A0A077Z1L9_TRITR Loading...

Sodium:potassium transporting ATPase subunit

AlphaFold DB , UniProt , Accession A0A077Z1L9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 428 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	69.1	Low	71.4	Confident	150 Å²	150	66.7 Å²	66.7	74%	0.739	37%	0.366	S	S	*	.				0	-61	0	-166	178.5	178	0	0	112	S3 Q4 L5 I19	M1-S3 VanDerWaalsContact C-N 3.35Å; M1-S3 PolarHBondContact O-N 3.22Å; M1-Q4 WeakPolarHBondContact O-CB 3.48Å; M1-Q4 PolarHBondContact O-N 2.69Å; M1-L5 HydrophobicContact CE-CD1 4.16Å; M1-L5 HydrophobicContact CG-CD1 3.95Å; M1-L5 PolarHBondContact O-N 3.01Å; M1-L5 VanDerWaalsContact O-N 3.12Å; M1-I19 HydrophobicContact CE-CD1 3.22Å; M1-I19 HydrophobicContact CG-CD1 3.98Å; M1-I19 HydrophobicContact SD-CD1 3.57Å; M1-I19 VanDerWaalsContact SD-CD1 3.57Å
2	C	73	Confident	71.6	Confident	18 Å²	18	66.9 Å²	66.9	12%	0.122	37%	0.373	C	S	.	.	H	α-helix	trans	-53.8	-44.7	179.8	-63	0	0	0	0	113.5	Q4 L5 L6 Y10 C17	C2-Q4 PolarHBondContact O-N 3.23Å; C2-L5 PolarHBondContact O-N 3.11Å; C2-L5 VanDerWaalsContact O-N 3.12Å; C2-L6 VanDerWaalsContact O-CB 3.28Å; C2-L6 WeakPolarHBondContact O-CB 3.26Å; C2-L6 PolarHBondContact O-N 2.86Å; C2-Y10 HydrophobicContact CB-CD1 3.93Å; C2-Y10 HydrophobicContact CB-CD2 4.08Å; C2-Y10 HydrophobicContact CB-CE1 3.87Å; C2-Y10 HydrophobicContact CB-CE2 4.06Å; C2-Y10 HydrophobicContact CB-CG 4.04Å; C2-C17 HydrophobicContact CB-CB 3.72Å; C2-C17 WeakPolarHBondContact CB-SG 3.35Å; C2-C17 WeakPolarHBondContact SG-CB 3.49Å; C2-C17 PolarHBondContact SG-O 3.11Å; C2-C17 CovalentContact SG-SG 2.03Å; C2-C17 PolarHBondContact SG-SG 3.19Å
3	S	78.3	Confident	71.5	Confident	65 Å²	65	71.7 Å²	71.7	46%	0.455	40%	0.397	S	S	.	.	H	α-helix	trans	-59.1	-30.6	175.3	-39.2	0	0	0	0	113.9	M1 G7 Y10	M1-S3 VanDerWaalsContact C-N 3.35Å; M1-S3 PolarHBondContact O-N 3.22Å; S3-G7 WeakPolarHBondContact O-CA 3.4Å; S3-G7 PolarHBondContact O-N 3.34Å; S3-Y10 WeakPolarHBondContact OG-CD1 3.44Å; S3-Y10 WeakPolarHBondContact OG-CE1 3.42Å
4	Q	77.5	Confident	71.1	Confident	159 Å²	159	71.1 Å²	71.1	74%	0.743	39%	0.393	S	S	*	.	H	α-helix	trans	-77.6	-35.7	177.1	-68.5	172.1	-25.4	0	0	112.1	M1 C2	M1-Q4 WeakPolarHBondContact O-CB 3.48Å; M1-Q4 PolarHBondContact O-N 2.69Å; C2-Q4 PolarHBondContact O-N 3.23Å
5	L	70.8	Confident	71.2	Confident	43 Å²	43	66.7 Å²	66.7	23%	0.225	37%	0.369	C	S	.	.	H	α-helix	trans	-80.2	-40.6	-177.8	-67.5	173.1	0	0	0	112.4	M1 C2 I19 I56	M1-L5 HydrophobicContact CE-CD1 4.16Å; M1-L5 HydrophobicContact CG-CD1 3.95Å; M1-L5 PolarHBondContact O-N 3.01Å; M1-L5 VanDerWaalsContact O-N 3.12Å; C2-L5 PolarHBondContact O-N 3.11Å; C2-L5 VanDerWaalsContact O-N 3.12Å; L5-I19 HydrophobicContact CD1-CD1 3.28Å; L5-I19 HydrophobicContact CD1-CG1 4.3Å; L5-I56 HydrophobicContact CB-CD1 4.29Å; L5-I56 HydrophobicContact CD1-CD1 3.66Å; L5-I56 HydrophobicContact CD2-CD1 3.62Å; L5-I56 HydrophobicContact CD2-CG1 3.76Å; L5-I56 HydrophobicContact CG-CD1 4.04Å
6	L	69.2	Low	71.8	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.026	36%	0.364	C	S	.	.	H	α-helix	trans	-98.6	-21.1	-173.5	-62.4	-177.4	0	0	0	112	C2 D8 K9 Y10 C17 L51 T53 V62 L64	C2-L6 VanDerWaalsContact O-CB 3.28Å; C2-L6 WeakPolarHBondContact O-CB 3.26Å; C2-L6 PolarHBondContact O-N 2.86Å; L6-D8 PolarHBondContact O-N 3.21Å; L6-K9 HydrophobicContact CB-CB 4.15Å; L6-K9 WeakPolarHBondContact O-CB 3.33Å; L6-K9 WeakPolarHBondContact O-CG 3.2Å; L6-K9 PolarHBondContact O-N 3.39Å; L6-Y10 HydrophobicContact CD1-CD2 4.23Å; L6-Y10 HydrophobicContact CD1-CG 4.32Å; L6-C17 HydrophobicContact CD1-CB 4.17Å; L6-L51 HydrophobicContact CD1-CD1 3.8Å; L6-L51 HydrophobicContact CD2-CB 4.07Å; L6-L51 HydrophobicContact CD2-CD1 3.53Å; L6-L51 HydrophobicContact CD2-CG 4.45Å; L6-L51 HydrophobicContact CG-CD1 4.25Å; L6-T53 HydrophobicContact CD2-CG2 3.65Å; L6-V62 HydrophobicContact CD1-CG1 3.84Å; L6-V62 HydrophobicContact CD2-CB 4.35Å; L6-V62 HydrophobicContact CD2-CG1 3.98Å; L6-V62 HydrophobicContact CG-CG1 4.12Å; L6-L64 HydrophobicContact CD1-CD1 4.18Å
7	G	72.8	Confident	72.1	Confident	38 Å²	38	64.8 Å²	64.8	39%	0.392	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	61.2	-130.5	-179.3	0	0	0	0	0	111.6	S3 K9 Y10	S3-G7 WeakPolarHBondContact O-CA 3.4Å; S3-G7 PolarHBondContact O-N 3.34Å; G7-K9 PolarHBondContact O-N 2.9Å; G7-K9 VanDerWaalsContact O-N 3.15Å; G7-Y10 PolarHBondContact O-N 3.33Å
8	D	69.5	Low	72.3	Confident	135 Å²	135	63.1 Å²	63.1	72%	0.722	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64	-10.5	174.8	60.6	-22.9	0	0	0	114	L6 Y10	L6-D8 PolarHBondContact O-N 3.21Å; D8-Y10 VanDerWaalsContact C-N 3.29Å; D8-Y10 PolarHBondContact O-N 3.05Å
9	K	63	Low	72.3	Confident	46 Å²	46	62.7 Å²	62.7	20%	0.2	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-80.1	-7.6	178.7	-49.3	177.1	-171.2	-170.8	0	114.3	L6 G7 G233 L234 Y236	L6-K9 HydrophobicContact CB-CB 4.15Å; L6-K9 WeakPolarHBondContact O-CB 3.33Å; L6-K9 WeakPolarHBondContact O-CG 3.2Å; L6-K9 PolarHBondContact O-N 3.39Å; G7-K9 PolarHBondContact O-N 2.9Å; G7-K9 VanDerWaalsContact O-N 3.15Å; K9-G233 WeakPolarHBondContact CA-O 3.28Å; K9-L234 HydrophobicContact CB-CD2 3.76Å; K9-L234 HydrophobicContact CD-CD2 3.94Å; K9-L234 HydrophobicContact CG-CD2 3.95Å; K9-Y236 HydrophobicContact CD-CD1 4.46Å; K9-Y236 HydrophobicContact CD-CE1 3.42Å; K9-Y236 VanDerWaalsContact CD-CE1 3.42Å; K9-Y236 WeakPolarHBondContact CD-OH 3.4Å; K9-Y236 VanDerWaalsContact CE-OH 3.32Å; K9-Y236 WeakPolarHBondContact CE-OH 3.45Å; K9-Y236 HydrophobicContact CG-CD1 4.37Å; K9-Y236 HydrophobicContact CG-CE1 3.63Å; K9-Y236 PolarHBondContact NZ-OH 3.18Å
10	Y	69.3	Low	72	Confident	39 Å²	39	60.6 Å²	60.6	15%	0.153	34%	0.336	C	S	.	.			trans	-119.2	120.9	-178.6	174.9	-111.1	0	0	0	110.2	C2 S3 L6 G7 D8 P12 D15 C17 L64	C2-Y10 HydrophobicContact CB-CD1 3.93Å; C2-Y10 HydrophobicContact CB-CD2 4.08Å; C2-Y10 HydrophobicContact CB-CE1 3.87Å; C2-Y10 HydrophobicContact CB-CE2 4.06Å; C2-Y10 HydrophobicContact CB-CG 4.04Å; S3-Y10 WeakPolarHBondContact OG-CD1 3.44Å; S3-Y10 WeakPolarHBondContact OG-CE1 3.42Å; L6-Y10 HydrophobicContact CD1-CD2 4.23Å; L6-Y10 HydrophobicContact CD1-CG 4.32Å; G7-Y10 PolarHBondContact O-N 3.33Å; D8-Y10 VanDerWaalsContact C-N 3.29Å; D8-Y10 PolarHBondContact O-N 3.05Å; Y10-P12 HydrophobicContact CE1-CB 3.83Å; Y10-P12 WeakPolarHBondContact O-CD 3.33Å; Y10-D15 HydrophobicContact CD2-CB 3.89Å; Y10-D15 HydrophobicContact CE2-CB 3.71Å; Y10-D15 WeakPolarHBondContact CE2-O 3.27Å; Y10-D15 PolarHBondContact OH-O 2.87Å; Y10-C17 HydrophobicContact CD2-CB 4.2Å; Y10-C17 HydrophobicContact CE2-CB 4.05Å; Y10-L64 HydrophobicContact CD2-CD1 3.87Å; Y10-L64 HydrophobicContact CE2-CD1 4.45Å
11	S	72.9	Confident	71.3	Confident	36 Å²	36	64.3 Å²	64.3	25%	0.252	35%	0.353	S	S	.	.			trans	-103.2	101.6	174.6	-175.6	0	0	0	0	109.1	D13 L14 D15	S11-D13 PolarHBondContact O-N 2.97Å; S11-L14 PolarHBondContact O-N 2.77Å; S11-D15 PolarHBondContact N-OD2 2.97Å; S11-D15 VanDerWaalsContact N-OD2 3.08Å; S11-D15 WeakPolarHBondContact O-CB 3.34Å; S11-D15 PolarHBondContact O-N 3.1Å
12	P	73.7	Confident	70.7	Confident	69 Å²	69	58.5 Å²	58.5	45%	0.448	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24	-176.6	23.5	-33.1	0	0	0	113.6	Y10 L14 Q67	Y10-P12 HydrophobicContact CE1-CB 3.83Å; Y10-P12 WeakPolarHBondContact O-CD 3.33Å; P12-L14 VanDerWaalsContact C-N 3.31Å; P12-Q67 PolarHBondContact O-NE2 2.95Å
13	D	70.4	Confident	69.8	Low	129 Å²	129	62.5 Å²	62.5	69%	0.69	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-16.8	177.3	-56.5	-36	0	0	0	113.6	S11	S11-D13 PolarHBondContact O-N 2.97Å
14	L	66.3	Low	68.5	Low	63 Å²	63	68.8 Å²	68.8	33%	0.33	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-19	-172.1	-64.7	174.7	0	0	0	113.3	S11 P12 Q67 F269	S11-L14 PolarHBondContact O-N 2.77Å; P12-L14 VanDerWaalsContact C-N 3.31Å; L14-Q67 WeakPolarHBondContact O-CG 3.4Å; L14-Q67 PolarHBondContact O-N 3.09Å; L14-F269 HydrophobicContact CD1-CE1 4.28Å; L14-F269 HydrophobicContact CD1-CZ 4.27Å
15	D	72.5	Confident	67.3	Low	6 Å²	6	65 Å²	65	3%	0.032	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.1	-170.4	-53	-45.7	0	0	0	112.2	Y10 S11 L64 F65	Y10-D15 HydrophobicContact CD2-CB 3.89Å; Y10-D15 HydrophobicContact CE2-CB 3.71Å; Y10-D15 WeakPolarHBondContact CE2-O 3.27Å; Y10-D15 PolarHBondContact OH-O 2.87Å; S11-D15 PolarHBondContact N-OD2 2.97Å; S11-D15 VanDerWaalsContact N-OD2 3.08Å; S11-D15 WeakPolarHBondContact O-CB 3.34Å; S11-D15 PolarHBondContact O-N 3.1Å; D15-L64 HydrophobicContact CB-CD1 3.7Å; D15-L64 HydrophobicContact CB-CG 4.18Å; D15-F65 CarbonylContact C-O 3.55Å; D15-F65 VanDerWaalsContact CA-O 3.27Å; D15-F65 WeakPolarHBondContact CA-O 3.47Å
16	Y	79.8	Confident	66.2	Low	77 Å²	77	66.6 Å²	66.6	30%	0.302	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	151.2	152.2	-64.5	-71.8	0	0	0	108.6	L33 Y44 F65 Q67	Y16-L33 HydrophobicContact CD2-CD2 4.03Å; Y16-L33 HydrophobicContact CG-CD2 3.86Å; Y16-Y44 HydrophobicContact CE2-CD1 4.39Å; Y16-Y44 WeakPolarHBondContact CE2-O 3.22Å; Y16-F65 PolarHBondContact N-O 2.86Å; Y16-F65 PolarHBondContact O-N 3.26Å; Y16-Q67 HydrophobicContact CD2-CB 4.35Å; Y16-Q67 HydrophobicContact CD2-CG 3.67Å; Y16-Q67 HydrophobicContact CE2-CB 3.94Å; Y16-Q67 HydrophobicContact CE2-CG 3.4Å; Y16-Q67 HydrophobicContact CG-CG 4.43Å
17	C	77.4	Confident	65.5	Low	23 Å²	23	70.7 Å²	70.7	16%	0.155	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.1	165.6	123.2	0	0	0	0	110.2	C2 L6 Y10 V62 D63 L64	C2-C17 HydrophobicContact CB-CB 3.72Å; C2-C17 WeakPolarHBondContact CB-SG 3.35Å; C2-C17 WeakPolarHBondContact SG-CB 3.49Å; C2-C17 PolarHBondContact SG-O 3.11Å; C2-C17 CovalentContact SG-SG 2.03Å; C2-C17 PolarHBondContact SG-SG 3.19Å; L6-C17 HydrophobicContact CD1-CB 4.17Å; Y10-C17 HydrophobicContact CD2-CB 4.2Å; Y10-C17 HydrophobicContact CE2-CB 4.05Å; C17-V62 HydrophobicContact CB-CG1 4.29Å; C17-V62 WeakPolarHBondContact SG-CG1 3.14Å; C17-D63 CarbonylContact C-O 3.6Å; C17-D63 WeakPolarHBondContact CA-O 3.41Å; C17-D63 WeakPolarHBondContact CB-O 3.25Å; C17-L64 HydrophobicContact CB-CD1 4.16Å
18	S	75.6	Confident	64.8	Low	35 Å²	35	73.9 Å²	73.9	25%	0.245	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.5	172.9	86.8	0	0	0	0	109.3	V62 D63 F65	S18-V62 CarbonylContact O-C 3.6Å; S18-V62 WeakPolarHBondContact O-CA 3.34Å; S18-D63 PolarHBondContact N-O 3.18Å; S18-D63 PolarHBondContact O-N 3.09Å; S18-F65 WeakPolarHBondContact OG-CE2 3.37Å
19	I	72.6	Confident	64.3	Low	55 Å²	55	69 Å²	69	28%	0.282	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.7	-179.8	-58.1	168.3	0	0	0	105.6	M1 L5 Y60 V62	M1-I19 HydrophobicContact CE-CD1 3.22Å; M1-I19 HydrophobicContact CG-CD1 3.98Å; M1-I19 HydrophobicContact SD-CD1 3.57Å; M1-I19 VanDerWaalsContact SD-CD1 3.57Å; L5-I19 HydrophobicContact CD1-CD1 3.28Å; L5-I19 HydrophobicContact CD1-CG1 4.3Å; I19-Y60 HydrophobicContact CG2-CD1 4.33Å; I19-V62 HydrophobicContact CG1-CG1 4.33Å; I19-V62 HydrophobicContact CG1-CG2 4.31Å
20	G	66.2	Low	64.3	Low	20 Å²	20	68 Å²	68	21%	0.206	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	153.9	-179	0	0	0	0	0	110.9	G22 Y60 E61	G20-G22 PolarHBondContact O-N 3.16Å; G20-Y60 WeakPolarHBondContact O-CA 3.3Å; G20-E61 PolarHBondContact N-O 3.19Å; G20-E61 VanDerWaalsContact N-O 3.11Å; G20-E61 PolarHBondContact O-N 3.27Å
