; V24-L150 HydrophobicContact CG2-CD2 3.35Å
25	Y	67.9	Low	61.2	Low	62 Å²	62	46.6 Å²	46.6	24%	0.243	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.9	174.2	-67.2	-111	0	0	0	108.6	L16 N17 V23 V59 I97 F98	L16-Y25 WeakPolarHBondContact O-CB 2.82Å; L16-Y25 WeakPolarHBondContact O-CD2 3.34Å; N17-Y25 HydrophobicContact CB-CD2 3.31Å; N17-Y25 HydrophobicContact CB-CE2 3.1Å; N17-Y25 WeakPolarHBondContact ND2-CE2 3.28Å; N17-Y25 PolarHBondContact ND2-OH 3.4Å; V23-Y25 HydrophobicContact CB-CE2 4.37Å; V23-Y25 HydrophobicContact CG1-CD2 4.11Å; V23-Y25 HydrophobicContact CG1-CE2 3.52Å; Y25-V59 HydrophobicContact CD1-CB 4.42Å; Y25-V59 HydrophobicContact CD1-CG1 4.33Å; Y25-V59 HydrophobicContact CD1-CG2 3.83Å; Y25-V59 HydrophobicContact CE1-CB 4.23Å; Y25-V59 HydrophobicContact CE1-CG1 3.85Å; Y25-V59 HydrophobicContact CE1-CG2 3.55Å; Y25-I97 HydrophobicContact CD1-CG2 3.82Å; Y25-I97 HydrophobicContact CG-CG2 4.49Å; Y25-F98 CarbonylContact C-O 3.59Å; Y25-F98 WeakPolarHBondContact CA-O 3.19Å
26	L	72.6	Confident	62.2	Low	6 Å²	6	44 Å²	44	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.3	177.9	170.2	63.2	0	0	0	108	H13 F47 F98 L100 L146	H13-L26 WeakPolarHBondContact CD2-CD1 3.16Å; L26-F47 HydrophobicContact CD2-CD1 4.23Å; L26-F47 HydrophobicContact CD2-CE1 3.46Å; L26-F47 VanDerWaalsContact CD2-CE1 3.46Å; L26-F47 HydrophobicContact CD2-CZ 3.96Å; L26-F98 HydrophobicContact CB-CB 4.3Å; L26-F98 PolarHBondContact N-O 3.37Å; L26-F98 PolarHBondContact O-N 3.46Å; L26-L100 HydrophobicContact CB-CD1 3.51Å; L26-L100 HydrophobicContact CD2-CD1 4.16Å; L26-L100 HydrophobicContact CG-CD1 4.48Å; L26-L146 HydrophobicContact CD1-CD1 4.16Å; L26-L146 HydrophobicContact CD2-CD1 3.93Å
27	Q	66.4	Low	63.7	Low	12 Å²	12	44.9 Å²	44.9	6%	0.056	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	141.9	168.3	-162.5	170	-25	0	0	109.2	S12 F14 E95 V96 I97	S12-Q27 CarbonylContact O-C 3.57Å; F14-Q27 HydrophobicContact CD2-CB 3.68Å; F14-Q27 HydrophobicContact CD2-CG 4.16Å; F14-Q27 HydrophobicContact CE2-CB 4.35Å; F14-Q27 HydrophobicContact CE2-CG 4.4Å; F14-Q27 VanDerWaalsContact CE2-OE1 3.3Å; Q27-E95 VanDerWaalsContact CD-CD 3.44Å; Q27-E95 HydrophobicContact CG-CG 3.59Å; Q27-E95 VanDerWaalsContact CG-OE1 3.28Å; Q27-E95 WeakPolarHBondContact CG-OE1 3.31Å; Q27-E95 PolarHBondContact NE2-OE1 2.86Å; Q27-E95 PolarHBondContact NE2-OE2 2.9Å; Q27-V96 CarbonylContact C-O 3.6Å; Q27-V96 WeakPolarHBondContact CA-O 3.5Å; Q27-I97 HydrophobicContact CG-CG1 4.24Å
28	T	75.1	Confident	65.2	Low	1 Å²	1	45 Å²	45	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	115.4	176.8	-63.3	0	0	0	0	107	I11 V30 E95 V96 I119	I11-T28 HydrophobicContact CG2-CG2 4.15Å; T28-V30 HydrophobicContact CG2-CG2 3.96Å; T28-E95 CarbonylContact O-C 3.45Å; T28-E95 WeakPolarHBondContact O-CA 3.49Å; T28-V96 PolarHBondContact N-O 2.82Å; T28-V96 PolarHBondContact O-N 3.23Å; T28-I119 HydrophobicContact CG2-CD1 4.45Å
29	V	76.2	Confident	66.8	Low	4 Å²	4	44.1 Å²	44.1	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.5	173	-179.8	0	0	0	0	107.7	H10 S12 K93 E95	H10-V29 CarbonylContact C-O 3.52Å; H10-V29 CarbonylContact O-C 3.53Å; H10-V29 WeakPolarHBondContact O-CB 3.23Å; S12-V29 WeakPolarHBondContact OG-CG2 3.41Å; V29-K93 HydrophobicContact CG1-CD 4.41Å; V29-K93 HydrophobicContact CG1-CG 4.12Å; V29-E95 HydrophobicContact CG2-CB 4.48Å; V29-E95 HydrophobicContact CG2-CG 4.15Å
30	V	79.2	Confident	68.6	Low	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	125.8	177.2	-179.2	0	0	0	0	106.6	L9 T28 L88 K93 Y94 I119	L9-V30 HydrophobicContact CD1-CB 3.92Å; L9-V30 HydrophobicContact CD1-CG1 3.25Å; L9-V30 HydrophobicContact CD1-CG2 4.11Å; T28-V30 HydrophobicContact CG2-CG2 3.96Å; V30-L88 HydrophobicContact CG1-CD2 3.78Å; V30-K93 CarbonylContact O-C 3.45Å; V30-K93 VanDerWaalsContact O-CA 3.32Å; V30-K93 WeakPolarHBondContact O-CA 3.22Å; V30-Y94 HydrophobicContact CB-CD1 4.05Å; V30-Y94 HydrophobicContact CB-CD2 4.37Å; V30-Y94 HydrophobicContact CB-CE1 3.52Å; V30-Y94 HydrophobicContact CB-CE2 3.86Å; V30-Y94 HydrophobicContact CB-CG 4.45Å; V30-Y94 HydrophobicContact CG1-CD1 4.36Å; V30-Y94 HydrophobicContact CG1-CE1 3.54Å; V30-Y94 HydrophobicContact CG2-CE1 4.21Å; V30-Y94 HydrophobicContact CG2-CE2 3.75Å; V30-Y94 WeakPolarHBondContact CG2-OH 3.46Å; V30-Y94 PolarHBondContact N-O 2.81Å; V30-Y94 PolarHBondContact O-N 2.75Å; V30-I119 HydrophobicContact CG1-CD1 4.42Å; V30-I119 HydrophobicContact CG2-CD1 3.45Å; V30-I119 VanDerWaalsContact CG2-CD1 3.45Å
31	Q	78.1	Confident	70.5	Confident	66 Å²	66	36.4 Å²	36.4	31%	0.308	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	152.3	-179.8	-174	170.7	4.7	0	0	109	A8 A92 K93	A8-Q31 CarbonylContact O-C 3.31Å; Q31-A92 WeakPolarHBondContact CA-O 3.28Å; Q31-K93 HydrophobicContact CB-CB 4.39Å; Q31-K93 HydrophobicContact CB-CG 4.34Å; Q31-K93 HydrophobicContact CG-CB 4.18Å; Q31-K93 HydrophobicContact CG-CG 4.5Å
32	M	71.7	Confident	71.9	Confident	13 Å²	13	39 Å²	39	6%	0.064	21%	0.211	C	C	.	.			trans	-114.6	117.1	167	-175.7	65.9	75.2	0	0	108.6	T36 C40 L88 Y89 F90 G91 A92	M32-T36 HydrophobicContact SD-CG2 3.97Å; M32-T36 PolarHBondContact SD-OG1 2.69Å; M32-C40 HydrophobicContact CE-CB 4.39Å; M32-C40 WeakPolarHBondContact CE-SG 3.47Å; M32-L88 HydrophobicContact CB-CD2 3.79Å; M32-L88 HydrophobicContact CB-CG 3.81Å; M32-L88 HydrophobicContact CE-CD2 4.16Å; M32-L88 HydrophobicContact CE-CG 4.5Å; M32-Y89 WeakPolarHBondContact CB-O 3.37Å; M32-F90 HydrophobicContact CG-CD1 3.86Å; M32-F90 HydrophobicContact CG-CE1 4.47Å; M32-G91 VanDerWaalsContact O-CA 3.28Å; M32-G91 WeakPolarHBondContact O-CA 3.5Å; M32-G91 PolarHBondContact O-N 2.78Å; M32-A92 PolarHBondContact N-O 3.12Å
33	M	69	Low	73	Confident	68 Å²	68	37 Å²	37	34%	0.335	20%	0.2	S	C	.	.			trans	-75.9	147.1	177.9	-62	-171.7	-49.8	0	0	111.2	N7 A8 G35 T36	N7-M33 VanDerWaalsContact C-CE 3.42Å; N7-M33 HydrophobicContact CB-CE 3.84Å; N7-M33 HydrophobicContact CB-SD 4.34Å; N7-M33 WeakPolarHBondContact O-CE 3.48Å; A8-M33 HydrophobicContact CB-CE 4.31Å; M33-G35 PolarHBondContact O-N 3.43Å; M33-T36 HydrophobicContact CB-CG2 4.5Å; M33-T36 PolarHBondContact O-N 2.84Å; M33-T36 PolarHBondContact O-OG1 3.11Å
34	N	63.8	Low	74	Confident	132 Å²	132	37.1 Å²	37.1	71%	0.706	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.2	178.1	-65.6	-9.3	0	0	0	114	G91	N34-G91 VanDerWaalsContact OD1-CA 3.31Å; N34-G91 WeakPolarHBondContact OD1-CA 3.46Å; N34-G91 PolarHBondContact OD1-N 2.59Å; N34-G91 VanDerWaalsContact OD1-N 3.14Å
35	G	56.8	Low	75	Confident	38 Å²	38	36.6 Å²	36.6	39%	0.392	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-5.4	-180	0	0	0	0	0	115.2	L3 M33	L3-G35 WeakPolarHBondContact CB-O 3.29Å; L3-G35 WeakPolarHBondContact CD1-O 3.32Å; M33-G35 PolarHBondContact O-N 3.43Å
36	T	57.4	Low	76.2	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.049	19%	0.192	C	C	.	.			trans	-76.3	132.7	175.3	57.9	0	0	0	0	108.2	A8 M32 M33 L38 F90	A8-T36 HydrophobicContact CB-CG2 3.59Å; M32-T36 HydrophobicContact SD-CG2 3.97Å; M32-T36 PolarHBondContact SD-OG1 2.69Å; M33-T36 HydrophobicContact CB-CG2 4.5Å; M33-T36 PolarHBondContact O-N 2.84Å; M33-T36 PolarHBondContact O-OG1 3.11Å; T36-L38 PolarHBondContact O-N 3.04Å; T36-L38 VanDerWaalsContact O-N 3.11Å; T36-F90 WeakPolarHBondContact O-CE1 3.48Å; T36-F90 VanDerWaalsContact O-CZ 3.25Å; T36-F90 WeakPolarHBondContact O-CZ 3.22Å; T36-F90 WeakPolarHBondContact OG1-CE1 3.48Å
37	G	63.4	Low	77.1	Confident	59 Å²	59	34.5 Å²	34.5	61%	0.608	19%	0.19	S	C	*	.	S	Bend	trans	-71.8	-2.1	-176.9	0	0	0	0	0	114.8
38	L	69.1	Low	78.4	Confident	47 Å²	47	37.6 Å²	37.6	25%	0.246	20%	0.202	C	C	.	.			trans	-146.6	139.5	-168.2	-64.4	171.4	0	0	0	112.2	T36 F90 P123 Y140	T36-L38 PolarHBondContact O-N 3.04Å; T36-L38 VanDerWaalsContact O-N 3.11Å; L38-F90 WeakPolarHBondContact O-CE1 3.44Å; L38-P123 HydrophobicContact CB-CB 4.22Å; L38-P123 HydrophobicContact CD1-CB 4.05Å; L38-Y140 HydrophobicContact CD1-CE2 3.54Å; L38-Y140 WeakPolarHBondContact CD1-OH 3.46Å
39	E	79.8	Confident	79.2	Confident	31 Å²	31	38.1 Å²	38.1	15%	0.145	21%	0.205	C	C	.	.			trans	-94	157.1	173.3	-61.9	171.1	129.6	0	0	110.6	Y89 F90 P123 Y124 R126	E39-Y89 WeakPolarHBondContact OE1-CD1 3.05Å; E39-F90 HydrophobicContact CG-CD1 4Å; E39-F90 HydrophobicContact CG-CD2 3.64Å; E39-F90 HydrophobicContact CG-CE1 3.74Å; E39-F90 HydrophobicContact CG-CE2 3.44Å; E39-F90 VanDerWaalsContact CG-CE2 3.44Å; E39-F90 HydrophobicContact CG-CG 3.94Å; E39-F90 HydrophobicContact CG-CZ 3.49Å; E39-F90 VanDerWaalsContact CG-CZ 3.49Å; E39-F90 WeakPolarHBondContact OE1-CD2 3.04Å; E39-F90 PolarHBondContact OE1-N 3.3Å; E39-P123 VanDerWaalsContact O-CA 3.32Å; E39-P123 WeakPolarHBondContact O-CA 3.37Å; E39-Y124 HydrophobicContact CB-CD2 3.83Å; E39-Y124 HydrophobicContact CB-CE2 3.89Å; E39-Y124 PolarHBondContact O-N 3.44Å; E39-R126 IonicContact OE2-NH2 3.2Å; E39-R126 PolarHBondContact OE2-NH2 2.76Å
40	C	83.2	Confident	79.7	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.027	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119	177.7	-60.4	0	0	0	0	110.8	M32 Q43 R87 L88 C121 K122	M32-C40 HydrophobicContact CE-CB 4.39Å; M32-C40 WeakPolarHBondContact CE-SG 3.47Å; C40-Q43 HydrophobicContact CB-CG 3.76Å; C40-R87 CarbonylContact O-C 3.49Å; C40-R87 WeakPolarHBondContact O-CA 3.4Å; C40-L88 HydrophobicContact CB-CB 4.05Å; C40-L88 PolarHBondContact N-O 2.89Å; C40-L88 PolarHBondContact O-N 3.11Å; C40-C121 WeakPolarHBondContact CA-SG 3.45Å; C40-C121 HydrophobicContact CB-CB 4.08Å; C40-C121 WeakPolarHBondContact CB-SG 3.11Å; C40-C121 WeakPolarHBondContact SG-CB 3.24Å; C40-C121 CovalentContact SG-SG 2.02Å; C40-C121 PolarHBondContact SG-SG 3.46Å; C40-K122 CarbonylContact C-O 3.55Å
41	E	85	Confident	80.1	Confident	44 Å²	44	42.2 Å²	42.2	21%	0.206	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	-41.2	170.7	-171.6	-160.9	168.2	0	0	110.6	R87 K122 Y124	E41-R87 WeakPolarHBondContact O-CG 3.29Å; E41-K122 PolarHBondContact N-O 2.94Å; E41-K122 WeakPolarHBondContact OE2-CE 3.42Å; E41-K122 IonicContact OE2-NZ 3.92Å; E41-K122 PolarHBondContact OE2-NZ 3.26Å; E41-Y124 HydrophobicContact CB-CD1 4.1Å; E41-Y124 HydrophobicContact CB-CD2 4.1Å; E41-Y124 HydrophobicContact CB-CE1 4.08Å; E41-Y124 HydrophobicContact CB-CE2 4.07Å; E41-Y124 HydrophobicContact CB-CG 4.13Å; E41-Y124 HydrophobicContact CG-CD1 4.11Å; E41-Y124 HydrophobicContact CG-CE1 3.88Å
42	R	87	Confident	80.5	Confident	156 Å²	156	42.7 Å²	42.7	59%	0.589	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.6	146.9	178.3	-67.7	-175.1	-175.2	161.6	1.7	110.6	K122	R42-K122 PolarHBondContact O-N 3.08Å
43	Q	89.8	Confident	81.2	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.3	-179.3	-62.3	173.1	95.1	0	0	111.1	C40 T84 T85 G86 Y94 V120	C40-Q43 HydrophobicContact CB-CG 3.76Å; Q43-T84 WeakPolarHBondContact O-CA 3.49Å; Q43-T84 PolarHBondContact O-OG1 3.15Å; Q43-T85 HydrophobicContact CB-CG2 3.67Å; Q43-T85 PolarHBondContact N-O 3.19Å; Q43-T85 PolarHBondContact O-N 3.49Å; Q43-T85 VanDerWaalsContact O-N 3.12Å; Q43-G86 PolarHBondContact NE2-O 2.92Å; Q43-Y94 PolarHBondContact OE1-OH 3.08Å; Q43-V120 CarbonylContact C-O 3.49Å; Q43-V120 WeakPolarHBondContact CA-O 3.42Å
44	S	91.4	Very high	82.1	Confident	16 Å²	16	44.7 Å²	44.7	11%	0.112	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.5	168.6	-70.4	0	0	0	0	109.9	Q82 F83 I119 V120	S44-Q82 PolarHBondContact OG-NE2 3.38Å; S44-F83 CarbonylContact C-O 3.5Å; S44-F83 VanDerWaalsContact CA-O 3.24Å; S44-F83 WeakPolarHBondContact CA-O 3.47Å; S44-I119 CarbonylContact O-C 3.46Å; S44-I119 WeakPolarHBondContact O-CA 3.38Å; S44-V120 PolarHBondContact N-O 3.47Å; S44-V120 PolarHBondContact O-N 3.21Å
45	I	91.6	Very high	83.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.4	173.1	-51.7	171.6	0	0	0	106.2	F47 V68 Q82 F83 Y94 F98 I119	I45-F47 HydrophobicContact CG2-CD2 4.19Å; I45-F47 HydrophobicContact CG2-CE2 3.51Å; I45-F47 HydrophobicContact CG2-CZ 3.75Å; I45-V68 HydrophobicContact CD1-CG1 4.32Å; I45-Q82 WeakPolarHBondContact O-CA 3.36Å; I45-F83 HydrophobicContact CB-CB 4.34Å; I45-F83 PolarHBondContact N-O 3Å; I45-F83 PolarHBondContact O-N 2.89Å; I45-Y94 HydrophobicContact CD1-CE2 4.46Å; I45-F98 HydrophobicContact CD1-CZ 4.2Å; I45-F98 HydrophobicContact CG2-CZ 4.45Å; I45-I119 HydrophobicContact CG1-CD1 4.18Å; I45-I119 HydrophobicContact CG1-CG1 4.38Å; I45-I119 HydrophobicContact CG2-CG1 4.4Å
46	I	92.7	Very high	85	Confident	23 Å²	23	38.4 Å²	38.4	12%	0.118	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.2	-178.3	-54.7	169.9	0	0	0	107.4	Y48 V81 Q82 A117 E118 V120	I46-Y48 HydrophobicContact CB-CE2 4.46Å; I46-Y48 HydrophobicContact CG2-CD2 4.36Å; I46-Y48 HydrophobicContact CG2-CE1 4.37Å; I46-Y48 HydrophobicContact CG2-CE2 3.78Å; I46-V81 CarbonylContact C-O 3.56Å; I46-V81 VanDerWaalsContact CA-O 3.3Å; I46-V81 WeakPolarHBondContact CA-O 3.46Å; I46-Q82 HydrophobicContact CG1-CB 4.27Å; I46-Q82 HydrophobicContact CG1-CG 3.95Å; I46-A117 CarbonylContact O-C 3.5Å; I46-E118 HydrophobicContact CB-CB 4.27Å; I46-E118 PolarHBondContact N-O 2.9Å; I46-E118 PolarHBondContact O-N 2.88Å; I46-V120 HydrophobicContact CD1-CG2 3.84Å
47	F	93	Very high	86.6	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.8	169.9	-64.9	-83.6	0	0	0	109.7	L26 I45 L49 I56 S80 V81 F83 F98 V115 L116 A117	L26-F47 HydrophobicContact CD2-CD1 4.23Å; L26-F47 HydrophobicContact CD2-CE1 3.46Å; L26-F47 VanDerWaalsContact CD2-CE1 3.46Å; L26-F47 HydrophobicContact CD2-CZ 3.96Å; I45-F47 HydrophobicContact CG2-CD2 4.19Å; I45-F47 HydrophobicContact CG2-CE2 3.51Å; I45-F47 HydrophobicContact CG2-CZ 3.75Å; F47-L49 HydrophobicContact CB-CD2 3.72Å; F47-L49 HydrophobicContact CB-CG 4.42Å; F47-I56 HydrophobicContact CB-CD1 4.42Å; F47-I56 HydrophobicContact CD1-CD1 4.27Å; F47-I56 HydrophobicContact CD2-CD1 3.61Å; F47-I56 HydrophobicContact CE1-CD1 4.46Å; F47-I56 HydrophobicContact CE2-CD1 3.8Å; F47-I56 HydrophobicContact CG-CD1 3.85Å; F47-I56 HydrophobicContact CZ-CD1 4.22Å; F47-S80 CarbonylContact O-C 3.53Å; F47-S80 WeakPolarHBondContact O-CA 3.22Å; F47-V81 HydrophobicContact CB-CG1 3.79Å; F47-V81 HydrophobicContact CD2-CG1 4.5Å; F47-V81 PolarHBondContact N-O 2.99Å; F47-V81 PolarHBondContact O-N 3.28Å; F47-F83 HydrophobicContact CD2-CD2 4.07Å; F47-F83 AromaticContact CD2-CE2 3.98Å; F47-F83 HydrophobicContact CD2-CE2 3.98Å; F47-F83 HydrophobicContact CE2-CD2 4.12Å; F47-F83 HydrophobicContact CE2-CE2 4.19Å; F47-F98 HydrophobicContact CE2-CD1 4.11Å; F47-F98 HydrophobicContact CE2-CD2 4.08Å; F47-F98 AromaticContact CE2-CE1 3.84Å; F47-F98 HydrophobicContact CE2-CE1 3.84Å; F47-F98 AromaticContact CE2-CE2 3.81Å; F47-F98 HydrophobicContact CE2-CE2 3.81Å; F47-F98 HydrophobicContact CE2-CG 4.22Å; F47-F98 AromaticContact CE2-CZ 3.69Å; F47-F98 HydrophobicContact CE2-CZ 3.69Å; F47-F98 AromaticContact CZ-CD2 3.83Å; F47-F98 HydrophobicContact CZ-CD2 3.83Å; F47-F98 AromaticContact CZ-CE2 3.69Å; F47-F98 HydrophobicContact CZ-CE2 3.69Å; F47-F98 HydrophobicContact CZ-CG 4.31Å; F47-F98 HydrophobicContact CZ-CZ 4.07Å; F47-V115 HydrophobicContact CD1-CG1 4.01Å; F47-L116 CarbonylContact C-O 3.4Å; F47-L116 WeakPolarHBondContact CA-O 3.23Å; F47-A117 HydrophobicContact CD1-CB 3.87Å; F47-A117 HydrophobicContact CE1-CB 3.67Å
48	Y	93	Very high	87.8	Confident	78 Å²	78	41.6 Å²	41.6	31%	0.306	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	112	166.6	-52.1	-96.2	0	0	0	107.7	I46 V115 L116 E118	I46-Y48 HydrophobicContact CB-CE2 4.46Å; I46-Y48 HydrophobicContact CG2-CD2 4.36Å; I46-Y48 HydrophobicContact CG2-CE1 4.37Å; I46-Y48 HydrophobicContact CG2-CE2 3.78Å; Y48-V115 WeakPolarHBondContact O-CA 3.36Å; Y48-L116 HydrophobicContact CD2-CB 3.99Å; Y48-L116 HydrophobicContact CD2-CD2 3.78Å; Y48-L116 HydrophobicContact CD2-CG 3.99Å; Y48-L116 HydrophobicContact CE2-CD2 4.19Å; Y48-L116 HydrophobicContact CG-CB 4.45Å; Y48-L116 HydrophobicContact CG-CD2 4.45Å; Y48-L116 PolarHBondContact N-O 2.89Å; Y48-L116 PolarHBondContact O-N 2.84Å; Y48-E118 HydrophobicContact CE2-CB 3.98Å; Y48-E118 PolarHBondContact OH-OE2 2.85Å
49	L	91.4	Very high	88.4	Confident	12 Å²	12	42.9 Å²	42.9	6%	0.063	21%	0.214	C	C	.	.			trans	-97.5	149	-168.3	-53.3	-178.5	0	0	0	111.5	F47 I53 I56 L74 K79 V81 V115	F47-L49 HydrophobicContact CB-CD2 3.72Å; F47-L49 HydrophobicContact CB-CG 4.42Å; L49-I53 HydrophobicContact CB-CB 4.11Å; L49-I53 HydrophobicContact CB-CD1 4.11Å; L49-I53 HydrophobicContact CB-CG2 4.39Å; L49-I53 HydrophobicContact CD1-CB 4.36Å; L49-I53 HydrophobicContact CD1-CG2 3.79Å; L49-I53 HydrophobicContact CD2-CD1 4.27Å; L49-I53 HydrophobicContact CD2-CG2 4.48Å; L49-I53 HydrophobicContact CG-CG2 4.45Å; L49-I56 HydrophobicContact CD1-CB 4.33Å; L49-I56 HydrophobicContact CD1-CG2 3.95Å; L49-L74 HydrophobicContact CD1-CD1 3.75Å; L49-L74 HydrophobicContact CD1-CD2 4.4Å; L49-L74 HydrophobicContact CG-CD1 4.39Å; L49-K79 HydrophobicContact CB-CB 4.42Å; L49-K79 PolarHBondContact N-O 3.04Å; L49-K79 WeakPolarHBondContact O-CB 3.45Å; L49-V81 HydrophobicContact CD1-CG1 4.21Å; L49-V81 HydrophobicContact CG-CG1 4.43Å; L49-V115 HydrophobicContact CD2-CG1 3.95Å; L49-V115 HydrophobicContact CD2-CG2 4.43Å
50	S	87.7	Confident	88.4	Confident	8 Å²	8	45.5 Å²	45.5	6%	0.056	23%	0.229	C	C	.	.			trans	-62.1	150.6	165.2	-76.2	0	0	0	0	111.8	Q52 I53 P114	S50-Q52 PolarHBondContact O-N 3.16Å; S50-I53 PolarHBondContact O-N 3.4Å; S50-P114 PolarHBondContact N-O 2.04Å; S50-P114 WeakPolarHBondContact OG-CD 3.39Å; S50-P114 WeakPolarHBondContact OG-CG 3.31Å; S50-P114 PolarHBondContact OG-O 3.22Å
51	P	87.3	Confident	88.4	Confident	81 Å²	81	47.8 Å²	47.8	53%	0.526	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-27	179	-27.4	35	0	0	0	115	I53	P51-I53 VanDerWaalsContact C-N 3.29Å
52	Q	85.6	Confident	88.2	Confident	77 Å²	77	49.1 Å²	49.1	36%	0.36	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.9	-179.5	-61.7	79.5	8.3	0	0	113.2	S50 F102 N103 Y113	S50-Q52 PolarHBondContact O-N 3.16Å; Q52-F102 CarbonylContact O-C 3.54Å; Q52-F102 WeakPolarHBondContact O-CA 3.34Å; Q52-N103 PolarHBondContact O-N 2.75Å; Q52-Y113 HydrophobicContact CB-CD1 3.99Å; Q52-Y113 HydrophobicContact CB-CE1 3.57Å; Q52-Y113 VanDerWaalsContact CD-CE1 3.43Å; Q52-Y113 HydrophobicContact CG-CD1 4.1Å; Q52-Y113 HydrophobicContact CG-CE1 3.37Å
53	I	86.2	Confident	87.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.3	175	-58.7	163	0	0	0	108	L49 S50 P51 L100 K101 F102 V115	L49-I53 HydrophobicContact CB-CB 4.11Å; L49-I53 HydrophobicContact CB-CD1 4.11Å; L49-I53 HydrophobicContact CB-CG2 4.39Å; L49-I53 HydrophobicContact CD1-CB 4.36Å; L49-I53 HydrophobicContact CD1-CG2 3.79Å; L49-I53 HydrophobicContact CD2-CD1 4.27Å; L49-I53 HydrophobicContact CD2-CG2 4.48Å; L49-I53 HydrophobicContact CG-CG2 4.45Å; S50-I53 PolarHBondContact O-N 3.4Å; P51-I53 VanDerWaalsContact C-N 3.29Å; I53-L100 HydrophobicContact CD1-CD2 4.06Å; I53-L100 HydrophobicContact CG2-CB 4.31Å; I53-K101 CarbonylContact C-O 3.44Å; I53-K101 WeakPolarHBondContact CG2-O 2.95Å; I53-F102 HydrophobicContact CD1-CE1 4.06Å; I53-F102 HydrophobicContact CD1-CZ 4.17Å; I53-F102 HydrophobicContact CG1-CD1 3.77Å; I53-F102 HydrophobicContact CG1-CE1 3.3Å; I53-F102 HydrophobicContact CG1-CE2 4.47Å; I53-F102 HydrophobicContact CG1-CZ 3.69Å; I53-V115 HydrophobicContact CD1-CG2 3.35Å
54	K	88.9	Confident	87.3	Confident	123 Å²	123	52 Å²	52	54%	0.535	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-43.3	-179	-176.6	173.3	179.7	169.9	0	112.6	L74 K101	K54-L74 VanDerWaalsContact O-CD2 3.3Å; K54-L74 WeakPolarHBondContact O-CD2 3.32Å; K54-K101 WeakPolarHBondContact CA-O 3.37Å; K54-K101 WeakPolarHBondContact CB-O 3.27Å; K54-K101 PolarHBondContact N-O 3.12Å
55	S	90.8	Very high	86.8	Confident	31 Å²	31	52.3 Å²	52.3	22%	0.217	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	161.4	-177.9	64.6	0	0	0	0	112	L100 K101	S55-L100 CarbonylContact O-C 3.57Å; S55-L100 WeakPolarHBondContact O-CA 3.27Å; S55-K101 PolarHBondContact N-O 2.82Å; S55-K101 PolarHBondContact O-N 3.16Å; S55-K101 VanDerWaalsContact OG-CB 3.3Å; S55-K101 WeakPolarHBondContact OG-CB 3.46Å
56	I	91	Very high	86.5	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.036	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.7	168.6	-174.6	173.3	0	0	0	108.9	F47 L49 V81 F83 F98 S99 L100	F47-I56 HydrophobicContact CB-CD1 4.42Å; F47-I56 HydrophobicContact CD1-CD1 4.27Å; F47-I56 HydrophobicContact CD2-CD1 3.61Å; F47-I56 HydrophobicContact CE1-CD1 4.46Å; F47-I56 HydrophobicContact CE2-CD1 3.8Å; F47-I56 HydrophobicContact CG-CD1 3.85Å; F47-I56 HydrophobicContact CZ-CD1 4.22Å; L49-I56 HydrophobicContact CD1-CB 4.33Å; L49-I56 HydrophobicContact CD1-CG2 3.95Å; I56-V81 HydrophobicContact CG2-CB 4.15Å; I56-V81 HydrophobicContact CG2-CG1 3.26Å; I56-V81 HydrophobicContact CG2-CG2 4.02Å; I56-F83 HydrophobicContact CG2-CE2 4.02Å; I56-F83 HydrophobicContact CG2-CZ 4.12Å; I56-F98 HydrophobicContact CD1-CB 3.85Å; I56-F98 HydrophobicContact CD1-CD1 4.1Å; I56-F98 HydrophobicContact CD1-CG 4.07Å; I56-F98 HydrophobicContact CG1-CB 3.82Å; I56-F98 HydrophobicContact CG1-CD1 4.08Å; I56-F98 HydrophobicContact CG1-CG 4.27Å; I56-S99 CarbonylContact C-O 3.52Å; I56-S99 VanDerWaalsContact CA-O 3.25Å; I56-S99 WeakPolarHBondContact CA-O 3.37Å; I56-L100 HydrophobicContact CB-CG 4.42Å; I56-L100 HydrophobicContact CD1-CD1 3.74Å; I56-L100 HydrophobicContact CD1-CG 4.05Å; I56-L100 HydrophobicContact CG1-CD1 3.92Å; I56-L100 HydrophobicContact CG1-CG 4.11Å
57	N	90.9	Very high	86.3	Confident	84 Å²	84	61.3 Å²	61.3	45%	0.449	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.8	-177.1	-58.2	-46.1	0	0	0	110.4	F98 S99	N57-F98 CarbonylContact O-C 3.57Å; N57-F98 WeakPolarHBondContact O-CA 3.03Å; N57-S99 PolarHBondContact N-O 3.04Å; N57-S99 PolarHBondContact O-N 2.6Å
58	V	89.1	Confident	86.2	Confident	50 Å²	50	61.7 Å²	61.7	30%	0.303	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	129.2	169.6	179.3	0	0	0	0	108.9	V68 F83 V96 F98	V58-V68 HydrophobicContact CG2-CB 4.49Å; V58-V68 HydrophobicContact CG2-CG1 4.1Å; V58-F83 HydrophobicContact CG2-CD1 3.78Å; V58-F83 HydrophobicContact CG2-CE1 3.72Å; V58-V96 HydrophobicContact CG1-CG1 3.9Å; V58-V96 HydrophobicContact CG2-CG1 4.24Å; V58-F98 HydrophobicContact CG2-CD1 3.97Å; V58-F98 HydrophobicContact CG2-CE1 3.62Å; V58-F98 HydrophobicContact CG2-CZ 4.5Å
59	V	81.1	Confident	86.3	Confident	74 Å²	74	61.4 Å²	61.4	45%	0.448	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-48.1	178.5	176.1	0	0	0	0	110.1	Y25 I97 S99	Y25-V59 HydrophobicContact CD1-CB 4.42Å; Y25-V59 HydrophobicContact CD1-CG1 4.33Å; Y25-V59 HydrophobicContact CD1-CG2 3.83Å; Y25-V59 HydrophobicContact CE1-CB 4.23Å; Y25-V59 HydrophobicContact CE1-CG1 3.85Å; Y25-V59 HydrophobicContact CE1-CG2 3.55Å; V59-I97 HydrophobicContact CB-CB 4.44Å; V59-I97 HydrophobicContact CB-CG2 4.18Å; V59-I97 WeakPolarHBondContact CB-O 3.35Å; V59-I97 PolarHBondContact N-O 2.92Å; V59-S99 VanDerWaalsContact CG2-CB 3.47Å
60	N	80.7	Confident	86.4	Confident	85 Å²	85	65.3 Å²	65.3	46%	0.455	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	159.9	-177.7	-163.9	13.1	0	0	0	109.7	I97	N60-I97 HydrophobicContact CB-CB 4.45Å; N60-I97 HydrophobicContact CB-CD1 4.39Å; N60-I97 PolarHBondContact N-O 2.81Å; N60-I97 PolarHBondContact O-N 3.4Å
61	Q	83.1	Confident	86.6	Confident	53 Å²	53	70.7 Å²	70.7	25%	0.248	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	148	173.2	64	179.9	11.6	0	0	109.4	N67 E95 V96	Q61-N67 PolarHBondContact NE2-OD1 2.69Å; Q61-E95 CarbonylContact C-O 3.59Å; Q61-E95 WeakPolarHBondContact CA-O 3.26Å; Q61-V96 HydrophobicContact CB-CG2 4.5Å
62	T	80.6	Confident	86.9	Confident	72 Å²	72	69.5 Å²	69.5	44%	0.442	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.3	174.7	63.8	0	0	0	0	110.4	Y94 E95	T62-Y94 WeakPolarHBondContact O-CA 3.46Å; T62-Y94 WeakPolarHBondContact O-CB 3.39Å; T62-E95 PolarHBondContact N-O 3.25Å; T62-E95 PolarHBondContact O-N 2.81Å
63	G	80	Confident	87.2	Confident	55 Å²	55	70 Å²	70	57%	0.567	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	104.2	174.1	-177.6	0	0	0	0	0	113.5	I65	G63-I65 VanDerWaalsContact C-N 3.34Å; G63-I65 PolarHBondContact O-N 2.77Å; G63-I65 VanDerWaalsContact O-N 3.12Å
64	N	76.7	Confident	87.6	Confident	163 Å²	163	72.4 Å²	72.4	87%	0.872	41%	0.405	S	S	*	.	S	Bend	trans	-89.7	68.7	-172.9	-164.3	16.7	0	0	0	110.8
65	I	82	Confident	87.7	Confident	22 Å²	22	69.4 Å²	69.4	11%	0.113	40%	0.395	C	S	.	.	S	Bend	trans	-136.3	151.5	-179.3	-166.6	63.5	0	0	0	110.5	G63 T85 R87 Y94	G63-I65 VanDerWaalsContact C-N 3.34Å; G63-I65 PolarHBondContact O-N 2.77Å; G63-I65 VanDerWaalsContact O-N 3.12Å; I65-T85 HydrophobicContact CG1-CG2 4.49Å; I65-T85 WeakPolarHBondContact CG1-OG1 3.34Å; I65-R87 WeakPolarHBondContact CD1-O 3.21Å; I65-Y94 HydrophobicContact CB-CD1 3.91Å; I65-Y94 HydrophobicContact CB-CG 3.88Å; I65-Y94 HydrophobicContact CD1-CD1 4.13Å; I65-Y94 HydrophobicContact CD1-CE1 4.2Å; I65-Y94 HydrophobicContact CG1-CD1 3.77Å; I65-Y94 HydrophobicContact CG1-CE1 4Å; I65-Y94 HydrophobicContact CG1-CG 4.1Å; I65-Y94 VanDerWaalsContact CG2-CB 3.46Å; I65-Y94 HydrophobicContact CG2-CD1 4.14Å; I65-Y94 HydrophobicContact CG2-CD2 3.94Å; I65-Y94 HydrophobicContact CG2-CG 3.6Å
66	D	85.2	Confident	87.7	Confident	102 Å²	102	72.8 Å²	72.8	55%	0.545	42%	0.416	S	S	.	.			trans	-60	151.1	168.9	-61.7	-31.4	0	0	0	111	V68 T85 G86	D66-V68 PolarHBondContact O-N 3.33Å; D66-T85 PolarHBondContact O-OG1 2.81Å; D66-G86 WeakPolarHBondContact OD2-CA 3.32Å
67	N	88.7	Confident	87.7	Confident	110 Å²	110	78.6 Å²	78.6	59%	0.588	45%	0.452	S	S	*	.			trans	-50.9	127.3	-178.9	-68.8	-6.4	0	0	0	112.5	Q61 T69	Q61-N67 PolarHBondContact NE2-OD1 2.69Å; N67-T69 HydrophobicContact CB-CG2 4.2Å; N67-T69 PolarHBondContact O-N 3.02Å
68	V	90.9	Very high	87.7	Confident	9 Å²	9	78.3 Å²	78.3	6%	0.055	45%	0.453	C	S	.	.			trans	-73.3	111.5	171.9	-177.3	0	0	0	0	108.2	I45 V58 D66 F83 T85 Y94 V96 F98	I45-V68 HydrophobicContact CD1-CG1 4.32Å; V58-V68 HydrophobicContact CG2-CB 4.49Å; V58-V68 HydrophobicContact CG2-CG1 4.1Å; D66-V68 PolarHBondContact O-N 3.33Å; V68-F83 HydrophobicContact CG1-CB 3.78Å; V68-F83 HydrophobicContact CG1-CD1 4.44Å; V68-F83 HydrophobicContact CG1-CG 4.36Å; V68-T85 HydrophobicContact CG2-CG2 4.39Å; V68-Y94 HydrophobicContact CG2-CE2 4.42Å; V68-V96 HydrophobicContact CB-CG1 4.36Å; V68-V96 HydrophobicContact CB-CG2 4.25Å; V68-V96 HydrophobicContact CG1-CG1 4.35Å; V68-V96 HydrophobicContact CG2-CG1 4.45Å; V68-V96 HydrophobicContact CG2-CG2 3.47Å; V68-V96 VanDerWaalsContact CG2-CG2 3.47Å; V68-F98 HydrophobicContact CG1-CZ 4.44Å
69	T	93.4	Very high	87.9	Confident	71 Å²	71	78.7 Å²	78.7	44%	0.436	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.5	-172.5	48.8	0	0	0	0	110.9	N67 K71 F83 T84	N67-T69 HydrophobicContact CB-CG2 4.2Å; N67-T69 PolarHBondContact O-N 3.02Å; T69-K71 PolarHBondContact O-N 2.82Å; T69-F83 CarbonylContact O-C 3.47Å; T69-F83 WeakPolarHBondContact O-CA 3.44Å; T69-T84 PolarHBondContact N-O 2.73Å; T69-T84 PolarHBondContact O-N 2.95Å; T69-T84 WeakPolarHBondContact OG1-CG2 2.85Å; T69-T84 PolarHBondContact OG1-O 2.91Å
70	L	94	Very high	88.6	Confident	95 Å²	95	76.4 Å²	76.4	50%	0.497	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	120.1	174.6	-176.7	67.6	0	0	0	109.1	T72 P73 V81 F83	L70-T72 WeakPolarHBondContact CD1-O 3.47Å; L70-P73 HydrophobicContact CD2-CB 4.43Å; L70-V81 HydrophobicContact CD1-CG2 3.62Å; L70-F83 HydrophobicContact CB-CD1 4.25Å; L70-F83 HydrophobicContact CB-CE1 4.14Å; L70-F83 HydrophobicContact CD1-CD1 4.1Å; L70-F83 HydrophobicContact CD1-CE1 3.69Å; L70-F83 HydrophobicContact CD1-CZ 3.98Å
71	K	92.8	Very high	89.3	Confident	120 Å²	120	72.6 Å²	72.6	52%	0.522	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-48.5	177.6	179.5	175.5	175	-177	0	111.7	T69 Q82 T84	T69-K71 PolarHBondContact O-N 2.82Å; K71-Q82 WeakPolarHBondContact CA-O 3.37Å; K71-Q82 HydrophobicContact CB-CG 4.33Å; K71-Q82 HydrophobicContact CD-CG 4.4Å; K71-Q82 PolarHBondContact N-O 2.75Å; K71-T84 HydrophobicContact CB-CG2 4Å; K71-T84 HydrophobicContact CD-CG2 4.34Å
72	T	92.7	Very high	89.9	Confident	57 Å²	57	72 Å²	72	35%	0.35	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.8	178.3	-47.1	0	0	0	0	108	L70 V81 Q82	L70-T72 WeakPolarHBondContact CD1-O 3.47Å; T72-V81 WeakPolarHBondContact O-CG2 3.36Å; T72-Q82 PolarHBondContact N-O 2.8Å; T72-Q82 PolarHBondContact O-N 3.3Å; T72-Q82 PolarHBondContact OG1-OE1 2.86Å
73	P	93.4	Very high	90.6	Very high	87 Å²	87	68.8 Å²	68.8	57%	0.565	40%	0.395	S	S	*	.			trans	-64.4	169.3	176.4	29.2	-35	0	0	0	111.2	L70 N75	L70-P73 HydrophobicContact CD2-CB 4.43Å; P73-N75 PolarHBondContact O-N 2.81Å
74	L	93.6	Very high	91.3	Very high	50 Å²	50	68 Å²	68	26%	0.262	38%	0.379	S	S	.	.			trans	-57.6	114.3	-179.2	-178.6	60.7	0	0	0	111.2	L49 K54 K79 V81	L49-L74 HydrophobicContact CD1-CD1 3.75Å; L49-L74 HydrophobicContact CD1-CD2 4.4Å; L49-L74 HydrophobicContact CG-CD1 4.39Å; K54-L74 VanDerWaalsContact O-CD2 3.3Å; K54-L74 WeakPolarHBondContact O-CD2 3.32Å; L74-K79 WeakPolarHBondContact CD1-O 3.31Å; L74-V81 HydrophobicContact CD1-CB 4.29Å
75	N	91.9	Very high	92	Very high	60 Å²	60	60.7 Å²	60.7	32%	0.321	34%	0.34	S	S	.	.			trans	-72.6	126.1	174.6	-177.9	-54.2	0	0	0	109.4	P73 V77 T78 K79 S80	P73-N75 PolarHBondContact O-N 2.81Å; N75-V77 VanDerWaalsContact C-N 3.27Å; N75-V77 PolarHBondContact O-N 2.99Å; N75-V77 WeakPolarHBondContact OD1-CA 3.24Å; N75-V77 WeakPolarHBondContact OD1-CB 3.41Å; N75-V77 PolarHBondContact OD1-N 2.83Å; N75-T78 VanDerWaalsContact CB-OG1 3.24Å; N75-T78 WeakPolarHBondContact CB-OG1 3.43Å; N75-T78 PolarHBondContact OD1-N 3.47Å; N75-T78 PolarHBondContact OD1-OG1 3.47Å; N75-K79 WeakPolarHBondContact O-CA 3.39Å; N75-K79 PolarHBondContact O-N 2.87Å; N75-S80 PolarHBondContact N-O 3.33Å
76	P	89.2	Confident	92.2	Very high	103 Å²	103	60 Å²	60	67%	0.669	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.6	-175	26.2	-33.9	0	0	0	113.5
77	V	90.6	Very high	92.4	Very high	129 Å²	129	61.4 Å²	61.4	78%	0.782	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-57	-176.9	-177.8	0	0	0	0	111	N75 K79	N75-V77 VanDerWaalsContact C-N 3.27Å; N75-V77 PolarHBondContact O-N 2.99Å; N75-V77 WeakPolarHBondContact OD1-CA 3.24Å; N75-V77 WeakPolarHBondContact OD1-CB 3.41Å; N75-V77 PolarHBondContact OD1-N 2.83Å; V77-K79 VanDerWaalsContact C-N 3.28Å; V77-K79 PolarHBondContact O-N 3.43Å
78	T	92.1	Very high	92.3	Very high	77 Å²	77	56.3 Å²	56.3	47%	0.472	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-11	-176.9	58.5	0	0	0	0	113	N75 S80	N75-T78 VanDerWaalsContact CB-OG1 3.24Å; N75-T78 WeakPolarHBondContact CB-OG1 3.43Å; N75-T78 PolarHBondContact OD1-N 3.47Å; N75-T78 PolarHBondContact OD1-OG1 3.47Å; T78-S80 PolarHBondContact O-N 3.12Å; T78-S80 PolarHBondContact OG1-N 3.15Å; T78-S80 PolarHBondContact OG1-OG 3.12Å
79	K	93.1	Very high	91.9	Very high	59 Å²	59	60.9 Å²	60.9	26%	0.257	33%	0.326	S	S	.	.			trans	51.3	27.9	-170.8	-63.4	-67.8	-175.7	170.5	0	112.9	L49 L74 N75 V77	L49-K79 HydrophobicContact CB-CB 4.42Å; L49-K79 PolarHBondContact N-O 3.04Å; L49-K79 WeakPolarHBondContact O-CB 3.45Å; L74-K79 WeakPolarHBondContact CD1-O 3.31Å; N75-K79 WeakPolarHBondContact O-CA 3.39Å; N75-K79 PolarHBondContact O-N 2.87Å; V77-K79 VanDerWaalsContact C-N 3.28Å; V77-K79 PolarHBondContact O-N 3.43Å
80	S	94.9	Very high	91.3	Very high	26 Å²	26	60.8 Å²	60.8	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.5	178.3	67	0	0	0	0	111.5	F47 N75 T78	F47-S80 CarbonylContact O-C 3.53Å; F47-S80 WeakPolarHBondContact O-CA 3.22Å; N75-S80 PolarHBondContact N-O 3.33Å; T78-S80 PolarHBondContact O-N 3.12Å; T78-S80 PolarHBondContact OG1-N 3.15Å; T78-S80 PolarHBondContact OG1-OG 3.12Å
81	V	96.2	Very high	90.3	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.024	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.4	176.8	55.3	0	0	0	0	108.3	I46 F47 L49 I56 L70 T72 L74 F83	I46-V81 CarbonylContact C-O 3.56Å; I46-V81 VanDerWaalsContact CA-O 3.3Å; I46-V81 WeakPolarHBondContact CA-O 3.46Å; F47-V81 HydrophobicContact CB-CG1 3.79Å; F47-V81 HydrophobicContact CD2-CG1 4.5Å; F47-V81 PolarHBondContact N-O 2.99Å; F47-V81 PolarHBondContact O-N 3.28Å; L49-V81 HydrophobicContact CD1-CG1 4.21Å; L49-V81 HydrophobicContact CG-CG1 4.43Å; I56-V81 HydrophobicContact CG2-CB 4.15Å; I56-V81 HydrophobicContact CG2-CG1 3.26Å; I56-V81 HydrophobicContact CG2-CG2 4.02Å; L70-V81 HydrophobicContact CD1-CG2 3.62Å; T72-V81 WeakPolarHBondContact O-CG2 3.36Å; L74-V81 HydrophobicContact CD1-CB 4.29Å; V81-F83 HydrophobicContact CG1-CE2 4.33Å; V81-F83 HydrophobicContact CG2-CE2 3.95Å; V81-F83 HydrophobicContact CG2-CZ 4.16Å
82	Q	96.1	Very high	89.8	Confident	42 Å²	42	53.8 Å²	53.8	20%	0.196	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125.8	-174.2	-178.4	175.8	3.9	0	0	110.5	S44 I45 I46 K71 T72	S44-Q82 PolarHBondContact OG-NE2 3.38Å; I45-Q82 WeakPolarHBondContact O-CA 3.36Å; I46-Q82 HydrophobicContact CG1-CB 4.27Å; I46-Q82 HydrophobicContact CG1-CG 3.95Å; K71-Q82 WeakPolarHBondContact CA-O 3.37Å; K71-Q82 HydrophobicContact CB-CG 4.33Å; K71-Q82 HydrophobicContact CD-CG 4.4Å; K71-Q82 PolarHBondContact N-O 2.75Å; T72-Q82 PolarHBondContact N-O 2.8Å; T72-Q82 PolarHBondContact O-N 3.3Å; T72-Q82 PolarHBondContact OG1-OE1 2.86Å
83	F	95.5	Very high	89.3	Confident	4 Å²	4	54 Å²	54	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	150.9	165.6	-58.2	-89.1	0	0	0	109.4	S44 I45 F47 I56 V58 V68 T69 L70 V81 F98	S44-F83 CarbonylContact C-O 3.5Å; S44-F83 VanDerWaalsContact CA-O 3.24Å; S44-F83 WeakPolarHBondContact CA-O 3.47Å; I45-F83 HydrophobicContact CB-CB 4.34Å; I45-F83 PolarHBondContact N-O 3Å; I45-F83 PolarHBondContact O-N 2.89Å; F47-F83 HydrophobicContact CD2-CD2 4.07Å; F47-F83 AromaticContact CD2-CE2 3.98Å; F47-F83 HydrophobicContact CD2-CE2 3.98Å; F47-F83 HydrophobicContact CE2-CD2 4.12Å; F47-F83 HydrophobicContact CE2-CE2 4.19Å; I56-F83 HydrophobicContact CG2-CE2 4.02Å; I56-F83 HydrophobicContact CG2-CZ 4.12Å; V58-F83 HydrophobicContact CG2-CD1 3.78Å; V58-F83 HydrophobicContact CG2-CE1 3.72Å; V68-F83 HydrophobicContact CG1-CB 3.78Å; V68-F83 HydrophobicContact CG1-CD1 4.44Å; V68-F83 HydrophobicContact CG1-CG 4.36Å; T69-F83 CarbonylContact O-C 3.47Å; T69-F83 WeakPolarHBondContact O-CA 3.44Å; L70-F83 HydrophobicContact CB-CD1 4.25Å; L70-F83 HydrophobicContact CB-CE1 4.14Å; L70-F83 HydrophobicContact CD1-CD1 4.1Å; L70-F83 HydrophobicContact CD1-CE1 3.69Å; L70-F83 HydrophobicContact CD1-CZ 3.98Å; V81-F83 HydrophobicContact CG1-CE2 4.33Å; V81-F83 HydrophobicContact CG2-CE2 3.95Å; V81-F83 HydrophobicContact CG2-CZ 4.16Å; F83-F98 HydrophobicContact CD1-CE1 4.13Å; F83-F98 HydrophobicContact CD2-CD1 4.44Å; F83-F98 AromaticContact CD2-CE1 3.64Å; F83-F98 HydrophobicContact CD2-CE1 3.64Å; F83-F98 HydrophobicContact CD2-CZ 4.32Å; F83-F98 HydrophobicContact CE1-CE1 4.15Å; F83-F98 HydrophobicContact CE2-CD1 4.01Å; F83-F98 AromaticContact CE2-CE1 3.66Å; F83-F98 HydrophobicContact CE2-CE1 3.66Å; F83-F98 AromaticContact CG-CE1 3.88Å; F83-F98 HydrophobicContact CG-CE1 3.88Å; F83-F98 HydrophobicContact CZ-CD1 4.07Å; F83-F98 AromaticContact CZ-CE1 3.93Å; F83-F98 HydrophobicContact CZ-CE1 3.93Å
84	T	93.7	Very high	88.7	Confident	38 Å²	38	50 Å²	50	23%	0.233	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.3	175.2	-163.7	0	0	0	0	109.4	Q43 T69 K71	Q43-T84 WeakPolarHBondContact O-CA 3.49Å; Q43-T84 PolarHBondContact O-OG1 3.15Å; T69-T84 PolarHBondContact N-O 2.73Å; T69-T84 PolarHBondContact O-N 2.95Å; T69-T84 WeakPolarHBondContact OG1-CG2 2.85Å; T69-T84 PolarHBondContact OG1-O 2.91Å; K71-T84 HydrophobicContact CB-CG2 4Å; K71-T84 HydrophobicContact CD-CG2 4.34Å
85	T	91.5	Very high	88	Confident	9 Å²	9	48.9 Å²	48.9	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	171.3	174.6	-175.9	0	0	0	0	109.6	Q43 I65 D66 V68	Q43-T85 HydrophobicContact CB-CG2 3.67Å; Q43-T85 PolarHBondContact N-O 3.19Å; Q43-T85 PolarHBondContact O-N 3.49Å; Q43-T85 VanDerWaalsContact O-N 3.12Å; I65-T85 HydrophobicContact CG1-CG2 4.49Å; I65-T85 WeakPolarHBondContact CG1-OG1 3.34Å; D66-T85 PolarHBondContact O-OG1 2.81Å; V68-T85 HydrophobicContact CG2-CG2 4.39Å
86	G	87.6	Confident	87.5	Confident	9 Å²	9	46 Å²	46	9%	0.093	25%	0.25	C	C	.	.			trans	-72.8	-153.7	-171.4	0	0	0	0	0	115.1	Q43 D66	Q43-G86 PolarHBondContact NE2-O 2.92Å; D66-G86 WeakPolarHBondContact OD2-CA 3.32Å
87	R	87.9	Confident	87	Confident	130 Å²	130	43 Å²	43	49%	0.491	23%	0.228	S	C	.	.			trans	-77	143.5	-175.4	-61.3	161.7	177.2	-168.3	7.4	111.1	C40 E41 I65 Y89 Y124	C40-R87 CarbonylContact O-C 3.49Å; C40-R87 WeakPolarHBondContact O-CA 3.4Å; E41-R87 WeakPolarHBondContact O-CG 3.29Å; I65-R87 WeakPolarHBondContact CD1-O 3.21Å; R87-Y89 HydrophobicContact CB-CE2 4.13Å; R87-Y89 VanDerWaalsContact CD-OH 3.31Å; R87-Y89 WeakPolarHBondContact CD-OH 3.05Å; R87-Y89 PolarHBondContact NH1-OH 2.87Å; R87-Y124 WeakPolarHBondContact CD-OH 3.12Å; R87-Y124 VanDerWaalsContact CG-OH 3.29Å; R87-Y124 WeakPolarHBondContact CG-OH 3.42Å
88	L	86.2	Confident	86.7	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-124	109.1	172.6	-167.1	68.5	0	0	0	110.2	V30 M32 C40 A92 Y94	V30-L88 HydrophobicContact CG1-CD2 3.78Å; M32-L88 HydrophobicContact CB-CD2 3.79Å; M32-L88 HydrophobicContact CB-CG 3.81Å; M32-L88 HydrophobicContact CE-CD2 4.16Å; M32-L88 HydrophobicContact CE-CG 4.5Å; C40-L88 HydrophobicContact CB-CB 4.05Å; C40-L88 PolarHBondContact N-O 2.89Å; C40-L88 PolarHBondContact O-N 3.11Å; L88-A92 HydrophobicContact CD1-CB 3.69Å; L88-A92 HydrophobicContact CG-CB 4.43Å; L88-Y94 HydrophobicContact CD1-CD1 3.81Å; L88-Y94 HydrophobicContact CD1-CE1 4Å; L88-Y94 HydrophobicContact CD2-CE1 4.44Å
89	Y	84	Confident	86.2	Confident	105 Å²	105	34 Å²	34	41%	0.412	17%	0.174	S	C	.	.			trans	-85.9	165.5	178.8	-56.7	-73.9	0	0	0	111.6	M32 E39 R87 G91 A92	M32-Y89 WeakPolarHBondContact CB-O 3.37Å; E39-Y89 WeakPolarHBondContact OE1-CD1 3.05Å; R87-Y89 HydrophobicContact CB-CE2 4.13Å; R87-Y89 VanDerWaalsContact CD-OH 3.31Å; R87-Y89 WeakPolarHBondContact CD-OH 3.05Å; R87-Y89 PolarHBondContact NH1-OH 2.87Å; Y89-G91 PolarHBondContact O-N 2.89Å; Y89-A92 VanDerWaalsContact O-CB 3.23Å; Y89-A92 WeakPolarHBondContact O-CB 3.47Å; Y89-A92 PolarHBondContact O-N 2.78Å; Y89-A92 VanDerWaalsContact O-N 3.14Å
90	F	79.6	Confident	85.8	Confident	69 Å²	69	31.2 Å²	31.2	30%	0.303	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	136.3	176.4	-60.5	-53.8	0	0	0	112.3	M32 T36 L38 E39 A92	M32-F90 HydrophobicContact CG-CD1 3.86Å; M32-F90 HydrophobicContact CG-CE1 4.47Å; T36-F90 WeakPolarHBondContact O-CE1 3.48Å; T36-F90 VanDerWaalsContact O-CZ 3.25Å; T36-F90 WeakPolarHBondContact O-CZ 3.22Å; T36-F90 WeakPolarHBondContact OG1-CE1 3.48Å; L38-F90 WeakPolarHBondContact O-CE1 3.44Å; E39-F90 HydrophobicContact CG-CD1 4Å; E39-F90 HydrophobicContact CG-CD2 3.64Å; E39-F90 HydrophobicContact CG-CE1 3.74Å; E39-F90 HydrophobicContact CG-CE2 3.44Å; E39-F90 VanDerWaalsContact CG-CE2 3.44Å; E39-F90 HydrophobicContact CG-CG 3.94Å; E39-F90 HydrophobicContact CG-CZ 3.49Å; E39-F90 VanDerWaalsContact CG-CZ 3.49Å; E39-F90 WeakPolarHBondContact OE1-CD2 3.04Å; E39-F90 PolarHBondContact OE1-N 3.3Å; F90-A92 PolarHBondContact O-N 2.96Å
91	G	74.3	Confident	85.3	Confident	41 Å²	41	34.2 Å²	34.2	42%	0.423	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	-10.9	-178.4	0	0	0	0	0	114.3	M32 N34 Y89	M32-G91 VanDerWaalsContact O-CA 3.28Å; M32-G91 WeakPolarHBondContact O-CA 3.5Å; M32-G91 PolarHBondContact O-N 2.78Å; N34-G91 VanDerWaalsContact OD1-CA 3.31Å; N34-G91 WeakPolarHBondContact OD1-CA 3.46Å; N34-G91 PolarHBondContact OD1-N 2.59Å; N34-G91 VanDerWaalsContact OD1-N 3.14Å; Y89-G91 PolarHBondContact O-N 2.89Å
92	A	82.3	Confident	84.6	Confident	26 Å²	26	34 Å²	34	22%	0.215	17%	0.17	C	C	.	.			trans	-71.1	144.8	178.6	0	0	0	0	0	111.5	Q31 M32 L88 Y89 F90	Q31-A92 WeakPolarHBondContact CA-O 3.28Å; M32-A92 PolarHBondContact N-O 3.12Å; L88-A92 HydrophobicContact CD1-CB 3.69Å; L88-A92 HydrophobicContact CG-CB 4.43Å; Y89-A92 VanDerWaalsContact O-CB 3.23Å; Y89-A92 WeakPolarHBondContact O-CB 3.47Å; Y89-A92 PolarHBondContact O-N 2.78Å; Y89-A92 VanDerWaalsContact O-N 3.14Å; F90-A92 PolarHBondContact O-N 2.96Å
93	K	81.3	Confident	83.9	Confident	62 Å²	62	35.5 Å²	35.5	27%	0.27	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	139	179.2	179	-178	176.2	-177.4	0	108.7	V29 V30 Q31 D290 T292	V29-K93 HydrophobicContact CG1-CD 4.41Å; V29-K93 HydrophobicContact CG1-CG 4.12Å; V30-K93 CarbonylContact O-C 3.45Å; V30-K93 VanDerWaalsContact O-CA 3.32Å; V30-K93 WeakPolarHBondContact O-CA 3.22Å; Q31-K93 HydrophobicContact CB-CB 4.39Å; Q31-K93 HydrophobicContact CB-CG 4.34Å; Q31-K93 HydrophobicContact CG-CB 4.18Å; Q31-K93 HydrophobicContact CG-CG 4.5Å; K93-D290 IonicContact NZ-OD2 3.97Å; K93-D290 PolarHBondContact NZ-OD2 2.97Å; K93-D290 VanDerWaalsContact NZ-OD2 3.11Å; K93-T292 PolarHBondContact NZ-OG1 2.85Å; K93-T292 VanDerWaalsContact NZ-OG1 3.1Å
94	Y	81.4	Confident	82.7	Confident	3 Å²	3	40.3 Å²	40.3	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	163.8	169.2	71	-95	0	0	0	110.7	V30 Q43 I45 T62 I65 V68 L88 V96	V30-Y94 HydrophobicContact CB-CD1 4.05Å; V30-Y94 HydrophobicContact CB-CD2 4.37Å; V30-Y94 HydrophobicContact CB-CE1 3.52Å; V30-Y94 HydrophobicContact CB-CE2 3.86Å; V30-Y94 HydrophobicContact CB-CG 4.45Å; V30-Y94 HydrophobicContact CG1-CD1 4.36Å; V30-Y94 HydrophobicContact CG1-CE1 3.54Å; V30-Y94 HydrophobicContact CG2-CE1 4.21Å; V30-Y94 HydrophobicContact CG2-CE2 3.75Å; V30-Y94 WeakPolarHBondContact CG2-OH 3.46Å; V30-Y94 PolarHBondContact N-O 2.81Å; V30-Y94 PolarHBondContact O-N 2.75Å; Q43-Y94 PolarHBondContact OE1-OH 3.08Å; I45-Y94 HydrophobicContact CD1-CE2 4.46Å; T62-Y94 WeakPolarHBondContact O-CA 3.46Å; T62-Y94 WeakPolarHBondContact O-CB 3.39Å; I65-Y94 HydrophobicContact CB-CD1 3.91Å; I65-Y94 HydrophobicContact CB-CG 3.88Å; I65-Y94 HydrophobicContact CD1-CD1 4.13Å; I65-Y94 HydrophobicContact CD1-CE1 4.2Å; I65-Y94 HydrophobicContact CG1-CD1 3.77Å; I65-Y94 HydrophobicContact CG1-CE1 4Å; I65-Y94 HydrophobicContact CG1-CG 4.1Å; I65-Y94 VanDerWaalsContact CG2-CB 3.46Å; I65-Y94 HydrophobicContact CG2-CD1 4.14Å; I65-Y94 HydrophobicContact CG2-CD2 3.94Å; I65-Y94 HydrophobicContact CG2-CG 3.6Å; V68-Y94 HydrophobicContact CG2-CE2 4.42Å; L88-Y94 HydrophobicContact CD1-CD1 3.81Å; L88-Y94 HydrophobicContact CD1-CE1 4Å; L88-Y94 HydrophobicContact CD2-CE1 4.44Å; Y94-V96 HydrophobicContact CD2-CG2 3.7Å; Y94-V96 HydrophobicContact CE2-CG2 3.63Å
95	E	78.3	Confident	81.5	Confident	26 Å²	26	40.7 Å²	40.7	12%	0.121	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.5	179.9	-177.9	-173.6	135.9	0	0	110.2	Q27 T28 V29 Q61 T62	Q27-E95 VanDerWaalsContact CD-CD 3.44Å; Q27-E95 HydrophobicContact CG-CG 3.59Å; Q27-E95 VanDerWaalsContact CG-OE1 3.28Å; Q27-E95 WeakPolarHBondContact CG-OE1 3.31Å; Q27-E95 PolarHBondContact NE2-OE1 2.86Å; Q27-E95 PolarHBondContact NE2-OE2 2.9Å; T28-E95 CarbonylContact O-C 3.45Å; T28-E95 WeakPolarHBondContact O-CA 3.49Å; V29-E95 HydrophobicContact CG2-CB 4.48Å; V29-E95 HydrophobicContact CG2-CG 4.15Å; Q61-E95 CarbonylContact C-O 3.59Å; Q61-E95 WeakPolarHBondContact CA-O 3.26Å; T62-E95 PolarHBondContact N-O 3.25Å; T62-E95 PolarHBondContact O-N 2.81Å
96	V	82.7	Confident	80.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.5	175.2	-169.2	0	0	0	0	109.2	Q27 T28 V58 Q61 V68 Y94 F98	Q27-V96 CarbonylContact C-O 3.6Å; Q27-V96 WeakPolarHBondContact CA-O 3.5Å; T28-V96 PolarHBondContact N-O 2.82Å; T28-V96 PolarHBondContact O-N 3.23Å; V58-V96 HydrophobicContact CG1-CG1 3.9Å; V58-V96 HydrophobicContact CG2-CG1 4.24Å; Q61-V96 HydrophobicContact CB-CG2 4.5Å; V68-V96 HydrophobicContact CB-CG1 4.36Å; V68-V96 HydrophobicContact CB-CG2 4.25Å; V68-V96 HydrophobicContact CG1-CG1 4.35Å; V68-V96 HydrophobicContact CG2-CG1 4.45Å; V68-V96 HydrophobicContact CG2-CG2 3.47Å; V68-V96 VanDerWaalsContact CG2-CG2 3.47Å; Y94-V96 HydrophobicContact CD2-CG2 3.7Å; Y94-V96 HydrophobicContact CE2-CG2 3.63Å; V96-F98 HydrophobicContact CB-CD2 4.4Å; V96-F98 HydrophobicContact CB-CE2 3.72Å; V96-F98 HydrophobicContact CB-CZ 4.03Å; V96-F98 HydrophobicContact CG1-CD1 4.5Å; V96-F98 HydrophobicContact CG1-CD2 4.11Å; V96-F98 HydrophobicContact CG1-CE1 4.01Å; V96-F98 HydrophobicContact CG1-CE2 3.57Å; V96-F98 HydrophobicContact CG1-CZ 3.51Å
97	I	77.8	Confident	79.1	Confident	40 Å²	40	49.6 Å²	49.6	21%	0.205	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.2	172.3	-58.1	177.6	0	0	0	108	Y25 Q27 V59 N60	Y25-I97 HydrophobicContact CD1-CG2 3.82Å; Y25-I97 HydrophobicContact CG-CG2 4.49Å; Q27-I97 HydrophobicContact CG-CG1 4.24Å; V59-I97 HydrophobicContact CB-CB 4.44Å; V59-I97 HydrophobicContact CB-CG2 4.18Å; V59-I97 WeakPolarHBondContact CB-O 3.35Å; V59-I97 PolarHBondContact N-O 2.92Å; N60-I97 HydrophobicContact CB-CB 4.45Å; N60-I97 HydrophobicContact CB-CD1 4.39Å; N60-I97 PolarHBondContact N-O 2.81Å; N60-I97 PolarHBondContact O-N 3.4Å
98	F	84.1	Confident	77.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	140.6	174.4	-62.7	-86.5	0	0	0	110.7	Y25 L26 I45 F47 I56 N57 V58 V68 F83 V96 L100	Y25-F98 CarbonylContact C-O 3.59Å; Y25-F98 WeakPolarHBondContact CA-O 3.19Å; L26-F98 HydrophobicContact CB-CB 4.3Å; L26-F98 PolarHBondContact N-O 3.37Å; L26-F98 PolarHBondContact O-N 3.46Å; I45-F98 HydrophobicContact CD1-CZ 4.2Å; I45-F98 HydrophobicContact CG2-CZ 4.45Å; F47-F98 HydrophobicContact CE2-CD1 4.11Å; F47-F98 HydrophobicContact CE2-CD2 4.08Å; F47-F98 AromaticContact CE2-CE1 3.84Å; F47-F98 HydrophobicContact CE2-CE1 3.84Å; F47-F98 AromaticContact CE2-CE2 3.81Å; F47-F98 HydrophobicContact CE2-CE2 3.81Å; F47-F98 HydrophobicContact CE2-CG 4.22Å; F47-F98 AromaticContact CE2-CZ 3.69Å; F47-F98 HydrophobicContact CE2-CZ 3.69Å; F47-F98 AromaticContact CZ-CD2 3.83Å; F47-F98 HydrophobicContact CZ-CD2 3.83Å; F47-F98 AromaticContact CZ-CE2 3.69Å; F47-F98 HydrophobicContact CZ-CE2 3.69Å; F47-F98 HydrophobicContact CZ-CG 4.31Å; F47-F98 HydrophobicContact CZ-CZ 4.07Å; I56-F98 HydrophobicContact CD1-CB 3.85Å; I56-F98 HydrophobicContact CD1-CD1 4.1Å; I56-F98 HydrophobicContact CD1-CG 4.07Å; I56-F98 HydrophobicContact CG1-CB 3.82Å; I56-F98 HydrophobicContact CG1-CD1 4.08Å; I56-F98 HydrophobicContact CG1-CG 4.27Å; N57-F98 CarbonylContact O-C 3.57Å; N57-F98 WeakPolarHBondContact O-CA 3.03Å; V58-F98 HydrophobicContact CG2-CD1 3.97Å; V58-F98 HydrophobicContact CG2-CE1 3.62Å; V58-F98 HydrophobicContact CG2-CZ 4.5Å; V68-F98 HydrophobicContact CG1-CZ 4.44Å; F83-F98 HydrophobicContact CD1-CE1 4.13Å; F83-F98 HydrophobicContact CD2-CD1 4.44Å; F83-F98 AromaticContact CD2-CE1 3.64Å; F83-F98 HydrophobicContact CD2-CE1 3.64Å; F83-F98 HydrophobicContact CD2-CZ 4.32Å; F83-F98 HydrophobicContact CE1-CE1 4.15Å; F83-F98 HydrophobicContact CE2-CD1 4.01Å; F83-F98 AromaticContact CE2-CE1 3.66Å; F83-F98 HydrophobicContact CE2-CE1 3.66Å; F83-F98 AromaticContact CG-CE1 3.88Å; F83-F98 HydrophobicContact CG-CE1 3.88Å; F83-F98 HydrophobicContact CZ-CD1 4.07Å; F83-F98 AromaticContact CZ-CE1 3.93Å; F83-F98 HydrophobicContact CZ-CE1 3.93Å; V96-F98 HydrophobicContact CB-CD2 4.4Å; V96-F98 HydrophobicContact CB-CE2 3.72Å; V96-F98 HydrophobicContact CB-CZ 4.03Å; V96-F98 HydrophobicContact CG1-CD1 4.5Å; V96-F98 HydrophobicContact CG1-CD2 4.11Å; V96-F98 HydrophobicContact CG1-CE1 4.01Å; V96-F98 HydrophobicContact CG1-CE2 3.57Å; V96-F98 HydrophobicContact CG1-CZ 3.51Å; F98-L100 HydrophobicContact CB-CD1 4.24Å