21	M	58.2	Low	64.3	Low	140 Å²	140	68.1 Å²	68.1	69%	0.69	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	105.1	158.3	-72	-176.3	168.3	0	0	107.1	T23 Y60	M21-T23 PolarHBondContact O-N 2.92Å; M21-Y60 HydrophobicContact CE-CE1 3.7Å; M21-Y60 WeakPolarHBondContact CE-OH 3.31Å; M21-Y60 HydrophobicContact CG-CD1 3.87Å; M21-Y60 HydrophobicContact CG-CE1 3.54Å; M21-Y60 HydrophobicContact SD-CE1 4.48Å
22	G	56.4	Low	64.3	Low	27 Å²	27	69.4 Å²	69.4	28%	0.278	40%	0.404	S	S	.	.			trans	-77.3	119.5	179.9	0	0	0	0	0	110.5	G20 K24	G20-G22 PolarHBondContact O-N 3.16Å; G22-K24 PolarHBondContact O-N 3.3Å
23	T	52.4	Low	64.5	Low	103 Å²	103	67.8 Å²	67.8	63%	0.632	39%	0.392	S	S	*	.			trans	-68	114.3	148.1	48.7	0	0	0	0	105.8	M21 G25 S26	M21-T23 PolarHBondContact O-N 2.92Å; T23-G25 PolarHBondContact O-N 2.82Å; T23-S26 PolarHBondContact OG1-OG 3.48Å
24	K	52.1	Low	64.8	Low	197 Å²	197	64.9 Å²	64.9	86%	0.857	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.6	115.2	177.6	-79.7	-177	173.8	-177.4	0	109.5	G22	G22-K24 PolarHBondContact O-N 3.3Å
25	G	51.4	Low	65.2	Low	79 Å²	79	64.4 Å²	64.4	81%	0.814	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.9	5.3	166.6	0	0	0	0	0	118.7	T23	T23-G25 PolarHBondContact O-N 2.82Å
26	S	47.8	Very low	65.1	Low	76 Å²	76	69 Å²	69	53%	0.531	40%	0.404	S	S	.	.			trans	-99	-4.6	-170.6	64.1	0	0	0	0	118	T23	T23-S26 PolarHBondContact OG1-OG 3.48Å
27	K	55.5	Low	64.8	Low	92 Å²	92	70.6 Å²	70.6	40%	0.4	41%	0.412	S	S	.	.			trans	-114.4	107.6	-173.3	-65.2	-174.8	-170.9	177.7	0	114	D63	K27-D63 VanDerWaalsContact CD-OD2 3.32Å; K27-D63 WeakPolarHBondContact CD-OD2 3.4Å; K27-D63 IonicContact NZ-OD2 3.63Å; K27-D63 PolarHBondContact NZ-OD2 2.83Å
28	R	57.8	Low	64.9	Low	105 Å²	105	75.5 Å²	75.5	40%	0.396	44%	0.437	S	S	.	.			trans	-72.3	138.7	176.8	-58.1	-176.5	-172.5	179	8	110	G30 A31 H47 E86 Q90	R28-G30 PolarHBondContact O-N 3.08Å; R28-A31 WeakPolarHBondContact O-CB 3.29Å; R28-A31 PolarHBondContact O-N 2.9Å; R28-H47 PolarHBondContact O-ND1 3.08Å; R28-E86 PolarHBondContact NH1-O 3.2Å; R28-Q90 VanDerWaalsContact CZ-CD 3.49Å
29	I	59.7	Low	64.9	Low	31 Å²	31	83.4 Å²	83.4	16%	0.159	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	137.3	167	-55.5	168.9	0	0	0	107.6	M48 Q91 R93	I29-M48 WeakPolarHBondContact CG2-O 3.19Å; I29-Q91 HydrophobicContact CB-CB 3.94Å; I29-Q91 HydrophobicContact CB-CG 4.36Å; I29-Q91 HydrophobicContact CD1-CB 4.23Å; I29-Q91 HydrophobicContact CG1-CB 4.46Å; I29-R93 HydrophobicContact CD1-CG 4.42Å
30	G	62.3	Low	64.1	Low	25 Å²	25	90 Å²	90	26%	0.258	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	100	-11.5	-174.1	0	0	0	0	0	114.8	R28 S32 H47	R28-G30 PolarHBondContact O-N 3.08Å; G30-S32 PolarHBondContact O-N 3.2Å; G30-H47 PolarHBondContact N-O 3.16Å
31	A	68.7	Low	64.1	Low	42 Å²	42	98 Å²	98	35%	0.347	51%	0.513	S	S	.	.			trans	-61.2	135.8	-179.7	0	0	0	0	0	112.7	R28 H47	R28-A31 WeakPolarHBondContact O-CB 3.29Å; R28-A31 PolarHBondContact O-N 2.9Å; A31-H47 HydrophobicContact CB-CB 3.81Å; A31-H47 WeakPolarHBondContact O-CA 3.39Å; A31-H47 WeakPolarHBondContact O-CB 3.06Å; A31-H47 PolarHBondContact O-N 2.81Å
32	S	72.9	Confident	64.8	Low	63 Å²	63	94 Å²	94	44%	0.441	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.9	-176	-54.6	0	0	0	0	112.6	G30 V34 M43	G30-S32 PolarHBondContact O-N 3.2Å; S32-V34 PolarHBondContact O-N 2.89Å; S32-M43 VanDerWaalsContact OG-CE 3.25Å; S32-M43 WeakPolarHBondContact OG-CE 3.02Å
33	L	77.6	Confident	65.7	Low	36 Å²	36	95.3 Å²	95.3	19%	0.188	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	104.7	159.4	177.4	65.9	0	0	0	107.9	Y16 M43 Y44 G45 F65	Y16-L33 HydrophobicContact CD2-CD2 4.03Å; Y16-L33 HydrophobicContact CG-CD2 3.86Å; L33-M43 CarbonylContact O-C 3.54Å; L33-Y44 PolarHBondContact O-N 3.17Å; L33-G45 PolarHBondContact N-O 3.29Å; L33-G45 PolarHBondContact O-N 3.07Å; L33-F65 HydrophobicContact CB-CB 4.35Å; L33-F65 HydrophobicContact CB-CD1 3.43Å; L33-F65 VanDerWaalsContact CB-CD1 3.43Å; L33-F65 HydrophobicContact CB-CE1 3.74Å; L33-F65 HydrophobicContact CB-CG 3.88Å; L33-F65 HydrophobicContact CB-CZ 4.45Å; L33-F65 HydrophobicContact CD2-CB 4.26Å; L33-F65 HydrophobicContact CD2-CD2 4.3Å; L33-F65 HydrophobicContact CD2-CG 4.14Å; L33-F65 HydrophobicContact CG-CD1 4.46Å
34	V	77	Confident	66.9	Low	67 Å²	67	93.6 Å²	93.6	41%	0.406	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.7	175.3	-64.1	0	0	0	0	110	S32 W41 V42 M43	S32-V34 PolarHBondContact O-N 2.89Å; V34-W41 HydrophobicContact CB-CE3 4.28Å; V34-W41 HydrophobicContact CG2-CE3 4.05Å; V34-W41 HydrophobicContact CG2-CZ3 4.35Å; V34-V42 CarbonylContact C-O 3.49Å; V34-V42 VanDerWaalsContact CA-O 3.3Å; V34-V42 WeakPolarHBondContact CA-O 3.46Å; V34-M43 HydrophobicContact CG1-CB 4.25Å; V34-M43 HydrophobicContact CG1-CG 4.46Å
35	C	74.6	Confident	67.9	Low	54 Å²	54	84.2 Å²	84.2	37%	0.365	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.6	170.1	-50	0	0	0	0	109.5	K37 V42 Y44	C35-K37 PolarHBondContact O-N 2.76Å; C35-V42 PolarHBondContact N-O 2.73Å; C35-V42 PolarHBondContact O-N 2.87Å; C35-Y44 HydrophobicContact CB-CD2 3.73Å; C35-Y44 HydrophobicContact CB-CE2 3.51Å
36	L	71.5	Confident	69	Low	101 Å²	101	80.6 Å²	80.6	53%	0.529	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	117.9	174.9	-172.3	70.3	0	0	0	108.8	W41	L36-W41 HydrophobicContact CB-CE3 4.16Å; L36-W41 HydrophobicContact CB-CH2 4.28Å; L36-W41 HydrophobicContact CB-CZ3 4.03Å; L36-W41 HydrophobicContact CD1-CD2 4.08Å; L36-W41 HydrophobicContact CD1-CG 4.37Å; L36-W41 HydrophobicContact CD1-CZ2 4.37Å
37	K	73.1	Confident	70.2	Confident	111 Å²	111	77 Å²	77	48%	0.483	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.2	174.6	-178	-178.8	175.4	-174.9	0	108.6	C35 F39 R40 V42	C35-K37 PolarHBondContact O-N 2.76Å; K37-F39 VanDerWaalsContact C-N 3.29Å; K37-F39 PolarHBondContact O-N 3.15Å; K37-R40 PolarHBondContact N-O 2.64Å; K37-R40 WeakPolarHBondContact O-CA 3.36Å; K37-R40 PolarHBondContact O-N 2.99Å; K37-V42 HydrophobicContact CB-CG2 4.09Å
38	D	79	Confident	70.7	Confident	127 Å²	127	74.3 Å²	74.3	68%	0.679	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	45.6	178.6	-51.2	-40.6	0	0	0	113.1	R40	D38-R40 PolarHBondContact O-N 3.49Å; D38-R40 VanDerWaalsContact O-N 3.14Å
39	F	75.2	Confident	71	Confident	201 Å²	201	69.3 Å²	69.3	88%	0.882	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	17.1	-176	-53.8	-83.7	0	0	0	115.1	K37	K37-F39 VanDerWaalsContact C-N 3.29Å; K37-F39 PolarHBondContact O-N 3.15Å
40	R	56	Low	71.2	Confident	192 Å²	192	68.5 Å²	68.5	73%	0.725	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.3	175	-62.1	-179.3	-177.9	-175.1	0.1	110.3	K37 D38 V42	K37-R40 PolarHBondContact N-O 2.64Å; K37-R40 WeakPolarHBondContact O-CA 3.36Å; K37-R40 PolarHBondContact O-N 2.99Å; D38-R40 PolarHBondContact O-N 3.49Å; D38-R40 VanDerWaalsContact O-N 3.14Å; R40-V42 PolarHBondContact O-N 2.69Å
41	W	67.6	Low	70.9	Confident	189 Å²	189	67.5 Å²	67.5	72%	0.716	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.6	171.3	-68.4	103.7	0	0	0	109.1	V34 L36	V34-W41 HydrophobicContact CB-CE3 4.28Å; V34-W41 HydrophobicContact CG2-CE3 4.05Å; V34-W41 HydrophobicContact CG2-CZ3 4.35Å; L36-W41 HydrophobicContact CB-CE3 4.16Å; L36-W41 HydrophobicContact CB-CH2 4.28Å; L36-W41 HydrophobicContact CB-CZ3 4.03Å; L36-W41 HydrophobicContact CD1-CD2 4.08Å; L36-W41 HydrophobicContact CD1-CG 4.37Å; L36-W41 HydrophobicContact CD1-CZ2 4.37Å
42	V	71.5	Confident	70.4	Confident	56 Å²	56	73 Å²	73	34%	0.339	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.7	179.2	-178.7	0	0	0	0	108.4	V34 C35 K37 R40 Y44	V34-V42 CarbonylContact C-O 3.49Å; V34-V42 VanDerWaalsContact CA-O 3.3Å; V34-V42 WeakPolarHBondContact CA-O 3.46Å; C35-V42 PolarHBondContact N-O 2.73Å; C35-V42 PolarHBondContact O-N 2.87Å; K37-V42 HydrophobicContact CB-CG2 4.09Å; R40-V42 PolarHBondContact O-N 2.69Å; V42-Y44 HydrophobicContact CB-CD2 4.39Å; V42-Y44 HydrophobicContact CB-CE2 3.74Å; V42-Y44 HydrophobicContact CG1-CD2 4.33Å; V42-Y44 HydrophobicContact CG1-CE2 3.86Å; V42-Y44 WeakPolarHBondContact O-CD2 3.21Å; V42-Y44 WeakPolarHBondContact O-CE2 3.33Å
43	M	76.8	Confident	69.5	Low	55 Å²	55	71 Å²	71	27%	0.271	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	118.9	175.1	-173.9	176.9	176.3	0	0	109.9	S32 L33 V34 G45 V46 V68	S32-M43 VanDerWaalsContact OG-CE 3.25Å; S32-M43 WeakPolarHBondContact OG-CE 3.02Å; L33-M43 CarbonylContact O-C 3.54Å; V34-M43 HydrophobicContact CG1-CB 4.25Å; V34-M43 HydrophobicContact CG1-CG 4.46Å; M43-G45 WeakPolarHBondContact CE-O 3.2Å; M43-V46 HydrophobicContact CE-CB 4.38Å; M43-V46 HydrophobicContact CE-CG2 3.33Å; M43-V68 HydrophobicContact CE-CG2 3.89Å; M43-V68 HydrophobicContact CG-CG1 4.5Å; M43-V68 HydrophobicContact CG-CG2 4.11Å; M43-V68 HydrophobicContact SD-CG2 4.44Å
44	Y	77.1	Confident	68.3	Low	66 Å²	66	81.9 Å²	81.9	26%	0.259	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-35.1	-179.9	-75.4	-93.9	0	0	0	112	Y16 L33 C35 V42 Q67 V68	Y16-Y44 HydrophobicContact CE2-CD1 4.39Å; Y16-Y44 WeakPolarHBondContact CE2-O 3.22Å; L33-Y44 PolarHBondContact O-N 3.17Å; C35-Y44 HydrophobicContact CB-CD2 3.73Å; C35-Y44 HydrophobicContact CB-CE2 3.51Å; V42-Y44 HydrophobicContact CB-CD2 4.39Å; V42-Y44 HydrophobicContact CB-CE2 3.74Å; V42-Y44 HydrophobicContact CG1-CD2 4.33Å; V42-Y44 HydrophobicContact CG1-CE2 3.86Å; V42-Y44 WeakPolarHBondContact O-CD2 3.21Å; V42-Y44 WeakPolarHBondContact O-CE2 3.33Å; Y44-Q67 WeakPolarHBondContact O-CA 3.25Å; Y44-V68 WeakPolarHBondContact O-CB 3.48Å; Y44-V68 PolarHBondContact O-N 3.16Å
45	G	73.7	Confident	67.2	Low	0 Å²	0	87.4 Å²	87.4	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	162.5	-172.3	0	0	0	0	0	113.9	L33 M43 S66 V68	L33-G45 PolarHBondContact N-O 3.29Å; L33-G45 PolarHBondContact O-N 3.07Å; M43-G45 WeakPolarHBondContact CE-O 3.2Å; G45-S66 CarbonylContact C-O 3.44Å; G45-S66 WeakPolarHBondContact CA-O 3.46Å; G45-V68 VanDerWaalsContact CA-CG2 3.49Å
46	V	72.9	Confident	66.3	Low	3 Å²	3	86.4 Å²	86.4	2%	0.018	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.3	168.2	-179.8	0	0	0	0	107.9	M43 M48 F65 S66 V68 M273	M43-V46 HydrophobicContact CE-CB 4.38Å; M43-V46 HydrophobicContact CE-CG2 3.33Å; V46-M48 WeakPolarHBondContact O-CG 3.45Å; V46-M48 PolarHBondContact O-N 3.29Å; V46-M48 VanDerWaalsContact O-N 3.15Å; V46-F65 CarbonylContact O-C 3.56Å; V46-F65 WeakPolarHBondContact O-CA 3.38Å; V46-S66 PolarHBondContact N-O 2.9Å; V46-S66 PolarHBondContact O-N 3.07Å; V46-V68 HydrophobicContact CG2-CG2 3.86Å; V46-M273 HydrophobicContact CG1-CE 4.45Å; V46-M273 HydrophobicContact CG2-CE 3.99Å; V46-M273 HydrophobicContact CG2-SD 4.22Å
47	H	73.4	Confident	65.2	Low	2 Å²	2	84.8 Å²	84.8	1%	0.009	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	115.6	180	179	-119.5	0	0	0	108.4	R28 G30 A31 N49 D63 F65	R28-H47 PolarHBondContact O-ND1 3.08Å; G30-H47 PolarHBondContact N-O 3.16Å; A31-H47 HydrophobicContact CB-CB 3.81Å; A31-H47 WeakPolarHBondContact O-CA 3.39Å; A31-H47 WeakPolarHBondContact O-CB 3.06Å; A31-H47 PolarHBondContact O-N 2.81Å; H47-N49 PolarHBondContact NE2-O 3.2Å; H47-D63 IonicContact NE2-OD1 2.78Å; H47-F65 HydrophobicContact CB-CD1 3.69Å; H47-F65 HydrophobicContact CB-CE1 3.51Å; H47-F65 HydrophobicContact CB-CZ 4.3Å; H47-F65 AromaticContact CD2-CZ 3.99Å; H47-F65 VanDerWaalsContact N-CD1 3.27Å