99	S	82	Confident	77	Confident	18 Å²	18	51.9 Å²	51.9	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.5	166.4	62.5	0	0	0	0	109.8	V24 I56 N57 V59	V24-S99 CarbonylContact O-C 3.57Å; I56-S99 CarbonylContact C-O 3.52Å; I56-S99 VanDerWaalsContact CA-O 3.25Å; I56-S99 WeakPolarHBondContact CA-O 3.37Å; N57-S99 PolarHBondContact N-O 3.04Å; N57-S99 PolarHBondContact O-N 2.6Å; V59-S99 VanDerWaalsContact CG2-CB 3.47Å
100	L	83.7	Confident	76.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.6	171.9	-74	72.3	0	0	0	108.7	V23 V24 L26 I53 S55 I56 F98 F102 V115 V148	V23-L100 CarbonylContact C-O 3.52Å; V23-L100 VanDerWaalsContact CA-O 3.25Å; V23-L100 WeakPolarHBondContact CA-O 3.44Å; V24-L100 HydrophobicContact CB-CB 4.46Å; V24-L100 PolarHBondContact N-O 2.84Å; V24-L100 PolarHBondContact O-N 3.43Å; L26-L100 HydrophobicContact CB-CD1 3.51Å; L26-L100 HydrophobicContact CD2-CD1 4.16Å; L26-L100 HydrophobicContact CG-CD1 4.48Å; I53-L100 HydrophobicContact CD1-CD2 4.06Å; I53-L100 HydrophobicContact CG2-CB 4.31Å; S55-L100 CarbonylContact O-C 3.57Å; S55-L100 WeakPolarHBondContact O-CA 3.27Å; I56-L100 HydrophobicContact CB-CG 4.42Å; I56-L100 HydrophobicContact CD1-CD1 3.74Å; I56-L100 HydrophobicContact CD1-CG 4.05Å; I56-L100 HydrophobicContact CG1-CD1 3.92Å; I56-L100 HydrophobicContact CG1-CG 4.11Å; F98-L100 HydrophobicContact CB-CD1 4.24Å; L100-F102 HydrophobicContact CB-CE2 4.01Å; L100-V115 HydrophobicContact CD2-CG2 4.23Å; L100-V148 HydrophobicContact CD2-CG2 4.15Å
101	K	84.6	Confident	75.7	Confident	88 Å²	88	48.7 Å²	48.7	38%	0.383	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.6	172.5	-166	168.8	-176.5	167.7	0	110.2	D22 V23 I53 K54 S55	D22-K101 HydrophobicContact CB-CG 4.37Å; D22-K101 CarbonylContact O-C 3.5Å; D22-K101 VanDerWaalsContact O-C 3.31Å; D22-K101 WeakPolarHBondContact O-CA 3.43Å; V23-K101 HydrophobicContact CG2-CG 4.25Å; I53-K101 CarbonylContact C-O 3.44Å; I53-K101 WeakPolarHBondContact CG2-O 2.95Å; K54-K101 WeakPolarHBondContact CA-O 3.37Å; K54-K101 WeakPolarHBondContact CB-O 3.27Å; K54-K101 PolarHBondContact N-O 3.12Å; S55-K101 PolarHBondContact N-O 2.82Å; S55-K101 PolarHBondContact O-N 3.16Å; S55-K101 VanDerWaalsContact OG-CB 3.3Å; S55-K101 WeakPolarHBondContact OG-CB 3.46Å
102	F	82.4	Confident	75.9	Confident	1 Å²	1	52.2 Å²	52.2	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	158.5	177.5	-69.3	-97.4	0	0	0	110.7	D22 V24 Q52 I53 L100 Y113 V148 L150	D22-F102 PolarHBondContact O-N 2.84Å; V24-F102 HydrophobicContact CB-CE2 3.89Å; V24-F102 HydrophobicContact CG2-CD2 4.25Å; V24-F102 HydrophobicContact CG2-CE2 3.56Å; V24-F102 HydrophobicContact CG2-CZ 4.32Å; Q52-F102 CarbonylContact O-C 3.54Å; Q52-F102 WeakPolarHBondContact O-CA 3.34Å; I53-F102 HydrophobicContact CD1-CE1 4.06Å; I53-F102 HydrophobicContact CD1-CZ 4.17Å; I53-F102 HydrophobicContact CG1-CD1 3.77Å; I53-F102 HydrophobicContact CG1-CE1 3.3Å; I53-F102 HydrophobicContact CG1-CE2 4.47Å; I53-F102 HydrophobicContact CG1-CZ 3.69Å; L100-F102 HydrophobicContact CB-CE2 4.01Å; F102-Y113 HydrophobicContact CD1-CD2 4.07Å; F102-Y113 HydrophobicContact CD1-CE2 4.21Å; F102-Y113 AromaticContact CE1-CD2 3.51Å; F102-Y113 HydrophobicContact CE1-CD2 3.51Å; F102-Y113 HydrophobicContact CE1-CE2 4.1Å; F102-Y113 AromaticContact CE1-CG 4Å; F102-Y113 HydrophobicContact CE1-CG 4Å; F102-Y113 HydrophobicContact CZ-CD2 4.43Å; F102-V148 HydrophobicContact CE2-CG1 4.16Å; F102-V148 HydrophobicContact CZ-CB 4.25Å; F102-V148 HydrophobicContact CZ-CG1 3.57Å; F102-L150 HydrophobicContact CB-CD1 4.23Å; F102-L150 HydrophobicContact CD1-CD1 3.58Å; F102-L150 HydrophobicContact CD2-CD1 3.93Å; F102-L150 HydrophobicContact CD2-CD2 4.44Å; F102-L150 HydrophobicContact CE1-CD1 3.83Å; F102-L150 HydrophobicContact CE1-CG 4.45Å; F102-L150 HydrophobicContact CE2-CD1 4.2Å; F102-L150 HydrophobicContact CE2-CD2 4.31Å; F102-L150 HydrophobicContact CG-CD1 3.63Å; F102-L150 HydrophobicContact CZ-CD1 4.15Å; F102-L150 HydrophobicContact CZ-CG 4.44Å
103	N	81.3	Confident	75.9	Confident	72 Å²	72	51.9 Å²	51.9	39%	0.385	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-70.9	144.1	163.2	-67.2	-37.2	0	0	0	109	Q52 S105	Q52-N103 PolarHBondContact O-N 2.75Å; N103-S105 PolarHBondContact O-N 3.29Å
104	P	71	Confident	75.9	Confident	105 Å²	105	53 Å²	53	68%	0.682	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-52.9	130.9	171.4	-23.8	32.7	0	0	0	110.2
105	S	67.8	Low	76	Confident	47 Å²	47	53 Å²	53	33%	0.329	30%	0.298	S	S	.	.			trans	-118.4	142.5	179.6	-175.2	0	0	0	0	110.4	N103 S107 Y152	N103-S105 PolarHBondContact O-N 3.29Å; S105-S107 VanDerWaalsContact C-N 3.27Å; S105-S107 WeakPolarHBondContact OG-CB 3.21Å; S105-S107 PolarHBondContact OG-N 2.85Å; S105-Y152 VanDerWaalsContact CB-OH 3.25Å; S105-Y152 WeakPolarHBondContact CB-OH 3.22Å
106	L	62.9	Low	76.3	Confident	175 Å²	175	54.3 Å²	54.3	92%	0.916	31%	0.305	S	S	*	.			trans	-87.4	5.6	171.8	-62.9	174.9	0	0	0	112.6	T108	L106-T108 PolarHBondContact O-N 2.97Å
107	S	65.6	Low	76.5	Confident	30 Å²	30	54.3 Å²	54.3	21%	0.21	31%	0.306	C	S	.	.			trans	-57.2	140.1	179	-170.8	0	0	0	0	110.8	S105 S109 V111 Y152	S105-S107 VanDerWaalsContact C-N 3.27Å; S105-S107 WeakPolarHBondContact OG-CB 3.21Å; S105-S107 PolarHBondContact OG-N 2.85Å; S107-S109 PolarHBondContact OG-N 2.93Å; S107-S109 PolarHBondContact OG-O 2.9Å; S107-S109 VanDerWaalsContact OG-O 3.09Å; S107-S109 PolarHBondContact OG-OG 2.81Å; S107-V111 VanDerWaalsContact OG-CG2 3.25Å; S107-V111 WeakPolarHBondContact OG-CG2 3.44Å; S107-Y152 WeakPolarHBondContact O-CB 3.5Å
108	T	62.7	Low	76.8	Confident	119 Å²	119	52.5 Å²	52.5	73%	0.73	30%	0.296	S	S	*	.			trans	-108	1.9	170.8	54.4	0	0	0	0	111.9	L106 T153	L106-T108 PolarHBondContact O-N 2.97Å; T108-T153 VanDerWaalsContact O-CA 3.3Å; T108-T153 WeakPolarHBondContact O-CA 3.37Å; T108-T153 WeakPolarHBondContact O-CG2 3.49Å
109	S	66.5	Low	76.9	Confident	63 Å²	63	52.7 Å²	52.7	44%	0.441	30%	0.297	S	S	.	.	S	Bend	trans	-115.7	162.9	-179.7	62.9	0	0	0	0	111.8	S107 V111 Y152	S107-S109 PolarHBondContact OG-N 2.93Å; S107-S109 PolarHBondContact OG-O 2.9Å; S107-S109 VanDerWaalsContact OG-O 3.09Å; S107-S109 PolarHBondContact OG-OG 2.81Å; S109-V111 WeakPolarHBondContact O-CG2 3.45Å; S109-V111 PolarHBondContact O-N 3.5Å; S109-Y152 WeakPolarHBondContact O-CD2 3.27Å
110	I	67.6	Low	77.1	Confident	75 Å²	75	52.7 Å²	52.7	39%	0.385	30%	0.296	S	S	.	.			trans	-63.3	125.3	169.9	-62.4	172.9	0	0	0	108.8	E149 L150 D151 T153	I110-E149 HydrophobicContact CG2-CG 3.39Å; I110-E149 VanDerWaalsContact CG2-OE1 3.24Å; I110-E149 WeakPolarHBondContact CG2-OE1 3.39Å; I110-L150 CarbonylContact C-O 3.46Å; I110-L150 WeakPolarHBondContact CA-O 3.28Å; I110-D151 HydrophobicContact CG1-CB 4.08Å; I110-D151 WeakPolarHBondContact CG1-OD1 3.24Å; I110-T153 HydrophobicContact CG1-CG2 3.97Å
111	V	70.5	Confident	77.2	Confident	32 Å²	32	53 Å²	53	19%	0.194	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.7	177.5	-168.7	0	0	0	0	110	S107 S109 Y113 E149 L150 Y152	S107-V111 VanDerWaalsContact OG-CG2 3.25Å; S107-V111 WeakPolarHBondContact OG-CG2 3.44Å; S109-V111 WeakPolarHBondContact O-CG2 3.45Å; S109-V111 PolarHBondContact O-N 3.5Å; V111-Y113 HydrophobicContact CB-CE2 3.96Å; V111-Y113 HydrophobicContact CG1-CD1 4.45Å; V111-Y113 HydrophobicContact CG1-CD2 4.36Å; V111-Y113 HydrophobicContact CG1-CE1 3.78Å; V111-Y113 HydrophobicContact CG1-CE2 3.69Å; V111-Y113 WeakPolarHBondContact CG1-OH 3.42Å; V111-E149 WeakPolarHBondContact O-CA 2.91Å; V111-L150 PolarHBondContact N-O 3Å; V111-L150 PolarHBondContact O-N 2.83Å; V111-Y152 HydrophobicContact CB-CE2 4.31Å; V111-Y152 HydrophobicContact CG2-CD2 4.05Å; V111-Y152 HydrophobicContact CG2-CE2 4Å
112	K	77.8	Confident	77.2	Confident	114 Å²	114	51.6 Å²	51.6	50%	0.496	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.1	177.4	-56.1	-172.4	-166.9	-130.6	0	109.8	V148 E149	K112-V148 CarbonylContact C-O 3.57Å; K112-V148 WeakPolarHBondContact CA-O 3.26Å; K112-E149 VanDerWaalsContact CE-OE2 3.29Å; K112-E149 WeakPolarHBondContact CE-OE2 3.29Å; K112-E149 HydrophobicContact CG-CB 4.49Å; K112-E149 HydrophobicContact CG-CG 4.23Å; K112-E149 IonicContact NZ-OE1 3.34Å; K112-E149 IonicContact NZ-OE2 3.75Å; K112-E149 PolarHBondContact NZ-OE2 2.99Å
113	Y	81.3	Confident	77.1	Confident	20 Å²	20	52.4 Å²	52.4	8%	0.078	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.3	178.4	-64.3	-70.4	0	0	0	110.9	Q52 F102 V111 V148 L150	Q52-Y113 HydrophobicContact CB-CD1 3.99Å; Q52-Y113 HydrophobicContact CB-CE1 3.57Å; Q52-Y113 VanDerWaalsContact CD-CE1 3.43Å; Q52-Y113 HydrophobicContact CG-CD1 4.1Å; Q52-Y113 HydrophobicContact CG-CE1 3.37Å; F102-Y113 HydrophobicContact CD1-CD2 4.07Å; F102-Y113 HydrophobicContact CD1-CE2 4.21Å; F102-Y113 AromaticContact CE1-CD2 3.51Å; F102-Y113 HydrophobicContact CE1-CD2 3.51Å; F102-Y113 HydrophobicContact CE1-CE2 4.1Å; F102-Y113 AromaticContact CE1-CG 4Å; F102-Y113 HydrophobicContact CE1-CG 4Å; F102-Y113 HydrophobicContact CZ-CD2 4.43Å; V111-Y113 HydrophobicContact CB-CE2 3.96Å; V111-Y113 HydrophobicContact CG1-CD1 4.45Å; V111-Y113 HydrophobicContact CG1-CD2 4.36Å; V111-Y113 HydrophobicContact CG1-CE1 3.78Å; V111-Y113 HydrophobicContact CG1-CE2 3.69Å; V111-Y113 WeakPolarHBondContact CG1-OH 3.42Å; Y113-V148 PolarHBondContact N-O 2.85Å; Y113-V148 PolarHBondContact O-N 3.24Å; Y113-L150 HydrophobicContact CD2-CD1 4.14Å; Y113-L150 HydrophobicContact CD2-CG 4.37Å; Y113-L150 HydrophobicContact CE2-CD1 3.76Å; Y113-L150 HydrophobicContact CE2-CG 4.28Å
114	P	82.8	Confident	76.8	Confident	86 Å²	86	51.5 Å²	51.5	56%	0.558	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	135.4	173.4	27.3	-33.9	0	0	0	111.1	S50 L146	S50-P114 PolarHBondContact N-O 2.04Å; S50-P114 WeakPolarHBondContact OG-CD 3.39Å; S50-P114 WeakPolarHBondContact OG-CG 3.31Å; S50-P114 PolarHBondContact OG-O 3.22Å; P114-L146 WeakPolarHBondContact CA-O 3.47Å
115	V	82.2	Confident	76.9	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	130.4	167.8	174.4	0	0	0	0	107	F47 Y48 L49 I53 L100 L146 V148	F47-V115 HydrophobicContact CD1-CG1 4.01Å; Y48-V115 WeakPolarHBondContact O-CA 3.36Å; L49-V115 HydrophobicContact CD2-CG1 3.95Å; L49-V115 HydrophobicContact CD2-CG2 4.43Å; I53-V115 HydrophobicContact CD1-CG2 3.35Å; L100-V115 HydrophobicContact CD2-CG2 4.23Å; V115-L146 HydrophobicContact CB-CB 4.16Å; V115-L146 HydrophobicContact CB-CD1 4.46Å; V115-L146 HydrophobicContact CG1-CD1 4.2Å; V115-L146 PolarHBondContact N-O 2.86Å; V115-L146 WeakPolarHBondContact O-CA 3.29Å; V115-L146 WeakPolarHBondContact O-CB 3.5Å; V115-L146 WeakPolarHBondContact O-CG 3.15Å; V115-L146 PolarHBondContact O-N 2.97Å; V115-V148 HydrophobicContact CB-CG2 4.46Å; V115-V148 HydrophobicContact CG2-CG2 3.83Å
116	L	85.6	Confident	76.7	Confident	53 Å²	53	57.6 Å²	57.6	28%	0.277	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.4	173	-179.1	68.5	0	0	0	108.6	F47 Y48 R143 P145	F47-L116 CarbonylContact C-O 3.4Å; F47-L116 WeakPolarHBondContact CA-O 3.23Å; Y48-L116 HydrophobicContact CD2-CB 3.99Å; Y48-L116 HydrophobicContact CD2-CD2 3.78Å; Y48-L116 HydrophobicContact CD2-CG 3.99Å; Y48-L116 HydrophobicContact CE2-CD2 4.19Å; Y48-L116 HydrophobicContact CG-CB 4.45Å; Y48-L116 HydrophobicContact CG-CD2 4.45Å; Y48-L116 PolarHBondContact N-O 2.89Å; Y48-L116 PolarHBondContact O-N 2.84Å; L116-R143 HydrophobicContact CD1-CB 4.2Å; L116-P145 HydrophobicContact CD1-CB 4.39Å
117	A	86.1	Confident	76.4	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.008	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.1	169.9	0	0	0	0	0	109.2	I11 I46 F47 R143 S144 L146	I11-A117 HydrophobicContact CD1-CB 4.23Å; I46-A117 CarbonylContact O-C 3.5Å; F47-A117 HydrophobicContact CD1-CB 3.87Å; F47-A117 HydrophobicContact CE1-CB 3.67Å; A117-R143 CarbonylContact O-C 3.54Å; A117-R143 WeakPolarHBondContact O-CA 3.46Å; A117-S144 PolarHBondContact N-O 2.78Å; A117-S144 PolarHBondContact O-N 2.81Å; A117-L146 HydrophobicContact CB-CD1 4.01Å; A117-L146 HydrophobicContact CB-CG 4.43Å
118	E	85.5	Confident	76	Confident	2 Å²	2	58 Å²	58	1%	0.009	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.6	174.3	-179.9	171.5	159	0	0	109.8	I46 Y48 V120 K141 F142 R143	I46-E118 HydrophobicContact CB-CB 4.27Å; I46-E118 PolarHBondContact N-O 2.9Å; I46-E118 PolarHBondContact O-N 2.88Å; Y48-E118 HydrophobicContact CE2-CB 3.98Å; Y48-E118 PolarHBondContact OH-OE2 2.85Å; E118-V120 HydrophobicContact CG-CG2 3.98Å; E118-K141 VanDerWaalsContact OE1-CD 3.3Å; E118-K141 WeakPolarHBondContact OE1-CD 3.3Å; E118-K141 IonicContact OE1-NZ 3.78Å; E118-F142 CarbonylContact C-O 3.57Å; E118-F142 WeakPolarHBondContact CA-O 3.46Å; E118-R143 HydrophobicContact CB-CG 4.14Å; E118-R143 HydrophobicContact CG-CG 3.99Å; E118-R143 IonicContact OE1-NH2 3.78Å; E118-R143 IonicContact OE2-CZ 2.75Å; E118-R143 IonicContact OE2-NE 3.04Å; E118-R143 PolarHBondContact OE2-NE 2.04Å; E118-R143 IonicContact OE2-NH2 2.69Å; E118-R143 PolarHBondContact OE2-NH2 2.75Å
119	I	85.8	Confident	75.1	Confident	3 Å²	3	58 Å²	58	2%	0.015	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.6	171.2	-59.3	-158.7	0	0	0	108.8	L9 I11 T28 V30 S44 I45 K141 F142	L9-I119 HydrophobicContact CD1-CD1 3.96Å; L9-I119 HydrophobicContact CD2-CB 3.76Å; L9-I119 HydrophobicContact CD2-CD1 3.72Å; L9-I119 HydrophobicContact CD2-CG1 3.83Å; L9-I119 HydrophobicContact CD2-CG2 4.37Å; L9-I119 HydrophobicContact CG-CD1 4.32Å; I11-I119 HydrophobicContact CD1-CD1 4.37Å; I11-I119 HydrophobicContact CD1-CG1 4.49Å; T28-I119 HydrophobicContact CG2-CD1 4.45Å; V30-I119 HydrophobicContact CG1-CD1 4.42Å; V30-I119 HydrophobicContact CG2-CD1 3.45Å; V30-I119 VanDerWaalsContact CG2-CD1 3.45Å; S44-I119 CarbonylContact O-C 3.46Å; S44-I119 WeakPolarHBondContact O-CA 3.38Å; I45-I119 HydrophobicContact CG1-CD1 4.18Å; I45-I119 HydrophobicContact CG1-CG1 4.38Å; I45-I119 HydrophobicContact CG2-CG1 4.4Å; I119-K141 CarbonylContact O-C 3.5Å; I119-K141 WeakPolarHBondContact O-CA 3.5Å; I119-F142 PolarHBondContact N-O 3.44Å; I119-F142 PolarHBondContact O-N 3.05Å
120	V	86.7	Confident	74.3	Confident	18 Å²	18	59.5 Å²	59.5	11%	0.109	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.6	178.8	-171.9	0	0	0	0	108.8	Q43 S44 I46 E118 F139 Y140 K141	Q43-V120 CarbonylContact C-O 3.49Å; Q43-V120 WeakPolarHBondContact CA-O 3.42Å; S44-V120 PolarHBondContact N-O 3.47Å; S44-V120 PolarHBondContact O-N 3.21Å; I46-V120 HydrophobicContact CD1-CG2 3.84Å; E118-V120 HydrophobicContact CG-CG2 3.98Å; V120-F139 HydrophobicContact CG1-CB 3.9Å; V120-F139 HydrophobicContact CG1-CD1 4.08Å; V120-F139 HydrophobicContact CG1-CG 4.29Å; V120-Y140 CarbonylContact C-O 3.52Å; V120-Y140 VanDerWaalsContact CA-O 3.32Å; V120-Y140 WeakPolarHBondContact CA-O 3.48Å; V120-K141 HydrophobicContact CG1-CG 4.25Å; V120-K141 HydrophobicContact CG2-CG 4.22Å
121	C	84.2	Confident	73.4	Confident	7 Å²	7	62.3 Å²	62.3	5%	0.047	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.3	177.3	165.7	0	0	0	0	109.7	C40 F139 Y140	C40-C121 WeakPolarHBondContact CA-SG 3.45Å; C40-C121 HydrophobicContact CB-CB 4.08Å; C40-C121 WeakPolarHBondContact CB-SG 3.11Å; C40-C121 WeakPolarHBondContact SG-CB 3.24Å; C40-C121 CovalentContact SG-SG 2.02Å; C40-C121 PolarHBondContact SG-SG 3.46Å; C121-F139 CarbonylContact O-C 3.59Å; C121-F139 WeakPolarHBondContact O-CA 3.46Å; C121-Y140 PolarHBondContact N-O 2.91Å; C121-Y140 PolarHBondContact O-N 3.4Å
122	K	84.2	Confident	72.2	Confident	59 Å²	59	66.9 Å²	66.9	26%	0.257	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.6	164.6	-171	-165.3	173	-146.6	0	107.9	C40 E41 R42 F139	C40-K122 CarbonylContact C-O 3.55Å; E41-K122 PolarHBondContact N-O 2.94Å; E41-K122 WeakPolarHBondContact OE2-CE 3.42Å; E41-K122 IonicContact OE2-NZ 3.92Å; E41-K122 PolarHBondContact OE2-NZ 3.26Å; R42-K122 PolarHBondContact O-N 3.08Å; K122-F139 HydrophobicContact CB-CD1 3.88Å; K122-F139 HydrophobicContact CB-CE1 3.84Å; K122-F139 HydrophobicContact CD-CE1 4.31Å; K122-F139 HydrophobicContact CG-CD1 4.15Å; K122-F139 HydrophobicContact CG-CE1 3.84Å
123	P	80.8	Confident	70.7	Confident	17 Å²	17	67.5 Å²	67.5	11%	0.11	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	158.1	176	34.3	-37.2	0	0	0	110.8	L38 E39 K138 Y140	L38-P123 HydrophobicContact CB-CB 4.22Å; L38-P123 HydrophobicContact CD1-CB 4.05Å; E39-P123 VanDerWaalsContact O-CA 3.32Å; E39-P123 WeakPolarHBondContact O-CA 3.37Å; P123-K138 VanDerWaalsContact CD-O 3.27Å; P123-K138 WeakPolarHBondContact CD-O 3.33Å; P123-Y140 HydrophobicContact CB-CD2 4.3Å; P123-Y140 HydrophobicContact CB-CE2 3.98Å; P123-Y140 HydrophobicContact CG-CD2 4.12Å; P123-Y140 HydrophobicContact CG-CE2 3.78Å
124	Y	76.5	Confident	69.3	Low	54 Å²	54	71.9 Å²	71.9	21%	0.212	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-61.4	138	165.8	-73.2	-91.7	0	0	0	111.1	E39 E41 R87 R126	E39-Y124 HydrophobicContact CB-CD2 3.83Å; E39-Y124 HydrophobicContact CB-CE2 3.89Å; E39-Y124 PolarHBondContact O-N 3.44Å; E41-Y124 HydrophobicContact CB-CD1 4.1Å; E41-Y124 HydrophobicContact CB-CD2 4.1Å; E41-Y124 HydrophobicContact CB-CE1 4.08Å; E41-Y124 HydrophobicContact CB-CE2 4.07Å; E41-Y124 HydrophobicContact CB-CG 4.13Å; E41-Y124 HydrophobicContact CG-CD1 4.11Å; E41-Y124 HydrophobicContact CG-CE1 3.88Å; R87-Y124 WeakPolarHBondContact CD-OH 3.12Å; R87-Y124 VanDerWaalsContact CG-OH 3.29Å; R87-Y124 WeakPolarHBondContact CG-OH 3.42Å; Y124-R126 VanDerWaalsContact C-N 3.33Å; Y124-R126 PolarHBondContact O-N 3.1Å
125	E	71.5	Confident	67.7	Low	175 Å²	175	72.1 Å²	72.1	82%	0.818	42%	0.421	S	S	*	.			trans	-72.5	89.9	167.8	-73.6	-177.7	-165.9	0	0	109.2
126	R	64	Low	66.3	Low	104 Å²	104	78.2 Å²	78.2	39%	0.392	45%	0.447	S	S	.	.			trans	-86	131.5	168.4	-60.8	-171.9	178.4	-173.4	0.5	108.8	E39 Y124 I128	E39-R126 IonicContact OE2-NH2 3.2Å; E39-R126 PolarHBondContact OE2-NH2 2.76Å; Y124-R126 VanDerWaalsContact C-N 3.33Å; Y124-R126 PolarHBondContact O-N 3.1Å; R126-I128 HydrophobicContact CB-CD1 3.8Å; R126-I128 HydrophobicContact CB-CG1 3.76Å; R126-I128 PolarHBondContact O-N 3.11Å
127	S	57.7	Low	64.8	Low	127 Å²	127	82 Å²	82	89%	0.888	46%	0.463	S	S	*	.			trans	-69.7	50.2	172.5	47.4	0	0	0	0	111.8	P129	S127-P129 WeakPolarHBondContact O-CD 3Å
128	I	55.2	Low	64	Low	86 Å²	86	89.8 Å²	89.8	44%	0.441	50%	0.497	S	S	.	.			trans	-88.7	118.8	173.9	-50.9	168.7	0	0	0	106.9	R126 V130 K136	R126-I128 HydrophobicContact CB-CD1 3.8Å; R126-I128 HydrophobicContact CB-CG1 3.76Å; R126-I128 PolarHBondContact O-N 3.11Å; I128-V130 HydrophobicContact CB-CG2 4.26Å; I128-V130 HydrophobicContact CG2-CG2 3.88Å; I128-V130 PolarHBondContact O-N 3.16Å; I128-K136 PolarHBondContact O-NZ 2.77Å
129	P	45.2	Very low	63.5	Low	119 Å²	119	94.4 Å²	94.4	77%	0.773	52%	0.517	S	S	*	.			trans	-68.9	101.5	170.7	27.6	-29.7	0	0	0	107.6	S127	S127-P129 WeakPolarHBondContact O-CD 3Å
130	V	49.3	Very low	63.1	Low	95 Å²	95	97.4 Å²	97.4	58%	0.576	53%	0.529	S	S	*	.			trans	-103	114.9	175.2	-178	0	0	0	0	107.5	I128 N132	I128-V130 HydrophobicContact CB-CG2 4.26Å; I128-V130 HydrophobicContact CG2-CG2 3.88Å; I128-V130 PolarHBondContact O-N 3.16Å; V130-N132 VanDerWaalsContact C-N 3.27Å; V130-N132 PolarHBondContact O-N 3Å
131	V	49.4	Very low	62.8	Low	134 Å²	134	102.4 Å²	102.4	81%	0.812	55%	0.549	S	S	*	.			trans	-75.3	1.3	-167.4	174.7	0	0	0	0	114.4
132	N	43.5	Very low	62.6	Low	128 Å²	128	104.1 Å²	104.1	68%	0.684	56%	0.556	S	S	*	*	S	Bend	trans	-115.3	133.7	-174	-73.5	-2.8	0	0	0	113.8	V130 C134	V130-N132 VanDerWaalsContact C-N 3.27Å; V130-N132 PolarHBondContact O-N 3Å; N132-C134 PolarHBondContact O-N 3.08Å
133	S	47.7	Very low	62.3	Low	128 Å²	128	108.9 Å²	108.9	90%	0.895	57%	0.572	S	S	*	*			trans	-62.7	6.2	-173.2	62.7	0	0	0	0	116.9	A135	S133-A135 VanDerWaalsContact C-N 3.33Å; S133-A135 PolarHBondContact O-N 2.94Å
134	C	50.6	Low	62.1	Low	112 Å²	112	109.4 Å²	109.4	76%	0.757	58%	0.577	S	S	*	*	S	Bend	trans	-73.1	94.7	165.6	-67.8	0	0	0	0	107.6	N132 K136	N132-C134 PolarHBondContact O-N 3.08Å; C134-K136 PolarHBondContact O-N 2.82Å
135	A	51.1	Low	62.1	Low	90 Å²	90	112.1 Å²	112.1	74%	0.744	60%	0.601	S	S	*	*			trans	-37.6	117.3	174.2	0	0	0	0	0	109.9	S133 Q137	S133-A135 VanDerWaalsContact C-N 3.33Å; S133-A135 PolarHBondContact O-N 2.94Å; A135-Q137 PolarHBondContact O-N 2.72Å
136	K	52.7	Low	62.2	Low	131 Å²	131	104.3 Å²	104.3	57%	0.57	57%	0.565	S	S	*	*			trans	-47.8	113.9	176.2	-76.6	-178.5	179.6	173.9	0	107	I128 C134 K138	I128-K136 PolarHBondContact O-NZ 2.77Å; C134-K136 PolarHBondContact O-N 2.82Å; K136-K138 PolarHBondContact O-N 3.4Å
137	Q	52.9	Low	62.5	Low	131 Å²	131	109.2 Å²	109.2	61%	0.612	58%	0.583	S	S	*	*			trans	-58.6	119.4	170	-72.9	-171.3	-5.6	0	0	106.5	A135 F139	A135-Q137 PolarHBondContact O-N 2.72Å; Q137-F139 PolarHBondContact O-N 2.97Å; Q137-F139 VanDerWaalsContact O-N 3.1Å
138	K	69.5	Low	63	Low	166 Å²	166	103.5 Å²	103.5	72%	0.722	54%	0.543	S	S	*	.	S	Bend	trans	-62.6	-16	179.2	-72.8	-173.5	177.2	-176.8	0	112.5	P123 K136	P123-K138 VanDerWaalsContact CD-O 3.27Å; P123-K138 WeakPolarHBondContact CD-O 3.33Å; K136-K138 PolarHBondContact O-N 3.4Å
139	F	75.6	Confident	63.5	Low	98 Å²	98	102.5 Å²	102.5	43%	0.43	54%	0.536	S	S	.	.	S	Bend	trans	-143.3	136.7	-178.6	-57.3	-83.6	0	0	0	109.6	V120 C121 K122 Q137	V120-F139 HydrophobicContact CG1-CB 3.9Å; V120-F139 HydrophobicContact CG1-CD1 4.08Å; V120-F139 HydrophobicContact CG1-CG 4.29Å; C121-F139 CarbonylContact O-C 3.59Å; C121-F139 WeakPolarHBondContact O-CA 3.46Å; K122-F139 HydrophobicContact CB-CD1 3.88Å; K122-F139 HydrophobicContact CB-CE1 3.84Å; K122-F139 HydrophobicContact CD-CE1 4.31Å; K122-F139 HydrophobicContact CG-CD1 4.15Å; K122-F139 HydrophobicContact CG-CE1 3.84Å; Q137-F139 PolarHBondContact O-N 2.97Å; Q137-F139 VanDerWaalsContact O-N 3.1Å
140	Y	76.1	Confident	64.4	Low	67 Å²	67	97.6 Å²	97.6	26%	0.263	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.6	167.2	-66.9	-83.4	0	0	0	108.9	L38 V120 C121 P123	L38-Y140 HydrophobicContact CD1-CE2 3.54Å; L38-Y140 WeakPolarHBondContact CD1-OH 3.46Å; V120-Y140 CarbonylContact C-O 3.52Å; V120-Y140 VanDerWaalsContact CA-O 3.32Å; V120-Y140 WeakPolarHBondContact CA-O 3.48Å; C121-Y140 PolarHBondContact N-O 2.91Å; C121-Y140 PolarHBondContact O-N 3.4Å; P123-Y140 HydrophobicContact CB-CD2 4.3Å; P123-Y140 HydrophobicContact CB-CE2 3.98Å; P123-Y140 HydrophobicContact CG-CD2 4.12Å; P123-Y140 HydrophobicContact CG-CE2 3.78Å
141	K	81.3	Confident	65	Low	123 Å²	123	95.7 Å²	95.7	54%	0.535	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.1	-177.6	-63.5	179.2	168	-163.7	0	109.7	E118 I119 V120	E118-K141 VanDerWaalsContact OE1-CD 3.3Å; E118-K141 WeakPolarHBondContact OE1-CD 3.3Å; E118-K141 IonicContact OE1-NZ 3.78Å; I119-K141 CarbonylContact O-C 3.5Å; I119-K141 WeakPolarHBondContact O-CA 3.5Å; V120-K141 HydrophobicContact CG1-CG 4.25Å; V120-K141 HydrophobicContact CG2-CG 4.22Å
142	F	79.3	Confident	65.5	Low	43 Å²	43	90 Å²	90	19%	0.189	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.7	176.6	-58.7	-78.1	0	0	0	108.3	C5 L9 E118 I119	C5-F142 HydrophobicContact CB-CE1 3.5Å; C5-F142 HydrophobicContact CB-CZ 3.5Å; C5-F142 VanDerWaalsContact CB-CZ 3.5Å; C5-F142 WeakPolarHBondContact O-CE1 3.46Å; L9-F142 HydrophobicContact CB-CG 4.41Å; L9-F142 HydrophobicContact CD2-CB 3.54Å; L9-F142 HydrophobicContact CD2-CD2 4.38Å; L9-F142 HydrophobicContact CD2-CG 4.05Å; E118-F142 CarbonylContact C-O 3.57Å; E118-F142 WeakPolarHBondContact CA-O 3.46Å; I119-F142 PolarHBondContact N-O 3.44Å; I119-F142 PolarHBondContact O-N 3.05Å
143	R	78.6	Confident	66	Low	158 Å²	158	87.3 Å²	87.3	60%	0.596	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	130	-178.2	-73.6	179.7	174.1	174.2	-1.7	109.7	L116 A117 E118	L116-R143 HydrophobicContact CD1-CB 4.2Å; A117-R143 CarbonylContact O-C 3.54Å; A117-R143 WeakPolarHBondContact O-CA 3.46Å; E118-R143 HydrophobicContact CB-CG 4.14Å; E118-R143 HydrophobicContact CG-CG 3.99Å; E118-R143 IonicContact OE1-NH2 3.78Å; E118-R143 IonicContact OE2-CZ 2.75Å; E118-R143 IonicContact OE2-NE 3.04Å; E118-R143 PolarHBondContact OE2-NE 2.04Å; E118-R143 IonicContact OE2-NH2 2.69Å; E118-R143 PolarHBondContact OE2-NH2 2.75Å
144	S	76.9	Confident	66.2	Low	29 Å²	29	84.5 Å²	84.5	20%	0.203	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	111.6	174.7	-172	0	0	0	0	109.4	A117 L146	A117-S144 PolarHBondContact N-O 2.78Å; A117-S144 PolarHBondContact O-N 2.81Å; S144-L146 WeakPolarHBondContact O-CD2 3.31Å; S144-L146 WeakPolarHBondContact OG-CD2 3.32Å
145	P	77	Confident	66.1	Low	111 Å²	111	82 Å²	82	72%	0.721	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	126	172	30.8	-32	0	0	0	110	L116	L116-P145 HydrophobicContact CD1-CB 4.39Å
146	L	72.3	Confident	66.2	Low	11 Å²	11	81.5 Å²	81.5	6%	0.058	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.2	-175	-39.2	-176.5	0	0	0	109.6	H13 L26 P114 V115 A117 S144	H13-L146 WeakPolarHBondContact CE1-CD2 3.44Å; H13-L146 WeakPolarHBondContact NE2-CD1 3.35Å; H13-L146 WeakPolarHBondContact NE2-CD2 3.31Å; H13-L146 WeakPolarHBondContact NE2-CG 3.21Å; L26-L146 HydrophobicContact CD1-CD1 4.16Å; L26-L146 HydrophobicContact CD2-CD1 3.93Å; P114-L146 WeakPolarHBondContact CA-O 3.47Å; V115-L146 HydrophobicContact CB-CB 4.16Å; V115-L146 HydrophobicContact CB-CD1 4.46Å; V115-L146 HydrophobicContact CG1-CD1 4.2Å; V115-L146 PolarHBondContact N-O 2.86Å; V115-L146 WeakPolarHBondContact O-CA 3.29Å; V115-L146 WeakPolarHBondContact O-CB 3.5Å; V115-L146 WeakPolarHBondContact O-CG 3.15Å; V115-L146 PolarHBondContact O-N 2.97Å; A117-L146 HydrophobicContact CB-CD1 4.01Å; A117-L146 HydrophobicContact CB-CG 4.43Å; S144-L146 WeakPolarHBondContact O-CD2 3.31Å; S144-L146 WeakPolarHBondContact OG-CD2 3.32Å
147	R	70.5	Confident	66.1	Low	207 Å²	207	81.2 Å²	81.2	78%	0.781	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.2	108.7	171.2	-67.9	-176	179.8	175.5	-0.1	108.6
148	V	69.5	Low	66.5	Low	6 Å²	6	77.3 Å²	77.3	4%	0.036	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.4	174.9	-178.7	0	0	0	0	108.4	L15 V24 L100 F102 K112 Y113 V115	L15-V148 HydrophobicContact CD2-CG1 3.86Å; V24-V148 HydrophobicContact CB-CG1 4.13Å; V24-V148 HydrophobicContact CG1-CG1 3.83Å; V24-V148 HydrophobicContact CG2-CG1 3.9Å; L100-V148 HydrophobicContact CD2-CG2 4.15Å; F102-V148 HydrophobicContact CE2-CG1 4.16Å; F102-V148 HydrophobicContact CZ-CB 4.25Å; F102-V148 HydrophobicContact CZ-CG1 3.57Å; K112-V148 CarbonylContact C-O 3.57Å; K112-V148 WeakPolarHBondContact CA-O 3.26Å; Y113-V148 PolarHBondContact N-O 2.85Å; Y113-V148 PolarHBondContact O-N 3.24Å; V115-V148 HydrophobicContact CB-CG2 4.46Å; V115-V148 HydrophobicContact CG2-CG2 3.83Å
149	E	65.2	Low	66.1	Low	66 Å²	66	74.1 Å²	74.1	31%	0.308	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.4	-179.2	-169.8	164.5	148.1	0	0	110	L15 I110 V111 K112	L15-E149 HydrophobicContact CD1-CB 3.91Å; I110-E149 HydrophobicContact CG2-CG 3.39Å; I110-E149 VanDerWaalsContact CG2-OE1 3.24Å; I110-E149 WeakPolarHBondContact CG2-OE1 3.39Å; V111-E149 WeakPolarHBondContact O-CA 2.91Å; K112-E149 VanDerWaalsContact CE-OE2 3.29Å; K112-E149 WeakPolarHBondContact CE-OE2 3.29Å; K112-E149 HydrophobicContact CG-CB 4.49Å; K112-E149 HydrophobicContact CG-CG 4.23Å; K112-E149 IonicContact NZ-OE1 3.34Å; K112-E149 IonicContact NZ-OE2 3.75Å; K112-E149 PolarHBondContact NZ-OE2 2.99Å
150	L	64.1	Low	65.5	Low	15 Å²	15	75.1 Å²	75.1	8%	0.079	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.8	170.5	-68.4	-175.4	0	0	0	108.5	V24 F102 I110 V111 Y113 Y152	V24-L150 HydrophobicContact CG2-CD2 3.35Å; F102-L150 HydrophobicContact CB-CD1 4.23Å; F102-L150 HydrophobicContact CD1-CD1 3.58Å; F102-L150 HydrophobicContact CD2-CD1 3.93Å; F102-L150 HydrophobicContact CD2-CD2 4.44Å; F102-L150 HydrophobicContact CE1-CD1 3.83Å; F102-L150 HydrophobicContact CE1-CG 4.45Å; F102-L150 HydrophobicContact CE2-CD1 4.2Å; F102-L150 HydrophobicContact CE2-CD2 4.31Å; F102-L150 HydrophobicContact CG-CD1 3.63Å; F102-L150 HydrophobicContact CZ-CD1 4.15Å; F102-L150 HydrophobicContact CZ-CG 4.44Å; I110-L150 CarbonylContact C-O 3.46Å; I110-L150 WeakPolarHBondContact CA-O 3.28Å; V111-L150 PolarHBondContact N-O 3Å; V111-L150 PolarHBondContact O-N 2.83Å; Y113-L150 HydrophobicContact CD2-CD1 4.14Å; Y113-L150 HydrophobicContact CD2-CG 4.37Å; Y113-L150 HydrophobicContact CE2-CD1 3.76Å; Y113-L150 HydrophobicContact CE2-CG 4.28Å; L150-Y152 HydrophobicContact CB-CD2 4.16Å; L150-Y152 HydrophobicContact CB-CE2 3.5Å; L150-Y152 VanDerWaalsContact CB-CE2 3.5Å; L150-Y152 HydrophobicContact CD1-CE2 4.16Å; L150-Y152 WeakPolarHBondContact CD1-OH 3.27Å; L150-Y152 HydrophobicContact CG-CE2 4.49Å
151	D	61.1	Low	65.1	Low	55 Å²	55	72.1 Å²	72.1	29%	0.294	35%	0.353	S	S	.	.			trans	-90.8	108	175.1	-174.6	3.4	0	0	0	110.3	I110 T153 Q175	I110-D151 HydrophobicContact CG1-CB 4.08Å; I110-D151 WeakPolarHBondContact CG1-OD1 3.24Å; D151-T153 VanDerWaalsContact OD1-CB 3.3Å; D151-T153 WeakPolarHBondContact OD1-CB 3.03Å; D151-T153 PolarHBondContact OD1-N 2.95Å; D151-T153 PolarHBondContact OD1-OG1 2.67Å; D151-T153 PolarHBondContact OD2-OG1 2.97Å; D151-Q175 PolarHBondContact OD2-NE2 3.2Å
152	Y	60.9	Low	64.4	Low	15 Å²	15	69.2 Å²	69.2	6%	0.059	35%	0.345	C	S	.	.			trans	-96.8	-7.1	173	-59.8	-92.3	0	0	0	113.5	S105 S107 S109 V111 L150 Y154	S105-Y152 VanDerWaalsContact CB-OH 3.25Å; S105-Y152 WeakPolarHBondContact CB-OH 3.22Å; S107-Y152 WeakPolarHBondContact O-CB 3.5Å; S109-Y152 WeakPolarHBondContact O-CD2 3.27Å; V111-Y152 HydrophobicContact CB-CE2 4.31Å; V111-Y152 HydrophobicContact CG2-CD2 4.05Å; V111-Y152 HydrophobicContact CG2-CE2 4Å; L150-Y152 HydrophobicContact CB-CD2 4.16Å; L150-Y152 HydrophobicContact CB-CE2 3.5Å; L150-Y152 VanDerWaalsContact CB-CE2 3.5Å; L150-Y152 HydrophobicContact CD1-CE2 4.16Å; L150-Y152 WeakPolarHBondContact CD1-OH 3.27Å; L150-Y152 HydrophobicContact CG-CE2 4.49Å; Y152-Y154 PolarHBondContact O-N 2.67Å
153	T	52.7	Low	63.8	Low	72 Å²	72	69.2 Å²	69.2	44%	0.442	35%	0.353	S	S	.	.			trans	-64.1	-24.3	-174.6	64.2	0	0	0	0	112.5	T108 I110 D151 P155	T108-T153 VanDerWaalsContact O-CA 3.3Å; T108-T153 WeakPolarHBondContact O-CA 3.37Å; T108-T153 WeakPolarHBondContact O-CG2 3.49Å; I110-T153 HydrophobicContact CG1-CG2 3.97Å; D151-T153 VanDerWaalsContact OD1-CB 3.3Å; D151-T153 WeakPolarHBondContact OD1-CB 3.03Å; D151-T153 PolarHBondContact OD1-N 2.95Å; D151-T153 PolarHBondContact OD1-OG1 2.67Å; D151-T153 PolarHBondContact OD2-OG1 2.97Å; T153-P155 VanDerWaalsContact O-CD 3.28Å; T153-P155 WeakPolarHBondContact O-CD 3.28Å
154	Y	52.4	Low	63.6	Low	69 Å²	69	61.9 Å²	61.9	27%	0.271	33%	0.325	S	S	.	.	S	Bend	trans	-83.1	114.5	178.7	-131	-89.8	0	0	0	110.8	R21 Y152 Y156 R174 Q175	R21-Y154 PolarHBondContact NH2-O 3.3Å; Y152-Y154 PolarHBondContact O-N 2.67Å; Y154-Y156 PolarHBondContact O-N 2.86Å; Y154-Y156 VanDerWaalsContact O-N 3.09Å; Y154-R174 HydrophobicContact CD1-CB 3.92Å; Y154-R174 HydrophobicContact CE1-CB 3.39Å; Y154-R174 HydrophobicContact CE1-CG 4.15Å; Y154-Q175 HydrophobicContact CD2-CG 4.2Å; Y154-Q175 HydrophobicContact CE2-CG 4.47Å; Y154-Q175 HydrophobicContact CG-CG 4.39Å
155	P	48.7	Very low	63.6	Low	60 Å²	60	64.9 Å²	64.9	39%	0.39	34%	0.336	S	S	.	.			trans	-76.9	104.6	-176.3	30.8	-34	0	0	0	110.3	T153 L158	T153-P155 VanDerWaalsContact O-CD 3.28Å; T153-P155 WeakPolarHBondContact O-CD 3.28Å; P155-L158 HydrophobicContact CB-CD1 4.44Å; P155-L158 HydrophobicContact CB-CD2 4.5Å; P155-L158 HydrophobicContact CB-CG 3.94Å; P155-L158 HydrophobicContact CG-CD1 3.77Å; P155-L158 HydrophobicContact CG-CD2 4.21Å; P155-L158 HydrophobicContact CG-CG 3.74Å
156	Y	53	Low	63.7	Low	78 Å²	78	60.5 Å²	60.5	31%	0.306	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-27.6	164.4	-177.4	-86.2	0	0	0	110.5	Y154 L158 Y161 Q165	Y154-Y156 PolarHBondContact O-N 2.86Å; Y154-Y156 VanDerWaalsContact O-N 3.09Å; Y156-L158 PolarHBondContact O-N 2.97Å; Y156-Y161 HydrophobicContact CD2-CD1 4.01Å; Y156-Y161 AromaticContact CD2-CE1 3.49Å; Y156-Y161 HydrophobicContact CD2-CE1 3.49Å; Y156-Y161 VanDerWaalsContact CD2-CE1 3.49Å; Y156-Y161 HydrophobicContact CE2-CD1 4.05Å; Y156-Y161 AromaticContact CE2-CE1 3.33Å; Y156-Y161 HydrophobicContact CE2-CE1 3.33Å; Y156-Y161 HydrophobicContact CG-CD1 4.28Å; Y156-Y161 HydrophobicContact CG-CE1 4.21Å; Y156-Y161 AromaticContact CZ-CE1 3.88Å; Y156-Q165 VanDerWaalsContact CE1-NE2 3.27Å; Y156-Q165 PolarHBondContact OH-NE2 3.48Å
157	N	51.1	Low	64.1	Low	126 Å²	126	65.2 Å²	65.2	67%	0.674	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	19.6	-177.9	-67.6	-5.2	0	0	0	113.7	P159	N157-P159 WeakPolarHBondContact O-CD 3.43Å
158	L	60.1	Low	64.6	Low	49 Å²	49	60.9 Å²	60.9	26%	0.257	33%	0.328	S	S	.	.			trans	-61.2	125.4	167.1	-75.9	165.9	0	0	0	107.4	P155 Y156 H160 Y161 V162	P155-L158 HydrophobicContact CB-CD1 4.44Å; P155-L158 HydrophobicContact CB-CD2 4.5Å; P155-L158 HydrophobicContact CB-CG 3.94Å; P155-L158 HydrophobicContact CG-CD1 3.77Å; P155-L158 HydrophobicContact CG-CD2 4.21Å; P155-L158 HydrophobicContact CG-CG 3.74Å; Y156-L158 PolarHBondContact O-N 2.97Å; L158-H160 PolarHBondContact O-N 2.96Å; L158-Y161 WeakPolarHBondContact O-CB 3.44Å; L158-Y161 PolarHBondContact O-N 2.73Å; L158-V162 PolarHBondContact O-N 3.44Å; L158-V162 VanDerWaalsContact O-N 3.14Å
159	P	61.6	Low	65.2	Low	99 Å²	99	60.6 Å²	60.6	64%	0.643	33%	0.326	S	S	*	.	H	α-helix	trans	-50.2	-36.8	-174.1	-30.6	34.9	0	0	0	113.3	N157 A163	N157-P159 WeakPolarHBondContact O-CD 3.43Å; P159-A163 VanDerWaalsContact O-CB 3.23Å; P159-A163 WeakPolarHBondContact O-CB 3.23Å; P159-A163 PolarHBondContact O-N 2.81Å
160	H	63.3	Low	65.8	Low	118 Å²	118	64.1 Å²	64.1	55%	0.546	34%	0.342	S	S	.	.	H	α-helix	trans	-66.6	-37.1	176.8	-61.5	-52.4	0	0	0	113.9	L158 M164	L158-H160 PolarHBondContact O-N 2.96Å; H160-M164 VanDerWaalsContact O-CG 3.24Å; H160-M164 WeakPolarHBondContact O-CG 3.18Å; H160-M164 PolarHBondContact O-N 3.35Å
161	Y	67.3	Low	66.4	Low	5 Å²	5	64.3 Å²	64.3	2%	0.02	34%	0.343	C	S	.	.	H	α-helix	trans	-72.8	-43.6	179.8	-166.9	-89.4	0	0	0	111	Y156 L158 A163 M164 L171 P172 R174 L239	Y156-Y161 HydrophobicContact CD2-CD1 4.01Å; Y156-Y161 AromaticContact CD2-CE1 3.49Å; Y156-Y161 HydrophobicContact CD2-CE1 3.49Å; Y156-Y161 VanDerWaalsContact CD2-CE1 3.49Å; Y156-Y161 HydrophobicContact CE2-CD1 4.05Å; Y156-Y161 AromaticContact CE2-CE1 3.33Å; Y156-Y161 HydrophobicContact CE2-CE1 3.33Å; Y156-Y161 HydrophobicContact CG-CD1 4.28Å; Y156-Y161 HydrophobicContact CG-CE1 4.21Å; Y156-Y161 AromaticContact CZ-CE1 3.88Å; L158-Y161 WeakPolarHBondContact O-CB 3.44Å; L158-Y161 PolarHBondContact O-N 2.73Å; Y161-A163 VanDerWaalsContact C-N 3.35Å; Y161-A163 PolarHBondContact O-N 3.11Å; Y161-M164 PolarHBondContact O-N 3.49Å; Y161-M164 VanDerWaalsContact O-N 3.16Å; Y161-L171 HydrophobicContact CD1-CD1 3.93Å; Y161-L171 HydrophobicContact CD2-CD1 4.23Å; Y161-L171 HydrophobicContact CE1-CB 3.96Å; Y161-L171 HydrophobicContact CE1-CD1 3.69Å; Y161-L171 HydrophobicContact CE2-CB 4.19Å; Y161-L171 HydrophobicContact CE2-CD1 4.1Å; Y161-L171 HydrophobicContact CG-CD1 4.2Å; Y161-L171 VanDerWaalsContact O-CD1 3.28Å; Y161-L171 WeakPolarHBondContact O-CD1 3.3Å; Y161-L171 VanDerWaalsContact OH-CB 3.27Å; Y161-L171 WeakPolarHBondContact OH-CB 3.24Å; Y161-P172 PolarHBondContact OH-O 3.4Å; Y161-R174 HydrophobicContact CD2-CG 4.48Å; Y161-R174 HydrophobicContact CE2-CG 3.83Å; Y161-L239 HydrophobicContact CD2-CD1 4.14Å; Y161-L239 HydrophobicContact CE2-CD1 3.64Å
162	V	67	Low	66.9	Low	61 Å²	61	62 Å²	62	37%	0.37	33%	0.332	S	S	.	.	H	α-helix	trans	-61	-44.1	174.6	179.3	0	0	0	0	111.1	L158 M164 Q165	L158-V162 PolarHBondContact O-N 3.44Å; L158-V162 VanDerWaalsContact O-N 3.14Å; V162-M164 PolarHBondContact O-N 3.32Å; V162-M164 VanDerWaalsContact O-N 3.11Å; V162-Q165 WeakPolarHBondContact O-CB 3.36Å; V162-Q165 PolarHBondContact O-N 2.92Å; V162-Q165 VanDerWaalsContact O-N 3.07Å
163	A	67.6	Low	67.3	Low	43 Å²	43	63.3 Å²	63.3	36%	0.355	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.3	179.1	0	0	0	0	0	114	P159 Y161 S261 Q265	P159-A163 VanDerWaalsContact O-CB 3.23Å; P159-A163 WeakPolarHBondContact O-CB 3.23Å; P159-A163 PolarHBondContact O-N 2.81Å; Y161-A163 VanDerWaalsContact C-N 3.35Å; Y161-A163 PolarHBondContact O-N 3.11Å; A163-S261 VanDerWaalsContact O-CB 3.27Å; A163-S261 WeakPolarHBondContact O-CB 3.35Å; A163-Q265 PolarHBondContact O-NE2 2.84Å
164	M	73.6	Confident	68	Low	4 Å²	4	60.2 Å²	60.2	2%	0.02	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.1	176.8	-72.2	179.4	69.9	0	0	113.9	H160 Y161 V162 N166 L171 I227 L239 A246 Y264	H160-M164 VanDerWaalsContact O-CG 3.24Å; H160-M164 WeakPolarHBondContact O-CG 3.18Å; H160-M164 PolarHBondContact O-N 3.35Å; Y161-M164 PolarHBondContact O-N 3.49Å; Y161-M164 VanDerWaalsContact O-N 3.16Å; V162-M164 PolarHBondContact O-N 3.32Å; V162-M164 VanDerWaalsContact O-N 3.11Å; M164-N166 PolarHBondContact O-N 3.19Å; M164-L171 HydrophobicContact CB-CD1 3.88Å; M164-L171 HydrophobicContact CB-CD2 4.4Å; M164-I227 HydrophobicContact CE-CD1 3.86Å; M164-L239 HydrophobicContact CE-CD2 3.38Å; M164-L239 HydrophobicContact SD-CD2 3.58Å; M164-L239 VanDerWaalsContact SD-CD2 3.58Å; M164-A246 HydrophobicContact CE-CB 3.23Å; M164-A246 HydrophobicContact CG-CB 4.4Å; M164-A246 HydrophobicContact SD-CB 3.54Å; M164-A246 VanDerWaalsContact SD-CB 3.54Å; M164-A246 PolarHBondContact SD-N 3.38Å; M164-Y264 HydrophobicContact CB-CD1 4.44Å; M164-Y264 HydrophobicContact CB-CE1 4.2Å; M164-Y264 HydrophobicContact CE-CD2 4.02Å; M164-Y264 HydrophobicContact CE-CE1 4.44Å; M164-Y264 HydrophobicContact CE-CE2 3.85Å; M164-Y264 HydrophobicContact CE-CG 4.38Å; M164-Y264 HydrophobicContact CG-CD1 4.43Å; M164-Y264 WeakPolarHBondContact O-CE1 3.2Å
165	Q	77.3	Confident	68.6	Low	92 Å²	92	59 Å²	59	43%	0.43	32%	0.317	S	S	.	.			trans	-58.4	127.7	173.8	-73.3	179.8	3.6	0	0	110.2	Y156 V162 L171 Q265	Y156-Q165 VanDerWaalsContact CE1-NE2 3.27Å; Y156-Q165 PolarHBondContact OH-NE2 3.48Å; V162-Q165 WeakPolarHBondContact O-CB 3.36Å; V162-Q165 PolarHBondContact O-N 2.92Å; V162-Q165 VanDerWaalsContact O-N 3.07Å; Q165-L171 HydrophobicContact CG-CD1 4.45Å; Q165-Q265 PolarHBondContact O-NE2 3.21Å
166	N	78.8	Confident	69.7	Low	19 Å²	19	56.3 Å²	56.3	10%	0.102	30%	0.299	C	S	.	.			trans	-140.8	144.3	177.8	177.3	-73	0	0	0	108.5	M164 F168 V169 Y264 Q265 L268 N269	M164-N166 PolarHBondContact O-N 3.19Å; N166-F168 PolarHBondContact O-N 3.37Å; N166-F168 WeakPolarHBondContact OD1-CA 3.33Å; N166-F168 VanDerWaalsContact OD1-CB 3.23Å; N166-F168 WeakPolarHBondContact OD1-CB 3.46Å; N166-F168 WeakPolarHBondContact OD1-CD2 3.23Å; N166-F168 PolarHBondContact OD1-N 3.29Å; N166-V169 CarbonylContact O-C 3.54Å; N166-V169 PolarHBondContact O-N 3.42Å; N166-Y264 HydrophobicContact CB-CE1 4.28Å; N166-Q265 PolarHBondContact ND2-OE1 2.71Å; N166-L268 HydrophobicContact CB-CD1 3.98Å; N166-N269 PolarHBondContact ND2-OD1 3.21Å
167	S	80	Confident	70.9	Confident	111 Å²	111	52.9 Å²	52.9	78%	0.776	29%	0.286	S	S	*	.	S	Bend	trans	-62.7	-28.5	-178.4	47.3	0	0	0	0	113.9
168	F	81	Confident	72.5	Confident	115 Å²	115	46.9 Å²	46.9	50%	0.504	25%	0.254	S	S	.	.	S	Bend	trans	-85	-24.9	-180	-53.9	-66.8	0	0	0	113.4	N166 N269 I274	N166-F168 PolarHBondContact O-N 3.37Å; N166-F168 WeakPolarHBondContact OD1-CA 3.33Å; N166-F168 VanDerWaalsContact OD1-CB 3.23Å; N166-F168 WeakPolarHBondContact OD1-CB 3.46Å; N166-F168 WeakPolarHBondContact OD1-CD2 3.23Å; N166-F168 PolarHBondContact OD1-N 3.29Å; F168-N269 WeakPolarHBondContact CE2-OD1 2.96Å; F168-I274 HydrophobicContact CB-CD1 3.56Å; F168-I274 HydrophobicContact CD2-CD1 4.4Å; F168-I274 HydrophobicContact CG-CD1 4.01Å
169	V	82.6	Confident	73.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	24%	0.243	C	C	.	.	S	Bend	trans	-128.2	103.1	-177.4	-177.6	0	0	0	0	109.6	N166 L171 A228 L268 I274 T276	N166-V169 CarbonylContact O-C 3.54Å; N166-V169 PolarHBondContact O-N 3.42Å; V169-L171 PolarHBondContact O-N 3.32Å; V169-A228 HydrophobicContact CG1-CB 3.94Å; V169-A228 HydrophobicContact CG2-CB 3.9Å; V169-L268 HydrophobicContact CB-CD1 4.06Å; V169-L268 HydrophobicContact CG2-CD1 3.58Å; V169-L268 HydrophobicContact CG2-CD2 3.76Å; V169-L268 HydrophobicContact CG2-CG 4.31Å; V169-I274 HydrophobicContact CG2-CG2 3.62Å; V169-T276 HydrophobicContact CB-CG2 4.45Å; V169-T276 HydrophobicContact CG1-CG2 4.36Å; V169-T276 HydrophobicContact CG2-CG2 4.13Å
170	Q	78.3	Confident	75.1	Confident	139 Å²	139	40 Å²	40	65%	0.65	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-70.2	122.6	169.5	-66.2	-174.7	0.6	0	0	109.1	P172	Q170-P172 WeakPolarHBondContact O-CD 3.29Å
171	L	76.5	Confident	76.3	Confident	19 Å²	19	36 Å²	36	10%	0.099	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-71.3	123.1	176.2	-62.9	176.7	0	0	0	109	Y161 M164 Q165 V169 I227	Y161-L171 HydrophobicContact CD1-CD1 3.93Å; Y161-L171 HydrophobicContact CD2-CD1 4.23Å; Y161-L171 HydrophobicContact CE1-CB 3.96Å; Y161-L171 HydrophobicContact CE1-CD1 3.69Å; Y161-L171 HydrophobicContact CE2-CB 4.19Å; Y161-L171 HydrophobicContact CE2-CD1 4.1Å; Y161-L171 HydrophobicContact CG-CD1 4.2Å; Y161-L171 VanDerWaalsContact O-CD1 3.28Å; Y161-L171 WeakPolarHBondContact O-CD1 3.3Å; Y161-L171 VanDerWaalsContact OH-CB 3.27Å; Y161-L171 WeakPolarHBondContact OH-CB 3.24Å; M164-L171 HydrophobicContact CB-CD1 3.88Å; M164-L171 HydrophobicContact CB-CD2 4.4Å; Q165-L171 HydrophobicContact CG-CD1 4.45Å; V169-L171 PolarHBondContact O-N 3.32Å; L171-I227 HydrophobicContact CD2-CD1 3.83Å
172	P	72	Confident	77.4	Confident	7 Å²	7	36.3 Å²	36.3	5%	0.045	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-68.1	150	176	31.2	-35.3	0	0	0	109.3	Y161 Q170 R174 T178 I227 V279	Y161-P172 PolarHBondContact OH-O 3.4Å; Q170-P172 WeakPolarHBondContact O-CD 3.29Å; P172-R174 PolarHBondContact O-N 3.44Å; P172-T178 HydrophobicContact CB-CG2 3.76Å; P172-T178 HydrophobicContact CG-CG2 3.72Å; P172-I227 HydrophobicContact CG-CG2 3.79Å; P172-V279 HydrophobicContact CB-CG2 3.39Å
173	D	68.7	Low	78.2	Confident	43 Å²	43	36.1 Å²	36.1	23%	0.23	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-56.4	138.6	169.4	173.3	51.2	0	0	0	110.3	P18 Q175 A176 Q225	P18-D173 HydrophobicContact CB-CB 3.43Å; P18-D173 VanDerWaalsContact CB-CB 3.43Å; P18-D173 HydrophobicContact CG-CB 3.29Å; D173-Q175 PolarHBondContact O-N 3.42Å; D173-Q175 WeakPolarHBondContact OD2-CA 3.35Å; D173-Q175 VanDerWaalsContact OD2-CB 3.22Å; D173-Q175 WeakPolarHBondContact OD2-CB 3.35Å; D173-Q175 PolarHBondContact OD2-N 3.27Å; D173-A176 HydrophobicContact CB-CB 4.19Å; D173-A176 VanDerWaalsContact O-CB 3.29Å; D173-A176 WeakPolarHBondContact O-CB 3.41Å; D173-A176 PolarHBondContact O-N 2.96Å; D173-A176 PolarHBondContact OD2-N 3.04Å; D173-Q225 PolarHBondContact O-NE2 3.2Å
174	R	66.6	Low	79.1	Confident	7 Å²	7	38.1 Å²	38.1	3%	0.026	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.5	-176.1	-72.8	-176.6	177.4	177.7	-0.2	113.2	Y154 Y161 P172 A176 R203 E224 Q225	Y154-R174 HydrophobicContact CD1-CB 3.92Å; Y154-R174 HydrophobicContact CE1-CB 3.39Å; Y154-R174 HydrophobicContact CE1-CG 4.15Å; Y161-R174 HydrophobicContact CD2-CG 4.48Å; Y161-R174 HydrophobicContact CE2-CG 3.83Å; P172-R174 PolarHBondContact O-N 3.44Å; R174-A176 VanDerWaalsContact C-N 3.33Å; R174-R203 PolarHBondContact O-NE 3.49Å; R174-E224 VanDerWaalsContact CD-OE1 3.3Å; R174-E224 WeakPolarHBondContact CD-OE1 3.5Å; R174-E224 IonicContact CZ-OE1 2.81Å; R174-E224 IonicContact NE-OE1 2.98Å; R174-E224 PolarHBondContact NE-OE1 3.38Å; R174-Q225 PolarHBondContact O-NE2 3.46Å
175	Q	66.5	Low	79.8	Confident	44 Å²	44	39.4 Å²	39.4	21%	0.206	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.4	169.5	-48.8	-164.4	46.6	0	0	112.7	D151 Y154 D173 R203 W282	D151-Q175 PolarHBondContact OD2-NE2 3.2Å; Y154-Q175 HydrophobicContact CD2-CG 4.2Å; Y154-Q175 HydrophobicContact CE2-CG 4.47Å; Y154-Q175 HydrophobicContact CG-CG 4.39Å; D173-Q175 PolarHBondContact O-N 3.42Å; D173-Q175 WeakPolarHBondContact OD2-CA 3.35Å; D173-Q175 VanDerWaalsContact OD2-CB 3.22Å; D173-Q175 WeakPolarHBondContact OD2-CB 3.35Å; D173-Q175 PolarHBondContact OD2-N 3.27Å; Q175-R203 VanDerWaalsContact CA-NH2 3.33Å; Q175-R203 VanDerWaalsContact O-CZ 3.26Å; Q175-R203 PolarHBondContact O-NH1 2.9Å; Q175-R203 PolarHBondContact O-NH2 3.32Å; Q175-W282 PolarHBondContact O-NE1 2.74Å
176	A	71.1	Confident	80.3	Confident	3 Å²	3	35 Å²	35	3%	0.025	20%	0.199	C	C	.	.	S	Bend	trans	-85.8	147.2	179.6	0	0	0	0	0	112.1	D173 R174 R203 Q225 V279	D173-A176 HydrophobicContact CB-CB 4.19Å; D173-A176 VanDerWaalsContact O-CB 3.29Å; D173-A176 WeakPolarHBondContact O-CB 3.41Å; D173-A176 PolarHBondContact O-N 2.96Å; D173-A176 PolarHBondContact OD2-N 3.04Å; R174-A176 VanDerWaalsContact C-N 3.33Å; A176-R203 PolarHBondContact O-NH1 3.47Å; A176-Q225 PolarHBondContact O-NE2 2.98Å; A176-V279 HydrophobicContact CB-CG1 3.27Å
177	N	78	Confident	80.9	Confident	6 Å²	6	34.2 Å²	34.2	3%	0.032	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.3	170.1	-66.7	-4.4	0	0	0	107.8	F179 Y188 C189 G190 R203 M280 W282	N177-F179 HydrophobicContact CB-CE2 4.22Å; N177-Y188 HydrophobicContact CB-CE2 4.17Å; N177-C189 CarbonylContact C-O 3.53Å; N177-C189 WeakPolarHBondContact CA-O 3.43Å; N177-C189 WeakPolarHBondContact CB-O 3.48Å; N177-G190 WeakPolarHBondContact OD1-CA 3.4Å; N177-R203 PolarHBondContact OD1-NH1 2.83Å; N177-M280 HydrophobicContact CB-CB 4.26Å; N177-M280 HydrophobicContact CB-CE 4.36Å; N177-M280 PolarHBondContact O-N 3.31Å; N177-W282 PolarHBondContact OD1-NE1 2.74Å
178	T	84.7	Confident	81.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	144.4	-178.1	70.4	0	0	0	0	110.9	P172 Y188 C189 Q225 I226 S278	P172-T178 HydrophobicContact CB-CG2 3.76Å; P172-T178 HydrophobicContact CG-CG2 3.72Å; T178-Y188 CarbonylContact O-C 3.4Å; T178-Y188 WeakPolarHBondContact O-CA 3.39Å; T178-C189 PolarHBondContact N-O 3.12Å; T178-C189 PolarHBondContact O-N 2.93Å; T178-C189 WeakPolarHBondContact OG1-CB 3.3Å; T178-Q225 HydrophobicContact CG2-CG 4.37Å; T178-I226 PolarHBondContact OG1-O 3Å; T178-S278 CarbonylContact C-O 3.58Å; T178-S278 WeakPolarHBondContact CA-O 3.18Å
179	F	86.5	Confident	81.5	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.009	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132.5	176.9	-62.2	-97.9	0	0	0	109.5	N177 L186 F187 Y188 A277 S278 M280 V302 V308 M313 W323	N177-F179 HydrophobicContact CB-CE2 4.22Å; F179-L186 HydrophobicContact CB-CD1 4.42Å; F179-F187 CarbonylContact C-O 3.55Å; F179-F187 VanDerWaalsContact CA-O 3.22Å; F179-F187 WeakPolarHBondContact CA-O 3.36Å; F179-Y188 AromaticContact CD1-CD2 3.8Å; F179-Y188 HydrophobicContact CD1-CD2 3.8Å; F179-Y188 HydrophobicContact CD1-CG 4.45Å; F179-Y188 AromaticContact CE1-CD2 3.18Å; F179-Y188 HydrophobicContact CE1-CD2 3.18Å; F179-Y188 AromaticContact CE1-CE2 3.82Å; F179-Y188 HydrophobicContact CE1-CE2 3.82Å; F179-Y188 AromaticContact CE1-CG 3.97Å; F179-Y188 HydrophobicContact CE1-CG 3.97Å; F179-Y188 AromaticContact CE2-CD2 3.93Å; F179-Y188 HydrophobicContact CE2-CD2 3.93Å; F179-Y188 HydrophobicContact CE2-CE2 4.05Å; F179-Y188 HydrophobicContact CG-CD2 4.43Å; F179-Y188 AromaticContact CZ-CD2 3.26Å; F179-Y188 HydrophobicContact CZ-CD2 3.26Å; F179-Y188 AromaticContact CZ-CE2 3.41Å; F179-Y188 HydrophobicContact CZ-CE2 3.41Å; F179-Y188 VanDerWaalsContact CZ-CE2 3.41Å; F179-Y188 HydrophobicContact CZ-CG 4.41Å; F179-A277 CarbonylContact O-C 3.37Å; F179-A277 WeakPolarHBondContact O-CA 3.4Å; F179-S278 PolarHBondContact N-O 2.81Å; F179-S278 PolarHBondContact O-N 3.29Å; F179-M280 HydrophobicContact CD2-CB 4.04Å; F179-M280 HydrophobicContact CE2-CB 3.51Å; F179-M280 HydrophobicContact CE2-CG 4.36Å; F179-M280 HydrophobicContact CE2-SD 4.07Å; F179-M280 HydrophobicContact CZ-SD 4.29Å; F179-V302 HydrophobicContact CB-CG1 3.74Å; F179-V308 HydrophobicContact CD1-CG2 3.78Å; F179-V308 HydrophobicContact CE1-CB 4.5Å; F179-V308 HydrophobicContact CE1-CG1 4.13Å; F179-V308 HydrophobicContact CE1-CG2 3.5Å; F179-V308 HydrophobicContact CE2-CG1 3.89Å; F179-V308 HydrophobicContact CE2-CG2 4.36Å; F179-V308 HydrophobicContact CG-CG2 4.28Å; F179-V308 HydrophobicContact CZ-CB 4.37Å; F179-V308 HydrophobicContact CZ-CG1 3.57Å; F179-V308 HydrophobicContact CZ-CG2 3.83Å; F179-M313 HydrophobicContact CE1-SD 4.24Å; F179-W323 HydrophobicContact CE1-CH2 4.15Å; F179-W323 HydrophobicContact CZ-CH2 4.07Å; F179-W323 HydrophobicContact CZ-CZ2 4.12Å