48	M	66.6	Low	64.4	Low	34 Å²	34	90.1 Å²	90.1	17%	0.167	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-44.6	-177.1	-65.3	-55.6	-76.2	0	0	109.8	I29 V46 L64 S66 Y231	I29-M48 WeakPolarHBondContact CG2-O 3.19Å; V46-M48 WeakPolarHBondContact O-CG 3.45Å; V46-M48 PolarHBondContact O-N 3.29Å; V46-M48 VanDerWaalsContact O-N 3.15Å; M48-L64 PolarHBondContact N-O 3.02Å; M48-S66 VanDerWaalsContact CG-N 3.33Å; M48-Y231 HydrophobicContact CB-CD1 4Å; M48-Y231 HydrophobicContact CB-CE1 3.67Å; M48-Y231 HydrophobicContact CE-CD1 4.38Å; M48-Y231 HydrophobicContact CE-CE1 4.23Å; M48-Y231 VanDerWaalsContact O-CE1 3.27Å; M48-Y231 WeakPolarHBondContact O-CE1 3.49Å; M48-Y231 VanDerWaalsContact O-CZ 3.31Å; M48-Y231 PolarHBondContact O-OH 2.99Å
49	N	64.1	Low	63.4	Low	0 Å²	0	89.9 Å²	89.9	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	152.3	-167.2	-162.5	-17.1	0	0	0	112.8	H47 L64 R93 Y231 R237	H47-N49 PolarHBondContact NE2-O 3.2Å; N49-L64 PolarHBondContact N-O 3.18Å; N49-L64 PolarHBondContact O-N 3.2Å; N49-R93 PolarHBondContact ND2-NH2 2.84Å; N49-R93 PolarHBondContact OD1-NH1 3.03Å; N49-R93 PolarHBondContact OD1-NH2 3.43Å; N49-Y231 HydrophobicContact CB-CD1 4.32Å; N49-Y231 HydrophobicContact CB-CE1 3.82Å; N49-Y231 HydrophobicContact CB-CE2 4.07Å; N49-Y231 VanDerWaalsContact ND2-CD2 3.29Å; N49-Y231 WeakPolarHBondContact ND2-CD2 3.36Å; N49-Y231 WeakPolarHBondContact ND2-CE2 3.43Å; N49-R237 PolarHBondContact ND2-NH1 3.5Å
50	V	62.8	Low	62.7	Low	14 Å²	14	84.9 Å²	84.9	9%	0.085	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.3	160.8	-171.1	0	0	0	0	110.8	Y52 E61 D63	V50-Y52 HydrophobicContact CG1-CE1 4.45Å; V50-Y52 HydrophobicContact CG1-CE2 4.44Å; V50-E61 HydrophobicContact CG1-CB 3.71Å; V50-E61 HydrophobicContact CG1-CG 3.94Å; V50-D63 WeakPolarHBondContact CG2-OD1 3.38Å
51	L	57.6	Low	63.2	Low	4 Å²	4	76.6 Å²	76.6	2%	0.021	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119	173.4	-62.5	179.7	0	0	0	110.6	L6 V62 L64 L234	L6-L51 HydrophobicContact CD1-CD1 3.8Å; L6-L51 HydrophobicContact CD2-CB 4.07Å; L6-L51 HydrophobicContact CD2-CD1 3.53Å; L6-L51 HydrophobicContact CD2-CG 4.45Å; L6-L51 HydrophobicContact CG-CD1 4.25Å; L51-V62 HydrophobicContact CB-CB 4.46Å; L51-V62 PolarHBondContact N-O 2.62Å; L51-V62 PolarHBondContact O-N 3.09Å; L51-L64 HydrophobicContact CD1-CB 4.44Å; L51-L234 HydrophobicContact CD1-CD2 4.43Å; L51-L234 HydrophobicContact CD2-CD1 3.49Å; L51-L234 VanDerWaalsContact CD2-CD1 3.49Å; L51-L234 HydrophobicContact CD2-CD2 3.8Å; L51-L234 HydrophobicContact CD2-CG 4.25Å
52	Y	58.1	Low	63.3	Low	159 Å²	159	67.7 Å²	67.7	62%	0.624	31%	0.306	S	S	*	.			trans	-84.9	114.7	166.7	-64.1	-73	0	0	0	109	V50 E61	V50-Y52 HydrophobicContact CG1-CE1 4.45Å; V50-Y52 HydrophobicContact CG1-CE2 4.44Å; Y52-E61 HydrophobicContact CE1-CG 3.99Å; Y52-E61 VanDerWaalsContact CE1-OE1 3.32Å; Y52-E61 WeakPolarHBondContact CE1-OE1 3.33Å; Y52-E61 PolarHBondContact OH-OE1 3.09Å
53	T	52.9	Low	63.4	Low	21 Å²	21	65 Å²	65	13%	0.129	29%	0.29	C	S	.	.			trans	-103.5	133.8	171.3	81.1	0	0	0	0	108.5	L6 K55 I56 V62	L6-T53 HydrophobicContact CD2-CG2 3.65Å; T53-K55 PolarHBondContact O-N 2.9Å; T53-K55 VanDerWaalsContact O-N 3.11Å; T53-I56 PolarHBondContact O-N 2.59Å; T53-I56 WeakPolarHBondContact OG1-CG1 3.36Å; T53-I56 PolarHBondContact OG1-N 3.15Å; T53-V62 HydrophobicContact CG2-CG2 4.43Å
54	R	53.7	Low	63.3	Low	264 Å²	264	62.7 Å²	62.7	100%	0.996	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.8	173.8	-73.5	-174.2	-179.3	178.6	0.2	113.1
55	K	52.7	Low	63.1	Low	182 Å²	182	60.2 Å²	60.2	79%	0.791	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-15.9	-174.8	-74.2	-172.8	176.8	-179.1	0	113.8	T53	T53-K55 PolarHBondContact O-N 2.9Å; T53-K55 VanDerWaalsContact O-N 3.11Å
56	I	55	Low	63	Low	34 Å²	34	60.6 Å²	60.6	17%	0.174	27%	0.272	C	S	.	.	S	Bend	trans	-111.9	131.5	177	-49.5	170.4	0	0	0	106.7	L5 T53 Y60 V62	L5-I56 HydrophobicContact CB-CD1 4.29Å; L5-I56 HydrophobicContact CD1-CD1 3.66Å; L5-I56 HydrophobicContact CD2-CD1 3.62Å; L5-I56 HydrophobicContact CD2-CG1 3.76Å; L5-I56 HydrophobicContact CG-CD1 4.04Å; T53-I56 PolarHBondContact O-N 2.59Å; T53-I56 WeakPolarHBondContact OG1-CG1 3.36Å; T53-I56 PolarHBondContact OG1-N 3.15Å; I56-Y60 HydrophobicContact CG2-CD2 3.94Å; I56-Y60 HydrophobicContact CG2-CG 4.08Å; I56-V62 HydrophobicContact CD1-CG2 3.45Å; I56-V62 VanDerWaalsContact CD1-CG2 3.45Å
57	S	49.2	Very low	63	Low	66 Å²	66	62 Å²	62	46%	0.462	28%	0.278	S	S	.	.			trans	-51.7	160.4	-176.5	63	0	0	0	0	111.7	L59 Y60	S57-L59 PolarHBondContact O-N 2.89Å; S57-Y60 PolarHBondContact O-N 2.72Å
58	K	57	Low	62.9	Low	224 Å²	224	62.1 Å²	62.1	97%	0.974	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-2.7	177.2	-68.9	-178.1	177.6	177.7	0	115.5
59	L	56.9	Low	62.9	Low	121 Å²	121	67.9 Å²	67.9	63%	0.634	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-16.8	-173.7	-68.1	164.9	0	0	0	114	S57	S57-L59 PolarHBondContact O-N 2.89Å
60	Y	60.3	Low	62.5	Low	96 Å²	96	70.7 Å²	70.7	38%	0.376	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.5	-177.1	-60.2	-88	0	0	0	111.8	I19 G20 M21 I56 S57	I19-Y60 HydrophobicContact CG2-CD1 4.33Å; G20-Y60 WeakPolarHBondContact O-CA 3.3Å; M21-Y60 HydrophobicContact CE-CE1 3.7Å; M21-Y60 WeakPolarHBondContact CE-OH 3.31Å; M21-Y60 HydrophobicContact CG-CD1 3.87Å; M21-Y60 HydrophobicContact CG-CE1 3.54Å; M21-Y60 HydrophobicContact SD-CE1 4.48Å; I56-Y60 HydrophobicContact CG2-CD2 3.94Å; I56-Y60 HydrophobicContact CG2-CG 4.08Å; S57-Y60 PolarHBondContact O-N 2.72Å
61	E	67.6	Low	62.1	Low	19 Å²	19	70.6 Å²	70.6	9%	0.089	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138	176.1	-71	-173.3	154.7	0	0	108.6	G20 V50 Y52	G20-E61 PolarHBondContact N-O 3.19Å; G20-E61 VanDerWaalsContact N-O 3.11Å; G20-E61 PolarHBondContact O-N 3.27Å; V50-E61 HydrophobicContact CG1-CB 3.71Å; V50-E61 HydrophobicContact CG1-CG 3.94Å; Y52-E61 HydrophobicContact CE1-CG 3.99Å; Y52-E61 VanDerWaalsContact CE1-OE1 3.32Å; Y52-E61 WeakPolarHBondContact CE1-OE1 3.33Å; Y52-E61 PolarHBondContact OH-OE1 3.09Å
62	V	69.5	Low	61.9	Low	1 Å²	1	75 Å²	75	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	107.7	174.8	-173	0	0	0	0	107.7	L6 C17 S18 I19 L51 T53 I56	L6-V62 HydrophobicContact CD1-CG1 3.84Å; L6-V62 HydrophobicContact CD2-CB 4.35Å; L6-V62 HydrophobicContact CD2-CG1 3.98Å; L6-V62 HydrophobicContact CG-CG1 4.12Å; C17-V62 HydrophobicContact CB-CG1 4.29Å; C17-V62 WeakPolarHBondContact SG-CG1 3.14Å; S18-V62 CarbonylContact O-C 3.6Å; S18-V62 WeakPolarHBondContact O-CA 3.34Å; I19-V62 HydrophobicContact CG1-CG1 4.33Å; I19-V62 HydrophobicContact CG1-CG2 4.31Å; L51-V62 HydrophobicContact CB-CB 4.46Å; L51-V62 PolarHBondContact N-O 2.62Å; L51-V62 PolarHBondContact O-N 3.09Å; T53-V62 HydrophobicContact CG2-CG2 4.43Å; I56-V62 HydrophobicContact CD1-CG2 3.45Å; I56-V62 VanDerWaalsContact CD1-CG2 3.45Å
63	D	73.8	Confident	61.6	Low	1 Å²	1	72.1 Å²	72.1	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.5	177.8	-62.7	-37.7	0	0	0	109.3	C17 S18 K27 H47 V50 F65	C17-D63 CarbonylContact C-O 3.6Å; C17-D63 WeakPolarHBondContact CA-O 3.41Å; C17-D63 WeakPolarHBondContact CB-O 3.25Å; S18-D63 PolarHBondContact N-O 3.18Å; S18-D63 PolarHBondContact O-N 3.09Å; K27-D63 VanDerWaalsContact CD-OD2 3.32Å; K27-D63 WeakPolarHBondContact CD-OD2 3.4Å; K27-D63 IonicContact NZ-OD2 3.63Å; K27-D63 PolarHBondContact NZ-OD2 2.83Å; H47-D63 IonicContact NE2-OD1 2.78Å; V50-D63 WeakPolarHBondContact CG2-OD1 3.38Å; D63-F65 HydrophobicContact CB-CD2 4.34Å; D63-F65 HydrophobicContact CB-CE2 3.48Å; D63-F65 VanDerWaalsContact CB-CE2 3.48Å; D63-F65 HydrophobicContact CB-CZ 3.96Å
64	L	73.4	Confident	61.4	Low	6 Å²	6	75.4 Å²	75.4	3%	0.031	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.8	175	-164.7	75.9	0	0	0	109.3	L6 Y10 D15 C17 M48 N49 L51	L6-L64 HydrophobicContact CD1-CD1 4.18Å; Y10-L64 HydrophobicContact CD2-CD1 3.87Å; Y10-L64 HydrophobicContact CE2-CD1 4.45Å; D15-L64 HydrophobicContact CB-CD1 3.7Å; D15-L64 HydrophobicContact CB-CG 4.18Å; C17-L64 HydrophobicContact CB-CD1 4.16Å; M48-L64 PolarHBondContact N-O 3.02Å; N49-L64 PolarHBondContact N-O 3.18Å; N49-L64 PolarHBondContact O-N 3.2Å; L51-L64 HydrophobicContact CD1-CB 4.44Å
65	F	74.5	Confident	61.1	Low	13 Å²	13	65.3 Å²	65.3	6%	0.057	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.8	177.1	-57.7	-104.3	0	0	0	109.9	D15 Y16 S18 L33 V46 H47 D63	D15-F65 CarbonylContact C-O 3.55Å; D15-F65 VanDerWaalsContact CA-O 3.27Å; D15-F65 WeakPolarHBondContact CA-O 3.47Å; Y16-F65 PolarHBondContact N-O 2.86Å; Y16-F65 PolarHBondContact O-N 3.26Å; S18-F65 WeakPolarHBondContact OG-CE2 3.37Å; L33-F65 HydrophobicContact CB-CB 4.35Å; L33-F65 HydrophobicContact CB-CD1 3.43Å; L33-F65 VanDerWaalsContact CB-CD1 3.43Å; L33-F65 HydrophobicContact CB-CE1 3.74Å; L33-F65 HydrophobicContact CB-CG 3.88Å; L33-F65 HydrophobicContact CB-CZ 4.45Å; L33-F65 HydrophobicContact CD2-CB 4.26Å; L33-F65 HydrophobicContact CD2-CD2 4.3Å; L33-F65 HydrophobicContact CD2-CG 4.14Å; L33-F65 HydrophobicContact CG-CD1 4.46Å; V46-F65 CarbonylContact O-C 3.56Å; V46-F65 WeakPolarHBondContact O-CA 3.38Å; H47-F65 HydrophobicContact CB-CD1 3.69Å; H47-F65 HydrophobicContact CB-CE1 3.51Å; H47-F65 HydrophobicContact CB-CZ 4.3Å; H47-F65 AromaticContact CD2-CZ 3.99Å; H47-F65 VanDerWaalsContact N-CD1 3.27Å; D63-F65 HydrophobicContact CB-CD2 4.34Å; D63-F65 HydrophobicContact CB-CE2 3.48Å; D63-F65 VanDerWaalsContact CB-CE2 3.48Å; D63-F65 HydrophobicContact CB-CZ 3.96Å
66	S	71.2	Confident	60.6	Low	9 Å²	9	60.9 Å²	60.9	6%	0.063	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	134	172.6	-176.6	0	0	0	0	108.8	G45 V46 M48	G45-S66 CarbonylContact C-O 3.44Å; G45-S66 WeakPolarHBondContact CA-O 3.46Å; V46-S66 PolarHBondContact N-O 2.9Å; V46-S66 PolarHBondContact O-N 3.07Å; M48-S66 VanDerWaalsContact CG-N 3.33Å
67	Q	73.5	Confident	60	Low	31 Å²	31	68.7 Å²	68.7	15%	0.145	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	138.6	176.9	-60.8	-164.5	24.8	0	0	111.1	P12 L14 Y16 Y44 P70 I71	P12-Q67 PolarHBondContact O-NE2 2.95Å; L14-Q67 WeakPolarHBondContact O-CG 3.4Å; L14-Q67 PolarHBondContact O-N 3.09Å; Y16-Q67 HydrophobicContact CD2-CB 4.35Å; Y16-Q67 HydrophobicContact CD2-CG 3.67Å; Y16-Q67 HydrophobicContact CE2-CB 3.94Å; Y16-Q67 HydrophobicContact CE2-CG 3.4Å; Y16-Q67 HydrophobicContact CG-CG 4.43Å; Y44-Q67 WeakPolarHBondContact O-CA 3.25Å; Q67-P70 HydrophobicContact CB-CG 4.42Å; Q67-I71 VanDerWaalsContact O-CD1 3.25Å; Q67-I71 WeakPolarHBondContact O-CD1 3.37Å; Q67-I71 WeakPolarHBondContact O-CG1 3.11Å