180	L	90.8	Very high	81.4	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	126.2	176.8	-179.5	73.8	0	0	0	109.6	V182 F187 I226 L236 I275 T276 A277	L180-V182 HydrophobicContact CD2-CG2 3.86Å; L180-V182 HydrophobicContact CG-CG2 3.95Å; L180-F187 HydrophobicContact CB-CB 4.24Å; L180-F187 PolarHBondContact N-O 3.17Å; L180-F187 PolarHBondContact O-N 3.06Å; L180-I226 HydrophobicContact CB-CG2 4.02Å; L180-I226 HydrophobicContact CD2-CG2 3.44Å; L180-I226 VanDerWaalsContact CD2-CG2 3.44Å; L180-I226 HydrophobicContact CG-CG2 4.37Å; L180-L236 HydrophobicContact CD2-CD1 3.49Å; L180-L236 VanDerWaalsContact CD2-CD1 3.49Å; L180-I275 HydrophobicContact CD1-CB 4.29Å; L180-I275 HydrophobicContact CD1-CG2 3.74Å; L180-I275 WeakPolarHBondContact CD1-O 3.15Å; L180-T276 WeakPolarHBondContact CD1-O 3.31Å; L180-A277 HydrophobicContact CB-CB 4.16Å; L180-A277 HydrophobicContact CD1-CB 4.44Å
181	N	88.2	Confident	81	Confident	34 Å²	34	21 Å²	21	18%	0.182	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.2	174.5	-172.8	48.5	0	0	0	110.2	L185 A303	N181-L185 PolarHBondContact OD1-O 2.87Å; N181-A303 HydrophobicContact CB-CB 3.49Å; N181-A303 VanDerWaalsContact CB-CB 3.49Å; N181-A303 VanDerWaalsContact CG-CB 3.44Å; N181-A303 WeakPolarHBondContact ND2-CB 3.28Å
182	V	89.3	Confident	80.5	Confident	10 Å²	10	20.7 Å²	20.7	6%	0.061	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	105.1	175.5	-176.1	0	0	0	0	108.3	L180 D184 L185 F187 Y229 L252	L180-V182 HydrophobicContact CD2-CG2 3.86Å; L180-V182 HydrophobicContact CG-CG2 3.95Å; V182-D184 PolarHBondContact O-N 3.35Å; V182-D184 VanDerWaalsContact O-N 3.16Å; V182-L185 PolarHBondContact N-O 2.88Å; V182-L185 PolarHBondContact O-N 2.9Å; V182-F187 HydrophobicContact CB-CE2 4.16Å; V182-F187 HydrophobicContact CG2-CD2 4.3Å; V182-F187 HydrophobicContact CG2-CE2 4.08Å; V182-Y229 HydrophobicContact CB-CG 4.46Å; V182-Y229 HydrophobicContact CG1-CD1 3.81Å; V182-Y229 HydrophobicContact CG1-CD2 3.81Å; V182-Y229 HydrophobicContact CG1-CE1 3.71Å; V182-Y229 HydrophobicContact CG1-CE2 3.7Å; V182-Y229 HydrophobicContact CG1-CG 3.84Å; V182-Y229 HydrophobicContact CG2-CD1 4.14Å; V182-Y229 HydrophobicContact CG2-CD2 4.08Å; V182-Y229 HydrophobicContact CG2-CG 3.7Å; V182-L252 HydrophobicContact CG1-CD2 3.95Å
183	G	85.1	Confident	79.8	Confident	57 Å²	57	23.4 Å²	23.4	59%	0.588	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	-117.3	-174.8	0	0	0	0	0	111.6
184	D	85.5	Confident	79.2	Confident	86 Å²	86	21.7 Å²	21.7	46%	0.46	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	1.4	-179.6	-70.4	-32.4	0	0	0	114	V182 K210	V182-D184 PolarHBondContact O-N 3.35Å; V182-D184 VanDerWaalsContact O-N 3.16Å; D184-K210 HydrophobicContact CB-CB 4.41Å; D184-K210 HydrophobicContact CB-CD 3.96Å; D184-K210 HydrophobicContact CB-CG 3.99Å; D184-K210 PolarHBondContact O-N 3.44Å; D184-K210 VanDerWaalsContact OD1-CD 3.28Å; D184-K210 WeakPolarHBondContact OD1-CD 3.19Å; D184-K210 WeakPolarHBondContact OD1-CE 3.5Å; D184-K210 IonicContact OD1-NZ 2.82Å; D184-K210 PolarHBondContact OD1-NZ 3Å; D184-K210 WeakPolarHBondContact OD2-CE 2.85Å; D184-K210 IonicContact OD2-NZ 2.75Å; D184-K210 PolarHBondContact OD2-NZ 2.84Å
185	L	88.9	Confident	78.6	Confident	31 Å²	31	28.4 Å²	28.4	16%	0.162	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.5	-176.8	-62.4	176.9	0	0	0	111.3	N181 V182 F187 K207 I208 L252	N181-L185 PolarHBondContact OD1-O 2.87Å; V182-L185 PolarHBondContact N-O 2.88Å; V182-L185 PolarHBondContact O-N 2.9Å; L185-F187 HydrophobicContact CB-CE2 4.1Å; L185-F187 HydrophobicContact CD1-CZ 4.36Å; L185-K207 HydrophobicContact CD1-CD 4.46Å; L185-I208 WeakPolarHBondContact CA-O 3.32Å; L185-L252 HydrophobicContact CD1-CB 4.09Å; L185-L252 HydrophobicContact CD1-CD1 3.94Å
186	L	88.2	Confident	78.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.4	166.9	178.3	66.7	0	0	0	109.5	F179 K207 I208 V302 W306 M313	F179-L186 HydrophobicContact CB-CD1 4.42Å; L186-K207 CarbonylContact O-C 3.6Å; L186-K207 VanDerWaalsContact O-CA 3.29Å; L186-K207 WeakPolarHBondContact O-CA 3.43Å; L186-I208 HydrophobicContact CB-CG2 3.83Å; L186-I208 HydrophobicContact CD2-CG2 4.44Å; L186-I208 HydrophobicContact CG-CG2 4.47Å; L186-I208 PolarHBondContact N-O 2.82Å; L186-I208 PolarHBondContact O-N 3.05Å; L186-V302 HydrophobicContact CD1-CG1 4.29Å; L186-W306 HydrophobicContact CB-CD2 4.26Å; L186-W306 HydrophobicContact CB-CZ2 4.22Å; L186-W306 HydrophobicContact CD2-CB 4.04Å; L186-W306 HydrophobicContact CD2-CD2 3.65Å; L186-W306 HydrophobicContact CD2-CE3 3.72Å; L186-W306 HydrophobicContact CD2-CG 3.79Å; L186-W306 HydrophobicContact CD2-CZ3 4.34Å; L186-M313 HydrophobicContact CD2-CE 4.21Å; L186-M313 HydrophobicContact CD2-CG 4.46Å; L186-M313 HydrophobicContact CD2-SD 3.31Å; L186-M313 WeakPolarHBondContact CD2-SD 3.32Å; L186-M313 HydrophobicContact CG-SD 4.48Å
187	F	91.1	Very high	77	Confident	1 Å²	1	39.3 Å²	39.3	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	134	169.4	-64.4	-93.6	0	0	0	109.2	F179 L180 V182 L185 F206 K207 V219 I226 L236 L252	F179-F187 CarbonylContact C-O 3.55Å; F179-F187 VanDerWaalsContact CA-O 3.22Å; F179-F187 WeakPolarHBondContact CA-O 3.36Å; L180-F187 HydrophobicContact CB-CB 4.24Å; L180-F187 PolarHBondContact N-O 3.17Å; L180-F187 PolarHBondContact O-N 3.06Å; V182-F187 HydrophobicContact CB-CE2 4.16Å; V182-F187 HydrophobicContact CG2-CD2 4.3Å; V182-F187 HydrophobicContact CG2-CE2 4.08Å; L185-F187 HydrophobicContact CB-CE2 4.1Å; L185-F187 HydrophobicContact CD1-CZ 4.36Å; F187-F206 CarbonylContact C-O 3.56Å; F187-F206 WeakPolarHBondContact CA-O 3.28Å; F187-K207 HydrophobicContact CD1-CB 3.77Å; F187-K207 HydrophobicContact CE1-CB 3.77Å; F187-K207 HydrophobicContact CE1-CD 3.92Å; F187-K207 HydrophobicContact CE1-CG 4.42Å; F187-K207 HydrophobicContact CG-CB 4.36Å; F187-K207 HydrophobicContact CZ-CB 4.34Å; F187-K207 HydrophobicContact CZ-CD 4.26Å; F187-V219 HydrophobicContact CD1-CG2 4.11Å; F187-V219 HydrophobicContact CE1-CG2 4.29Å; F187-I226 HydrophobicContact CB-CG1 4.3Å; F187-I226 HydrophobicContact CB-CG2 4.43Å; F187-I226 HydrophobicContact CD1-CG1 4.24Å; F187-L236 HydrophobicContact CD1-CD2 4.09Å; F187-L236 HydrophobicContact CE1-CD2 3.48Å; F187-L236 VanDerWaalsContact CE1-CD2 3.48Å; F187-L236 HydrophobicContact CE2-CD1 4.38Å; F187-L236 HydrophobicContact CE2-CD2 4.25Å; F187-L236 HydrophobicContact CZ-CD2 3.58Å; F187-L252 HydrophobicContact CZ-CB 4.36Å
188	Y	86.9	Confident	75.6	Confident	8 Å²	8	41.2 Å²	41.2	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126	175	165	-114.1	0	0	0	109.4	N177 T178 F179 C205 F206 W216 W323	N177-Y188 HydrophobicContact CB-CE2 4.17Å; T178-Y188 CarbonylContact O-C 3.4Å; T178-Y188 WeakPolarHBondContact O-CA 3.39Å; F179-Y188 AromaticContact CD1-CD2 3.8Å; F179-Y188 HydrophobicContact CD1-CD2 3.8Å; F179-Y188 HydrophobicContact CD1-CG 4.45Å; F179-Y188 AromaticContact CE1-CD2 3.18Å; F179-Y188 HydrophobicContact CE1-CD2 3.18Å; F179-Y188 AromaticContact CE1-CE2 3.82Å; F179-Y188 HydrophobicContact CE1-CE2 3.82Å; F179-Y188 AromaticContact CE1-CG 3.97Å; F179-Y188 HydrophobicContact CE1-CG 3.97Å; F179-Y188 AromaticContact CE2-CD2 3.93Å; F179-Y188 HydrophobicContact CE2-CD2 3.93Å; F179-Y188 HydrophobicContact CE2-CE2 4.05Å; F179-Y188 HydrophobicContact CG-CD2 4.43Å; F179-Y188 AromaticContact CZ-CD2 3.26Å; F179-Y188 HydrophobicContact CZ-CD2 3.26Å; F179-Y188 AromaticContact CZ-CE2 3.41Å; F179-Y188 HydrophobicContact CZ-CE2 3.41Å; F179-Y188 VanDerWaalsContact CZ-CE2 3.41Å; F179-Y188 HydrophobicContact CZ-CG 4.41Å; Y188-C205 CarbonylContact O-C 3.57Å; Y188-C205 VanDerWaalsContact O-CA 3.32Å; Y188-C205 WeakPolarHBondContact O-CA 3.45Å; Y188-F206 HydrophobicContact CD1-CD2 4.29Å; Y188-F206 PolarHBondContact N-O 3.34Å; Y188-F206 PolarHBondContact O-N 2.64Å; Y188-W216 HydrophobicContact CD1-CZ3 4.39Å; Y188-W323 HydrophobicContact CD1-CZ3 4.21Å; Y188-W323 HydrophobicContact CD2-CH2 4.32Å; Y188-W323 HydrophobicContact CD2-CZ3 4.45Å; Y188-W323 HydrophobicContact CE1-CE3 4.21Å; Y188-W323 HydrophobicContact CE1-CH2 4.39Å; Y188-W323 AromaticContact CE1-CZ3 3.62Å; Y188-W323 HydrophobicContact CE1-CZ3 3.62Å; Y188-W323 HydrophobicContact CE2-CE3 4.5Å; Y188-W323 AromaticContact CE2-CH2 3.92Å; Y188-W323 HydrophobicContact CE2-CH2 3.92Å; Y188-W323 AromaticContact CE2-CZ3 3.86Å; Y188-W323 HydrophobicContact CE2-CZ3 3.86Å; Y188-W323 AromaticContact CZ-CE3 3.81Å; Y188-W323 AromaticContact CZ-CH2 3.96Å; Y188-W323 AromaticContact CZ-CZ3 3.4Å
189	C	86.5	Confident	74.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.8	173.5	-56.6	0	0	0	0	110.8	N177 T178 R204 C205 I226	N177-C189 CarbonylContact C-O 3.53Å; N177-C189 WeakPolarHBondContact CA-O 3.43Å; N177-C189 WeakPolarHBondContact CB-O 3.48Å; T178-C189 PolarHBondContact N-O 3.12Å; T178-C189 PolarHBondContact O-N 2.93Å; T178-C189 WeakPolarHBondContact OG1-CB 3.3Å; C189-R204 CarbonylContact C-O 3.51Å; C189-R204 VanDerWaalsContact CA-O 3.29Å; C189-R204 WeakPolarHBondContact CA-O 3.17Å; C189-C205 HydrophobicContact CB-CB 4.13Å; C189-C205 WeakPolarHBondContact CB-SG 3.36Å; C189-C205 WeakPolarHBondContact SG-CB 3.28Å; C189-C205 CovalentContact SG-SG 2.04Å; C189-C205 PolarHBondContact SG-SG 3.39Å; C189-I226 VanDerWaalsContact SG-CG1 3.6Å; C189-I226 PolarHBondContact SG-N 3.39Å
190	G	79.2	Confident	72.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	-174.8	-174.4	0	0	0	0	0	112.7	N177 R203 R204	N177-G190 WeakPolarHBondContact OD1-CA 3.4Å; G190-R203 WeakPolarHBondContact O-CA 3.25Å; G190-R204 PolarHBondContact N-O 3.22Å; G190-R204 PolarHBondContact O-N 3.24Å
191	R	71.9	Confident	71.3	Confident	82 Å²	82	58.3 Å²	58.3	31%	0.309	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.5	172.5	-78.8	-173.5	-180	126.1	-2.2	109.5	L201 V202 W282	R191-L201 HydrophobicContact CB-CB 4.1Å; R191-L201 HydrophobicContact CB-CD1 4.44Å; R191-L201 HydrophobicContact CG-CB 4.32Å; R191-V202 WeakPolarHBondContact CA-O 3.02Å; R191-W282 HydrophobicContact CB-CH2 4.45Å; R191-W282 HydrophobicContact CB-CZ2 4.45Å; R191-W282 HydrophobicContact CG-CH2 4.3Å; R191-W282 HydrophobicContact CG-CZ2 4.07Å; R191-W282 VanDerWaalsContact NH1-CZ2 3.32Å
192	A	65.5	Low	70.4	Confident	11 Å²	11	59.3 Å²	59.3	9%	0.091	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	160.4	175.5	0	0	0	0	0	110	G194 L201 V202 R204 F206	A192-G194 PolarHBondContact O-N 3.05Å; A192-L201 CarbonylContact O-C 3.56Å; A192-L201 WeakPolarHBondContact O-CA 3.4Å; A192-V202 PolarHBondContact N-O 3.35Å; A192-V202 PolarHBondContact O-N 3.34Å; A192-R204 HydrophobicContact CB-CB 4.27Å; A192-R204 HydrophobicContact CB-CG 4.25Å; A192-F206 HydrophobicContact CB-CE2 3.96Å; A192-F206 HydrophobicContact CB-CZ 4.05Å
193	I	56.6	Low	69.9	Low	64 Å²	64	60.1 Å²	60.1	33%	0.328	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.5	178	-60.5	171.6	0	0	0	109.2	L201 C327	I193-L201 HydrophobicContact CG1-CD2 4.34Å; I193-C327 HydrophobicContact CD1-CB 4.28Å; I193-C327 VanDerWaalsContact CD1-SG 3.54Å
194	G	56.4	Low	69.7	Low	8 Å²	8	58.3 Å²	58.3	8%	0.082	31%	0.313	C	S	.	.			trans	-66.3	138.8	175.5	0	0	0	0	0	112.4	A192 K196 G197 D200	A192-G194 PolarHBondContact O-N 3.05Å; G194-K196 PolarHBondContact O-N 3Å; G194-K196 VanDerWaalsContact O-N 3.08Å; G194-G197 PolarHBondContact O-N 3.31Å; G194-D200 PolarHBondContact N-O 3.44Å
195	M	54.3	Low	69.8	Low	148 Å²	148	54.2 Å²	54.2	73%	0.729	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.6	175.3	-73	-172.5	170.2	0	0	114	G197	M195-G197 PolarHBondContact O-N 3.4Å
196	K	55.6	Low	69.7	Low	204 Å²	204	54 Å²	54	89%	0.887	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	13.7	-179.9	-72.9	-170.6	176.1	-176.1	0	113.9	G194 S198	G194-K196 PolarHBondContact O-N 3Å; G194-K196 VanDerWaalsContact O-N 3.08Å; K196-S198 PolarHBondContact O-N 3.34Å
197	G	48.9	Very low	69.8	Low	72 Å²	72	54.7 Å²	54.7	74%	0.742	29%	0.292	S	S	*	.	S	Bend	trans	73.1	1.8	179.3	0	0	0	0	0	114.7	G194 M195	G194-G197 PolarHBondContact O-N 3.31Å; M195-G197 PolarHBondContact O-N 3.4Å
198	S	48.2	Very low	69.4	Low	45 Å²	45	54.7 Å²	54.7	32%	0.315	29%	0.292	S	S	.	.			trans	-76.5	135.9	166.5	64.8	0	0	0	0	109.3	K196 D200	K196-S198 PolarHBondContact O-N 3.34Å; S198-D200 PolarHBondContact O-N 2.85Å; S198-D200 VanDerWaalsContact O-N 3.12Å
199	L	51.8	Low	69.2	Low	154 Å²	154	54.9 Å²	54.9	81%	0.806	29%	0.294	S	S	*	.			trans	-69.4	2.3	169.5	-69.4	167.5	0	0	0	112.2	L201	L199-L201 PolarHBondContact O-N 3.38Å
200	D	55.9	Low	68.7	Low	114 Å²	114	59.1 Å²	59.1	61%	0.61	31%	0.312	S	S	*	.			trans	-64.5	123.1	175.6	-65.4	-32.2	0	0	0	109.8	G194 S198 V202	G194-D200 PolarHBondContact N-O 3.44Å; S198-D200 PolarHBondContact O-N 2.85Å; S198-D200 VanDerWaalsContact O-N 3.12Å; D200-V202 PolarHBondContact O-N 3.26Å; D200-V202 VanDerWaalsContact O-N 3.15Å
201	L	62.9	Low	68	Low	95 Å²	95	61.2 Å²	61.2	50%	0.497	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	108.2	173.2	-68.5	176.2	0	0	0	109.2	R191 A192 I193 L199	R191-L201 HydrophobicContact CB-CB 4.1Å; R191-L201 HydrophobicContact CB-CD1 4.44Å; R191-L201 HydrophobicContact CG-CB 4.32Å; A192-L201 CarbonylContact O-C 3.56Å; A192-L201 WeakPolarHBondContact O-CA 3.4Å; I193-L201 HydrophobicContact CG1-CD2 4.34Å; L199-L201 PolarHBondContact O-N 3.38Å
202	V	70.7	Confident	68	Low	56 Å²	56	62.5 Å²	62.5	34%	0.339	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	153.1	173	-61	0	0	0	0	110.3	R191 A192 D200 R204	R191-V202 WeakPolarHBondContact CA-O 3.02Å; A192-V202 PolarHBondContact N-O 3.35Å; A192-V202 PolarHBondContact O-N 3.34Å; D200-V202 PolarHBondContact O-N 3.26Å; D200-V202 VanDerWaalsContact O-N 3.15Å; V202-R204 HydrophobicContact CG2-CG 3.98Å; V202-R204 PolarHBondContact O-N 2.59Å
203	R	77.3	Confident	68.1	Low	27 Å²	27	68.6 Å²	68.6	10%	0.102	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.7	171.9	-75.2	-82.4	175	-161.8	-23.1	109.7	R174 Q175 A176 N177 G190 E224	R174-R203 PolarHBondContact O-NE 3.49Å; Q175-R203 VanDerWaalsContact CA-NH2 3.33Å; Q175-R203 VanDerWaalsContact O-CZ 3.26Å; Q175-R203 PolarHBondContact O-NH1 2.9Å; Q175-R203 PolarHBondContact O-NH2 3.32Å; A176-R203 PolarHBondContact O-NH1 3.47Å; N177-R203 PolarHBondContact OD1-NH1 2.83Å; G190-R203 WeakPolarHBondContact O-CA 3.25Å; R203-E224 HydrophobicContact CB-CB 3.68Å; R203-E224 HydrophobicContact CG-CB 4.41Å
204	R	81.6	Confident	68.8	Low	19 Å²	19	70.6 Å²	70.6	7%	0.072	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	155.1	171.6	-58.3	-163.6	83.1	109.9	-7.1	110.7	C189 G190 A192 V202 F206 D218	C189-R204 CarbonylContact C-O 3.51Å; C189-R204 VanDerWaalsContact CA-O 3.29Å; C189-R204 WeakPolarHBondContact CA-O 3.17Å; G190-R204 PolarHBondContact N-O 3.22Å; G190-R204 PolarHBondContact O-N 3.24Å; A192-R204 HydrophobicContact CB-CB 4.27Å; A192-R204 HydrophobicContact CB-CG 4.25Å; V202-R204 HydrophobicContact CG2-CG 3.98Å; V202-R204 PolarHBondContact O-N 2.59Å; R204-F206 HydrophobicContact CB-CE2 3.8Å; R204-F206 HydrophobicContact CB-CZ 3.99Å; R204-D218 IonicContact CZ-OD2 3.42Å; R204-D218 IonicContact NE-OD1 3.99Å; R204-D218 IonicContact NE-OD2 3.11Å; R204-D218 PolarHBondContact NE-OD2 3.24Å; R204-D218 IonicContact NH2-OD1 2.82Å; R204-D218 IonicContact NH2-OD2 2.68Å; R204-D218 PolarHBondContact NH2-OD2 2.7Å
205	C	87.3	Confident	69.7	Low	0 Å²	0	73 Å²	73	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.8	171.7	-66.2	0	0	0	0	110.2	Y188 C189 V219 V223 E224 Q225 I226	Y188-C205 CarbonylContact O-C 3.57Å; Y188-C205 VanDerWaalsContact O-CA 3.32Å; Y188-C205 WeakPolarHBondContact O-CA 3.45Å; C189-C205 HydrophobicContact CB-CB 4.13Å; C189-C205 WeakPolarHBondContact CB-SG 3.36Å; C189-C205 WeakPolarHBondContact SG-CB 3.28Å; C189-C205 CovalentContact SG-SG 2.04Å; C189-C205 PolarHBondContact SG-SG 3.39Å; C205-V219 HydrophobicContact CB-CB 3.86Å; C205-V219 HydrophobicContact CB-CG1 4.25Å; C205-V219 HydrophobicContact CB-CG2 4.19Å; C205-V219 WeakPolarHBondContact O-CB 3.39Å; C205-V219 PolarHBondContact O-N 2.76Å; C205-V223 HydrophobicContact CB-CG1 4.47Å; C205-E224 VanDerWaalsContact SG-C 3.56Å; C205-Q225 VanDerWaalsContact SG-CA 3.57Å; C205-Q225 PolarHBondContact SG-N 3.41Å; C205-I226 HydrophobicContact CB-CG1 4.39Å
206	F	87.5	Confident	70.9	Confident	27 Å²	27	67.4 Å²	67.4	12%	0.118	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	154.8	174.1	-55.6	-90	0	0	0	108.9	F187 Y188 A192 R204 W216 F217 D218 I330	F187-F206 CarbonylContact C-O 3.56Å; F187-F206 WeakPolarHBondContact CA-O 3.28Å; Y188-F206 HydrophobicContact CD1-CD2 4.29Å; Y188-F206 PolarHBondContact N-O 3.34Å; Y188-F206 PolarHBondContact O-N 2.64Å; A192-F206 HydrophobicContact CB-CE2 3.96Å; A192-F206 HydrophobicContact CB-CZ 4.05Å; R204-F206 HydrophobicContact CB-CE2 3.8Å; R204-F206 HydrophobicContact CB-CZ 3.99Å; F206-W216 HydrophobicContact CB-CE3 3.65Å; F206-W216 HydrophobicContact CB-CZ3 3.81Å; F206-W216 HydrophobicContact CG-CE3 4.38Å; F206-F217 CarbonylContact C-O 3.59Å; F206-F217 WeakPolarHBondContact CA-O 3.47Å; F206-D218 HydrophobicContact CD1-CB 4.24Å; F206-D218 HydrophobicContact CE1-CB 4.24Å; F206-I330 HydrophobicContact CD2-CD1 4.22Å; F206-I330 HydrophobicContact CE2-CD1 4.05Å; F206-I330 HydrophobicContact CZ-CD1 4.21Å
207	K	89.1	Confident	72.2	Confident	14 Å²	14	62.3 Å²	62.3	6%	0.061	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.7	167.2	64.4	-177.6	179.5	-175.5	0	109.6	L185 L186 F187 W216 F217 V219 L252 N254	L185-K207 HydrophobicContact CD1-CD 4.46Å; L186-K207 CarbonylContact O-C 3.6Å; L186-K207 VanDerWaalsContact O-CA 3.29Å; L186-K207 WeakPolarHBondContact O-CA 3.43Å; F187-K207 HydrophobicContact CD1-CB 3.77Å; F187-K207 HydrophobicContact CE1-CB 3.77Å; F187-K207 HydrophobicContact CE1-CD 3.92Å; F187-K207 HydrophobicContact CE1-CG 4.42Å; F187-K207 HydrophobicContact CG-CB 4.36Å; F187-K207 HydrophobicContact CZ-CB 4.34Å; F187-K207 HydrophobicContact CZ-CD 4.26Å; K207-W216 CarbonylContact O-C 3.48Å; K207-W216 WeakPolarHBondContact O-CA 3.32Å; K207-F217 HydrophobicContact CD-CB 4.43Å; K207-F217 HydrophobicContact CG-CB 3.75Å; K207-F217 HydrophobicContact CG-CD2 4.3Å; K207-F217 HydrophobicContact CG-CG 4.47Å; K207-F217 PolarHBondContact N-O 3.43Å; K207-F217 PolarHBondContact O-N 3.43Å; K207-V219 HydrophobicContact CB-CG2 4.16Å; K207-V219 HydrophobicContact CG-CG2 4.19Å; K207-L252 WeakPolarHBondContact CD-O 3.28Å; K207-L252 PolarHBondContact NZ-O 3Å; K207-N254 PolarHBondContact NZ-OD1 2.87Å
208	I	83.4	Confident	73.9	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.4	176.5	-167.3	-175.1	0	0	0	109.9	L185 L186 R214 I215 W216 W306 M313 L320	L185-I208 WeakPolarHBondContact CA-O 3.32Å; L186-I208 HydrophobicContact CB-CG2 3.83Å; L186-I208 HydrophobicContact CD2-CG2 4.44Å; L186-I208 HydrophobicContact CG-CG2 4.47Å; L186-I208 PolarHBondContact N-O 2.82Å; L186-I208 PolarHBondContact O-N 3.05Å; I208-R214 HydrophobicContact CD1-CB 4.39Å; I208-I215 WeakPolarHBondContact CA-O 3.24Å; I208-W216 HydrophobicContact CB-CD2 4.03Å; I208-W216 HydrophobicContact CB-CE3 4.02Å; I208-W216 HydrophobicContact CB-CZ3 4.31Å; I208-W216 HydrophobicContact CD1-CD2 4.12Å; I208-W216 HydrophobicContact CD1-CG 4.46Å; I208-W216 HydrophobicContact CD1-CZ2 3.89Å; I208-W216 HydrophobicContact CG1-CD2 4.13Å; I208-W216 HydrophobicContact CG1-CG 4.31Å; I208-W306 HydrophobicContact CD1-CH2 4.2Å; I208-W306 HydrophobicContact CD1-CZ3 4.17Å; I208-W306 HydrophobicContact CG1-CH2 4.43Å; I208-W306 HydrophobicContact CG2-CH2 3.69Å; I208-W306 HydrophobicContact CG2-CZ2 4.36Å; I208-W306 HydrophobicContact CG2-CZ3 3.88Å; I208-M313 HydrophobicContact CD1-CE 4.37Å; I208-M313 HydrophobicContact CG2-CE 4.09Å; I208-L320 HydrophobicContact CD1-CD1 4.15Å
209	S	82.8	Confident	75.7	Confident	12 Å²	12	59.5 Å²	59.5	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	153.6	170.9	60.5	0	0	0	0	112.3	R214 I215	S209-R214 PolarHBondContact OG-N 2.76Å; S209-I215 PolarHBondContact N-O 3.3Å; S209-I215 PolarHBondContact OG-N 2.82Å; S209-I215 VanDerWaalsContact OG-N 3.11Å
210	K	75.4	Confident	77	Confident	88 Å²	88	53 Å²	53	38%	0.383	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-56.2	162.9	173.6	66.7	170.3	170.5	-157.7	0	113.2	D184 E213 Q305 W306	D184-K210 HydrophobicContact CB-CB 4.41Å; D184-K210 HydrophobicContact CB-CD 3.96Å; D184-K210 HydrophobicContact CB-CG 3.99Å; D184-K210 PolarHBondContact O-N 3.44Å; D184-K210 VanDerWaalsContact OD1-CD 3.28Å; D184-K210 WeakPolarHBondContact OD1-CD 3.19Å; D184-K210 WeakPolarHBondContact OD1-CE 3.5Å; D184-K210 IonicContact OD1-NZ 2.82Å; D184-K210 PolarHBondContact OD1-NZ 3Å; D184-K210 WeakPolarHBondContact OD2-CE 2.85Å; D184-K210 IonicContact OD2-NZ 2.75Å; D184-K210 PolarHBondContact OD2-NZ 2.84Å; K210-E213 PolarHBondContact O-N 3.11Å; K210-Q305 VanDerWaalsContact CB-NE2 3.32Å; K210-W306 HydrophobicContact CB-CZ2 4.49Å
211	L	64.8	Low	77.8	Confident	45 Å²	45	51.9 Å²	51.9	24%	0.236	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	139.4	166.6	-73.2	167.8	0	0	0	110.5	R214 A315 N316	L211-R214 HydrophobicContact CD2-CG 3.78Å; L211-A315 HydrophobicContact CD1-CB 4.13Å; L211-N316 HydrophobicContact CD1-CB 4.39Å; L211-N316 VanDerWaalsContact CD1-ND2 3.34Å; L211-N316 WeakPolarHBondContact CD1-ND2 3.3Å
212	P	71.6	Confident	78.6	Confident	109 Å²	109	50.2 Å²	50.2	71%	0.708	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	cis	-94.3	-13	9.8	35.3	-34.8	0	0	0	115.8
213	E	67.5	Low	79.4	Confident	139 Å²	139	47.6 Å²	47.6	65%	0.65	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-42.9	-166.9	-66.5	173.6	-170.1	0	0	113.8	K210 I215	K210-E213 PolarHBondContact O-N 3.11Å; E213-I215 VanDerWaalsContact C-N 3.28Å; E213-I215 HydrophobicContact CB-CG1 4.38Å; E213-I215 PolarHBondContact O-N 3.1Å
214	R	71.2	Confident	79.8	Confident	106 Å²	106	46.5 Å²	46.5	40%	0.4	24%	0.242	S	C	.	.			trans	48.7	41.6	175.4	-63.5	-177.3	-71.6	-177.7	1.8	114.8	I208 S209 L211 W216	I208-R214 HydrophobicContact CD1-CB 4.39Å; S209-R214 PolarHBondContact OG-N 2.76Å; L211-R214 HydrophobicContact CD2-CG 3.78Å; R214-W216 PolarHBondContact O-N 3.3Å
215	I	74.9	Confident	80.1	Confident	58 Å²	58	45.6 Å²	45.6	30%	0.297	24%	0.238	S	C	.	.			trans	-85.1	119.1	179.8	-53.4	173.4	0	0	0	108.4	I208 S209 E213 F217	I208-I215 WeakPolarHBondContact CA-O 3.24Å; S209-I215 PolarHBondContact N-O 3.3Å; S209-I215 PolarHBondContact OG-N 2.82Å; S209-I215 VanDerWaalsContact OG-N 3.11Å; E213-I215 VanDerWaalsContact C-N 3.28Å; E213-I215 HydrophobicContact CB-CG1 4.38Å; E213-I215 PolarHBondContact O-N 3.1Å; I215-F217 HydrophobicContact CB-CD2 4.35Å; I215-F217 HydrophobicContact CB-CE2 3.58Å; I215-F217 HydrophobicContact CB-CZ 3.86Å; I215-F217 HydrophobicContact CD1-CZ 4.44Å; I215-F217 HydrophobicContact CG2-CD1 4.4Å; I215-F217 HydrophobicContact CG2-CD2 4.01Å; I215-F217 HydrophobicContact CG2-CE1 3.84Å; I215-F217 HydrophobicContact CG2-CE2 3.4Å; I215-F217 HydrophobicContact CG2-CG 4.49Å; I215-F217 HydrophobicContact CG2-CZ 3.3Å; I215-F217 WeakPolarHBondContact O-CD2 3.21Å