68	V	69.7	Low	59.6	Low	5 Å²	5	69.8 Å²	69.8	3%	0.03	36%	0.358	C	S	.	.	S	Bend	trans	-87.9	-23.3	-176.5	168.9	0	0	0	0	111.7	M43 Y44 G45 V46 I71 L72	M43-V68 HydrophobicContact CE-CG2 3.89Å; M43-V68 HydrophobicContact CG-CG1 4.5Å; M43-V68 HydrophobicContact CG-CG2 4.11Å; M43-V68 HydrophobicContact SD-CG2 4.44Å; Y44-V68 WeakPolarHBondContact O-CB 3.48Å; Y44-V68 PolarHBondContact O-N 3.16Å; G45-V68 VanDerWaalsContact CA-CG2 3.49Å; V46-V68 HydrophobicContact CG2-CG2 3.86Å; V68-I71 CarbonylContact O-C 3.6Å; V68-I71 WeakPolarHBondContact O-CA 3.4Å; V68-I71 WeakPolarHBondContact O-CB 3.39Å; V68-I71 PolarHBondContact O-N 3.19Å; V68-L72 HydrophobicContact CG1-CD1 3.52Å; V68-L72 HydrophobicContact CG1-CD2 3.83Å; V68-L72 HydrophobicContact CG1-CG 3.37Å; V68-L72 WeakPolarHBondContact O-CG 3.4Å; V68-L72 PolarHBondContact O-N 2.89Å
69	H	67	Low	58.5	Low	155 Å²	155	67.7 Å²	67.7	72%	0.718	36%	0.357	S	S	*	.	H	α-helix	trans	-60.7	-45.8	-179.2	-173.3	65	0	0	0	114.4	I71	H69-I71 PolarHBondContact O-N 3.42Å
70	P	56.8	Low	57.6	Low	59 Å²	59	65 Å²	65	38%	0.383	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-30.3	172.5	-22	34	0	0	0	112.5	Q67 S73	Q67-P70 HydrophobicContact CB-CG 4.42Å; P70-S73 PolarHBondContact O-OG 2.77Å
71	I	54.2	Low	56.3	Low	13 Å²	13	65.3 Å²	65.3	7%	0.067	37%	0.365	C	S	.	.	H	α-helix	trans	-80.9	-44.4	-174.5	-62.3	177.1	0	0	0	111.7	Q67 V68 H69 S73 E74 P271 M273	Q67-I71 VanDerWaalsContact O-CD1 3.25Å; Q67-I71 WeakPolarHBondContact O-CD1 3.37Å; Q67-I71 WeakPolarHBondContact O-CG1 3.11Å; V68-I71 CarbonylContact O-C 3.6Å; V68-I71 WeakPolarHBondContact O-CA 3.4Å; V68-I71 WeakPolarHBondContact O-CB 3.39Å; V68-I71 PolarHBondContact O-N 3.19Å; H69-I71 PolarHBondContact O-N 3.42Å; I71-S73 PolarHBondContact O-N 3.3Å; I71-E74 PolarHBondContact O-N 3.35Å; I71-E74 VanDerWaalsContact O-N 3.1Å; I71-P271 HydrophobicContact CG1-CG 4.27Å; I71-M273 HydrophobicContact CG2-CB 4.13Å; I71-M273 HydrophobicContact CG2-CG 3.25Å
72	L	53.3	Low	55	Low	95 Å²	95	69.4 Å²	69.4	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-64.6	-28.7	-178.9	-70	178.7	0	0	0	112.4	V68 E74 L75	V68-L72 HydrophobicContact CG1-CD1 3.52Å; V68-L72 HydrophobicContact CG1-CD2 3.83Å; V68-L72 HydrophobicContact CG1-CG 3.37Å; V68-L72 WeakPolarHBondContact O-CG 3.4Å; V68-L72 PolarHBondContact O-N 2.89Å; L72-E74 PolarHBondContact O-N 2.8Å; L72-E74 VanDerWaalsContact O-N 3.1Å; L72-L75 HydrophobicContact CD2-CD1 3.7Å; L72-L75 PolarHBondContact O-N 3Å; L72-L75 VanDerWaalsContact O-N 3.1Å
73	S	51.7	Low	53.3	Low	99 Å²	99	75.3 Å²	75.3	69%	0.692	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.5	175.3	74	0	0	0	0	113.5	P70 I71	P70-S73 PolarHBondContact O-OG 2.77Å; I71-S73 PolarHBondContact O-N 3.3Å
74	E	48.2	Very low	51.6	Low	90 Å²	90	79.9 Å²	79.9	42%	0.421	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-0.3	177.8	-60.7	-158.9	170.2	0	0	114.2	I71 L72 K270 K354	I71-E74 PolarHBondContact O-N 3.35Å; I71-E74 VanDerWaalsContact O-N 3.1Å; L72-E74 PolarHBondContact O-N 2.8Å; L72-E74 VanDerWaalsContact O-N 3.1Å; E74-K270 IonicContact OE1-NZ 2.96Å; E74-K354 PolarHBondContact O-NZ 2.98Å
75	L	46.9	Very low	50	Low	52 Å²	52	81.8 Å²	81.8	27%	0.272	47%	0.465	S	S	.	.	S	Bend	trans	-93.1	133	-179.6	-62.9	-176.2	0	0	0	111.5	L72 M273	L72-L75 HydrophobicContact CD2-CD1 3.7Å; L72-L75 PolarHBondContact O-N 3Å; L72-L75 VanDerWaalsContact O-N 3.1Å; L75-M273 HydrophobicContact CD1-CB 4.16Å; L75-M273 HydrophobicContact CD2-CB 4.07Å; L75-M273 WeakPolarHBondContact CD2-O 3.14Å
76	P	41.8	Very low	48.4	Very low	89 Å²	89	88.6 Å²	88.6	58%	0.578	50%	0.496	S	S	*	.			trans	-62.9	140.9	166.9	26.6	-30.2	0	0	0	109.3	T78	P76-T78 PolarHBondContact O-N 3.08Å
77	E	44	Very low	47.3	Very low	198 Å²	198	94.1 Å²	94.1	93%	0.925	53%	0.525	S	S	*	.			trans	-58.1	112.4	172.4	-67.8	-176.7	171.5	0	0	109
78	T	41	Very low	46.1	Very low	90 Å²	90	94.2 Å²	94.2	55%	0.552	53%	0.529	S	S	*	.			trans	-104.5	127	174.4	58.4	0	0	0	0	109.5	P76 S80	P76-T78 PolarHBondContact O-N 3.08Å; T78-S80 PolarHBondContact O-N 3.33Å
79	N	33.4	Very low	45	Very low	179 Å²	179	96.2 Å²	96.2	96%	0.957	54%	0.542	S	S	*	.			trans	-75.4	8.4	174.2	-86.2	-11.5	0	0	0	114
80	S	37.2	Very low	43.9	Very low	66 Å²	66	92.9 Å²	92.9	46%	0.462	53%	0.527	S	S	.	.	S	Bend	trans	-90.8	132.1	-176.6	34.4	0	0	0	0	112.3	T78 I82	T78-S80 PolarHBondContact O-N 3.33Å; S80-I82 PolarHBondContact O-N 3.41Å
81	S	33.7	Very low	43.4	Very low	101 Å²	101	91.7 Å²	91.7	71%	0.706	52%	0.516	S	S	*	.			trans	-66.8	113.3	168.6	50.5	0	0	0	0	109.8	I83	S81-I83 PolarHBondContact O-N 2.81Å; S81-I83 VanDerWaalsContact O-N 3.13Å
82	I	40	Very low	42.4	Very low	106 Å²	106	100.3 Å²	100.3	54%	0.544	55%	0.548	S	S	.	.			trans	-71.8	103.7	173.9	-57.1	172.8	0	0	0	107.8	S80 L280	S80-I82 PolarHBondContact O-N 3.41Å; I82-L280 HydrophobicContact CD1-CD1 4.46Å; I82-L280 HydrophobicContact CD1-CD2 4.29Å; I82-L280 HydrophobicContact CG2-CB 4.36Å
83	I	33.4	Very low	41.5	Very low	124 Å²	124	99 Å²	99	64%	0.636	54%	0.536	S	S	*	.			trans	-87.6	125.9	172.4	-57.9	175.3	0	0	0	107.1	S81 D85	S81-I83 PolarHBondContact O-N 2.81Å; S81-I83 VanDerWaalsContact O-N 3.13Å; I83-D85 VanDerWaalsContact C-N 3.32Å; I83-D85 PolarHBondContact O-N 2.95Å
84	A	37.7	Very low	40.7	Very low	97 Å²	97	99.1 Å²	99.1	80%	0.802	53%	0.529	S	S	*	.			trans	-69.4	92.3	169.1	0	0	0	0	0	108.5
85	D	39.9	Very low	39.8	Very low	47 Å²	47	98.6 Å²	98.6	25%	0.251	53%	0.529	S	S	.	.			trans	-76.4	125.3	172.7	-168.3	-20.3	0	0	0	109.2	I83 N87 C88 R393	I83-D85 VanDerWaalsContact C-N 3.32Å; I83-D85 PolarHBondContact O-N 2.95Å; D85-N87 PolarHBondContact O-N 2.8Å; D85-N87 VanDerWaalsContact O-N 3.16Å; D85-N87 VanDerWaalsContact OD1-CB 3.29Å; D85-N87 WeakPolarHBondContact OD1-CB 3.29Å; D85-N87 PolarHBondContact OD1-N 3.46Å; D85-N87 PolarHBondContact OD1-ND2 2.99Å; D85-C88 WeakPolarHBondContact O-CB 3.22Å; D85-C88 PolarHBondContact O-N 3.11Å; D85-C88 VanDerWaalsContact O-N 3.07Å; D85-C88 PolarHBondContact O-SG 2.96Å; D85-R393 IonicContact OD2-CZ 3.72Å; D85-R393 IonicContact OD2-NH1 3.89Å; D85-R393 IonicContact OD2-NH2 3.71Å; D85-R393 PolarHBondContact OD2-NH2 2.98Å
86	E	41.9	Very low	38.9	Very low	155 Å²	155	103.6 Å²	103.6	72%	0.724	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-19.3	176.6	-65.3	-167.3	161.9	0	0	112.7	R28 C88	R28-E86 PolarHBondContact NH1-O 3.2Å; E86-C88 VanDerWaalsContact C-N 3.29Å
87	N	47.6	Very low	38.2	Very low	125 Å²	125	104.3 Å²	104.3	67%	0.668	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	5.2	176.3	-62.6	-40.9	0	0	0	113.8	D85	D85-N87 PolarHBondContact O-N 2.8Å; D85-N87 VanDerWaalsContact O-N 3.16Å; D85-N87 VanDerWaalsContact OD1-CB 3.29Å; D85-N87 WeakPolarHBondContact OD1-CB 3.29Å; D85-N87 PolarHBondContact OD1-N 3.46Å; D85-N87 PolarHBondContact OD1-ND2 2.99Å
88	C	47.7	Very low	37.4	Very low	33 Å²	33	102.1 Å²	102.1	22%	0.223	56%	0.564	C	S	.	*	S	Bend	trans	-51.4	132.2	172.6	-74.9	0	0	0	0	110.6	D85 E86 Q90 C279	D85-C88 WeakPolarHBondContact O-CB 3.22Å; D85-C88 PolarHBondContact O-N 3.11Å; D85-C88 VanDerWaalsContact O-N 3.07Å; D85-C88 PolarHBondContact O-SG 2.96Å; E86-C88 VanDerWaalsContact C-N 3.29Å; C88-Q90 WeakPolarHBondContact O-CA 3.48Å; C88-Q90 PolarHBondContact O-N 3.07Å; C88-C279 WeakPolarHBondContact CA-SG 3.02Å; C88-C279 HydrophobicContact CB-CB 3.74Å; C88-C279 WeakPolarHBondContact CB-SG 3.28Å; C88-C279 WeakPolarHBondContact SG-CB 3.43Å; C88-C279 CovalentContact SG-SG 2Å; C88-C279 PolarHBondContact SG-SG 2.55Å
89	P	46.9	Very low	36.8	Very low	47 Å²	47	105 Å²	105	31%	0.305	58%	0.575	S	S	.	*			trans	-52.2	104.8	-176.8	15.5	-27	0	0	0	108	Q91 D277 M389	P89-Q91 PolarHBondContact O-N 2.84Å; P89-Q91 VanDerWaalsContact O-N 3.15Å; P89-D277 HydrophobicContact CG-CB 4.47Å; P89-M389 HydrophobicContact CG-CE 3.88Å
90	Q	43.7	Very low	36.3	Very low	86 Å²	86	105.8 Å²	105.8	40%	0.402	57%	0.57	S	S	.	*			trans	-63.8	128.7	-169.6	-70	-168.7	13.6	0	0	106.6	R28 C88 R92	R28-Q90 VanDerWaalsContact CZ-CD 3.49Å; C88-Q90 WeakPolarHBondContact O-CA 3.48Å; C88-Q90 PolarHBondContact O-N 3.07Å; Q90-R92 HydrophobicContact CB-CG 4.22Å; Q90-R92 PolarHBondContact O-N 2.82Å
91	Q	47.1	Very low	35.8	Very low	33 Å²	33	109 Å²	109	15%	0.154	58%	0.577	C	S	.	*			trans	-68.4	71.2	159.3	-65.4	-161.6	10.3	0	0	107.7	I29 P89 R93	I29-Q91 HydrophobicContact CB-CB 3.94Å; I29-Q91 HydrophobicContact CB-CG 4.36Å; I29-Q91 HydrophobicContact CD1-CB 4.23Å; I29-Q91 HydrophobicContact CG1-CB 4.46Å; P89-Q91 PolarHBondContact O-N 2.84Å; P89-Q91 VanDerWaalsContact O-N 3.15Å; Q91-R93 PolarHBondContact O-N 2.89Å
92	R	32.3	Very low	35.4	Very low	195 Å²	195	111.1 Å²	111.1	74%	0.736	58%	0.58	S	S	*	*			trans	-59.3	112.5	162.9	-77.6	-166.5	-175.8	-172.9	4.1	105.3	Q90	Q90-R92 HydrophobicContact CB-CG 4.22Å; Q90-R92 PolarHBondContact O-N 2.82Å
93	R	36.3	Very low	34.6	Very low	67 Å²	67	110.7 Å²	110.7	25%	0.253	58%	0.584	S	S	.	*			trans	-55.1	137.7	150.4	-83.7	-178.3	177.9	-176.8	-6.9	106.2	I29 N49 Q91 N95 Y231	I29-R93 HydrophobicContact CD1-CG 4.42Å; N49-R93 PolarHBondContact ND2-NH2 2.84Å; N49-R93 PolarHBondContact OD1-NH1 3.03Å; N49-R93 PolarHBondContact OD1-NH2 3.43Å; Q91-R93 PolarHBondContact O-N 2.89Å; R93-N95 HydrophobicContact CB-CB 4.25Å; R93-N95 PolarHBondContact O-N 2.87Å; R93-Y231 PolarHBondContact NH2-OH 2.94Å
94	N	33.8	Very low	34.3	Very low	102 Å²	102	114.3 Å²	114.3	55%	0.545	59%	0.591	S	S	.	*	S	Bend	trans	-67.3	58.5	166.2	-72.1	-25.8	0	0	0	109.8
95	N	29.1	Very low	33.6	Very low	79 Å²	79	117.4 Å²	117.4	42%	0.422	59%	0.594	S	S	.	*			trans	-112.2	83.4	168.8	-73.1	-2.2	0	0	0	104.4	R93 Y200	R93-N95 HydrophobicContact CB-CB 4.25Å; R93-N95 PolarHBondContact O-N 2.87Å; N95-Y200 VanDerWaalsContact OD1-CE1 3.32Å; N95-Y200 WeakPolarHBondContact OD1-CE1 3.43Å; N95-Y200 PolarHBondContact OD1-OH 2.81Å
96	D	29.3	Very low	33	Very low	157 Å²	157	123.8 Å²	123.8	84%	0.84	62%	0.62	S	S	*	*			trans	-164.5	103.6	134.5	-85.7	-26.4	0	0	0	105.9	D98	D96-D98 PolarHBondContact O-N 2.97Å
97	A	26.1	Very low	32	Very low	103 Å²	103	121.7 Å²	121.7	85%	0.851	62%	0.623	S	S	*	*			trans	-64.9	88.2	157.1	0	0	0	0	0	106.2
98	D	27.2	Very low	31.1	Very low	153 Å²	153	121.8 Å²	121.8	82%	0.818	63%	0.627	S	S	*	*			trans	-160.8	109.1	150.1	-96.9	-26.1	0	0	0	109.3	D96 K100	D96-D98 PolarHBondContact O-N 2.97Å; D98-K100 PolarHBondContact O-N 2.82Å
99	I	28.1	Very low	30.1	Very low	150 Å²	150	125.1 Å²	125.1	77%	0.769	65%	0.651	S	S	*	*			trans	-70.2	109.3	169.9	-64.7	169.4	0	0	0	106.4	E101	I99-E101 HydrophobicContact CG2-CG 3.63Å
100	K	24.2	Very low	29.2	Very low	195 Å²	195	127.9 Å²	127.9	85%	0.848	67%	0.672	S	S	*	*			trans	-109.8	101.3	140.7	-79.8	-172	177.1	-178.3	0	106.7	D98 L102	D98-K100 PolarHBondContact O-N 2.82Å; K100-L102 PolarHBondContact O-N 2.87Å; K100-L102 VanDerWaalsContact O-N 3.13Å
101	E	25.4	Very low	28.5	Very low	133 Å²	133	131.8 Å²	131.8	62%	0.621	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-52	116.2	163.6	-62.9	-165.2	142.4	0	0	107.6	I99 H137	I99-E101 HydrophobicContact CG2-CG 3.63Å; E101-H137 IonicContact OE1-ND1 3.54Å; E101-H137 IonicContact OE2-CE1 3.39Å; E101-H137 PolarHBondContact OE2-CE1 3.18Å; E101-H137 IonicContact OE2-ND1 2.78Å; E101-H137 PolarHBondContact OE2-ND1 3.08Å; E101-H137 IonicContact OE2-NE2 3.95Å
102	L	25.3	Very low	27.7	Very low	146 Å²	146	138.8 Å²	138.8	76%	0.764	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-84.2	124.1	169.4	-81.4	164.9	0	0	0	107.5	K100	K100-L102 PolarHBondContact O-N 2.87Å; K100-L102 VanDerWaalsContact O-N 3.13Å