216	W	80.3	Confident	80.4	Confident	31 Å²	31	45.6 Å²	45.6	12%	0.117	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	128.3	170	-72.8	93.8	0	0	0	109.9	Y188 F206 K207 I208 R214 M313 A321 I330	Y188-W216 HydrophobicContact CD1-CZ3 4.39Å; F206-W216 HydrophobicContact CB-CE3 3.65Å; F206-W216 HydrophobicContact CB-CZ3 3.81Å; F206-W216 HydrophobicContact CG-CE3 4.38Å; K207-W216 CarbonylContact O-C 3.48Å; K207-W216 WeakPolarHBondContact O-CA 3.32Å; I208-W216 HydrophobicContact CB-CD2 4.03Å; I208-W216 HydrophobicContact CB-CE3 4.02Å; I208-W216 HydrophobicContact CB-CZ3 4.31Å; I208-W216 HydrophobicContact CD1-CD2 4.12Å; I208-W216 HydrophobicContact CD1-CG 4.46Å; I208-W216 HydrophobicContact CD1-CZ2 3.89Å; I208-W216 HydrophobicContact CG1-CD2 4.13Å; I208-W216 HydrophobicContact CG1-CG 4.31Å; R214-W216 PolarHBondContact O-N 3.3Å; W216-M313 HydrophobicContact CH2-CE 3.31Å; W216-M313 HydrophobicContact CH2-SD 4.46Å; W216-M313 HydrophobicContact CZ2-CE 3.42Å; W216-M313 VanDerWaalsContact CZ2-CE 3.42Å; W216-M313 HydrophobicContact CZ3-CE 4.4Å; W216-A321 HydrophobicContact CH2-CB 4.17Å; W216-A321 HydrophobicContact CZ2-CB 3.95Å; W216-I330 HydrophobicContact CB-CG2 4.21Å; W216-I330 HydrophobicContact CD2-CG2 3.79Å; W216-I330 HydrophobicContact CE3-CG2 4.38Å; W216-I330 HydrophobicContact CG-CG2 3.72Å
217	F	83.1	Confident	80.5	Confident	96 Å²	96	44.3 Å²	44.3	42%	0.421	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.8	171.7	-59.7	-89.2	0	0	0	109.3	F206 K207 I215	F206-F217 CarbonylContact C-O 3.59Å; F206-F217 WeakPolarHBondContact CA-O 3.47Å; K207-F217 HydrophobicContact CD-CB 4.43Å; K207-F217 HydrophobicContact CG-CB 3.75Å; K207-F217 HydrophobicContact CG-CD2 4.3Å; K207-F217 HydrophobicContact CG-CG 4.47Å; K207-F217 PolarHBondContact N-O 3.43Å; K207-F217 PolarHBondContact O-N 3.43Å; I215-F217 HydrophobicContact CB-CD2 4.35Å; I215-F217 HydrophobicContact CB-CE2 3.58Å; I215-F217 HydrophobicContact CB-CZ 3.86Å; I215-F217 HydrophobicContact CD1-CZ 4.44Å; I215-F217 HydrophobicContact CG2-CD1 4.4Å; I215-F217 HydrophobicContact CG2-CD2 4.01Å; I215-F217 HydrophobicContact CG2-CE1 3.84Å; I215-F217 HydrophobicContact CG2-CE2 3.4Å; I215-F217 HydrophobicContact CG2-CG 4.49Å; I215-F217 HydrophobicContact CG2-CZ 3.3Å; I215-F217 WeakPolarHBondContact O-CD2 3.21Å
218	D	83.9	Confident	80.8	Confident	54 Å²	54	43.7 Å²	43.7	29%	0.289	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	128.2	166.2	-170.6	-20.3	0	0	0	108.6	R204 F206 G220	R204-D218 IonicContact CZ-OD2 3.42Å; R204-D218 IonicContact NE-OD1 3.99Å; R204-D218 IonicContact NE-OD2 3.11Å; R204-D218 PolarHBondContact NE-OD2 3.24Å; R204-D218 IonicContact NH2-OD1 2.82Å; R204-D218 IonicContact NH2-OD2 2.68Å; R204-D218 PolarHBondContact NH2-OD2 2.7Å; F206-D218 HydrophobicContact CD1-CB 4.24Å; F206-D218 HydrophobicContact CE1-CB 4.24Å; D218-G220 PolarHBondContact O-N 3.37Å; D218-G220 WeakPolarHBondContact OD1-CA 3.39Å; D218-G220 PolarHBondContact OD1-N 3.31Å
219	V	87.5	Confident	81.4	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.03	24%	0.237	C	C	.	.			trans	-78.2	-10.7	-179.8	174.7	0	0	0	0	111.5	F187 C205 K207 V223 I226 W256	F187-V219 HydrophobicContact CD1-CG2 4.11Å; F187-V219 HydrophobicContact CE1-CG2 4.29Å; C205-V219 HydrophobicContact CB-CB 3.86Å; C205-V219 HydrophobicContact CB-CG1 4.25Å; C205-V219 HydrophobicContact CB-CG2 4.19Å; C205-V219 WeakPolarHBondContact O-CB 3.39Å; C205-V219 PolarHBondContact O-N 2.76Å; K207-V219 HydrophobicContact CB-CG2 4.16Å; K207-V219 HydrophobicContact CG-CG2 4.19Å; V219-V223 HydrophobicContact CG1-CB 4.47Å; V219-V223 HydrophobicContact CG1-CG2 4.46Å; V219-I226 HydrophobicContact CG1-CD1 4.47Å; V219-W256 HydrophobicContact CG1-CZ2 3.35Å; V219-W256 PolarHBondContact O-NE1 3.47Å
220	G	78.8	Confident	82	Confident	18 Å²	18	44.8 Å²	44.8	19%	0.186	23%	0.233	C	C	.	.			trans	118.8	154.5	173.3	0	0	0	0	0	112.6	D218 S222 V223	D218-G220 PolarHBondContact O-N 3.37Å; D218-G220 WeakPolarHBondContact OD1-CA 3.39Å; D218-G220 PolarHBondContact OD1-N 3.31Å; G220-S222 PolarHBondContact O-N 2.79Å; G220-S222 VanDerWaalsContact O-N 3.12Å; G220-V223 PolarHBondContact O-N 3.07Å
221	P	72.3	Confident	82.7	Confident	89 Å²	89	43.6 Å²	43.6	58%	0.578	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.3	-173	29.2	-36.7	0	0	0	114.2	S241	P221-S241 PolarHBondContact O-OG 3.11Å
222	S	78.6	Confident	84.1	Confident	60 Å²	60	45.8 Å²	45.8	42%	0.42	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-6.4	-174.6	-65	0	0	0	0	113.6	G220 R240 S241	G220-S222 PolarHBondContact O-N 2.79Å; G220-S222 VanDerWaalsContact O-N 3.12Å; S222-R240 WeakPolarHBondContact O-CA 3.4Å; S222-S241 PolarHBondContact O-N 2.92Å
223	V	88.3	Confident	85.1	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114	-176.5	-171	0	0	0	0	109	C205 V219 G220 Q225 I226 L239 V247 W256	C205-V223 HydrophobicContact CB-CG1 4.47Å; V219-V223 HydrophobicContact CG1-CB 4.47Å; V219-V223 HydrophobicContact CG1-CG2 4.46Å; G220-V223 PolarHBondContact O-N 3.07Å; V223-Q225 WeakPolarHBondContact CG1-O 3.01Å; V223-I226 HydrophobicContact CG1-CD1 3.82Å; V223-L239 WeakPolarHBondContact CA-O 3.32Å; V223-V247 HydrophobicContact CG2-CG2 4.2Å; V223-W256 HydrophobicContact CG1-CZ2 4.41Å; V223-W256 HydrophobicContact CG2-CD2 3.67Å; V223-W256 HydrophobicContact CG2-CE3 4.29Å; V223-W256 HydrophobicContact CG2-CG 3.86Å; V223-W256 HydrophobicContact CG2-CZ2 4.12Å
224	E	85.3	Confident	86.4	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.019	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-28.2	178.2	64.8	176.6	-166.5	0	0	112.4	R174 R203 C205 L239 R240 S241	R174-E224 VanDerWaalsContact CD-OE1 3.3Å; R174-E224 WeakPolarHBondContact CD-OE1 3.5Å; R174-E224 IonicContact CZ-OE1 2.81Å; R174-E224 IonicContact NE-OE1 2.98Å; R174-E224 PolarHBondContact NE-OE1 3.38Å; R203-E224 HydrophobicContact CB-CB 3.68Å; R203-E224 HydrophobicContact CG-CB 4.41Å; C205-E224 VanDerWaalsContact SG-C 3.56Å; E224-L239 HydrophobicContact CG-CB 4.19Å; E224-L239 WeakPolarHBondContact CG-O 3.45Å; E224-L239 PolarHBondContact N-O 3.16Å; E224-R240 VanDerWaalsContact CD-O 3.24Å; E224-S241 VanDerWaalsContact OE2-CA 3.28Å; E224-S241 WeakPolarHBondContact OE2-CA 3.25Å
225	Q	88.5	Confident	87.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	145.2	-178.1	-69.7	-172.3	-39.2	0	0	111.9	D173 R174 A176 T178 C205 V223 G238 L239	D173-Q225 PolarHBondContact O-NE2 3.2Å; R174-Q225 PolarHBondContact O-NE2 3.46Å; A176-Q225 PolarHBondContact O-NE2 2.98Å; T178-Q225 HydrophobicContact CG2-CG 4.37Å; C205-Q225 VanDerWaalsContact SG-CA 3.57Å; C205-Q225 PolarHBondContact SG-N 3.41Å; V223-Q225 WeakPolarHBondContact CG1-O 3.01Å; Q225-G238 CarbonylContact O-C 3.56Å; Q225-G238 WeakPolarHBondContact O-CA 3.23Å; Q225-L239 HydrophobicContact CB-CB 4.41Å; Q225-L239 PolarHBondContact O-N 3.03Å
226	I	92.7	Very high	88.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.8	164.9	-62.1	-60	0	0	0	107.7	T178 L180 F187 C189 C205 V219 V223 L236 W256 A277	T178-I226 PolarHBondContact OG1-O 3Å; L180-I226 HydrophobicContact CB-CG2 4.02Å; L180-I226 HydrophobicContact CD2-CG2 3.44Å; L180-I226 VanDerWaalsContact CD2-CG2 3.44Å; L180-I226 HydrophobicContact CG-CG2 4.37Å; F187-I226 HydrophobicContact CB-CG1 4.3Å; F187-I226 HydrophobicContact CB-CG2 4.43Å; F187-I226 HydrophobicContact CD1-CG1 4.24Å; C189-I226 VanDerWaalsContact SG-CG1 3.6Å; C189-I226 PolarHBondContact SG-N 3.39Å; C205-I226 HydrophobicContact CB-CG1 4.39Å; V219-I226 HydrophobicContact CG1-CD1 4.47Å; V223-I226 HydrophobicContact CG1-CD1 3.82Å; I226-L236 HydrophobicContact CD1-CD2 4.03Å; I226-L236 HydrophobicContact CD1-CG 4.3Å; I226-L236 HydrophobicContact CG2-CD1 3.73Å; I226-L236 HydrophobicContact CG2-CG 4.3Å; I226-W256 HydrophobicContact CD1-CH2 3.32Å; I226-W256 HydrophobicContact CD1-CZ2 3.66Å; I226-W256 HydrophobicContact CD1-CZ3 4.39Å; I226-A277 VanDerWaalsContact O-CB 3.23Å; I226-A277 WeakPolarHBondContact O-CB 3.32Å
227	I	91.6	Very high	89.3	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-35	-170.7	61	174.5	0	0	0	113.7	M164 L171 P172 F237 L239 Y264 A277	M164-I227 HydrophobicContact CE-CD1 3.86Å; L171-I227 HydrophobicContact CD2-CD1 3.83Å; P172-I227 HydrophobicContact CG-CG2 3.79Å; I227-F237 HydrophobicContact CD1-CB 4.15Å; I227-F237 HydrophobicContact CG1-CB 3.77Å; I227-F237 WeakPolarHBondContact CG1-O 3.32Å; I227-F237 PolarHBondContact N-O 2.87Å; I227-L239 HydrophobicContact CD1-CD2 4.31Å; I227-L239 HydrophobicContact CD1-CG 4.41Å; I227-L239 HydrophobicContact CG2-CD1 3.92Å; I227-L239 HydrophobicContact CG2-CG 3.89Å; I227-Y264 HydrophobicContact CD1-CE2 3.86Å; I227-A277 PolarHBondContact O-N 2.98Å
228	A	94.2	Very high	89.7	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	160.4	-177.9	0	0	0	0	0	112.3	V169 F237 I274 I275	V169-A228 HydrophobicContact CG1-CB 3.94Å; V169-A228 HydrophobicContact CG2-CB 3.9Å; A228-F237 PolarHBondContact O-N 3.14Å; A228-I274 HydrophobicContact CB-CG2 4.11Å; A228-I275 CarbonylContact C-O 3.56Å; A228-I275 WeakPolarHBondContact CA-O 3.36Å
229	Y	96	Very high	89.9	Confident	37 Å²	37	23 Å²	23	15%	0.145	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.1	167.7	171.7	-96	0	0	0	109.7	V182 N231 I235 L236 L252 I274 I275	V182-Y229 HydrophobicContact CB-CG 4.46Å; V182-Y229 HydrophobicContact CG1-CD1 3.81Å; V182-Y229 HydrophobicContact CG1-CD2 3.81Å; V182-Y229 HydrophobicContact CG1-CE1 3.71Å; V182-Y229 HydrophobicContact CG1-CE2 3.7Å; V182-Y229 HydrophobicContact CG1-CG 3.84Å; V182-Y229 HydrophobicContact CG2-CD1 4.14Å; V182-Y229 HydrophobicContact CG2-CD2 4.08Å; V182-Y229 HydrophobicContact CG2-CG 3.7Å; Y229-N231 HydrophobicContact CE1-CB 4.26Å; Y229-I235 CarbonylContact C-O 3.22Å; Y229-I235 WeakPolarHBondContact CA-O 3.45Å; Y229-L236 HydrophobicContact CD2-CB 4.35Å; Y229-L236 HydrophobicContact CD2-CD1 4.36Å; Y229-L252 HydrophobicContact CD2-CD2 4.47Å; Y229-L252 HydrophobicContact CE2-CD2 3.97Å; Y229-I274 WeakPolarHBondContact O-CA 3.43Å; Y229-I275 HydrophobicContact CD1-CD1 4.05Å; Y229-I275 HydrophobicContact CD1-CG1 4.44Å; Y229-I275 PolarHBondContact N-O 2.81Å; Y229-I275 PolarHBondContact O-N 2.86Å
230	T	95.2	Very high	89.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.2	-178.5	58.8	0	0	0	0	112	G234 I235 F237 L268 S271 I274	T230-G234 WeakPolarHBondContact O-CA 3.25Å; T230-G234 PolarHBondContact O-N 2.68Å; T230-I235 PolarHBondContact N-O 3.19Å; T230-I235 PolarHBondContact O-N 2.83Å; T230-I235 WeakPolarHBondContact OG1-CB 3.47Å; T230-I235 PolarHBondContact OG1-N 3.24Å; T230-I235 PolarHBondContact OG1-O 3.14Å; T230-F237 HydrophobicContact CG2-CD2 4.32Å; T230-F237 HydrophobicContact CG2-CE2 4.01Å; T230-L268 HydrophobicContact CG2-CD2 3.74Å; T230-S271 VanDerWaalsContact CB-OG 3.27Å; T230-S271 WeakPolarHBondContact CB-OG 3.45Å; T230-I274 HydrophobicContact CG2-CG1 4.38Å
231	N	91.3	Very high	89.5	Confident	62 Å²	62	28.7 Å²	28.7	33%	0.332	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.6	175.6	-175.8	31.5	0	0	0	108.8	Y229 S271 T272 E273	Y229-N231 HydrophobicContact CE1-CB 4.26Å; N231-S271 PolarHBondContact N-OG 2.57Å; N231-S271 PolarHBondContact O-OG 3Å; N231-T272 PolarHBondContact O-N 2.72Å; N231-T272 PolarHBondContact O-OG1 2.02Å; N231-T272 VanDerWaalsContact O-OG1 3.11Å; N231-E273 HydrophobicContact CB-CB 4.11Å; N231-E273 HydrophobicContact CB-CG 4.41Å; N231-E273 PolarHBondContact N-O 3.37Å; N231-E273 PolarHBondContact ND2-OE2 3.49Å; N231-E273 PolarHBondContact O-N 3.09Å
232	P	92.9	Very high	89.1	Confident	92 Å²	92	32 Å²	32	60%	0.597	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.7	5.1	5.4	37.8	-38.8	0	0	0	116	G234 T272	P232-G234 PolarHBondContact O-N 3.19Å; P232-G234 VanDerWaalsContact O-N 3.11Å; P232-T272 VanDerWaalsContact CD-OG1 3.26Å; P232-T272 WeakPolarHBondContact CD-OG1 3.32Å
233	L	93.9	Very high	88.3	Confident	79 Å²	79	29.4 Å²	29.4	41%	0.414	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.8	-175.7	-60.6	179.3	0	0	0	113.4	I235 T267	L233-I235 VanDerWaalsContact C-N 3.31Å; L233-I235 HydrophobicContact CB-CD1 3.99Å; L233-I235 HydrophobicContact CB-CG1 4.15Å; L233-I235 PolarHBondContact O-N 3.14Å; L233-T267 HydrophobicContact CD1-CG2 3.7Å
234	G	94.9	Very high	87.2	Confident	22 Å²	22	30.4 Å²	30.4	23%	0.227	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	29.4	176.9	0	0	0	0	0	112.8	T230 P232	T230-G234 WeakPolarHBondContact O-CA 3.25Å; T230-G234 PolarHBondContact O-N 2.68Å; P232-G234 PolarHBondContact O-N 3.19Å; P232-G234 VanDerWaalsContact O-N 3.11Å
235	I	96.2	Very high	86.8	Confident	14 Å²	14	31.1 Å²	31.1	7%	0.072	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.4	-173.7	-60.1	169.6	0	0	0	109.7	Y229 T230 L233 F237 M248 S249 K250 T267	Y229-I235 CarbonylContact C-O 3.22Å; Y229-I235 WeakPolarHBondContact CA-O 3.45Å; T230-I235 PolarHBondContact N-O 3.19Å; T230-I235 PolarHBondContact O-N 2.83Å; T230-I235 WeakPolarHBondContact OG1-CB 3.47Å; T230-I235 PolarHBondContact OG1-N 3.24Å; T230-I235 PolarHBondContact OG1-O 3.14Å; L233-I235 VanDerWaalsContact C-N 3.31Å; L233-I235 HydrophobicContact CB-CD1 3.99Å; L233-I235 HydrophobicContact CB-CG1 4.15Å; L233-I235 PolarHBondContact O-N 3.14Å; I235-F237 HydrophobicContact CB-CE2 4.46Å; I235-F237 HydrophobicContact CG2-CD2 4.22Å; I235-F237 HydrophobicContact CG2-CE1 4.19Å; I235-F237 HydrophobicContact CG2-CE2 3.81Å; I235-F237 HydrophobicContact CG2-CZ 3.79Å; I235-M248 HydrophobicContact CG2-CB 3.68Å; I235-M248 HydrophobicContact CG2-CG 4.28Å; I235-M248 HydrophobicContact CG2-SD 4.09Å; I235-S249 WeakPolarHBondContact CA-O 3.5Å; I235-K250 HydrophobicContact CG1-CG 4.28Å; I235-T267 HydrophobicContact CD1-CG2 3.59Å
236	L	95.6	Very high	86.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128	171.7	-174.6	71.1	0	0	0	109.4	L180 F187 I226 Y229 M248 S249 W256	L180-L236 HydrophobicContact CD2-CD1 3.49Å; L180-L236 VanDerWaalsContact CD2-CD1 3.49Å; F187-L236 HydrophobicContact CD1-CD2 4.09Å; F187-L236 HydrophobicContact CE1-CD2 3.48Å; F187-L236 VanDerWaalsContact CE1-CD2 3.48Å; F187-L236 HydrophobicContact CE2-CD1 4.38Å; F187-L236 HydrophobicContact CE2-CD2 4.25Å; F187-L236 HydrophobicContact CZ-CD2 3.58Å; I226-L236 HydrophobicContact CD1-CD2 4.03Å; I226-L236 HydrophobicContact CD1-CG 4.3Å; I226-L236 HydrophobicContact CG2-CD1 3.73Å; I226-L236 HydrophobicContact CG2-CG 4.3Å; Y229-L236 HydrophobicContact CD2-CB 4.35Å; Y229-L236 HydrophobicContact CD2-CD1 4.36Å; L236-M248 CarbonylContact O-C 3.39Å; L236-M248 WeakPolarHBondContact O-CA 3.47Å; L236-S249 PolarHBondContact N-O 3.45Å; L236-S249 PolarHBondContact O-N 3.28Å; L236-W256 HydrophobicContact CB-CH2 4.43Å; L236-W256 HydrophobicContact CD2-CH2 3.58Å; L236-W256 HydrophobicContact CD2-CZ2 3.89Å; L236-W256 HydrophobicContact CG-CH2 3.86Å
237	F	94.7	Very high	86.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.9	176.4	-75.3	-71.3	0	0	0	112	I227 A228 T230 I235 V247 M248 V259 Y264 T267 L268	I227-F237 HydrophobicContact CD1-CB 4.15Å; I227-F237 HydrophobicContact CG1-CB 3.77Å; I227-F237 WeakPolarHBondContact CG1-O 3.32Å; I227-F237 PolarHBondContact N-O 2.87Å; A228-F237 PolarHBondContact O-N 3.14Å; T230-F237 HydrophobicContact CG2-CD2 4.32Å; T230-F237 HydrophobicContact CG2-CE2 4.01Å; I235-F237 HydrophobicContact CB-CE2 4.46Å; I235-F237 HydrophobicContact CG2-CD2 4.22Å; I235-F237 HydrophobicContact CG2-CE1 4.19Å; I235-F237 HydrophobicContact CG2-CE2 3.81Å; I235-F237 HydrophobicContact CG2-CZ 3.79Å; F237-V247 WeakPolarHBondContact CA-O 3.44Å; F237-M248 HydrophobicContact CD1-CB 3.78Å; F237-M248 HydrophobicContact CE1-CB 3.61Å; F237-M248 HydrophobicContact CZ-CB 4.42Å; F237-V259 HydrophobicContact CE1-CG2 4.19Å; F237-Y264 HydrophobicContact CB-CE2 4.25Å; F237-Y264 AromaticContact CD1-CD2 3.58Å; F237-Y264 HydrophobicContact CD1-CD2 3.58Å; F237-Y264 AromaticContact CD1-CE2 3.96Å; F237-Y264 HydrophobicContact CD1-CE2 3.96Å; F237-Y264 HydrophobicContact CD2-CD2 4.43Å; F237-Y264 HydrophobicContact CD2-CE2 4.31Å; F237-Y264 AromaticContact CE1-CD2 3.63Å; F237-Y264 HydrophobicContact CE1-CD2 3.63Å; F237-Y264 HydrophobicContact CE1-CE2 4.37Å; F237-Y264 HydrophobicContact CE2-CD2 4.47Å; F237-Y264 AromaticContact CG-CD2 4Å; F237-Y264 HydrophobicContact CG-CD2 4Å; F237-Y264 AromaticContact CG-CE2 3.92Å; F237-Y264 HydrophobicContact CG-CE2 3.92Å; F237-Y264 HydrophobicContact CZ-CD2 4.08Å; F237-T267 HydrophobicContact CE2-CG2 3.83Å; F237-T267 HydrophobicContact CZ-CG2 3.69Å; F237-L268 HydrophobicContact CD2-CD2 4.18Å; F237-L268 HydrophobicContact CE2-CD2 4.05Å
238	G	92.2	Very high	86.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	174.5	173.5	0	0	0	0	0	112.7	Q225 V247	Q225-G238 CarbonylContact O-C 3.56Å; Q225-G238 WeakPolarHBondContact O-CA 3.23Å; G238-V247 PolarHBondContact N-O 2.82Å; G238-V247 WeakPolarHBondContact O-CG2 2.85Å; G238-V247 PolarHBondContact O-N 2.86Å
239	L	88	Confident	86.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144	175.7	-63.6	176.3	0	0	0	109.9	Y161 M164 V223 E224 Q225 I227	Y161-L239 HydrophobicContact CD2-CD1 4.14Å; Y161-L239 HydrophobicContact CE2-CD1 3.64Å; M164-L239 HydrophobicContact CE-CD2 3.38Å; M164-L239 HydrophobicContact SD-CD2 3.58Å; M164-L239 VanDerWaalsContact SD-CD2 3.58Å; V223-L239 WeakPolarHBondContact CA-O 3.32Å; E224-L239 HydrophobicContact CG-CB 4.19Å; E224-L239 WeakPolarHBondContact CG-O 3.45Å; E224-L239 PolarHBondContact N-O 3.16Å; Q225-L239 HydrophobicContact CB-CB 4.41Å; Q225-L239 PolarHBondContact O-N 3.03Å; I227-L239 HydrophobicContact CD1-CD2 4.31Å; I227-L239 HydrophobicContact CD1-CG 4.41Å; I227-L239 HydrophobicContact CG2-CD1 3.92Å; I227-L239 HydrophobicContact CG2-CG 3.89Å
240	R	81.4	Confident	86.5	Confident	101 Å²	101	37.7 Å²	37.7	38%	0.381	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	148.8	176.9	-71.3	-178.5	66.7	171.5	-2.1	112.6	S222 E224 G244 G245 V247 S258	S222-R240 WeakPolarHBondContact O-CA 3.4Å; E224-R240 VanDerWaalsContact CD-O 3.24Å; R240-G244 PolarHBondContact O-N 3.17Å; R240-G245 PolarHBondContact N-O 2.96Å; R240-V247 HydrophobicContact CG-CB 4.45Å; R240-V247 HydrophobicContact CG-CG1 3.4Å; R240-V247 HydrophobicContact CG-CG2 4.28Å; R240-S258 PolarHBondContact NH1-OG 3.4Å
241	S	75.5	Confident	86.4	Confident	40 Å²	40	40 Å²	40	28%	0.28	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-53.1	153.3	174.4	-48.3	0	0	0	0	113.5	P221 S222 E224 G243 G244	P221-S241 PolarHBondContact O-OG 3.11Å; S222-S241 PolarHBondContact O-N 2.92Å; E224-S241 VanDerWaalsContact OE2-CA 3.28Å; E224-S241 WeakPolarHBondContact OE2-CA 3.25Å; S241-G243 PolarHBondContact O-N 2.92Å; S241-G243 VanDerWaalsContact O-N 3.1Å; S241-G244 PolarHBondContact O-N 2.94Å
242	N	65.2	Low	86.4	Confident	158 Å²	158	40 Å²	40	85%	0.845	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	57.4	22.9	178.7	-61.8	-17.9	0	0	0	113.7
243	G	59.9	Low	86.3	Confident	6 Å²	6	35.7 Å²	35.7	6%	0.062	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	75.4	28.5	179	0	0	0	0	0	117.8	S241	S241-G243 PolarHBondContact O-N 2.92Å; S241-G243 VanDerWaalsContact O-N 3.1Å
244	G	66	Low	86.1	Confident	22 Å²	22	37.4 Å²	37.4	23%	0.227	21%	0.205	C	C	.	.			trans	-58.3	166.9	160.9	0	0	0	0	0	112.4	R240 S241	R240-G244 PolarHBondContact O-N 3.17Å; S241-G244 PolarHBondContact O-N 2.94Å
245	G	76.8	Confident	85.9	Confident	20 Å²	20	40.3 Å²	40.3	21%	0.206	22%	0.219	C	C	.	.			trans	-72.8	-169.7	-179.3	0	0	0	0	0	114.2	R240	R240-G245 PolarHBondContact N-O 2.96Å
246	A	85.4	Confident	85.6	Confident	2 Å²	2	42.2 Å²	42.2	2%	0.017	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	142.1	175.5	0	0	0	0	0	111.5	M164 S258 V259 Y264	M164-A246 HydrophobicContact CE-CB 3.23Å; M164-A246 HydrophobicContact CG-CB 4.4Å; M164-A246 HydrophobicContact SD-CB 3.54Å; M164-A246 VanDerWaalsContact SD-CB 3.54Å; M164-A246 PolarHBondContact SD-N 3.38Å; A246-S258 WeakPolarHBondContact O-CA 3.14Å; A246-V259 HydrophobicContact CB-CG2 3.51Å; A246-V259 PolarHBondContact O-N 3.12Å; A246-Y264 HydrophobicContact CB-CD2 4.32Å
247	V	90.1	Very high	85.3	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.024	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.8	160.8	-74.9	0	0	0	0	109.5	V223 F237 G238 R240 W256 I257	V223-V247 HydrophobicContact CG2-CG2 4.2Å; F237-V247 WeakPolarHBondContact CA-O 3.44Å; G238-V247 PolarHBondContact N-O 2.82Å; G238-V247 WeakPolarHBondContact O-CG2 2.85Å; G238-V247 PolarHBondContact O-N 2.86Å; R240-V247 HydrophobicContact CG-CB 4.45Å; R240-V247 HydrophobicContact CG-CG1 3.4Å; R240-V247 HydrophobicContact CG-CG2 4.28Å; V247-W256 HydrophobicContact CB-CB 4.46Å; V247-W256 HydrophobicContact CB-CE3 3.72Å; V247-W256 HydrophobicContact CB-CZ3 4.39Å; V247-W256 HydrophobicContact CG2-CD2 4.22Å; V247-W256 HydrophobicContact CG2-CE3 3.48Å; V247-W256 VanDerWaalsContact CG2-CE3 3.48Å; V247-W256 HydrophobicContact CG2-CZ3 3.86Å; V247-I257 CarbonylContact C-O 3.52Å; V247-I257 VanDerWaalsContact CA-O 3.22Å; V247-I257 WeakPolarHBondContact CA-O 3.36Å
248	M	92.4	Very high	84.9	Confident	22 Å²	22	50 Å²	50	11%	0.108	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.4	172.3	79.1	175	176.5	0	0	110.7	I235 L236 F237 I257 V259	I235-M248 HydrophobicContact CG2-CB 3.68Å; I235-M248 HydrophobicContact CG2-CG 4.28Å; I235-M248 HydrophobicContact CG2-SD 4.09Å; L236-M248 CarbonylContact O-C 3.39Å; L236-M248 WeakPolarHBondContact O-CA 3.47Å; F237-M248 HydrophobicContact CD1-CB 3.78Å; F237-M248 HydrophobicContact CE1-CB 3.61Å; F237-M248 HydrophobicContact CZ-CB 4.42Å; M248-I257 HydrophobicContact CG-CB 4.48Å; M248-I257 PolarHBondContact N-O 3.34Å; M248-I257 PolarHBondContact O-N 3.26Å; M248-V259 HydrophobicContact CB-CG1 4.34Å; M248-V259 HydrophobicContact CE-CG1 3.84Å; M248-V259 HydrophobicContact CG-CG1 3.7Å; M248-V259 HydrophobicContact SD-CG1 3.76Å
249	S	94.7	Very high	84.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.4	172.6	167.8	0	0	0	0	108.8	I235 L236 D251 L252 G253 T255	I235-S249 WeakPolarHBondContact CA-O 3.5Å; L236-S249 PolarHBondContact N-O 3.45Å; L236-S249 PolarHBondContact O-N 3.28Å; S249-D251 PolarHBondContact OG-N 2.75Å; S249-D251 PolarHBondContact OG-OD1 2.9Å; S249-L252 PolarHBondContact OG-N 3.1Å; S249-G253 WeakPolarHBondContact OG-CA 3.5Å; S249-G253 PolarHBondContact OG-N 2.94Å; S249-T255 WeakPolarHBondContact CA-O 3.17Å; S249-T255 WeakPolarHBondContact CB-O 3.16Å; S249-T255 PolarHBondContact OG-O 3.38Å
250	K	93.9	Very high	84.1	Confident	146 Å²	146	55.4 Å²	55.4	64%	0.635	30%	0.301	S	S	*	.	S	Bend	trans	-102.2	2.3	174.5	-66.5	-175.8	175.5	-175.9	0	112.6	I235	I235-K250 HydrophobicContact CG1-CG 4.28Å
251	D	92.6	Very high	84.1	Confident	50 Å²	50	53 Å²	53	27%	0.267	30%	0.299	S	S	.	.	S	Bend	trans	-132.8	33.5	-172.4	61	7.7	0	0	0	111.4	S249 G253 N254 T255	S249-D251 PolarHBondContact OG-N 2.75Å; S249-D251 PolarHBondContact OG-OD1 2.9Å; D251-G253 VanDerWaalsContact C-N 3.28Å; D251-G253 PolarHBondContact O-N 3.2Å; D251-N254 HydrophobicContact CB-CB 4.39Å; D251-N254 PolarHBondContact O-N 3.21Å; D251-N254 PolarHBondContact O-ND2 2.81Å; D251-N254 PolarHBondContact OD1-N 2.9Å; D251-N254 VanDerWaalsContact OD1-N 3.11Å; D251-T255 VanDerWaalsContact CG-OG1 3.29Å; D251-T255 PolarHBondContact OD1-N 2.86Å; D251-T255 PolarHBondContact OD1-OG1 3.09Å; D251-T255 VanDerWaalsContact OD2-CB 3.31Å; D251-T255 WeakPolarHBondContact OD2-CB 3.32Å; D251-T255 WeakPolarHBondContact OD2-CG2 3.19Å; D251-T255 PolarHBondContact OD2-N 2.84Å; D251-T255 VanDerWaalsContact OD2-N 3.12Å; D251-T255 PolarHBondContact OD2-OG1 3.29Å
252	L	91.9	Very high	84.4	Confident	61 Å²	61	57.9 Å²	57.9	32%	0.319	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	41.6	175.8	-59.6	171.6	0	0	0	113.3	V182 L185 F187 K207 Y229 S249	V182-L252 HydrophobicContact CG1-CD2 3.95Å; L185-L252 HydrophobicContact CD1-CB 4.09Å; L185-L252 HydrophobicContact CD1-CD1 3.94Å; F187-L252 HydrophobicContact CZ-CB 4.36Å; K207-L252 WeakPolarHBondContact CD-O 3.28Å; K207-L252 PolarHBondContact NZ-O 3Å; Y229-L252 HydrophobicContact CD2-CD2 4.47Å; Y229-L252 HydrophobicContact CE2-CD2 3.97Å; S249-L252 PolarHBondContact OG-N 3.1Å
253	G	91.1	Very high	85.3	Confident	2 Å²	2	52.8 Å²	52.8	2%	0.021	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	16.2	172	0	0	0	0	0	115.5	S249 D251 W256	S249-G253 WeakPolarHBondContact OG-CA 3.5Å; S249-G253 PolarHBondContact OG-N 2.94Å; D251-G253 VanDerWaalsContact C-N 3.28Å; D251-G253 PolarHBondContact O-N 3.2Å; G253-W256 PolarHBondContact O-NE1 2.9Å
254	N	89	Confident	86.6	Confident	115 Å²	115	52.5 Å²	52.5	62%	0.615	29%	0.287	S	S	*	.	S	Bend	trans	-77.4	-39.6	171.6	-62.8	-29.4	0	0	0	111.1	K207 D251	K207-N254 PolarHBondContact NZ-OD1 2.87Å; D251-N254 HydrophobicContact CB-CB 4.39Å; D251-N254 PolarHBondContact O-N 3.21Å; D251-N254 PolarHBondContact O-ND2 2.81Å; D251-N254 PolarHBondContact OD1-N 2.9Å; D251-N254 VanDerWaalsContact OD1-N 3.11Å
255	T	90.5	Very high	87.7	Confident	82 Å²	82	53.7 Å²	53.7	50%	0.503	29%	0.287	S	S	.	.	S	Bend	trans	-128.9	150.4	174.6	67.7	0	0	0	0	111.4	S249 D251	S249-T255 WeakPolarHBondContact CA-O 3.17Å; S249-T255 WeakPolarHBondContact CB-O 3.16Å; S249-T255 PolarHBondContact OG-O 3.38Å; D251-T255 VanDerWaalsContact CG-OG1 3.29Å; D251-T255 PolarHBondContact OD1-N 2.86Å; D251-T255 PolarHBondContact OD1-OG1 3.09Å; D251-T255 VanDerWaalsContact OD2-CB 3.31Å; D251-T255 WeakPolarHBondContact OD2-CB 3.32Å; D251-T255 WeakPolarHBondContact OD2-CG2 3.19Å; D251-T255 PolarHBondContact OD2-N 2.84Å; D251-T255 VanDerWaalsContact OD2-N 3.12Å; D251-T255 PolarHBondContact OD2-OG1 3.29Å
256	W	91.5	Very high	88.4	Confident	55 Å²	55	58.6 Å²	58.6	21%	0.208	30%	0.303	C	S	.	.			trans	-131.7	132.1	-174.5	-69.3	96.5	0	0	0	111.3	V219 V223 I226 L236 V247 G253	V219-W256 HydrophobicContact CG1-CZ2 3.35Å; V219-W256 PolarHBondContact O-NE1 3.47Å; V223-W256 HydrophobicContact CG1-CZ2 4.41Å; V223-W256 HydrophobicContact CG2-CD2 3.67Å; V223-W256 HydrophobicContact CG2-CE3 4.29Å; V223-W256 HydrophobicContact CG2-CG 3.86Å; V223-W256 HydrophobicContact CG2-CZ2 4.12Å; I226-W256 HydrophobicContact CD1-CH2 3.32Å; I226-W256 HydrophobicContact CD1-CZ2 3.66Å; I226-W256 HydrophobicContact CD1-CZ3 4.39Å; L236-W256 HydrophobicContact CB-CH2 4.43Å; L236-W256 HydrophobicContact CD2-CH2 3.58Å; L236-W256 HydrophobicContact CD2-CZ2 3.89Å; L236-W256 HydrophobicContact CG-CH2 3.86Å; V247-W256 HydrophobicContact CB-CB 4.46Å; V247-W256 HydrophobicContact CB-CE3 3.72Å; V247-W256 HydrophobicContact CB-CZ3 4.39Å; V247-W256 HydrophobicContact CG2-CD2 4.22Å; V247-W256 HydrophobicContact CG2-CE3 3.48Å; V247-W256 VanDerWaalsContact CG2-CE3 3.48Å; V247-W256 HydrophobicContact CG2-CZ3 3.86Å; G253-W256 PolarHBondContact O-NE1 2.9Å
257	I	88.2	Confident	88.7	Confident	94 Å²	94	59.3 Å²	59.3	48%	0.482	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.8	177.3	-58.1	169.8	0	0	0	108.1	V247 M248	V247-I257 CarbonylContact C-O 3.52Å; V247-I257 VanDerWaalsContact CA-O 3.22Å; V247-I257 WeakPolarHBondContact CA-O 3.36Å; M248-I257 HydrophobicContact CG-CB 4.48Å; M248-I257 PolarHBondContact N-O 3.34Å; M248-I257 PolarHBondContact O-N 3.26Å
258	S	87.7	Confident	88.8	Confident	68 Å²	68	59.2 Å²	59.2	48%	0.476	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.1	172.9	-63	0	0	0	0	110.1	R240 A246	R240-S258 PolarHBondContact NH1-OG 3.4Å; A246-S258 WeakPolarHBondContact O-CA 3.14Å
259	V	83.1	Confident	88.8	Confident	20 Å²	20	62.7 Å²	62.7	12%	0.121	33%	0.325	C	S	.	.			trans	-127.8	150.4	178.8	-60.3	0	0	0	0	110.7	F237 A246 M248 V263	F237-V259 HydrophobicContact CE1-CG2 4.19Å; A246-V259 HydrophobicContact CB-CG2 3.51Å; A246-V259 PolarHBondContact O-N 3.12Å; M248-V259 HydrophobicContact CB-CG1 4.34Å; M248-V259 HydrophobicContact CE-CG1 3.84Å; M248-V259 HydrophobicContact CG-CG1 3.7Å; M248-V259 HydrophobicContact SD-CG1 3.76Å; V259-V263 HydrophobicContact CB-CB 4.26Å; V259-V263 HydrophobicContact CB-CG1 4.15Å; V259-V263 HydrophobicContact CG1-CG1 4.12Å
260	N	79.5	Confident	88.7	Confident	95 Å²	95	66.7 Å²	66.7	51%	0.508	35%	0.349	S	S	.	.			trans	-82.7	170	173.8	65.4	29.9	0	0	0	110.9	F262 V263 Y264	N260-F262 VanDerWaalsContact C-N 3.27Å; N260-F262 PolarHBondContact O-N 2.87Å; N260-F262 WeakPolarHBondContact OD1-CB 3.35Å; N260-F262 PolarHBondContact OD1-N 3Å; N260-V263 PolarHBondContact O-N 2.87Å; N260-V263 WeakPolarHBondContact OD1-CG2 3.34Å; N260-V263 PolarHBondContact OD1-N 3.11Å; N260-Y264 WeakPolarHBondContact O-CB 3.25Å; N260-Y264 PolarHBondContact O-N 2.83Å; N260-Y264 VanDerWaalsContact O-N 3.11Å
261	S	81	Confident	88.6	Confident	50 Å²	50	60.4 Å²	60.4	35%	0.35	32%	0.324	S	S	.	.	H	α-helix	trans	-57.9	-38.7	179	52.2	0	0	0	0	112.4	A163 Y264 Q265	A163-S261 VanDerWaalsContact O-CB 3.27Å; A163-S261 WeakPolarHBondContact O-CB 3.35Å; S261-Y264 WeakPolarHBondContact O-CB 3.34Å; S261-Y264 PolarHBondContact O-N 3.45Å; S261-Q265 VanDerWaalsContact O-CB 3.31Å; S261-Q265 WeakPolarHBondContact O-CB 3.45Å; S261-Q265 WeakPolarHBondContact O-CG 3.38Å; S261-Q265 PolarHBondContact O-N 2.78Å
262	F	81.6	Confident	88.6	Confident	142 Å²	142	64 Å²	64	62%	0.623	35%	0.348	S	S	*	.	H	α-helix	trans	-60.5	-50	179.9	176.8	-96.5	0	0	0	112.6	N260 Y264 Q265 K266	N260-F262 VanDerWaalsContact C-N 3.27Å; N260-F262 PolarHBondContact O-N 2.87Å; N260-F262 WeakPolarHBondContact OD1-CB 3.35Å; N260-F262 PolarHBondContact OD1-N 3Å; F262-Y264 VanDerWaalsContact C-N 3.34Å; F262-Y264 PolarHBondContact O-N 2.8Å; F262-Q265 PolarHBondContact O-N 2.77Å; F262-K266 HydrophobicContact CE1-CD 4.22Å; F262-K266 HydrophobicContact CZ-CD 4.35Å; F262-K266 VanDerWaalsContact O-CB 3.26Å; F262-K266 WeakPolarHBondContact O-CB 3.19Å; F262-K266 PolarHBondContact O-N 2.95Å
263	V	84	Confident	88.6	Confident	52 Å²	52	65.6 Å²	65.6	32%	0.315	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-42.3	178.4	172.6	0	0	0	0	110.8	V259 N260 T267	V259-V263 HydrophobicContact CB-CB 4.26Å; V259-V263 HydrophobicContact CB-CG1 4.15Å; V259-V263 HydrophobicContact CG1-CG1 4.12Å; N260-V263 PolarHBondContact O-N 2.87Å; N260-V263 WeakPolarHBondContact OD1-CG2 3.34Å; N260-V263 PolarHBondContact OD1-N 3.11Å; V263-T267 WeakPolarHBondContact O-CB 3.25Å; V263-T267 PolarHBondContact O-N 2.89Å; V263-T267 PolarHBondContact O-OG1 2.71Å
264	Y	88.6	Confident	88.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-57.3	-54.9	175.5	172.8	-97.8	0	0	0	111.8	M164 N166 I227 F237 A246 N260 S261 F262 K266 T267 L268	M164-Y264 HydrophobicContact CB-CD1 4.44Å; M164-Y264 HydrophobicContact CB-CE1 4.2Å; M164-Y264 HydrophobicContact CE-CD2 4.02Å; M164-Y264 HydrophobicContact CE-CE1 4.44Å; M164-Y264 HydrophobicContact CE-CE2 3.85Å; M164-Y264 HydrophobicContact CE-CG 4.38Å; M164-Y264 HydrophobicContact CG-CD1 4.43Å; M164-Y264 WeakPolarHBondContact O-CE1 3.2Å; N166-Y264 HydrophobicContact CB-CE1 4.28Å; I227-Y264 HydrophobicContact CD1-CE2 3.86Å; F237-Y264 HydrophobicContact CB-CE2 4.25Å; F237-Y264 AromaticContact CD1-CD2 3.58Å; F237-Y264 HydrophobicContact CD1-CD2 3.58Å; F237-Y264 AromaticContact CD1-CE2 3.96Å; F237-Y264 HydrophobicContact CD1-CE2 3.96Å; F237-Y264 HydrophobicContact CD2-CD2 4.43Å; F237-Y264 HydrophobicContact CD2-CE2 4.31Å; F237-Y264 AromaticContact CE1-CD2 3.63Å; F237-Y264 HydrophobicContact CE1-CD2 3.63Å; F237-Y264 HydrophobicContact CE1-CE2 4.37Å; F237-Y264 HydrophobicContact CE2-CD2 4.47Å; F237-Y264 AromaticContact CG-CD2 4Å; F237-Y264 HydrophobicContact CG-CD2 4Å; F237-Y264 AromaticContact CG-CE2 3.92Å; F237-Y264 HydrophobicContact CG-CE2 3.92Å; F237-Y264 HydrophobicContact CZ-CD2 4.08Å; A246-Y264 HydrophobicContact CB-CD2 4.32Å; N260-Y264 WeakPolarHBondContact O-CB 3.25Å; N260-Y264 PolarHBondContact O-N 2.83Å; N260-Y264 VanDerWaalsContact O-N 3.11Å; S261-Y264 WeakPolarHBondContact O-CB 3.34Å; S261-Y264 PolarHBondContact O-N 3.45Å; F262-Y264 VanDerWaalsContact C-N 3.34Å; F262-Y264 PolarHBondContact O-N 2.8Å; Y264-K266 PolarHBondContact O-N 3.15Å; Y264-T267 PolarHBondContact O-N 2.72Å; Y264-L268 HydrophobicContact CD1-CD1 4.16Å; Y264-L268 HydrophobicContact CE1-CD1 3.49Å; Y264-L268 VanDerWaalsContact CE1-CD1 3.49Å; Y264-L268 HydrophobicContact CE2-CD1 3.92Å; Y264-L268 HydrophobicContact CE2-CG 4.42Å; Y264-L268 PolarHBondContact O-N 2.68Å
265	Q	88.5	Confident	88.9	Confident	47 Å²	47	64.7 Å²	64.7	22%	0.22	35%	0.347	C	S	.	.	H	α-helix	trans	-60.9	-47.7	-179.2	-66.1	-77.9	-3.1	0	0	111.3	A163 Q165 N166 S261 F262 T267 L268 N269	A163-Q265 PolarHBondContact O-NE2 2.84Å; Q165-Q265 PolarHBondContact O-NE2 3.21Å; N166-Q265 PolarHBondContact ND2-OE1 2.71Å; S261-Q265 VanDerWaalsContact O-CB 3.31Å; S261-Q265 WeakPolarHBondContact O-CB 3.45Å; S261-Q265 WeakPolarHBondContact O-CG 3.38Å; S261-Q265 PolarHBondContact O-N 2.78Å; F262-Q265 PolarHBondContact O-N 2.77Å; Q265-T267 VanDerWaalsContact C-N 3.3Å; Q265-T267 PolarHBondContact O-N 2.96Å; Q265-L268 PolarHBondContact O-N 2.91Å; Q265-N269 WeakPolarHBondContact O-CB 3.31Å; Q265-N269 PolarHBondContact O-N 3.44Å; Q265-N269 PolarHBondContact O-ND2 3.13Å; Q265-N269 PolarHBondContact O-OD1 3.49Å
266	K	90.7	Very high	88.9	Confident	123 Å²	123	63.9 Å²	63.9	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-57.4	-46.1	177.9	-177.5	177.8	178.2	-179.9	0	111	F262 Y264 N269 T270	F262-K266 HydrophobicContact CE1-CD 4.22Å; F262-K266 HydrophobicContact CZ-CD 4.35Å; F262-K266 VanDerWaalsContact O-CB 3.26Å; F262-K266 WeakPolarHBondContact O-CB 3.19Å; F262-K266 PolarHBondContact O-N 2.95Å; Y264-K266 PolarHBondContact O-N 3.15Å; K266-N269 PolarHBondContact O-N 3.29Å; K266-T270 HydrophobicContact CG-CG2 4.47Å; K266-T270 WeakPolarHBondContact O-CB 3.22Å; K266-T270 VanDerWaalsContact O-CG2 3.29Å; K266-T270 WeakPolarHBondContact O-CG2 3.17Å; K266-T270 PolarHBondContact O-N 2.82Å; K266-T270 PolarHBondContact O-OG1 2.91Å
267	T	91.8	Very high	88.8	Confident	17 Å²	17	62 Å²	62	10%	0.104	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-47.2	-178.9	-56	0	0	0	0	111.7	L233 I235 F237 V263 Y264 Q265 T270 S271	L233-T267 HydrophobicContact CD1-CG2 3.7Å; I235-T267 HydrophobicContact CD1-CG2 3.59Å; F237-T267 HydrophobicContact CE2-CG2 3.83Å; F237-T267 HydrophobicContact CZ-CG2 3.69Å; V263-T267 WeakPolarHBondContact O-CB 3.25Å; V263-T267 PolarHBondContact O-N 2.89Å; V263-T267 PolarHBondContact O-OG1 2.71Å; Y264-T267 PolarHBondContact O-N 2.72Å; Q265-T267 VanDerWaalsContact C-N 3.3Å; Q265-T267 PolarHBondContact O-N 2.96Å; T267-T270 WeakPolarHBondContact CA-OG1 3Å; T267-T270 PolarHBondContact O-N 2.79Å; T267-T270 PolarHBondContact O-OG1 2.82Å; T267-S271 PolarHBondContact O-N 3.23Å; T267-S271 VanDerWaalsContact O-N 3.17Å
268	L	92.7	Very high	88.5	Confident	1 Å²	1	60 Å²	60	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-60.8	-47.9	176.8	-68.7	-177.9	0	0	0	111.3	N166 V169 T230 F237 Y264 Q265 T270 S271 I274	N166-L268 HydrophobicContact CB-CD1 3.98Å; V169-L268 HydrophobicContact CB-CD1 4.06Å; V169-L268 HydrophobicContact CG2-CD1 3.58Å; V169-L268 HydrophobicContact CG2-CD2 3.76Å; V169-L268 HydrophobicContact CG2-CG 4.31Å; T230-L268 HydrophobicContact CG2-CD2 3.74Å; F237-L268 HydrophobicContact CD2-CD2 4.18Å; F237-L268 HydrophobicContact CE2-CD2 4.05Å; Y264-L268 HydrophobicContact CD1-CD1 4.16Å; Y264-L268 HydrophobicContact CE1-CD1 3.49Å; Y264-L268 VanDerWaalsContact CE1-CD1 3.49Å; Y264-L268 HydrophobicContact CE2-CD1 3.92Å; Y264-L268 HydrophobicContact CE2-CG 4.42Å; Y264-L268 PolarHBondContact O-N 2.68Å; Q265-L268 PolarHBondContact O-N 2.91Å; L268-T270 PolarHBondContact O-N 2.63Å; L268-S271 WeakPolarHBondContact O-CB 3.01Å; L268-S271 PolarHBondContact O-N 2.72Å; L268-I274 HydrophobicContact CB-CD1 4.21Å; L268-I274 HydrophobicContact CD2-CD1 4.14Å; L268-I274 HydrophobicContact CD2-CG1 4.4Å; L268-I274 HydrophobicContact CD2-CG2 4.18Å
269	N	91.7	Very high	87.9	Confident	95 Å²	95	59.5 Å²	59.5	51%	0.508	33%	0.327	S	S	.	.	H	α-helix	trans	-65.7	-25.2	-178.2	-64.4	-11.4	0	0	0	113.2	N166 F168 Q265 K266	N166-N269 PolarHBondContact ND2-OD1 3.21Å; F168-N269 WeakPolarHBondContact CE2-OD1 2.96Å; Q265-N269 WeakPolarHBondContact O-CB 3.31Å; Q265-N269 PolarHBondContact O-N 3.44Å; Q265-N269 PolarHBondContact O-ND2 3.13Å; Q265-N269 PolarHBondContact O-OD1 3.49Å; K266-N269 PolarHBondContact O-N 3.29Å
270	T	92.9	Very high	87	Confident	85 Å²	85	59.6 Å²	59.6	52%	0.521	33%	0.326	S	S	.	.	H	α-helix	trans	-86.3	-12.9	174.9	53.1	0	0	0	0	114	K266 T267 L268	K266-T270 HydrophobicContact CG-CG2 4.47Å; K266-T270 WeakPolarHBondContact O-CB 3.22Å; K266-T270 VanDerWaalsContact O-CG2 3.29Å; K266-T270 WeakPolarHBondContact O-CG2 3.17Å; K266-T270 PolarHBondContact O-N 2.82Å; K266-T270 PolarHBondContact O-OG1 2.91Å; T267-T270 WeakPolarHBondContact CA-OG1 3Å; T267-T270 PolarHBondContact O-N 2.79Å; T267-T270 PolarHBondContact O-OG1 2.82Å; L268-T270 PolarHBondContact O-N 2.63Å
271	S	92.9	Very high	85.7	Confident	15 Å²	15	57 Å²	57	11%	0.105	32%	0.315	C	S	.	.			trans	-78.8	137.7	-178.2	-161.7	0	0	0	0	110.6	T230 N231 T267 L268 E273	T230-S271 VanDerWaalsContact CB-OG 3.27Å; T230-S271 WeakPolarHBondContact CB-OG 3.45Å; N231-S271 PolarHBondContact N-OG 2.57Å; N231-S271 PolarHBondContact O-OG 3Å; T267-S271 PolarHBondContact O-N 3.23Å; T267-S271 VanDerWaalsContact O-N 3.17Å; L268-S271 WeakPolarHBondContact O-CB 3.01Å; L268-S271 PolarHBondContact O-N 2.72Å; S271-E273 PolarHBondContact OG-O 2.87Å
272	T	91.7	Very high	84.2	Confident	124 Å²	124	59.5 Å²	59.5	76%	0.761	32%	0.316	S	S	*	.	S	Bend	trans	-79.2	-29.3	176	53.7	0	0	0	0	112	N231 P232	N231-T272 PolarHBondContact O-N 2.72Å; N231-T272 PolarHBondContact O-OG1 2.02Å; N231-T272 VanDerWaalsContact O-OG1 3.11Å; P232-T272 VanDerWaalsContact CD-OG1 3.26Å; P232-T272 WeakPolarHBondContact CD-OG1 3.32Å
273	E	92.8	Very high	82.4	Confident	96 Å²	96	54.5 Å²	54.5	45%	0.449	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.7	177.2	174.9	-177.7	-160.7	0	0	110	N231 S271 I275	N231-E273 HydrophobicContact CB-CB 4.11Å; N231-E273 HydrophobicContact CB-CG 4.41Å; N231-E273 PolarHBondContact N-O 3.37Å; N231-E273 PolarHBondContact ND2-OE2 3.49Å; N231-E273 PolarHBondContact O-N 3.09Å; S271-E273 PolarHBondContact OG-O 2.87Å; E273-I275 HydrophobicContact CG-CG1 4.49Å
274	I	93.6	Very high	80.5	Confident	41 Å²	41	55.7 Å²	55.7	21%	0.21	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	116.6	178.9	-56.7	164.5	0	0	0	107.5	F168 V169 A228 Y229 T230 L268 T276	F168-I274 HydrophobicContact CB-CD1 3.56Å; F168-I274 HydrophobicContact CD2-CD1 4.4Å; F168-I274 HydrophobicContact CG-CD1 4.01Å; V169-I274 HydrophobicContact CG2-CG2 3.62Å; A228-I274 HydrophobicContact CB-CG2 4.11Å; Y229-I274 WeakPolarHBondContact O-CA 3.43Å; T230-I274 HydrophobicContact CG2-CG1 4.38Å; L268-I274 HydrophobicContact CB-CD1 4.21Å; L268-I274 HydrophobicContact CD2-CD1 4.14Å; L268-I274 HydrophobicContact CD2-CG1 4.4Å; L268-I274 HydrophobicContact CD2-CG2 4.18Å; I274-T276 HydrophobicContact CG2-CG2 4.24Å
275	I	91.8	Very high	78.3	Confident	56 Å²	56	58.8 Å²	58.8	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114	174.8	-50.1	179.1	0	0	0	107	L180 A228 Y229 E273	L180-I275 HydrophobicContact CD1-CB 4.29Å; L180-I275 HydrophobicContact CD1-CG2 3.74Å; L180-I275 WeakPolarHBondContact CD1-O 3.15Å; A228-I275 CarbonylContact C-O 3.56Å; A228-I275 WeakPolarHBondContact CA-O 3.36Å; Y229-I275 HydrophobicContact CD1-CD1 4.05Å; Y229-I275 HydrophobicContact CD1-CG1 4.44Å; Y229-I275 PolarHBondContact N-O 2.81Å; Y229-I275 PolarHBondContact O-N 2.86Å; E273-I275 HydrophobicContact CG-CG1 4.49Å
276	T	91.4	Very high	76	Confident	65 Å²	65	60.6 Å²	60.6	40%	0.399	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	149.6	-179	53.5	0	0	0	0	111.6	V169 L180 I274	V169-T276 HydrophobicContact CB-CG2 4.45Å; V169-T276 HydrophobicContact CG1-CG2 4.36Å; V169-T276 HydrophobicContact CG2-CG2 4.13Å; L180-T276 WeakPolarHBondContact CD1-O 3.31Å; I274-T276 HydrophobicContact CG2-CG2 4.24Å
277	A	89.1	Confident	73.8	Confident	15 Å²	15	57.6 Å²	57.6	12%	0.124	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-69.5	137	176.7	0	0	0	0	0	110.5	F179 L180 I226 I227	F179-A277 CarbonylContact O-C 3.37Å; F179-A277 WeakPolarHBondContact O-CA 3.4Å; L180-A277 HydrophobicContact CB-CB 4.16Å; L180-A277 HydrophobicContact CD1-CB 4.44Å; I226-A277 VanDerWaalsContact O-CB 3.23Å; I226-A277 WeakPolarHBondContact O-CB 3.32Å; I227-A277 PolarHBondContact O-N 2.98Å
278	S	82	Confident	71.7	Confident	54 Å²	54	62.1 Å²	62.1	38%	0.378	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	138.2	169.6	-66.4	0	0	0	0	110	T178 F179	T178-S278 CarbonylContact C-O 3.58Å; T178-S278 WeakPolarHBondContact CA-O 3.18Å; F179-S278 PolarHBondContact N-O 2.81Å; F179-S278 PolarHBondContact O-N 3.29Å
279	V	73.7	Confident	69.7	Low	56 Å²	56	65.2 Å²	65.2	34%	0.339	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	120	178	178	0	0	0	0	109.5	P172 A176	P172-V279 HydrophobicContact CB-CG2 3.39Å; A176-V279 HydrophobicContact CB-CG1 3.27Å
280	M	66	Low	68	Low	22 Å²	22	64 Å²	64	11%	0.108	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	124.8	166.2	-172.7	-178.2	87.7	0	0	109.2	N177 F179 V308	N177-M280 HydrophobicContact CB-CB 4.26Å; N177-M280 HydrophobicContact CB-CE 4.36Å; N177-M280 PolarHBondContact O-N 3.31Å; F179-M280 HydrophobicContact CD2-CB 4.04Å; F179-M280 HydrophobicContact CE2-CB 3.51Å; F179-M280 HydrophobicContact CE2-CG 4.36Å; F179-M280 HydrophobicContact CE2-SD 4.07Å; F179-M280 HydrophobicContact CZ-SD 4.29Å; M280-V308 HydrophobicContact CG-CG1 4.23Å; M280-V308 HydrophobicContact SD-CG1 3.27Å; M280-V308 WeakPolarHBondContact SD-CG1 3.18Å
281	P	52.2	Low	66.3	Low	41 Å²	41	65.9 Å²	65.9	27%	0.266	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-77.2	134.8	-177.1	38.4	-40.7	0	0	0	109.7	L16 I283	L16-P281 HydrophobicContact CB-CB 4.22Å; L16-P281 VanDerWaalsContact CD1-C 3.47Å; L16-P281 HydrophobicContact CD1-CB 3.31Å; L16-P281 HydrophobicContact CD1-CG 4.13Å; L16-P281 HydrophobicContact CD2-CB 3.17Å; L16-P281 HydrophobicContact CG-CB 3.56Å; P281-I283 PolarHBondContact O-N 2.86Å
282	W	49.2	Very low	64.6	Low	102 Å²	102	68.9 Å²	68.9	39%	0.386	41%	0.411	S	S	.	.			trans	-70.3	113.7	174.1	-86	80.4	0	0	0	112.9	L16 Q175 N177 R191	L16-W282 WeakPolarHBondContact CD1-O 3.11Å; L16-W282 WeakPolarHBondContact CG-O 3.25Å; Q175-W282 PolarHBondContact O-NE1 2.74Å; N177-W282 PolarHBondContact OD1-NE1 2.74Å; R191-W282 HydrophobicContact CB-CH2 4.45Å; R191-W282 HydrophobicContact CB-CZ2 4.45Å; R191-W282 HydrophobicContact CG-CH2 4.3Å; R191-W282 HydrophobicContact CG-CZ2 4.07Å; R191-W282 VanDerWaalsContact NH1-CZ2 3.32Å
283	I	44.4	Very low	62.7	Low	38 Å²	38	63.8 Å²	63.8	20%	0.195	38%	0.379	C	S	.	.			trans	-108.2	117	177.1	46.9	-166	0	0	0	110.3	F14 L16 P281 I310	F14-I283 HydrophobicContact CB-CG2 4.17Å; F14-I283 HydrophobicContact CD1-CB 3.56Å; F14-I283 HydrophobicContact CD1-CG2 3.56Å; F14-I283 HydrophobicContact CE1-CB 3.99Å; F14-I283 HydrophobicContact CE1-CG2 4.27Å; F14-I283 HydrophobicContact CG-CG2 4.07Å; L16-I283 HydrophobicContact CD1-CG2 3.52Å; P281-I283 PolarHBondContact O-N 2.86Å; I283-I310 HydrophobicContact CD1-CB 3.83Å; I283-I310 HydrophobicContact CD1-CD1 3.13Å; I283-I310 HydrophobicContact CD1-CG1 3.35Å; I283-I310 HydrophobicContact CG1-CD1 3.57Å; I283-I310 HydrophobicContact CG1-CG1 3.65Å
284	S	43.1	Very low	60.8	Low	76 Å²	76	61.6 Å²	61.6	53%	0.531	37%	0.368	S	S	.	.			trans	-85.2	124.2	165.9	47.8	0	0	0	0	108.8
285	L	42.3	Very low	59.1	Low	66 Å²	66	65.4 Å²	65.4	35%	0.346	39%	0.385	S	S	.	.			trans	-102.9	128.8	174.8	-77	155.8	0	0	0	109.6	F14 I289 L293 I310	F14-L285 HydrophobicContact CE1-CD2 3.57Å; F14-L285 HydrophobicContact CE1-CG 3.96Å; F14-L285 HydrophobicContact CZ-CD2 3.67Å; L285-I289 HydrophobicContact CD1-CD1 3.41Å; L285-I289 VanDerWaalsContact CD1-CD1 3.41Å; L285-I289 HydrophobicContact CD1-CG1 3.55Å; L285-I289 HydrophobicContact CD2-CG1 4.27Å; L285-I289 HydrophobicContact CG-CG1 4.48Å; L285-L293 HydrophobicContact CD2-CD2 4.48Å; L285-I310 HydrophobicContact CD1-CD1 3.25Å; L285-I310 HydrophobicContact CD1-CG1 4.16Å; L285-I310 HydrophobicContact CD2-CD1 4.41Å; L285-I310 HydrophobicContact CG-CD1 3.98Å
286	S	40.8	Very low	57.4	Low	85 Å²	85	66.1 Å²	66.1	59%	0.594	40%	0.395	S	S	*	.			trans	-108.6	124.8	159	51.2	0	0	0	0	109
287	G	44.7	Very low	55.5	Low	59 Å²	59	66 Å²	66	61%	0.608	39%	0.389	S	S	*	.	S	Bend	trans	101.8	177.4	-178.1	0	0	0	0	0	114.4
288	S	48.1	Very low	54	Low	113 Å²	113	66.3 Å²	66.3	79%	0.79	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-73.7	132.4	179.2	56.5	0	0	0	0	111.2	D290	S288-D290 PolarHBondContact O-N 2.9Å
289	I	50.3	Low	52.6	Low	65 Å²	65	71.1 Å²	71.1	33%	0.333	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-70.9	116.7	171.9	-53.9	174	0	0	0	108.2	L285 F294	L285-I289 HydrophobicContact CD1-CD1 3.41Å; L285-I289 VanDerWaalsContact CD1-CD1 3.41Å; L285-I289 HydrophobicContact CD1-CG1 3.55Å; L285-I289 HydrophobicContact CD2-CG1 4.27Å; L285-I289 HydrophobicContact CG-CG1 4.48Å; I289-F294 HydrophobicContact CG2-CB 3.89Å; I289-F294 HydrophobicContact CG2-CD2 4.46Å
290	D	55	Low	51.8	Low	71 Å²	71	72.4 Å²	72.4	38%	0.38	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-72.5	133.5	165.3	175.8	1.3	0	0	0	108.9	K93 S288 T292 L293 F294	K93-D290 IonicContact NZ-OD2 3.97Å; K93-D290 PolarHBondContact NZ-OD2 2.97Å; K93-D290 VanDerWaalsContact NZ-OD2 3.11Å; S288-D290 PolarHBondContact O-N 2.9Å; D290-T292 PolarHBondContact O-N 2.97Å; D290-T292 PolarHBondContact OD1-N 2.81Å; D290-T292 PolarHBondContact OD1-OG1 2.82Å; D290-T292 PolarHBondContact OD2-OG1 2.88Å; D290-L293 WeakPolarHBondContact O-CB 3.3Å; D290-L293 PolarHBondContact O-N 3.21Å; D290-F294 PolarHBondContact O-N 2.79Å; D290-F294 VanDerWaalsContact O-N 3.12Å
291	N	58.2	Low	51.4	Low	124 Å²	124	80 Å²	80	66%	0.663	44%	0.435	S	S	*	.	H	α-helix	trans	-51.9	-30.7	-179.7	-70.5	-11	0	0	0	112.6	F294 E295	N291-F294 WeakPolarHBondContact O-CB 3.36Å; N291-F294 PolarHBondContact O-N 3.21Å; N291-E295 PolarHBondContact O-N 2.67Å
292	T	56.4	Low	51.9	Low	78 Å²	78	79.2 Å²	79.2	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-66.2	-38.8	177.5	61.9	0	0	0	0	113.1	K93 D290 S296	K93-T292 PolarHBondContact NZ-OG1 2.85Å; K93-T292 VanDerWaalsContact NZ-OG1 3.1Å; D290-T292 PolarHBondContact O-N 2.97Å; D290-T292 PolarHBondContact OD1-N 2.81Å; D290-T292 PolarHBondContact OD1-OG1 2.82Å; D290-T292 PolarHBondContact OD2-OG1 2.88Å; T292-S296 PolarHBondContact O-N 3.04Å
293	L	51.7	Low	52.7	Low	17 Å²	17	75 Å²	75	9%	0.089	42%	0.416	C	S	.	.	H	α-helix	trans	-72.6	-35.4	175.3	-167.4	77.1	0	0	0	110.6	F14 L285 D290 S296 F297	F14-L293 HydrophobicContact CZ-CD2 4.2Å; L285-L293 HydrophobicContact CD2-CD2 4.48Å; D290-L293 WeakPolarHBondContact O-CB 3.3Å; D290-L293 PolarHBondContact O-N 3.21Å; L293-S296 PolarHBondContact O-N 2.95Å; L293-S296 PolarHBondContact O-OG 3.06Å; L293-F297 HydrophobicContact CD1-CE2 4.02Å; L293-F297 HydrophobicContact CG-CD2 4.22Å; L293-F297 HydrophobicContact CG-CE2 4.11Å; L293-F297 VanDerWaalsContact O-CD2 3.32Å; L293-F297 WeakPolarHBondContact O-CD2 3.43Å; L293-F297 PolarHBondContact O-N 3.24Å