103	P	23.4	Very low	27.6	Very low	97 Å²	97	135.5 Å²	135.5	63%	0.63	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-80.3	128	179	32.7	-29.9	0	0	0	108.5
104	Y	26.6	Very low	27.2	Very low	200 Å²	200	136.1 Å²	136.1	78%	0.784	77%	0.767	S	S	*	*			trans	-123	96.5	163.2	-93.3	-85.7	0	0	0	108.9
105	N	22.7	Very low	27.2	Very low	162 Å²	162	137.1 Å²	137.1	87%	0.866	78%	0.782	S	S	*	*			trans	-80.6	121.3	158.9	-93.1	-17.5	0	0	0	107.7
106	F	27.5	Very low	27.3	Very low	181 Å²	181	142.6 Å²	142.6	79%	0.794	81%	0.805	S	S	*	*			trans	-129.9	110.5	156.9	-111.1	-87.9	0	0	0	108.9	V108	F106-V108 HydrophobicContact CD1-CG2 4.48Å
107	S	22.3	Very low	27.3	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	80%	0.803	S	S	*	*			trans	-83	125.6	165.5	50.6	0	0	0	0	108.6
108	V	27.9	Very low	27.5	Very low	126 Å²	126	143.1 Å²	143.1	76%	0.764	80%	0.798	S	S	*	*			trans	-136.1	119.9	157.4	-176	0	0	0	0	108.9	F106	F106-V108 HydrophobicContact CD1-CG2 4.48Å
109	S	27.3	Very low	27.5	Very low	104 Å²	104	139.6 Å²	139.6	73%	0.727	80%	0.798	S	S	*	*			trans	-61.5	135.7	170.2	40.5	0	0	0	0	111
110	S	26.8	Very low	27.7	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	80%	0.797	S	S	*	*			trans	-61.5	128.3	165.7	48.1	0	0	0	0	111
111	D	30.8	Very low	28.3	Very low	168 Å²	168	135.9 Å²	135.9	90%	0.898	79%	0.793	S	S	*	*			trans	-145.3	116.5	144	-87.4	-35.7	0	0	0	109.5
112	L	28.8	Very low	29.3	Very low	179 Å²	179	133 Å²	133	94%	0.937	79%	0.788	S	S	*	*			trans	-90.2	123.3	174	-81.7	152.9	0	0	0	108.3
113	S	31.5	Very low	30.1	Very low	126 Å²	126	128.3 Å²	128.3	88%	0.881	77%	0.765	S	S	*	*			trans	-154.7	131.8	149.2	61.7	0	0	0	0	108.5
114	G	27.8	Very low	31.3	Very low	81 Å²	81	123.9 Å²	123.9	84%	0.835	74%	0.737	S	S	*	*			trans	-96.6	-176.9	-159.6	0	0	0	0	0	116
115	S	33.4	Very low	32.5	Very low	122 Å²	122	115.9 Å²	115.9	85%	0.853	71%	0.712	S	S	*	*			trans	-163.1	136.1	147	59.1	0	0	0	0	108.9
116	E	29.9	Very low	33.8	Very low	194 Å²	194	112.7 Å²	112.7	91%	0.907	70%	0.695	S	S	*	*			trans	-61.3	133.8	170.8	-63.8	169.5	135.8	0	0	110.4
117	D	30.2	Very low	35	Very low	149 Å²	149	104.2 Å²	104.2	80%	0.797	66%	0.658	S	S	*	*			trans	-159.3	164.5	143.5	-136.2	-24.1	0	0	0	112.5
118	T	29.8	Very low	36.3	Very low	123 Å²	123	105 Å²	105	76%	0.755	64%	0.644	S	S	*	*			trans	-93.1	133.2	-144	42.4	0	0	0	0	114.7
119	G	27.5	Very low	37.4	Very low	79 Å²	79	107 Å²	107	81%	0.814	64%	0.642	S	S	*	*			trans	66.3	49.3	136.2	0	0	0	0	0	120.9
120	V	32.1	Very low	37.9	Very low	121 Å²	121	103.6 Å²	103.6	73%	0.733	62%	0.616	S	S	*	*			trans	-144.4	109.8	157.1	-173.8	0	0	0	0	111.4	S122	V120-S122 PolarHBondContact O-N 2.58Å
121	N	38.3	Very low	38	Very low	145 Å²	145	101.4 Å²	101.4	78%	0.775	60%	0.599	S	S	*	*			trans	13.1	87.9	161	-65	-23.5	0	0	0	120.1	V123	N121-V123 PolarHBondContact O-N 3.32Å
122	S	44.6	Very low	38.1	Very low	74 Å²	74	99 Å²	99	52%	0.517	59%	0.585	S	S	.	*			trans	-84	73.2	175.5	72.7	0	0	0	0	113.6	V120 A124 A125	V120-S122 PolarHBondContact O-N 2.58Å; S122-A124 PolarHBondContact O-N 3.03Å; S122-A125 PolarHBondContact O-N 2.79Å; S122-A125 WeakPolarHBondContact OG-CB 3.36Å
123	V	44.1	Very low	38.2	Very low	46 Å²	46	93 Å²	93	28%	0.279	56%	0.556	S	S	.	*	H	α-helix	trans	-53.7	-36.1	173.7	177	0	0	0	0	111.7	N121 K335 L359	N121-V123 PolarHBondContact O-N 3.32Å; V123-K335 HydrophobicContact CG1-CG 4.05Å; V123-L359 HydrophobicContact CG1-CD2 3.87Å
124	A	47.1	Very low	37.9	Very low	5 Å²	5	97 Å²	97	4%	0.041	55%	0.551	C	S	.	*	H	α-helix	trans	-82.5	-15.5	-179.2	0	0	0	0	0	113.6	S122 R128 V400 Q402 F408	S122-A124 PolarHBondContact O-N 3.03Å; A124-R128 VanDerWaalsContact O-CG 3.28Å; A124-R128 WeakPolarHBondContact O-CG 3.22Å; A124-R128 PolarHBondContact O-N 3.18Å; A124-R128 VanDerWaalsContact O-N 3.13Å; A124-V400 HydrophobicContact CB-CG1 4.1Å; A124-V400 HydrophobicContact CB-CG2 4.46Å; A124-Q402 VanDerWaalsContact C-NE2 3.3Å; A124-Q402 HydrophobicContact CB-CG 4.08Å; A124-Q402 PolarHBondContact O-NE2 2.83Å; A124-F408 HydrophobicContact CB-CE1 4.42Å; A124-F408 HydrophobicContact CB-CZ 4.06Å
125	A	51.8	Low	37.8	Very low	32 Å²	32	99.1 Å²	99.1	26%	0.264	55%	0.548	S	S	.	.	H	α-helix	trans	-75	-33.7	174.4	0	0	0	0	0	112.3	S122 R128 K129	S122-A125 PolarHBondContact O-N 2.79Å; S122-A125 WeakPolarHBondContact OG-CB 3.36Å; A125-R128 WeakPolarHBondContact O-CB 3.39Å; A125-R128 PolarHBondContact O-N 2.88Å; A125-K129 PolarHBondContact O-N 2.97Å
126	D	51.2	Low	37.3	Very low	94 Å²	94	100 Å²	100	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-69.7	-35.7	175	-75.9	-27.7	0	0	0	111.9	R128 K129	D126-R128 VanDerWaalsContact C-N 3.33Å; D126-K129 PolarHBondContact O-N 3.46Å; D126-K129 IonicContact OD1-NZ 3.79Å; D126-K129 PolarHBondContact OD1-NZ 3.41Å
127	L	51.5	Low	37.2	Very low	3 Å²	3	95.9 Å²	95.9	2%	0.016	52%	0.522	C	S	.	.	H	α-helix	trans	-70.9	-26.8	173	-69.1	175.1	0	0	0	113	K129 L130 L359 F408	L127-K129 VanDerWaalsContact C-N 3.29Å; L127-K129 PolarHBondContact O-N 3.3Å; L127-L130 HydrophobicContact CD2-CD1 3.81Å; L127-L130 VanDerWaalsContact O-CB 3.27Å; L127-L130 WeakPolarHBondContact O-CB 3.13Å; L127-L130 PolarHBondContact O-N 2.05Å; L127-L359 HydrophobicContact CD1-CB 4.4Å; L127-L359 HydrophobicContact CD1-CD2 3.72Å; L127-L359 HydrophobicContact CD1-CG 3.8Å; L127-F408 HydrophobicContact CB-CE1 3.94Å; L127-F408 HydrophobicContact CD1-CD1 4.17Å; L127-F408 HydrophobicContact CD1-CE1 3.89Å
128	R	50.7	Low	37	Very low	130 Å²	130	93.3 Å²	93.3	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-69	-23.4	175.6	-84.3	178.2	177.5	-178.6	0.9	113.9	A124 A125 D126 L130	A124-R128 VanDerWaalsContact O-CG 3.28Å; A124-R128 WeakPolarHBondContact O-CG 3.22Å; A124-R128 PolarHBondContact O-N 3.18Å; A124-R128 VanDerWaalsContact O-N 3.13Å; A125-R128 WeakPolarHBondContact O-CB 3.39Å; A125-R128 PolarHBondContact O-N 2.88Å; D126-R128 VanDerWaalsContact C-N 3.33Å; R128-L130 PolarHBondContact O-N 3.01Å
129	K	51.1	Low	36.7	Very low	167 Å²	167	96.6 Å²	96.6	73%	0.726	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-13.1	173.4	-64.6	169.9	-173.2	158.8	0	112.1	A125 D126 L127	A125-K129 PolarHBondContact O-N 2.97Å; D126-K129 PolarHBondContact O-N 3.46Å; D126-K129 IonicContact OD1-NZ 3.79Å; D126-K129 PolarHBondContact OD1-NZ 3.41Å; L127-K129 VanDerWaalsContact C-N 3.29Å; L127-K129 PolarHBondContact O-N 3.3Å
130	L	36.7	Very low	36.8	Very low	33 Å²	33	103.2 Å²	103.2	17%	0.173	52%	0.523	C	S	.	.	S	Bend	trans	-78.2	135.6	175.9	-60.3	168	0	0	0	110.8	L127 R128 H333 R361 F364	L127-L130 HydrophobicContact CD2-CD1 3.81Å; L127-L130 VanDerWaalsContact O-CB 3.27Å; L127-L130 WeakPolarHBondContact O-CB 3.13Å; L127-L130 PolarHBondContact O-N 2.05Å; R128-L130 PolarHBondContact O-N 3.01Å; L130-H333 HydrophobicContact CD1-CB 3.93Å; L130-H333 HydrophobicContact CD2-CB 4.06Å; L130-R361 PolarHBondContact O-NH1 3.02Å; L130-F364 HydrophobicContact CB-CZ 4.43Å
131	P	29.7	Very low	36.5	Very low	59 Å²	59	104 Å²	104	38%	0.383	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-62.1	139.8	-173	18.8	-26.8	0	0	0	112.8	V180	P131-V180 HydrophobicContact CB-CG1 4.1Å; P131-V180 HydrophobicContact CB-CG2 4.4Å; P131-V180 HydrophobicContact CG-CB 4.17Å; P131-V180 HydrophobicContact CG-CG1 3.83Å; P131-V180 HydrophobicContact CG-CG2 3.4Å; P131-V180 VanDerWaalsContact CG-CG2 3.4Å
132	I	33.4	Very low	35.9	Very low	118 Å²	118	107.1 Å²	107.1	61%	0.605	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-80.4	123.7	176.8	-59.6	174.4	0	0	0	108.8	R134 R361	I132-R134 PolarHBondContact O-N 3.28Å; I132-R361 VanDerWaalsContact CG1-NH1 3.31Å
133	V	29.9	Very low	35.1	Very low	53 Å²	53	112.1 Å²	112.1	32%	0.321	55%	0.551	S	S	.	*			trans	-68.7	114.2	170.3	178.5	0	0	0	0	108.7	H182 G183	V133-H182 WeakPolarHBondContact CG1-O 3.29Å; V133-G183 VanDerWaalsContact CG2-C 3.45Å; V133-G183 VanDerWaalsContact CG2-CA 3.43Å; V133-G183 VanDerWaalsContact CG2-O 3.31Å; V133-G183 WeakPolarHBondContact CG2-O 3.24Å
134	R	24.4	Very low	34.2	Very low	209 Å²	209	116.9 Å²	116.9	79%	0.789	58%	0.575	S	S	*	*			trans	-100.2	117.5	164.1	-70.7	-177.2	177.2	166.4	-1	108.6	I132	I132-R134 PolarHBondContact O-N 3.28Å
135	T	26.2	Very low	33.3	Very low	126 Å²	126	123.9 Å²	123.9	77%	0.773	61%	0.612	S	S	*	*			trans	-78.4	126.5	171.9	-42.9	0	0	0	0	109
136	I	24.3	Very low	32.1	Very low	140 Å²	140	131 Å²	131	72%	0.718	64%	0.64	S	S	*	*			trans	-107.8	122.8	171.6	-58.4	174.9	0	0	0	106.9	S138	I136-S138 PolarHBondContact O-N 2.85Å
137	H	26	Very low	31	Very low	107 Å²	107	135 Å²	135	50%	0.495	66%	0.66	S	S	.	*			trans	-67.9	128.3	172.1	-79.9	-46.6	0	0	0	110.1	E101	E101-H137 IonicContact OE1-ND1 3.54Å; E101-H137 IonicContact OE2-CE1 3.39Å; E101-H137 PolarHBondContact OE2-CE1 3.18Å; E101-H137 IonicContact OE2-ND1 2.78Å; E101-H137 PolarHBondContact OE2-ND1 3.08Å; E101-H137 IonicContact OE2-NE2 3.95Å
138	S	26	Very low	29.6	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	70%	0.695	S	S	*	*			trans	-106.1	101	165.2	160.1	0	0	0	0	107.3	I136 R140	I136-S138 PolarHBondContact O-N 2.85Å; S138-R140 PolarHBondContact O-N 2.96Å
139	E	25	Very low	28.5	Very low	192 Å²	192	144.5 Å²	144.5	90%	0.897	71%	0.712	S	S	*	*			trans	-61.4	116.7	164	-71.2	179.5	160.5	0	0	108.8
140	R	28.9	Very low	27.2	Very low	217 Å²	217	140.5 Å²	140.5	82%	0.819	71%	0.71	S	S	*	*			trans	-132.5	112.7	159.5	-83.5	-169.1	-173	172.6	2.7	110	S138	S138-R140 PolarHBondContact O-N 2.96Å
141	T	26	Very low	26.5	Very low	139 Å²	139	146.3 Å²	146.3	85%	0.853	74%	0.741	S	S	*	*			trans	-47.7	125.9	163.2	35.8	0	0	0	0	111.1
142	F	25.4	Very low	26.4	Very low	209 Å²	209	150.2 Å²	150.2	92%	0.917	76%	0.763	S	S	*	*			trans	-86.8	104.5	171.2	-121.8	-95.6	0	0	0	107.7
143	E	28.9	Very low	26	Very low	179 Å²	179	150 Å²	150	84%	0.836	77%	0.768	S	S	*	*			trans	-93.2	122.2	159.3	-82.6	-173.7	161.7	0	0	108.6
144	D	25	Very low	25.8	Very low	147 Å²	147	152.9 Å²	152.9	79%	0.786	79%	0.79	S	S	*	*			trans	-76.8	117.6	-179.4	-158.6	10.7	0	0	0	108.5
145	N	28.3	Very low	25.9	Very low	151 Å²	151	148.8 Å²	148.8	81%	0.807	79%	0.788	S	S	*	*			trans	-146.6	114.8	165	-90.8	-37.4	0	0	0	110.9
146	Q	25.6	Very low	26	Very low	182 Å²	182	151.4 Å²	151.4	85%	0.85	79%	0.792	S	S	*	*			trans	-52.5	135.3	165.3	-71	172.5	4.6	0	0	111.2
147	L	27.8	Very low	26.1	Very low	178 Å²	178	154.1 Å²	154.1	93%	0.932	80%	0.802	S	S	*	*			trans	-151.2	128.8	149.4	-110.5	126	0	0	0	112
148	D	23.5	Very low	26.3	Very low	140 Å²	140	154.6 Å²	154.6	75%	0.749	82%	0.817	S	S	*	*			trans	-79	153.5	-172.6	-99.2	-29.9	0	0	0	114.5
149	F	25.6	Very low	26.3	Very low	192 Å²	192	159.2 Å²	159.2	84%	0.842	83%	0.825	S	S	*	*			trans	13.3	144.7	151.8	-71.5	-86.4	0	0	0	123.9
150	A	23.7	Very low	26.4	Very low	83 Å²	83	159.2 Å²	159.2	69%	0.686	83%	0.825	S	S	*	*			trans	99	135.2	135.9	0	0	0	0	0	118.6
151	N	23.8	Very low	26.3	Very low	155 Å²	155	155.7 Å²	155.7	83%	0.829	82%	0.821	S	S	*	*			trans	71.3	110.7	172.6	-60.1	-20.1	0	0	0	115.5
152	V	27.4	Very low	26.2	Very low	141 Å²	141	155.5 Å²	155.5	86%	0.855	82%	0.82	S	S	*	*				-163.8	129	112.4	169	0	0	0	0	109
153	T	25.3	Very low	26.5	Very low	114 Å²	114	149.6 Å²	149.6	70%	0.699	80%	0.797	S	S	*	*			trans	-63.9	149.8	179.3	38.6	0	0	0	0	115
154	S	24.2	Very low	26.7	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	79%	0.785	S	S	*	*			trans	10.6	114.4	151.3	58.1	0	0	0	0	118.4
155	V	27.5	Very low	26.9	Very low	124 Å²	124	143.4 Å²	143.4	75%	0.752	79%	0.791	S	S	*	*			trans	-138.7	109.7	157.9	-178.2	0	0	0	0	110.3
156	E	28.4	Very low	27.5	Very low	180 Å²	180	141.2 Å²	141.2	84%	0.841	78%	0.784	S	S	*	*			trans	48.9	118.9	147.1	-66.9	178	148.6	0	0	122.2	S158	E156-S158 PolarHBondContact O-N 3.18Å
157	E	25.7	Very low	28.7	Very low	198 Å²	198	141 Å²	141	93%	0.925	78%	0.782	S	S	*	*			trans	-45.7	108.6	154.3	-78.4	170.6	132.6	0	0	111.9	K159	E157-K159 PolarHBondContact O-N 3.28Å
158	S	30.9	Very low	30	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	75%	0.752	S	S	*	*			trans	-72.6	98.4	162.1	59.6	0	0	0	0	109.1	E156	E156-S158 PolarHBondContact O-N 3.18Å
159	K	26.4	Very low	31.7	Very low	193 Å²	193	130.6 Å²	130.6	84%	0.839	73%	0.731	S	S	*	*			trans	4.1	110.4	162.1	-69.4	177.2	177.5	176.3	0	115.5	E157 I161	E157-K159 PolarHBondContact O-N 3.28Å; K159-I161 PolarHBondContact O-N 3.08Å; K159-I161 VanDerWaalsContact O-N 3.11Å
160	E	26.7	Very low	33.6	Very low	192 Å²	192	122.7 Å²	122.7	90%	0.897	70%	0.697	S	S	*	*			trans	-53.3	112.5	155.6	-101.2	178.4	158.6	0	0	108.9	T162	E160-T162 PolarHBondContact O-N 3.18Å
161	I	25.8	Very low	35.3	Very low	143 Å²	143	120.9 Å²	120.9	73%	0.733	68%	0.676	S	S	*	*			trans	-73.9	107	162.5	-61.5	174.1	0	0	0	105.3	K159 I163	K159-I161 PolarHBondContact O-N 3.08Å; K159-I161 VanDerWaalsContact O-N 3.11Å; I161-I163 VanDerWaalsContact C-N 3.28Å; I161-I163 HydrophobicContact CG2-CG1 4.15Å; I161-I163 PolarHBondContact O-N 2.98Å
162	T	24.9	Very low	36.9	Very low	135 Å²	135	119.3 Å²	119.3	83%	0.828	67%	0.668	S	S	*	*			trans	-62.7	92.2	169	-38.3	0	0	0	0	108.1	E160 S164	E160-T162 PolarHBondContact O-N 3.18Å; T162-S164 PolarHBondContact O-N 2.96Å; T162-S164 VanDerWaalsContact O-N 3.11Å
163	I	31.2	Very low	38.7	Very low	85 Å²	85	113.8 Å²	113.8	44%	0.436	63%	0.634	S	S	.	*			trans	-73.6	103.3	173.1	-64.8	152.1	0	0	0	106.3	I161 I168	I161-I163 VanDerWaalsContact C-N 3.28Å; I161-I163 HydrophobicContact CG2-CG1 4.15Å; I161-I163 PolarHBondContact O-N 2.98Å; I163-I168 HydrophobicContact CD1-CD1 3.98Å; I163-I168 HydrophobicContact CG2-CD1 4.11Å; I163-I168 HydrophobicContact CG2-CG1 4.33Å
164	S	33.3	Very low	40.7	Very low	85 Å²	85	108.5 Å²	108.5	59%	0.594	60%	0.601	S	S	*	*			trans	-51.3	144.3	166.9	57.9	0	0	0	0	109.3	T162 T166	T162-S164 PolarHBondContact O-N 2.96Å; T162-S164 VanDerWaalsContact O-N 3.11Å; S164-T166 PolarHBondContact O-N 2.76Å; S164-T166 PolarHBondContact O-OG1 3.28Å
165	A	29.7	Very low	42.6	Very low	111 Å²	111	108.6 Å²	108.6	92%	0.917	59%	0.587	S	S	*	*	S	Bend	trans	-64.4	51.9	-169.7	0	0	0	0	0	116.4
166	T	40.3	Very low	44.1	Very low	105 Å²	105	104.5 Å²	104.5	64%	0.644	56%	0.564	S	S	*	*			trans	-87.9	117.3	156.9	20	0	0	0	0	107.3	S164 I168	S164-T166 PolarHBondContact O-N 2.76Å; S164-T166 PolarHBondContact O-OG1 3.28Å; T166-I168 PolarHBondContact O-N 2.95Å
167	E	50.1	Low	45.2	Very low	176 Å²	176	101.8 Å²	101.8	82%	0.822	56%	0.555	S	S	*	*			trans	-46.2	113.8	174.8	-103.9	-178.8	140	0	0	110	S169	E167-S169 VanDerWaalsContact C-N 3.33Å; E167-S169 PolarHBondContact O-N 2.74Å
168	I	56.3	Low	46.3	Very low	59 Å²	59	98.6 Å²	98.6	30%	0.303	54%	0.538	S	S	.	.			trans	-68.7	99	171	-60.2	168.2	0	0	0	106.4	I163 T166 V173 P298 L301	I163-I168 HydrophobicContact CD1-CD1 3.98Å; I163-I168 HydrophobicContact CG2-CD1 4.11Å; I163-I168 HydrophobicContact CG2-CG1 4.33Å; T166-I168 PolarHBondContact O-N 2.95Å; I168-V173 HydrophobicContact CG2-CG2 3.87Å; I168-P298 HydrophobicContact CD1-CG 3.9Å; I168-L301 HydrophobicContact CB-CD2 4.33Å; I168-L301 HydrophobicContact CG2-CD1 3.79Å; I168-L301 HydrophobicContact CG2-CD2 4.21Å
169	S	58.3	Low	46.8	Very low	42 Å²	42	101.2 Å²	101.2	29%	0.294	54%	0.535	S	S	.	.			trans	-68.9	133.7	176.9	177.7	0	0	0	0	110.6	E167 N171 N172	E167-S169 VanDerWaalsContact C-N 3.33Å; E167-S169 PolarHBondContact O-N 2.74Å; S169-N171 PolarHBondContact O-N 3.16Å; S169-N171 VanDerWaalsContact O-N 3.16Å; S169-N171 PolarHBondContact OG-N 2.99Å; S169-N172 PolarHBondContact O-N 3.45Å; S169-N172 VanDerWaalsContact O-N 3.09Å
170	L	64.8	Low	47.5	Very low	25 Å²	25	95.5 Å²	95.5	13%	0.131	52%	0.516	C	S	.	.	H	α-helix	trans	-51	-36.4	173.7	-160.1	72.5	0	0	0	111.7	N172 V173 F174 P190 W191 L301 P302 V303 W381	L170-N172 PolarHBondContact O-N 3.29Å; L170-V173 PolarHBondContact O-N 3.26Å; L170-V173 VanDerWaalsContact O-N 3.1Å; L170-F174 PolarHBondContact O-N 2.66Å; L170-P190 HydrophobicContact CD1-CG 3.93Å; L170-W191 HydrophobicContact CD1-CE3 3.71Å; L170-W191 HydrophobicContact CD1-CZ3 3.79Å; L170-W191 HydrophobicContact CD2-CE3 4.07Å; L170-W191 HydrophobicContact CD2-CZ3 3.71Å; L170-W191 HydrophobicContact CG-CE3 4.15Å; L170-W191 HydrophobicContact CG-CZ3 3.74Å; L170-L301 HydrophobicContact CD1-CB 3.59Å; L170-L301 HydrophobicContact CD1-CD1 4.08Å; L170-P302 WeakPolarHBondContact CD1-O 3.39Å; L170-V303 HydrophobicContact CD2-CG2 4.5Å; L170-W381 HydrophobicContact CD2-CB 3.85Å
171	N	61	Low	47.9	Very low	45 Å²	45	90.5 Å²	90.5	24%	0.241	49%	0.491	C	S	.	.	H	α-helix	trans	-67	-26	-175.5	-52.5	-19.8	0	0	0	112.2	S169 N379 D380	S169-N171 PolarHBondContact O-N 3.16Å; S169-N171 VanDerWaalsContact O-N 3.16Å; S169-N171 PolarHBondContact OG-N 2.99Å; N171-N379 PolarHBondContact ND2-O 2.66Å; N171-N379 PolarHBondContact OD1-O 3.27Å; N171-N379 VanDerWaalsContact OD1-O 3.08Å; N171-D380 PolarHBondContact ND2-OD1 3.36Å
172	N	57.6	Low	48.5	Very low	123 Å²	123	89.4 Å²	89.4	66%	0.658	48%	0.483	S	S	*	.	H	α-helix	trans	-82.1	-21	177.3	-67.9	-20	0	0	0	112.6	S169 L170	S169-N172 PolarHBondContact O-N 3.45Å; S169-N172 VanDerWaalsContact O-N 3.09Å; L170-N172 PolarHBondContact O-N 3.29Å
173	V	63.9	Low	49.4	Very low	24 Å²	24	83.4 Å²	83.4	15%	0.145	45%	0.448	C	S	.	.	H	α-helix	trans	-98.4	-46.8	-173.9	170.2	0	0	0	0	111.5	I168 L170 K175 S188 P190 P298 L301	I168-V173 HydrophobicContact CG2-CG2 3.87Å; L170-V173 PolarHBondContact O-N 3.26Å; L170-V173 VanDerWaalsContact O-N 3.1Å; V173-K175 PolarHBondContact O-N 2.71Å; V173-S188 WeakPolarHBondContact CG1-OG 3.44Å; V173-P190 HydrophobicContact CG1-CB 3.95Å; V173-P190 HydrophobicContact CG1-CG 3.73Å; V173-P298 WeakPolarHBondContact CG1-O 3.49Å; V173-P298 HydrophobicContact CG2-CB 4.28Å; V173-L301 HydrophobicContact CB-CD1 3.99Å; V173-L301 HydrophobicContact CG1-CD1 4.31Å; V173-L301 HydrophobicContact CG2-CD1 3.65Å
174	F	68.1	Low	49.8	Very low	3 Å²	3	81 Å²	81	1%	0.013	44%	0.437	C	S	.	.			trans	-77.2	106.2	179.4	-174.6	-103.2	0	0	0	109.2	L170 S188 A189 W191 Y319 T321 Q331 W381	L170-F174 PolarHBondContact O-N 2.66Å; F174-S188 VanDerWaalsContact CD2-O 3.29Å; F174-S188 WeakPolarHBondContact CD2-O 3.23Å; F174-A189 HydrophobicContact CE2-CB 4.31Å; F174-W191 HydrophobicContact CB-CH2 3.95Å; F174-W191 HydrophobicContact CB-CZ3 3.96Å; F174-W191 AromaticContact CD1-CH2 3.96Å; F174-W191 HydrophobicContact CD1-CH2 3.96Å; F174-W191 AromaticContact CD2-CH2 3.11Å; F174-W191 HydrophobicContact CD2-CH2 3.11Å; F174-W191 AromaticContact CD2-CZ2 3.64Å; F174-W191 HydrophobicContact CD2-CZ2 3.64Å; F174-W191 AromaticContact CD2-CZ3 3.79Å; F174-W191 HydrophobicContact CD2-CZ3 3.79Å; F174-W191 HydrophobicContact CE1-CH2 4.16Å; F174-W191 AromaticContact CE2-CH2 3.37Å; F174-W191 HydrophobicContact CE2-CH2 3.37Å; F174-W191 AromaticContact CE2-CZ2 3.43Å; F174-W191 HydrophobicContact CE2-CZ2 3.43Å; F174-W191 VanDerWaalsContact CE2-CZ2 3.43Å; F174-W191 HydrophobicContact CE2-CZ3 4.42Å; F174-W191 AromaticContact CG-CH2 3.4Å; F174-W191 HydrophobicContact CG-CH2 3.4Å; F174-W191 VanDerWaalsContact CG-CH2 3.4Å; F174-W191 HydrophobicContact CG-CZ2 4.32Å; F174-W191 AromaticContact CG-CZ3 3.94Å; F174-W191 HydrophobicContact CG-CZ3 3.94Å; F174-W191 AromaticContact CZ-CH2 3.85Å; F174-W191 HydrophobicContact CZ-CH2 3.85Å; F174-W191 AromaticContact CZ-CZ2 3.94Å; F174-W191 HydrophobicContact CZ-CZ2 3.94Å; F174-Y319 HydrophobicContact CE1-CD2 4.22Å; F174-Y319 HydrophobicContact CZ-CD2 4.23Å; F174-Y319 HydrophobicContact CZ-CG 4.3Å; F174-T321 HydrophobicContact CE2-CG2 4.19Å; F174-Q331 VanDerWaalsContact CZ-CD 3.4Å; F174-W381 AromaticContact CD1-CD2 3.71Å; F174-W381 HydrophobicContact CD1-CD2 3.71Å; F174-W381 AromaticContact CD1-CE2 3.37Å; F174-W381 HydrophobicContact CD1-CE3 4.18Å; F174-W381 HydrophobicContact CD1-CG 4.23Å; F174-W381 HydrophobicContact CD1-CH2 4.09Å; F174-W381 AromaticContact CD1-CZ2 3.58Å; F174-W381 HydrophobicContact CD1-CZ2 3.58Å; F174-W381 HydrophobicContact CD1-CZ3 4.34Å; F174-W381 AromaticContact CD1-NE1 3.69Å; F174-W381 AromaticContact CE1-CD2 3.81Å; F174-W381 HydrophobicContact CE1-CD2 3.81Å; F174-W381 AromaticContact CE1-CE2 3.68Å; F174-W381 AromaticContact CE1-CE3 3.78Å; F174-W381 HydrophobicContact CE1-CE3 3.78Å; F174-W381 AromaticContact CE1-CH2 3.54Å; F174-W381 HydrophobicContact CE1-CH2 3.54Å; F174-W381 AromaticContact CE1-CZ2 3.55Å; F174-W381 HydrophobicContact CE1-CZ2 3.55Å; F174-W381 AromaticContact CE1-CZ3 3.65Å; F174-W381 HydrophobicContact CE1-CZ3 3.65Å
175	K	64.1	Low	50.2	Low	115 Å²	115	77.8 Å²	77.8	50%	0.5	42%	0.415	S	S	.	.			trans	-105.8	110.3	175.7	-67.8	-171.4	179	-176.2	0	108.4	V173 D177 F178	V173-K175 PolarHBondContact O-N 2.71Å; K175-D177 PolarHBondContact O-N 2.93Å; K175-F178 HydrophobicContact CD-CD2 4.34Å
176	P	58.7	Low	51.1	Low	39 Å²	39	74.7 Å²	74.7	25%	0.253	38%	0.382	S	S	.	.	S	Bend	trans	-57.8	-21.8	-177.2	11.6	-22.3	0	0	0	114.1	Y319 W381	P176-Y319 HydrophobicContact CB-CE1 4.41Å; P176-Y319 HydrophobicContact CB-CE2 3.62Å; P176-Y319 VanDerWaalsContact CB-CZ 3.48Å; P176-Y319 WeakPolarHBondContact CB-OH 3.16Å; P176-W381 HydrophobicContact CG-CZ2 4.22Å
177	D	51.4	Low	51.9	Low	123 Å²	123	69.9 Å²	69.9	66%	0.658	35%	0.353	S	S	*	.			trans	-136.7	102.1	-178.5	-68.7	-48.9	0	0	0	111.8	K175	K175-D177 PolarHBondContact O-N 2.93Å
178	F	48.9	Very low	52.5	Low	131 Å²	131	63.2 Å²	63.2	58%	0.575	33%	0.325	S	S	*	.			trans	-150.3	117.6	159.4	-122.6	-89.1	0	0	0	111.3	K175	K175-F178 HydrophobicContact CD-CD2 4.34Å
179	K	40.9	Very low	53.8	Low	171 Å²	171	60.4 Å²	60.4	74%	0.743	31%	0.311	S	S	*	.			trans	46.9	98.2	171.7	-69.5	-174.6	178.7	-178	0	116.7	F181	K179-F181 PolarHBondContact O-N 2.93Å
180	V	40.9	Very low	55.2	Low	73 Å²	73	58.6 Å²	58.6	44%	0.442	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	114.7	161.4	176.3	0	0	0	0	108.6	P131	P131-V180 HydrophobicContact CB-CG1 4.1Å; P131-V180 HydrophobicContact CB-CG2 4.4Å; P131-V180 HydrophobicContact CG-CB 4.17Å; P131-V180 HydrophobicContact CG-CG1 3.83Å; P131-V180 HydrophobicContact CG-CG2 3.4Å; P131-V180 VanDerWaalsContact CG-CG2 3.4Å
181	F	36	Very low	56.5	Low	87 Å²	87	57.4 Å²	57.4	38%	0.382	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.1	172	-159.5	-102.8	0	0	0	107.5	K179 G183 T184 I186 L249	K179-F181 PolarHBondContact O-N 2.93Å; F181-G183 VanDerWaalsContact C-N 3.29Å; F181-G183 PolarHBondContact O-N 2.84Å; F181-T184 PolarHBondContact N-O 2.91Å; F181-T184 PolarHBondContact O-N 3.13Å; F181-T184 PolarHBondContact O-OG1 2.88Å; F181-I186 HydrophobicContact CB-CD1 4.33Å; F181-L249 HydrophobicContact CD2-CD2 4.48Å; F181-L249 HydrophobicContact CE2-CD2 3.76Å; F181-L249 HydrophobicContact CZ-CD2 4.19Å