294	F	54.2	Low	53.8	Low	49 Å²	49	79.6 Å²	79.6	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-59.3	-48.7	174.1	-177.6	-99.6	0	0	0	111.4	I289 D290 N291 S296 F297 C298 I310 N311	I289-F294 HydrophobicContact CG2-CB 3.89Å; I289-F294 HydrophobicContact CG2-CD2 4.46Å; D290-F294 PolarHBondContact O-N 2.79Å; D290-F294 VanDerWaalsContact O-N 3.12Å; N291-F294 WeakPolarHBondContact O-CB 3.36Å; N291-F294 PolarHBondContact O-N 3.21Å; F294-S296 VanDerWaalsContact C-N 3.34Å; F294-S296 PolarHBondContact O-N 2.81Å; F294-F297 PolarHBondContact O-N 2.91Å; F294-C298 HydrophobicContact CE1-CB 4.49Å; F294-C298 WeakPolarHBondContact CE1-SG 3.14Å; F294-C298 WeakPolarHBondContact CZ-SG 3.39Å; F294-C298 VanDerWaalsContact O-CB 3.31Å; F294-C298 WeakPolarHBondContact O-CB 3.43Å; F294-C298 PolarHBondContact O-N 3.34Å; F294-I310 HydrophobicContact CD2-CG2 3.71Å; F294-I310 HydrophobicContact CE2-CG2 3.87Å; F294-N311 HydrophobicContact CE2-CB 3.97Å; F294-N311 VanDerWaalsContact CE2-CG 3.4Å; F294-N311 WeakPolarHBondContact CE2-OD1 3.15Å; F294-N311 WeakPolarHBondContact CZ-OD1 3.45Å
295	E	56.6	Low	55.2	Low	121 Å²	121	77.8 Å²	77.8	57%	0.565	42%	0.42	S	S	*	.	H	α-helix	trans	-63.5	-34.7	179.4	-76.1	-172	-174.9	0	0	113.7	N291 F297 C298	N291-E295 PolarHBondContact O-N 2.67Å; E295-F297 VanDerWaalsContact C-N 3.34Å; E295-C298 PolarHBondContact O-N 2.78Å
296	S	57.3	Low	56.7	Low	72 Å²	72	74.8 Å²	74.8	50%	0.503	40%	0.404	S	S	.	.	H	α-helix	trans	-67.4	-35.4	178.1	60.1	0	0	0	0	112.4	T292 L293 F294	T292-S296 PolarHBondContact O-N 3.04Å; L293-S296 PolarHBondContact O-N 2.95Å; L293-S296 PolarHBondContact O-OG 3.06Å; F294-S296 VanDerWaalsContact C-N 3.34Å; F294-S296 PolarHBondContact O-N 2.81Å
297	F	51.6	Low	58.3	Low	61 Å²	61	73 Å²	73	27%	0.268	39%	0.388	S	S	.	.	H	α-helix	trans	-86.9	-18.3	176.1	-74.3	-72.7	0	0	0	113.7	L293 F294 E295 K299	L293-F297 HydrophobicContact CD1-CE2 4.02Å; L293-F297 HydrophobicContact CG-CD2 4.22Å; L293-F297 HydrophobicContact CG-CE2 4.11Å; L293-F297 VanDerWaalsContact O-CD2 3.32Å; L293-F297 WeakPolarHBondContact O-CD2 3.43Å; L293-F297 PolarHBondContact O-N 3.24Å; F294-F297 PolarHBondContact O-N 2.91Å; E295-F297 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.22Å
298	C	55.9	Low	59.4	Low	23 Å²	23	70.2 Å²	70.2	16%	0.155	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-4.1	-180	-112.2	0	0	0	0	114.9	F294 E295 C309	F294-C298 HydrophobicContact CE1-CB 4.49Å; F294-C298 WeakPolarHBondContact CE1-SG 3.14Å; F294-C298 WeakPolarHBondContact CZ-SG 3.39Å; F294-C298 VanDerWaalsContact O-CB 3.31Å; F294-C298 WeakPolarHBondContact O-CB 3.43Å; F294-C298 PolarHBondContact O-N 3.34Å; E295-C298 PolarHBondContact O-N 2.78Å; C298-C309 WeakPolarHBondContact CA-SG 3.44Å; C298-C309 HydrophobicContact CB-CB 4.03Å; C298-C309 WeakPolarHBondContact CB-SG 3.34Å; C298-C309 WeakPolarHBondContact SG-CB 3.16Å; C298-C309 CovalentContact SG-SG 2.04Å; C298-C309 PolarHBondContact SG-SG 3.12Å
299	K	53.6	Low	60.3	Low	155 Å²	155	65 Å²	65	67%	0.674	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	13	-175.5	-69	-179.8	-175.4	176.6	0	114.1	F297 R301	F297-K299 PolarHBondContact O-N 3.22Å; K299-R301 PolarHBondContact O-N 3.28Å
300	M	57.2	Low	60.9	Low	82 Å²	82	63 Å²	63	40%	0.404	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	89	170.2	-165	-177.1	-67.4	0	0	108.6	V302 V308	M300-V302 HydrophobicContact CG-CG2 4.36Å; M300-V302 PolarHBondContact O-N 3.47Å; M300-V302 VanDerWaalsContact O-N 3.08Å; M300-V308 PolarHBondContact O-N 2.96Å
301	R	57.7	Low	61.3	Low	181 Å²	181	60.7 Å²	60.7	68%	0.683	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	101.5	172.9	-167.3	175.2	-165.5	163.2	3.7	107.1	K299 Q304	K299-R301 PolarHBondContact O-N 3.28Å; R301-Q304 PolarHBondContact NE-O 2.84Å; R301-Q304 PolarHBondContact NH2-O 3.25Å
302	V	63	Low	61.8	Low	26 Å²	26	54.8 Å²	54.8	16%	0.158	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-38.2	-179.6	174.9	0	0	0	0	110.2	F179 L186 M300 W306 V308	F179-V302 HydrophobicContact CB-CG1 3.74Å; L186-V302 HydrophobicContact CD1-CG1 4.29Å; M300-V302 HydrophobicContact CG-CG2 4.36Å; M300-V302 PolarHBondContact O-N 3.47Å; M300-V302 VanDerWaalsContact O-N 3.08Å; V302-W306 PolarHBondContact N-O 2.86Å; V302-W306 VanDerWaalsContact N-O 3.16Å; V302-V308 HydrophobicContact CB-CG2 4.28Å; V302-V308 HydrophobicContact CG2-CB 3.82Å; V302-V308 HydrophobicContact CG2-CG2 3.45Å; V302-V308 VanDerWaalsContact CG2-CG2 3.45Å
303	A	64.4	Low	62.7	Low	13 Å²	13	51.1 Å²	51.1	11%	0.107	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	135.6	173.4	0	0	0	0	0	111.8	N181 Q305 W306	N181-A303 HydrophobicContact CB-CB 3.49Å; N181-A303 VanDerWaalsContact CB-CB 3.49Å; N181-A303 VanDerWaalsContact CG-CB 3.44Å; N181-A303 WeakPolarHBondContact ND2-CB 3.28Å; A303-Q305 PolarHBondContact O-N 2.83Å; A303-W306 WeakPolarHBondContact O-CA 3.14Å; A303-W306 WeakPolarHBondContact O-CB 3.29Å; A303-W306 PolarHBondContact O-N 2.81Å
304	Q	68.7	Low	63.8	Low	135 Å²	135	51.9 Å²	51.9	63%	0.631	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	39.9	-98.5	169.6	-61.8	-178.9	26.2	0	0	114.1	R301	R301-Q304 PolarHBondContact NE-O 2.84Å; R301-Q304 PolarHBondContact NH2-O 3.25Å
305	Q	71.2	Confident	64.7	Low	37 Å²	37	49.5 Å²	49.5	17%	0.173	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-14.5	-178.4	67.2	-171.6	-15.2	0	0	114.8	K210 A303 A315 N316	K210-Q305 VanDerWaalsContact CB-NE2 3.32Å; A303-Q305 PolarHBondContact O-N 2.83Å; Q305-A315 HydrophobicContact CG-CB 4.43Å; Q305-A315 VanDerWaalsContact O-CA 3.31Å; Q305-A315 WeakPolarHBondContact O-CA 3.45Å; Q305-N316 PolarHBondContact O-N 3Å
306	W	73.4	Confident	65.6	Low	4 Å²	4	48.7 Å²	48.7	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.8	-171.5	-48.9	105.3	0	0	0	111.8	L186 I208 K210 V302 A303 M313 Y314 A315 L320	L186-W306 HydrophobicContact CB-CD2 4.26Å; L186-W306 HydrophobicContact CB-CZ2 4.22Å; L186-W306 HydrophobicContact CD2-CB 4.04Å; L186-W306 HydrophobicContact CD2-CD2 3.65Å; L186-W306 HydrophobicContact CD2-CE3 3.72Å; L186-W306 HydrophobicContact CD2-CG 3.79Å; L186-W306 HydrophobicContact CD2-CZ3 4.34Å; I208-W306 HydrophobicContact CD1-CH2 4.2Å; I208-W306 HydrophobicContact CD1-CZ3 4.17Å; I208-W306 HydrophobicContact CG1-CH2 4.43Å; I208-W306 HydrophobicContact CG2-CH2 3.69Å; I208-W306 HydrophobicContact CG2-CZ2 4.36Å; I208-W306 HydrophobicContact CG2-CZ3 3.88Å; K210-W306 HydrophobicContact CB-CZ2 4.49Å; V302-W306 PolarHBondContact N-O 2.86Å; V302-W306 VanDerWaalsContact N-O 3.16Å; A303-W306 WeakPolarHBondContact O-CA 3.14Å; A303-W306 WeakPolarHBondContact O-CB 3.29Å; A303-W306 PolarHBondContact O-N 2.81Å; W306-M313 HydrophobicContact CE3-CE 4.46Å; W306-M313 HydrophobicContact CZ3-CE 4.3Å; W306-Y314 WeakPolarHBondContact CA-O 3.24Å; W306-A315 HydrophobicContact CE3-CB 3.85Å; W306-A315 HydrophobicContact CZ3-CB 3.97Å; W306-L320 HydrophobicContact CE3-CD1 3.86Å; W306-L320 HydrophobicContact CH2-CD1 4.36Å; W306-L320 HydrophobicContact CZ3-CD1 3.3Å
307	N	74.4	Confident	66.2	Low	46 Å²	46	53.8 Å²	53.8	25%	0.246	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.3	171.1	-63.7	-35.8	0	0	0	109.1	Y314	N307-Y314 PolarHBondContact N-O 2.92Å; N307-Y314 PolarHBondContact O-N 2.94Å
308	V	69.6	Low	67.3	Low	2 Å²	2	55.1 Å²	55.1	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.5	174.4	176.1	0	0	0	0	108.4	F179 M280 M300 V302 M313 W323	F179-V308 HydrophobicContact CD1-CG2 3.78Å; F179-V308 HydrophobicContact CE1-CB 4.5Å; F179-V308 HydrophobicContact CE1-CG1 4.13Å; F179-V308 HydrophobicContact CE1-CG2 3.5Å; F179-V308 HydrophobicContact CE2-CG1 3.89Å; F179-V308 HydrophobicContact CE2-CG2 4.36Å; F179-V308 HydrophobicContact CG-CG2 4.28Å; F179-V308 HydrophobicContact CZ-CB 4.37Å; F179-V308 HydrophobicContact CZ-CG1 3.57Å; F179-V308 HydrophobicContact CZ-CG2 3.83Å; M280-V308 HydrophobicContact CG-CG1 4.23Å; M280-V308 HydrophobicContact SD-CG1 3.27Å; M280-V308 WeakPolarHBondContact SD-CG1 3.18Å; M300-V308 PolarHBondContact O-N 2.96Å; V302-V308 HydrophobicContact CB-CG2 4.28Å; V302-V308 HydrophobicContact CG2-CB 3.82Å; V302-V308 HydrophobicContact CG2-CG2 3.45Å; V302-V308 VanDerWaalsContact CG2-CG2 3.45Å; V308-M313 HydrophobicContact CG2-CG 4.31Å; V308-W323 HydrophobicContact CG1-CZ2 4.37Å
309	C	66.8	Low	68.1	Low	4 Å²	4	57.6 Å²	57.6	3%	0.027	27%	0.273	C	S	.	.			trans	-119.8	167.4	178.7	-57.5	0	0	0	0	111	C298 N311 G312 Y314 W323	C298-C309 WeakPolarHBondContact CA-SG 3.44Å; C298-C309 HydrophobicContact CB-CB 4.03Å; C298-C309 WeakPolarHBondContact CB-SG 3.34Å; C298-C309 WeakPolarHBondContact SG-CB 3.16Å; C298-C309 CovalentContact SG-SG 2.04Å; C298-C309 PolarHBondContact SG-SG 3.12Å; C309-N311 WeakPolarHBondContact CB-OD1 3.49Å; C309-N311 PolarHBondContact O-N 2.97Å; C309-G312 CarbonylContact C-O 3.55Å; C309-G312 WeakPolarHBondContact CA-O 3.27Å; C309-G312 WeakPolarHBondContact CB-O 3.33Å; C309-G312 PolarHBondContact N-O 2.97Å; C309-G312 PolarHBondContact O-N 2.78Å; C309-Y314 HydrophobicContact CB-CD2 4.2Å; C309-Y314 HydrophobicContact CB-CE2 3.7Å; C309-Y314 WeakPolarHBondContact SG-CD2 3.49Å; C309-Y314 WeakPolarHBondContact SG-CE2 3.47Å; C309-W323 PolarHBondContact O-NE1 3.06Å; C309-W323 VanDerWaalsContact O-NE1 3.12Å
310	I	62.2	Low	68.8	Low	22 Å²	22	51.2 Å²	51.2	11%	0.113	25%	0.247	C	C	.	.	S	Bend	trans	-53.6	-37.6	173	-172.3	164.1	0	0	0	114.1	I283 L285 F294 W323	I283-I310 HydrophobicContact CD1-CB 3.83Å; I283-I310 HydrophobicContact CD1-CD1 3.13Å; I283-I310 HydrophobicContact CD1-CG1 3.35Å; I283-I310 HydrophobicContact CG1-CD1 3.57Å; I283-I310 HydrophobicContact CG1-CG1 3.65Å; L285-I310 HydrophobicContact CD1-CD1 3.25Å; L285-I310 HydrophobicContact CD1-CG1 4.16Å; L285-I310 HydrophobicContact CD2-CD1 4.41Å; L285-I310 HydrophobicContact CG-CD1 3.98Å; F294-I310 HydrophobicContact CD2-CG2 3.71Å; F294-I310 HydrophobicContact CE2-CG2 3.87Å; I310-W323 VanDerWaalsContact O-CD1 3.27Å
311	N	62.5	Low	69.2	Low	23 Å²	23	47.3 Å²	47.3	12%	0.123	23%	0.228	C	C	.	.	S	Bend	trans	-93.4	-21.7	-177	72.9	-32.5	0	0	0	113.4	F294 C309 Y314 N322 W323 T324	F294-N311 HydrophobicContact CE2-CB 3.97Å; F294-N311 VanDerWaalsContact CE2-CG 3.4Å; F294-N311 WeakPolarHBondContact CE2-OD1 3.15Å; F294-N311 WeakPolarHBondContact CZ-OD1 3.45Å; C309-N311 WeakPolarHBondContact CB-OD1 3.49Å; C309-N311 PolarHBondContact O-N 2.97Å; N311-Y314 VanDerWaalsContact CG-OH 3.29Å; N311-Y314 PolarHBondContact ND2-OH 3.05Å; N311-Y314 WeakPolarHBondContact OD1-CE2 3.21Å; N311-Y314 PolarHBondContact OD1-OH 3.1Å; N311-N322 CarbonylContact O-C 3.59Å; N311-N322 VanDerWaalsContact O-CA 3.32Å; N311-N322 WeakPolarHBondContact O-CA 3.3Å; N311-N322 PolarHBondContact O-OD1 2.75Å; N311-W323 VanDerWaalsContact O-CD1 3.3Å; N311-W323 PolarHBondContact O-N 3.34Å; N311-T324 HydrophobicContact CB-CG2 3.81Å
312	G	69.9	Low	69.6	Low	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	-179.3	-168.9	0	0	0	0	0	115.1	C309 A321 W323	C309-G312 CarbonylContact C-O 3.55Å; C309-G312 WeakPolarHBondContact CA-O 3.27Å; C309-G312 WeakPolarHBondContact CB-O 3.33Å; C309-G312 PolarHBondContact N-O 2.97Å; C309-G312 PolarHBondContact O-N 2.78Å; G312-A321 CarbonylContact C-O 3.5Å; G312-A321 WeakPolarHBondContact CA-O 3.16Å; G312-W323 VanDerWaalsContact C-CE2 3.43Å
313	M	74.1	Confident	69.5	Low	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.1	170.8	176.5	178.8	85.2	0	0	109.5	F179 L186 I208 W216 W306 V308 L320 A321 W323	F179-M313 HydrophobicContact CE1-SD 4.24Å; L186-M313 HydrophobicContact CD2-CE 4.21Å; L186-M313 HydrophobicContact CD2-CG 4.46Å; L186-M313 HydrophobicContact CD2-SD 3.31Å; L186-M313 WeakPolarHBondContact CD2-SD 3.32Å; L186-M313 HydrophobicContact CG-SD 4.48Å; I208-M313 HydrophobicContact CD1-CE 4.37Å; I208-M313 HydrophobicContact CG2-CE 4.09Å; W216-M313 HydrophobicContact CH2-CE 3.31Å; W216-M313 HydrophobicContact CH2-SD 4.46Å; W216-M313 HydrophobicContact CZ2-CE 3.42Å; W216-M313 VanDerWaalsContact CZ2-CE 3.42Å; W216-M313 HydrophobicContact CZ3-CE 4.4Å; W306-M313 HydrophobicContact CE3-CE 4.46Å; W306-M313 HydrophobicContact CZ3-CE 4.3Å; V308-M313 HydrophobicContact CG2-CG 4.31Å; M313-L320 HydrophobicContact CE-CB 3.98Å; M313-L320 HydrophobicContact CE-CD1 4.02Å; M313-L320 WeakPolarHBondContact O-CB 3.49Å; M313-L320 PolarHBondContact O-N 3.06Å; M313-A321 HydrophobicContact CB-CB 4.45Å; M313-A321 PolarHBondContact N-O 2.84Å; M313-A321 PolarHBondContact O-N 3.45Å; M313-W323 HydrophobicContact CB-CH2 3.43Å; M313-W323 VanDerWaalsContact CB-CH2 3.43Å; M313-W323 HydrophobicContact CB-CZ2 3.68Å; M313-W323 HydrophobicContact CB-CZ3 4.45Å; M313-W323 VanDerWaalsContact N-CZ2 3.29Å
314	Y	74.9	Confident	69	Low	33 Å²	33	44.4 Å²	44.4	13%	0.129	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.4	-177	-60.3	-105.6	0	0	0	110.5	W306 N307 C309 N311 L318 L319	W306-Y314 WeakPolarHBondContact CA-O 3.24Å; N307-Y314 PolarHBondContact N-O 2.92Å; N307-Y314 PolarHBondContact O-N 2.94Å; C309-Y314 HydrophobicContact CB-CD2 4.2Å; C309-Y314 HydrophobicContact CB-CE2 3.7Å; C309-Y314 WeakPolarHBondContact SG-CD2 3.49Å; C309-Y314 WeakPolarHBondContact SG-CE2 3.47Å; N311-Y314 VanDerWaalsContact CG-OH 3.29Å; N311-Y314 PolarHBondContact ND2-OH 3.05Å; N311-Y314 WeakPolarHBondContact OD1-CE2 3.21Å; N311-Y314 PolarHBondContact OD1-OH 3.1Å; Y314-L318 CarbonylContact C-O 3.49Å; Y314-L318 WeakPolarHBondContact CA-O 3.43Å; Y314-L319 HydrophobicContact CD1-CB 4.04Å; Y314-L319 HydrophobicContact CD1-CD1 4.35Å; Y314-L319 HydrophobicContact CD2-CD1 4.37Å; Y314-L319 HydrophobicContact CE1-CB 3.76Å; Y314-L319 HydrophobicContact CE1-CD1 3.83Å; Y314-L319 HydrophobicContact CE1-CG 4.36Å; Y314-L319 HydrophobicContact CE2-CD1 3.81Å
315	A	74.4	Confident	68.1	Low	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.8	160.3	0	0	0	0	0	109.1	L211 Q305 W306 E317 L318 L320	L211-A315 HydrophobicContact CD1-CB 4.13Å; Q305-A315 HydrophobicContact CG-CB 4.43Å; Q305-A315 VanDerWaalsContact O-CA 3.31Å; Q305-A315 WeakPolarHBondContact O-CA 3.45Å; W306-A315 HydrophobicContact CE3-CB 3.85Å; W306-A315 HydrophobicContact CZ3-CB 3.97Å; A315-E317 VanDerWaalsContact C-N 3.3Å; A315-E317 PolarHBondContact O-N 2.98Å; A315-L318 PolarHBondContact N-O 2.87Å; A315-L318 VanDerWaalsContact O-CB 3.23Å; A315-L318 WeakPolarHBondContact O-CB 3.46Å; A315-L318 PolarHBondContact O-N 3.48Å; A315-L320 HydrophobicContact CB-CD1 3.56Å; A315-L320 HydrophobicContact CB-CG 4.31Å
316	N	74.2	Confident	66.8	Low	103 Å²	103	46.5 Å²	46.5	55%	0.551	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	52.5	-177.5	-60.1	-25.8	0	0	0	112.3	L211 Q305 L318	L211-N316 HydrophobicContact CD1-CB 4.39Å; L211-N316 VanDerWaalsContact CD1-ND2 3.34Å; L211-N316 WeakPolarHBondContact CD1-ND2 3.3Å; Q305-N316 PolarHBondContact O-N 3Å; N316-L318 PolarHBondContact O-N 2.95Å; N316-L318 VanDerWaalsContact O-N 3.08Å
317	E	71.3	Confident	65.3	Low	179 Å²	179	49 Å²	49	84%	0.836	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	-2.8	-179.7	-50.9	-178.5	167.5	0	0	116.1	A315	A315-E317 VanDerWaalsContact C-N 3.3Å; A315-E317 PolarHBondContact O-N 2.98Å
318	L	73.1	Confident	63.7	Low	90 Å²	90	48.3 Å²	48.3	47%	0.471	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	121	179.1	-126.1	154.4	0	0	0	110.5	Y314 A315 N316 L320	Y314-L318 CarbonylContact C-O 3.49Å; Y314-L318 WeakPolarHBondContact CA-O 3.43Å; A315-L318 PolarHBondContact N-O 2.87Å; A315-L318 VanDerWaalsContact O-CB 3.23Å; A315-L318 WeakPolarHBondContact O-CB 3.46Å; A315-L318 PolarHBondContact O-N 3.48Å; N316-L318 PolarHBondContact O-N 2.95Å; N316-L318 VanDerWaalsContact O-N 3.08Å; L318-L320 WeakPolarHBondContact O-CG 3.3Å; L318-L320 PolarHBondContact O-N 3.41Å
319	L	73.7	Confident	62.2	Low	74 Å²	74	53 Å²	53	39%	0.387	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	120.4	177.1	-179.2	66.2	0	0	0	110.8	Y314 A321 N322	Y314-L319 HydrophobicContact CD1-CB 4.04Å; Y314-L319 HydrophobicContact CD1-CD1 4.35Å; Y314-L319 HydrophobicContact CD2-CD1 4.37Å; Y314-L319 HydrophobicContact CE1-CB 3.76Å; Y314-L319 HydrophobicContact CE1-CD1 3.83Å; Y314-L319 HydrophobicContact CE1-CG 4.36Å; Y314-L319 HydrophobicContact CE2-CD1 3.81Å; L319-A321 VanDerWaalsContact CD1-O 3.32Å; L319-A321 WeakPolarHBondContact CD1-O 3.19Å; L319-N322 HydrophobicContact CD1-CB 4.47Å; L319-N322 HydrophobicContact CD2-CB 4.09Å
320	L	68.3	Low	61.1	Low	21 Å²	21	54.1 Å²	54.1	11%	0.11	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-32.3	-175.5	-60.8	-176.1	0	0	0	113.9	I208 W306 M313 A315 L318	I208-L320 HydrophobicContact CD1-CD1 4.15Å; W306-L320 HydrophobicContact CE3-CD1 3.86Å; W306-L320 HydrophobicContact CH2-CD1 4.36Å; W306-L320 HydrophobicContact CZ3-CD1 3.3Å; M313-L320 HydrophobicContact CE-CB 3.98Å; M313-L320 HydrophobicContact CE-CD1 4.02Å; M313-L320 WeakPolarHBondContact O-CB 3.49Å; M313-L320 PolarHBondContact O-N 3.06Å; A315-L320 HydrophobicContact CB-CD1 3.56Å; A315-L320 HydrophobicContact CB-CG 4.31Å; L318-L320 WeakPolarHBondContact O-CG 3.3Å; L318-L320 PolarHBondContact O-N 3.41Å
321	A	66.6	Low	59.8	Low	1 Å²	1	60.3 Å²	60.3	1%	0.008	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	134.7	174.6	0	0	0	0	0	108	W216 G312 M313 L319 W323	W216-A321 HydrophobicContact CH2-CB 4.17Å; W216-A321 HydrophobicContact CZ2-CB 3.95Å; G312-A321 CarbonylContact C-O 3.5Å; G312-A321 WeakPolarHBondContact CA-O 3.16Å; M313-A321 HydrophobicContact CB-CB 4.45Å; M313-A321 PolarHBondContact N-O 2.84Å; M313-A321 PolarHBondContact O-N 3.45Å; L319-A321 VanDerWaalsContact CD1-O 3.32Å; L319-A321 WeakPolarHBondContact CD1-O 3.19Å; A321-W323 HydrophobicContact CB-CE3 3.97Å; A321-W323 HydrophobicContact CB-CH2 4.01Å; A321-W323 HydrophobicContact CB-CZ3 3.44Å; A321-W323 VanDerWaalsContact CB-CZ3 3.44Å
322	N	65.3	Low	58.6	Low	26 Å²	26	63.3 Å²	63.3	14%	0.139	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	111.3	177.7	-179.7	-21.2	0	0	0	109.2	N311 L319 T324 N325 P328	N311-N322 CarbonylContact O-C 3.59Å; N311-N322 VanDerWaalsContact O-CA 3.32Å; N311-N322 WeakPolarHBondContact O-CA 3.3Å; N311-N322 PolarHBondContact O-OD1 2.75Å; L319-N322 HydrophobicContact CD1-CB 4.47Å; L319-N322 HydrophobicContact CD2-CB 4.09Å; N322-T324 WeakPolarHBondContact OD1-CA 3.47Å; N322-T324 PolarHBondContact OD1-N 3.04Å; N322-T324 PolarHBondContact OD1-OG1 2.73Å; N322-N325 PolarHBondContact OD1-N 2.96Å; N322-P328 VanDerWaalsContact O-CA 3.24Å; N322-P328 WeakPolarHBondContact O-CA 3.45Å
323	W	59.7	Low	57	Low	45 Å²	45	74 Å²	74	17%	0.17	39%	0.385	C	S	.	.	S	Bend	trans	-89.6	-5.5	178.4	10.2	93.3	0	0	0	114.5	F179 Y188 V308 C309 I310 N311 G312 M313 A321 N325	F179-W323 HydrophobicContact CE1-CH2 4.15Å; F179-W323 HydrophobicContact CZ-CH2 4.07Å; F179-W323 HydrophobicContact CZ-CZ2 4.12Å; Y188-W323 HydrophobicContact CD1-CZ3 4.21Å; Y188-W323 HydrophobicContact CD2-CH2 4.32Å; Y188-W323 HydrophobicContact CD2-CZ3 4.45Å; Y188-W323 HydrophobicContact CE1-CE3 4.21Å; Y188-W323 HydrophobicContact CE1-CH2 4.39Å; Y188-W323 AromaticContact CE1-CZ3 3.62Å; Y188-W323 HydrophobicContact CE1-CZ3 3.62Å; Y188-W323 HydrophobicContact CE2-CE3 4.5Å; Y188-W323 AromaticContact CE2-CH2 3.92Å; Y188-W323 HydrophobicContact CE2-CH2 3.92Å; Y188-W323 AromaticContact CE2-CZ3 3.86Å; Y188-W323 HydrophobicContact CE2-CZ3 3.86Å; Y188-W323 AromaticContact CZ-CE3 3.81Å; Y188-W323 AromaticContact CZ-CH2 3.96Å; Y188-W323 AromaticContact CZ-CZ3 3.4Å; V308-W323 HydrophobicContact CG1-CZ2 4.37Å; C309-W323 PolarHBondContact O-NE1 3.06Å; C309-W323 VanDerWaalsContact O-NE1 3.12Å; I310-W323 VanDerWaalsContact O-CD1 3.27Å; N311-W323 VanDerWaalsContact O-CD1 3.3Å; N311-W323 PolarHBondContact O-N 3.34Å; G312-W323 VanDerWaalsContact C-CE2 3.43Å; M313-W323 HydrophobicContact CB-CH2 3.43Å; M313-W323 VanDerWaalsContact CB-CH2 3.43Å; M313-W323 HydrophobicContact CB-CZ2 3.68Å; M313-W323 HydrophobicContact CB-CZ3 4.45Å; M313-W323 VanDerWaalsContact N-CZ2 3.29Å; A321-W323 HydrophobicContact CB-CE3 3.97Å; A321-W323 HydrophobicContact CB-CH2 4.01Å; A321-W323 HydrophobicContact CB-CZ3 3.44Å; A321-W323 VanDerWaalsContact CB-CZ3 3.44Å; W323-N325 VanDerWaalsContact C-N 3.3Å
324	T	55.4	Low	56.1	Low	87 Å²	87	77.7 Å²	77.7	53%	0.534	40%	0.404	S	S	.	.	S	Bend	trans	-77.3	-17.2	174.3	49	0	0	0	0	113.6	N311 N322	N311-T324 HydrophobicContact CB-CG2 3.81Å; N322-T324 WeakPolarHBondContact OD1-CA 3.47Å; N322-T324 PolarHBondContact OD1-N 3.04Å; N322-T324 PolarHBondContact OD1-OG1 2.73Å
325	N	49.6	Very low	55.1	Low	70 Å²	70	80.1 Å²	80.1	37%	0.374	42%	0.418	S	S	.	.	S	Bend	trans	-77.9	142.6	172.3	-67.9	-15.3	0	0	0	109.8	N322 W323 C327	N322-N325 PolarHBondContact OD1-N 2.96Å; W323-N325 VanDerWaalsContact C-N 3.3Å; N325-C327 CarbonylContact C-O 3.56Å; N325-C327 WeakPolarHBondContact CB-O 3.24Å; N325-C327 CarbonylContact O-C 3.59Å; N325-C327 VanDerWaalsContact O-C 3.22Å; N325-C327 PolarHBondContact O-N 3.38Å
326	T	43.9	Very low	54	Low	146 Å²	146	84.5 Å²	84.5	90%	0.896	44%	0.442	S	S	*	.	S	Bend	trans	-51.3	-25.1	176.2	18	0	0	0	0	113.3
327	C	41.1	Very low	52.9	Low	58 Å²	58	83.4 Å²	83.4	39%	0.392	44%	0.435	S	S	.	.	S	Bend	trans	-115.3	126.7	160.4	-61	0	0	0	0	107.2	I193 N325 N329	I193-C327 HydrophobicContact CD1-CB 4.28Å; I193-C327 VanDerWaalsContact CD1-SG 3.54Å; N325-C327 CarbonylContact C-O 3.56Å; N325-C327 WeakPolarHBondContact CB-O 3.24Å; N325-C327 CarbonylContact O-C 3.59Å; N325-C327 VanDerWaalsContact O-C 3.22Å; N325-C327 PolarHBondContact O-N 3.38Å; C327-N329 VanDerWaalsContact C-N 3.33Å; C327-N329 PolarHBondContact O-N 2.85Å
328	P	41.2	Very low	51.7	Low	31 Å²	31	77.4 Å²	77.4	20%	0.201	41%	0.41	C	S	.	.			trans	-55.5	107	159.5	-17.7	29.4	0	0	0	107	N322 I330	N322-P328 VanDerWaalsContact O-CA 3.24Å; N322-P328 WeakPolarHBondContact O-CA 3.45Å; P328-I330 HydrophobicContact CB-CG1 4.28Å; P328-I330 PolarHBondContact O-N 3.32Å
329	N	38.4	Very low	50.3	Low	99 Å²	99	76.6 Å²	76.6	53%	0.529	41%	0.406	S	S	.	.			trans	-71.2	68.2	169.4	-92	-19.6	0	0	0	106.5	C327 K331	C327-N329 VanDerWaalsContact C-N 3.33Å; C327-N329 PolarHBondContact O-N 2.85Å; N329-K331 PolarHBondContact O-N 3.03Å
330	I	43.8	Very low	48.6	Very low	29 Å²	29	76.8 Å²	76.8	15%	0.149	41%	0.407	C	S	.	.			trans	-65.8	111.4	149.1	-55.1	174.3	0	0	0	101.6	F206 W216 P328 P332	F206-I330 HydrophobicContact CD2-CD1 4.22Å; F206-I330 HydrophobicContact CE2-CD1 4.05Å; F206-I330 HydrophobicContact CZ-CD1 4.21Å; W216-I330 HydrophobicContact CB-CG2 4.21Å; W216-I330 HydrophobicContact CD2-CG2 3.79Å; W216-I330 HydrophobicContact CE3-CG2 4.38Å; W216-I330 HydrophobicContact CG-CG2 3.72Å; P328-I330 HydrophobicContact CB-CG1 4.28Å; P328-I330 PolarHBondContact O-N 3.32Å; I330-P332 VanDerWaalsContact C-CD 3.4Å; I330-P332 WeakPolarHBondContact O-CD 3.46Å
331	K	35.7	Very low	47.1	Very low	152 Å²	152	81.1 Å²	81.1	66%	0.661	43%	0.43	S	S	*	.			trans	-81.2	98.3	165.6	-75.8	-172.6	174.8	-172.8	0	106.2	N329 F333	N329-K331 PolarHBondContact O-N 3.03Å; K331-F333 PolarHBondContact O-N 2.95Å
332	P	35.7	Very low	45.5	Very low	85 Å²	85	87.8 Å²	87.8	55%	0.552	47%	0.465	S	S	*	.			trans	-67.5	95.7	152.2	30.5	-30.1	0	0	0	104.8	I330	I330-P332 VanDerWaalsContact C-CD 3.4Å; I330-P332 WeakPolarHBondContact O-CD 3.46Å
333	F	36.2	Very low	43.7	Very low	225 Å²	225	93.4 Å²	93.4	99%	0.987	50%	0.495	S	S	*	.			trans	79.4	0	177.2	-43.9	-76.1	0	0	0	115.6	K331	K331-F333 PolarHBondContact O-N 2.95Å

Retrieved 333 of 333 residues in 113.4 ms (Link to these results)

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