182	H	39	Very low	57.9	Low	121 Å²	121	55.7 Å²	55.7	56%	0.56	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	40.8	-173.2	-67.5	-75.4	0	0	0	114.6	V133 T184	V133-H182 WeakPolarHBondContact CG1-O 3.29Å; H182-T184 PolarHBondContact O-N 2.81Å; H182-T184 VanDerWaalsContact O-N 3.07Å
183	G	42.5	Very low	59.5	Low	9 Å²	9	50 Å²	50	9%	0.093	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-3	-178.3	0	0	0	0	0	114.7	V133 F181	V133-G183 VanDerWaalsContact CG2-C 3.45Å; V133-G183 VanDerWaalsContact CG2-CA 3.43Å; V133-G183 VanDerWaalsContact CG2-O 3.31Å; V133-G183 WeakPolarHBondContact CG2-O 3.24Å; F181-G183 VanDerWaalsContact C-N 3.29Å; F181-G183 PolarHBondContact O-N 2.84Å
184	T	39.5	Very low	60.8	Low	34 Å²	34	48.8 Å²	48.8	21%	0.209	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.8	169.4	20.1	0	0	0	0	110.7	F181 H182 I186 I330 P365	F181-T184 PolarHBondContact N-O 2.91Å; F181-T184 PolarHBondContact O-N 3.13Å; F181-T184 PolarHBondContact O-OG1 2.88Å; H182-T184 PolarHBondContact O-N 2.81Å; H182-T184 VanDerWaalsContact O-N 3.07Å; T184-I186 PolarHBondContact O-N 3.32Å; T184-I330 HydrophobicContact CG2-CG2 4.05Å; T184-P365 HydrophobicContact CG2-CG 3.21Å
185	S	41.5	Very low	61.8	Low	18 Å²	18	48.7 Å²	48.7	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	109.9	165.4	-155.4	0	0	0	0	107.9	T187	S185-T187 PolarHBondContact O-N 3.29Å; S185-T187 WeakPolarHBondContact OG-CG2 3.3Å
186	I	48.8	Very low	62.8	Low	46 Å²	46	43.2 Å²	43.2	24%	0.236	22%	0.222	C	C	.	.			trans	-87.6	87	170.6	-57.8	172.1	0	0	0	106.1	F181 T184 P248	F181-I186 HydrophobicContact CB-CD1 4.33Å; T184-I186 PolarHBondContact O-N 3.32Å; I186-P248 HydrophobicContact CB-CB 4.34Å; I186-P248 HydrophobicContact CD1-CB 3.71Å; I186-P248 HydrophobicContact CG2-CB 4.26Å
187	T	57.2	Low	63.8	Low	4 Å²	4	41.6 Å²	41.6	3%	0.025	21%	0.211	C	C	.	.			trans	-107.8	151.6	-179.7	47	0	0	0	0	110.7	S185 A189 Q331	S185-T187 PolarHBondContact O-N 3.29Å; S185-T187 WeakPolarHBondContact OG-CG2 3.3Å; T187-A189 PolarHBondContact O-N 2.68Å; T187-Q331 VanDerWaalsContact CB-OE1 3.27Å; T187-Q331 WeakPolarHBondContact OG1-CB 3.25Å; T187-Q331 VanDerWaalsContact OG1-CD 3.31Å; T187-Q331 PolarHBondContact OG1-OE1 2.91Å
188	S	64	Low	65.1	Low	35 Å²	35	39.6 Å²	39.6	25%	0.245	20%	0.196	C	C	.	.			trans	-69.9	95.5	174.9	175.8	0	0	0	0	109	V173 F174 P190	V173-S188 WeakPolarHBondContact CG1-OG 3.44Å; F174-S188 VanDerWaalsContact CD2-O 3.29Å; F174-S188 WeakPolarHBondContact CD2-O 3.23Å; S188-P190 WeakPolarHBondContact O-CD 3.47Å
189	A	83.2	Confident	66.2	Low	1 Å²	1	37.9 Å²	37.9	1%	0.008	19%	0.193	C	C	.	.			trans	-96.9	85.5	162.6	0	0	0	0	0	108.4	F174 T187 W191 S192 T321 I329	F174-A189 HydrophobicContact CE2-CB 4.31Å; T187-A189 PolarHBondContact O-N 2.68Å; A189-W191 HydrophobicContact CB-CZ2 4.38Å; A189-W191 PolarHBondContact O-N 3Å; A189-W191 VanDerWaalsContact O-N 3.11Å; A189-S192 VanDerWaalsContact CB-OG 3.22Å; A189-S192 WeakPolarHBondContact CB-OG 3.5Å; A189-S192 WeakPolarHBondContact O-CB 3.48Å; A189-S192 PolarHBondContact O-N 2.98Å; A189-S192 PolarHBondContact O-OG 3.45Å; A189-T321 HydrophobicContact CB-CG2 3.56Å; A189-I329 HydrophobicContact CB-CG2 3.84Å
190	P	87.4	Confident	67.3	Low	4 Å²	4	32.8 Å²	32.8	3%	0.026	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.3	-164.9	34	-42.2	0	0	0	113.1	L170 V173 S188 R300 L301	L170-P190 HydrophobicContact CD1-CG 3.93Å; V173-P190 HydrophobicContact CG1-CB 3.95Å; V173-P190 HydrophobicContact CG1-CG 3.73Å; S188-P190 WeakPolarHBondContact O-CD 3.47Å; P190-R300 VanDerWaalsContact O-CA 3.29Å; P190-R300 WeakPolarHBondContact O-CA 3.16Å; P190-L301 CarbonylContact C-O 3.53Å; P190-L301 HydrophobicContact CB-CB 3.96Å; P190-L301 HydrophobicContact CB-CG 4.32Å; P190-L301 HydrophobicContact CG-CB 3.92Å; P190-L301 HydrophobicContact CG-CD1 4.43Å; P190-L301 HydrophobicContact CG-CG 4.46Å; P190-L301 PolarHBondContact O-N 2.67Å; P190-L301 VanDerWaalsContact O-N 3.08Å; P190-L301 VanDerWaalsContact O-O 3.09Å
191	W	91.7	Very high	68	Low	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-20	173.4	53	77.1	0	0	0	113.1	L170 F174 A189 V193 S210 L211 L301 V303 T321 V374	L170-W191 HydrophobicContact CD1-CE3 3.71Å; L170-W191 HydrophobicContact CD1-CZ3 3.79Å; L170-W191 HydrophobicContact CD2-CE3 4.07Å; L170-W191 HydrophobicContact CD2-CZ3 3.71Å; L170-W191 HydrophobicContact CG-CE3 4.15Å; L170-W191 HydrophobicContact CG-CZ3 3.74Å; F174-W191 HydrophobicContact CB-CH2 3.95Å; F174-W191 HydrophobicContact CB-CZ3 3.96Å; F174-W191 AromaticContact CD1-CH2 3.96Å; F174-W191 HydrophobicContact CD1-CH2 3.96Å; F174-W191 AromaticContact CD2-CH2 3.11Å; F174-W191 HydrophobicContact CD2-CH2 3.11Å; F174-W191 AromaticContact CD2-CZ2 3.64Å; F174-W191 HydrophobicContact CD2-CZ2 3.64Å; F174-W191 AromaticContact CD2-CZ3 3.79Å; F174-W191 HydrophobicContact CD2-CZ3 3.79Å; F174-W191 HydrophobicContact CE1-CH2 4.16Å; F174-W191 AromaticContact CE2-CH2 3.37Å; F174-W191 HydrophobicContact CE2-CH2 3.37Å; F174-W191 AromaticContact CE2-CZ2 3.43Å; F174-W191 HydrophobicContact CE2-CZ2 3.43Å; F174-W191 VanDerWaalsContact CE2-CZ2 3.43Å; F174-W191 HydrophobicContact CE2-CZ3 4.42Å; F174-W191 AromaticContact CG-CH2 3.4Å; F174-W191 HydrophobicContact CG-CH2 3.4Å; F174-W191 VanDerWaalsContact CG-CH2 3.4Å; F174-W191 HydrophobicContact CG-CZ2 4.32Å; F174-W191 AromaticContact CG-CZ3 3.94Å; F174-W191 HydrophobicContact CG-CZ3 3.94Å; F174-W191 AromaticContact CZ-CH2 3.85Å; F174-W191 HydrophobicContact CZ-CH2 3.85Å; F174-W191 AromaticContact CZ-CZ2 3.94Å; F174-W191 HydrophobicContact CZ-CZ2 3.94Å; A189-W191 HydrophobicContact CB-CZ2 4.38Å; A189-W191 PolarHBondContact O-N 3Å; A189-W191 VanDerWaalsContact O-N 3.11Å; W191-V193 PolarHBondContact O-N 3.22Å; W191-S210 CarbonylContact O-C 3.59Å; W191-S210 WeakPolarHBondContact O-CA 3.31Å; W191-L211 PolarHBondContact O-N 3.44Å; W191-L301 WeakPolarHBondContact CA-O 3.4Å; W191-L301 WeakPolarHBondContact CB-O 3.37Å; W191-L301 PolarHBondContact N-O 3.14Å; W191-L301 VanDerWaalsContact N-O 3.09Å; W191-V303 HydrophobicContact CB-CB 3.85Å; W191-V303 HydrophobicContact CB-CG1 3.97Å; W191-V303 HydrophobicContact CD2-CB 4.02Å; W191-V303 HydrophobicContact CD2-CG2 4.44Å; W191-V303 HydrophobicContact CE3-CB 4.2Å; W191-V303 HydrophobicContact CG-CB 3.89Å; W191-V303 HydrophobicContact CG-CG1 4.09Å; W191-T321 HydrophobicContact CZ2-CG2 4.23Å; W191-T321 PolarHBondContact NE1-OG1 2.91Å; W191-V374 HydrophobicContact CH2-CG1 4.18Å; W191-V374 HydrophobicContact CZ2-CB 4.1Å; W191-V374 HydrophobicContact CZ2-CG1 4.03Å; W191-V374 HydrophobicContact CZ2-CG2 3.78Å
192	S	90.8	Very high	69.1	Low	9 Å²	9	41.5 Å²	41.5	6%	0.063	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.1	-171.9	-60.2	0	0	0	0	110.8	A189 T321	A189-S192 VanDerWaalsContact CB-OG 3.22Å; A189-S192 WeakPolarHBondContact CB-OG 3.5Å; A189-S192 WeakPolarHBondContact O-CB 3.48Å; A189-S192 PolarHBondContact O-N 2.98Å; A189-S192 PolarHBondContact O-OG 3.45Å; S192-T321 WeakPolarHBondContact OG-CB 3.22Å; S192-T321 PolarHBondContact OG-OG1 2.88Å
193	V	91.6	Very high	70	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	154.5	175.3	-63.3	0	0	0	0	110	W191 S208 G209 V223 V240	W191-V193 PolarHBondContact O-N 3.22Å; V193-S208 CarbonylContact O-C 3.59Å; V193-S208 VanDerWaalsContact O-CA 3.29Å; V193-S208 WeakPolarHBondContact O-CA 3.38Å; V193-G209 PolarHBondContact N-O 2.98Å; V193-G209 PolarHBondContact O-N 3.14Å; V193-V223 HydrophobicContact CG2-CG1 3.55Å; V193-V223 HydrophobicContact CG2-CG2 4.2Å; V193-V240 HydrophobicContact CB-CG1 3.6Å; V193-V240 HydrophobicContact CG1-CG1 4.04Å; V193-V240 HydrophobicContact CG2-CG1 3.75Å
194	I	89.9	Confident	71.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	143.2	172.6	59.2	171.7	0	0	0	110.5	M196 A205 V240 G241 V243 F254 I259 A323	I194-M196 HydrophobicContact CD1-CG 3.89Å; I194-M196 HydrophobicContact CD1-SD 3.85Å; I194-M196 HydrophobicContact CG1-CG 4.19Å; I194-M196 HydrophobicContact CG1-SD 4.38Å; I194-A205 HydrophobicContact CB-CB 4.04Å; I194-A205 HydrophobicContact CD1-CB 4.34Å; I194-A205 HydrophobicContact CG2-CB 4.12Å; I194-V240 CarbonylContact O-C 3.4Å; I194-V240 WeakPolarHBondContact O-CA 3.05Å; I194-G241 WeakPolarHBondContact CG1-O 3.4Å; I194-G241 PolarHBondContact N-O 3.03Å; I194-G241 PolarHBondContact O-N 2.92Å; I194-V243 HydrophobicContact CD1-CG2 4.49Å; I194-F254 HydrophobicContact CD1-CE2 4.06Å; I194-F254 HydrophobicContact CD1-CZ 4.24Å; I194-I259 HydrophobicContact CD1-CD1 4.1Å; I194-I259 HydrophobicContact CD1-CG2 4.45Å; I194-A323 HydrophobicContact CG2-CB 3.22Å
195	I	89.6	Confident	72.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	121.6	169.5	-59.7	168	0	0	0	106.3	V206 C207 T225 C229 V230 Y238 L288	I195-V206 HydrophobicContact CB-CG2 4.37Å; I195-V206 HydrophobicContact CG2-CG2 4Å; I195-V206 VanDerWaalsContact O-CG2 3.22Å; I195-V206 WeakPolarHBondContact O-CG2 3.09Å; I195-V206 PolarHBondContact O-N 2.82Å; I195-C207 HydrophobicContact CB-CB 4.07Å; I195-C207 HydrophobicContact CD1-CB 3.95Å; I195-C207 HydrophobicContact CG1-CB 4.45Å; I195-C207 PolarHBondContact N-O 2.87Å; I195-C207 PolarHBondContact O-N 2.94Å; I195-T225 HydrophobicContact CD1-CG2 3.62Å; I195-T225 WeakPolarHBondContact CD1-OG1 3.06Å; I195-C229 HydrophobicContact CD1-CB 3.97Å; I195-V230 HydrophobicContact CD1-CG1 4.37Å; I195-V230 HydrophobicContact CG2-CG1 4.07Å; I195-Y238 HydrophobicContact CG2-CD1 4.1Å; I195-L288 HydrophobicContact CD1-CD1 3.95Å; I195-L288 HydrophobicContact CG1-CD1 4.1Å
196	M	85.2	Confident	74.5	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.3	-179.7	-65.6	168.3	-67	0	0	109.5	I194 P203 T204 Y238 S239 G241 F254 I259 K261	I194-M196 HydrophobicContact CD1-CG 3.89Å; I194-M196 HydrophobicContact CD1-SD 3.85Å; I194-M196 HydrophobicContact CG1-CG 4.19Å; I194-M196 HydrophobicContact CG1-SD 4.38Å; M196-P203 HydrophobicContact SD-CB 4.43Å; M196-T204 WeakPolarHBondContact CA-O 3.39Å; M196-Y238 CarbonylContact O-C 3.47Å; M196-Y238 WeakPolarHBondContact O-CA 3.3Å; M196-S239 PolarHBondContact N-O 2.61Å; M196-S239 PolarHBondContact O-N 2.59Å; M196-G241 VanDerWaalsContact CE-CA 3.47Å; M196-F254 HydrophobicContact SD-CZ 4.25Å; M196-I259 HydrophobicContact CE-CG2 4.2Å; M196-I259 HydrophobicContact SD-CG2 4.36Å; M196-K261 HydrophobicContact CE-CB 4.43Å; M196-K261 HydrophobicContact CE-CD 3.85Å; M196-K261 HydrophobicContact CE-CG 3.76Å; M196-K261 HydrophobicContact SD-CD 4.4Å
197	D	80.6	Confident	76.4	Confident	4 Å²	4	38 Å²	38	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.1	168.9	-174.4	-14.1	0	0	0	109.1	D199 Y200 V206 R237 Y238	D197-D199 VanDerWaalsContact C-N 3.32Å; D197-D199 WeakPolarHBondContact OD1-CB 3.37Å; D197-D199 PolarHBondContact OD1-N 2.84Å; D197-Y200 HydrophobicContact CB-CD2 3.63Å; D197-Y200 HydrophobicContact CB-CE2 3.74Å; D197-Y200 WeakPolarHBondContact OD2-CE2 3.45Å; D197-V206 HydrophobicContact CB-CG1 3.67Å; D197-V206 HydrophobicContact CB-CG2 4.32Å; D197-R237 WeakPolarHBondContact OD1-CG 3.47Å; D197-R237 IonicContact OD1-NE 3.52Å; D197-R237 PolarHBondContact OD1-NE 2.93Å; D197-R237 IonicContact OD2-CZ 3.74Å; D197-R237 IonicContact OD2-NE 2.95Å; D197-R237 PolarHBondContact OD2-NE 2.9Å; D197-R237 IonicContact OD2-NH2 2.8Å; D197-R237 PolarHBondContact OD2-NH2 3.25Å; D197-Y238 HydrophobicContact CB-CD1 4.4Å; D197-Y238 HydrophobicContact CB-CE1 4.22Å
198	K	78.4	Confident	78	Confident	81 Å²	81	37.8 Å²	37.8	35%	0.352	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-15.4	-176.7	-66.1	168.5	174.4	170.1	0	112.8	Y200 Y236 R237 Y238 S239 D263	K198-Y200 PolarHBondContact O-N 2.85Å; K198-Y236 VanDerWaalsContact CD-O 3.25Å; K198-Y236 WeakPolarHBondContact CD-O 3.35Å; K198-R237 VanDerWaalsContact CB-O 3.27Å; K198-R237 WeakPolarHBondContact CB-O 3.48Å; K198-R237 WeakPolarHBondContact CG-O 3.36Å; K198-R237 PolarHBondContact N-O 3.13Å; K198-Y238 VanDerWaalsContact CE-O 3.26Å; K198-Y238 WeakPolarHBondContact CE-O 3.46Å; K198-Y238 PolarHBondContact NZ-O 3.48Å; K198-Y238 VanDerWaalsContact NZ-O 3.13Å; K198-S239 VanDerWaalsContact CE-CB 3.46Å; K198-D263 IonicContact NZ-OD1 3.92Å; K198-D263 PolarHBondContact NZ-OD1 2.92Å
199	D	71.1	Confident	79.4	Confident	96 Å²	96	36.1 Å²	36.1	51%	0.513	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.3	-178.7	-70.7	-18.1	0	0	0	111.9	D197 R237	D197-D199 VanDerWaalsContact C-N 3.32Å; D197-D199 WeakPolarHBondContact OD1-CB 3.37Å; D197-D199 PolarHBondContact OD1-N 2.84Å; D199-R237 WeakPolarHBondContact OD2-CD 3.28Å; D199-R237 WeakPolarHBondContact OD2-CG 3.03Å; D199-R237 IonicContact OD2-CZ 3.68Å; D199-R237 IonicContact OD2-NE 3.99Å; D199-R237 PolarHBondContact OD2-NE 2.73Å
200	Y	64.6	Low	80	Confident	64 Å²	64	36.1 Å²	36.1	25%	0.251	18%	0.184	S	C	.	.	S	Bend	trans	-77.6	137.3	173.4	-69	-89.7	0	0	0	111.5	N95 D197 K198 R202 V206	N95-Y200 VanDerWaalsContact OD1-CE1 3.32Å; N95-Y200 WeakPolarHBondContact OD1-CE1 3.43Å; N95-Y200 PolarHBondContact OD1-OH 2.81Å; D197-Y200 HydrophobicContact CB-CD2 3.63Å; D197-Y200 HydrophobicContact CB-CE2 3.74Å; D197-Y200 WeakPolarHBondContact OD2-CE2 3.45Å; K198-Y200 PolarHBondContact O-N 2.85Å; Y200-R202 WeakPolarHBondContact CB-O 3.42Å; Y200-R202 PolarHBondContact O-N 3.07Å; Y200-R202 VanDerWaalsContact O-N 3.15Å; Y200-V206 HydrophobicContact CE2-CG1 4.33Å
201	V	55.2	Low	80.3	Confident	150 Å²	150	35.9 Å²	35.9	91%	0.909	18%	0.183	S	C	*	.	S	Bend	trans	-54.1	-34.9	174.9	-178.9	0	0	0	0	111.3
202	R	60.1	Low	80.5	Confident	192 Å²	192	36 Å²	36	73%	0.725	18%	0.184	S	C	*	.	S	Bend	trans	-113.7	119.1	170.2	-63.4	-175.6	-176.6	-179.6	0.8	107.7	Y200 T204	Y200-R202 WeakPolarHBondContact CB-O 3.42Å; Y200-R202 PolarHBondContact O-N 3.07Å; Y200-R202 VanDerWaalsContact O-N 3.15Å; R202-T204 PolarHBondContact O-N 3.2Å
203	P	57.4	Low	80.5	Confident	30 Å²	30	40.6 Å²	40.6	20%	0.195	20%	0.202	C	C	.	.			trans	-59	114.7	177.1	-17.5	28.1	0	0	0	108.6	M196 F254	M196-P203 HydrophobicContact SD-CB 4.43Å; P203-F254 HydrophobicContact CB-CE1 4.25Å; P203-F254 WeakPolarHBondContact O-CE1 3.36Å; P203-F254 WeakPolarHBondContact O-CZ 3.25Å
204	T	65.5	Low	80.3	Confident	57 Å²	57	41.4 Å²	41.4	35%	0.35	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	144.1	173.8	51.9	0	0	0	0	108.9	M196 R202 V206	M196-T204 WeakPolarHBondContact CA-O 3.39Å; R202-T204 PolarHBondContact O-N 3.2Å; T204-V206 PolarHBondContact O-N 2.99Å; T204-V206 VanDerWaalsContact O-N 3.14Å
205	A	73.7	Confident	79.9	Confident	16 Å²	16	46.8 Å²	46.8	13%	0.132	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	112	168.3	0	0	0	0	0	107.9	I194	I194-A205 HydrophobicContact CB-CB 4.04Å; I194-A205 HydrophobicContact CD1-CB 4.34Å; I194-A205 HydrophobicContact CG2-CB 4.12Å
206	V	78.1	Confident	79.4	Confident	46 Å²	46	48.6 Å²	48.6	28%	0.279	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-27.7	177.7	-67.1	0	0	0	0	111.8	I195 D197 Y200 T204 Y238	I195-V206 HydrophobicContact CB-CG2 4.37Å; I195-V206 HydrophobicContact CG2-CG2 4Å; I195-V206 VanDerWaalsContact O-CG2 3.22Å; I195-V206 WeakPolarHBondContact O-CG2 3.09Å; I195-V206 PolarHBondContact O-N 2.82Å; D197-V206 HydrophobicContact CB-CG1 3.67Å; D197-V206 HydrophobicContact CB-CG2 4.32Å; Y200-V206 HydrophobicContact CE2-CG1 4.33Å; T204-V206 PolarHBondContact O-N 2.99Å; T204-V206 VanDerWaalsContact O-N 3.14Å; V206-Y238 HydrophobicContact CG2-CE1 4.48Å
207	C	88.5	Confident	78.9	Confident	6 Å²	6	54 Å²	54	4%	0.041	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	173.6	-179.6	-88	0	0	0	0	111.2	I195 C229 R369	I195-C207 HydrophobicContact CB-CB 4.07Å; I195-C207 HydrophobicContact CD1-CB 3.95Å; I195-C207 HydrophobicContact CG1-CB 4.45Å; I195-C207 PolarHBondContact N-O 2.87Å; I195-C207 PolarHBondContact O-N 2.94Å; C207-C229 HydrophobicContact CB-CB 3.44Å; C207-C229 VanDerWaalsContact CB-CB 3.44Å; C207-C229 WeakPolarHBondContact CB-SG 3.44Å; C207-C229 WeakPolarHBondContact SG-CA 3.26Å; C207-C229 WeakPolarHBondContact SG-CB 3.34Å; C207-C229 CovalentContact SG-SG 2.03Å; C207-C229 PolarHBondContact SG-SG 3.39Å; C207-R369 WeakPolarHBondContact CB-O 3.41Å; C207-R369 PolarHBondContact SG-O 2.83Å
208	S	90.4	Very high	79.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	171	168	-66	0	0	0	0	112.1	V193 T225 A323 S368 R369 G370 S371	V193-S208 CarbonylContact O-C 3.59Å; V193-S208 VanDerWaalsContact O-CA 3.29Å; V193-S208 WeakPolarHBondContact O-CA 3.38Å; S208-T225 PolarHBondContact O-OG1 2.84Å; S208-A323 PolarHBondContact OG-N 2.88Å; S208-S368 WeakPolarHBondContact CB-OG 3.33Å; S208-S368 PolarHBondContact N-OG 3.21Å; S208-S368 VanDerWaalsContact N-OG 3.13Å; S208-S368 PolarHBondContact OG-OG 2.76Å; S208-R369 PolarHBondContact N-O 3.47Å; S208-G370 CarbonylContact O-C 3.53Å; S208-G370 VanDerWaalsContact O-C 3.23Å; S208-G370 VanDerWaalsContact O-CA 3.27Å; S208-G370 WeakPolarHBondContact O-CA 3.33Å; S208-S371 WeakPolarHBondContact CB-OG 3.4Å
209	G	93.9	Very high	80.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	-175.3	173.5	0	0	0	0	0	111.2	V193 L224 G370	V193-G209 PolarHBondContact N-O 2.98Å; V193-G209 PolarHBondContact O-N 3.14Å; G209-L224 CarbonylContact C-O 3.54Å; G209-L224 WeakPolarHBondContact CA-O 3.34Å; G209-G370 WeakPolarHBondContact CA-O 3.42Å
210	S	95.4	Very high	81.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.1	175.2	55.2	0	0	0	0	111.4	W191 V223 L224 Q383	W191-S210 CarbonylContact O-C 3.59Å; W191-S210 WeakPolarHBondContact O-CA 3.31Å; S210-V223 CarbonylContact O-C 3.45Å; S210-V223 VanDerWaalsContact O-CA 3.24Å; S210-V223 WeakPolarHBondContact O-CA 3.41Å; S210-L224 PolarHBondContact N-O 2.66Å; S210-L224 PolarHBondContact O-N 3.35Å; S210-Q383 VanDerWaalsContact CB-OE1 3.32Å; S210-Q383 PolarHBondContact OG-OE1 3.08Å
211	L	95.5	Very high	82.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.9	166.7	-171	68.2	0	0	0	108.7	W191 V223 Y294 F296 R300 P302 V303	W191-L211 PolarHBondContact O-N 3.44Å; L211-V223 HydrophobicContact CD1-CG2 4.21Å; L211-Y294 HydrophobicContact CD1-CD2 4.02Å; L211-F296 HydrophobicContact CD2-CE1 4.38Å; L211-R300 HydrophobicContact CD2-CG 4.12Å; L211-P302 HydrophobicContact CG-CB 4.44Å; L211-P302 CarbonylContact O-C 3.59Å; L211-P302 WeakPolarHBondContact O-CA 3.44Å; L211-V303 PolarHBondContact O-N 3.09Å
212	L	95	Very high	84.6	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-92	150.1	-179.1	-65.1	-169.7	0	0	0	112.2	T214 S220 V222 L224 P302 V303 I305 I423 L427	L212-T214 PolarHBondContact O-N 3.4Å; L212-S220 WeakPolarHBondContact O-CB 3.43Å; L212-S220 PolarHBondContact O-OG 3.3Å; L212-V222 HydrophobicContact CB-CB 4.43Å; L212-V222 HydrophobicContact CB-CG1 4.4Å; L212-V222 HydrophobicContact CD1-CG1 4.28Å; L212-V222 PolarHBondContact N-O 3.3Å; L212-L224 HydrophobicContact CD1-CB 3.81Å; L212-L224 HydrophobicContact CD1-CD2 4.31Å; L212-L224 HydrophobicContact CD2-CB 3.99Å; L212-L224 HydrophobicContact CD2-CD2 4.22Å; L212-L224 HydrophobicContact CG-CB 3.86Å; L212-P302 VanDerWaalsContact C-CB 3.43Å; L212-V303 HydrophobicContact CD2-CG1 4.25Å; L212-I305 HydrophobicContact CD1-CG2 4.48Å; L212-I305 HydrophobicContact CD2-CG2 3.99Å; L212-I423 HydrophobicContact CD1-CG2 3.76Å; L212-L427 HydrophobicContact CB-CD2 3.88Å; L212-L427 HydrophobicContact CD1-CD2 3.92Å
213	K	90.9	Very high	86.4	Confident	105 Å²	105	36.1 Å²	36.1	46%	0.457	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-71.4	128.5	173.5	-169.4	173.7	-178.6	176	0	108.6	P302 V303	K213-P302 HydrophobicContact CB-CB 3.96Å; K213-P302 HydrophobicContact CB-CG 3.95Å; K213-P302 HydrophobicContact CG-CG 4.14Å; K213-V303 PolarHBondContact N-O 2.83Å; K213-V303 VanDerWaalsContact N-O 3.15Å
214	T	88.1	Confident	88.3	Confident	19 Å²	19	34.7 Å²	34.7	12%	0.117	21%	0.206	C	C	.	.			trans	-107.6	176.5	175.5	68.4	0	0	0	0	109.8	L212 S216 Q219 S220 V222	L212-T214 PolarHBondContact O-N 3.4Å; T214-S216 PolarHBondContact O-N 2.89Å; T214-S216 PolarHBondContact OG1-N 3.13Å; T214-Q219 PolarHBondContact OG1-O 2.84Å; T214-S220 WeakPolarHBondContact CG2-OG 3.3Å; T214-V222 HydrophobicContact CG2-CB 4.08Å; T214-V222 HydrophobicContact CG2-CG2 3.56Å
215	S	81.9	Confident	89.7	Confident	114 Å²	114	32 Å²	32	80%	0.797	19%	0.189	S	C	*	.	S	Bend	trans	-63	-16.6	172.8	53.4	0	0	0	0	113.6
216	S	77.6	Confident	90.6	Very high	38 Å²	38	31.2 Å²	31.2	27%	0.266	18%	0.183	S	C	.	.	S	Bend	trans	-73.4	131.4	175.1	-167.3	0	0	0	0	110.8	T214 N218 Q219	T214-S216 PolarHBondContact O-N 2.89Å; T214-S216 PolarHBondContact OG1-N 3.13Å; S216-N218 PolarHBondContact O-N 2.69Å; S216-Q219 WeakPolarHBondContact CB-O 3.09Å; S216-Q219 VanDerWaalsContact OG-CG 3.26Å; S216-Q219 WeakPolarHBondContact OG-CG 3.45Å
217	S	74.5	Confident	91	Very high	113 Å²	113	29.5 Å²	29.5	79%	0.79	17%	0.174	S	C	*	.	S	Bend	trans	-70.9	-25.5	-173.5	55.5	0	0	0	0	114.6
218	N	91	Very high	90.8	Very high	87 Å²	87	30.4 Å²	30.4	47%	0.465	18%	0.178	S	C	.	.	S	Bend	trans	-130.4	6.2	-169.3	68	-14.5	0	0	0	115.4	S216 F296	S216-N218 PolarHBondContact O-N 2.69Å; N218-F296 VanDerWaalsContact CA-CD2 3.49Å; N218-F296 WeakPolarHBondContact O-CG 3.27Å; N218-F296 PolarHBondContact O-N 3.03Å
219	Q	93.5	Very high	90.6	Very high	70 Å²	70	30.7 Å²	30.7	33%	0.327	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	159.3	-177.8	64.5	179.5	9.8	0	0	112.6	T214 S216 P293 Y294 F296	T214-Q219 PolarHBondContact OG1-O 2.84Å; S216-Q219 WeakPolarHBondContact CB-O 3.09Å; S216-Q219 VanDerWaalsContact OG-CG 3.26Å; S216-Q219 WeakPolarHBondContact OG-CG 3.45Å; Q219-P293 HydrophobicContact CB-CB 4.04Å; Q219-P293 HydrophobicContact CB-CG 4.46Å; Q219-P293 HydrophobicContact CG-CB 4.15Å; Q219-P293 HydrophobicContact CG-CG 4.32Å; Q219-Y294 CarbonylContact C-O 3.56Å; Q219-Y294 WeakPolarHBondContact CA-O 3.23Å; Q219-Y294 WeakPolarHBondContact CB-O 3.29Å; Q219-F296 VanDerWaalsContact O-CZ 3.27Å; Q219-F296 WeakPolarHBondContact O-CZ 3.25Å
220	S	94.7	Very high	90	Very high	1 Å²	1	31 Å²	31	1%	0.007	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	141	173.8	175.3	0	0	0	0	111.8	L212 T214 V222 P293 Y294	L212-S220 WeakPolarHBondContact O-CB 3.43Å; L212-S220 PolarHBondContact O-OG 3.3Å; T214-S220 WeakPolarHBondContact CG2-OG 3.3Å; S220-V222 PolarHBondContact OG-N 2.98Å; S220-P293 CarbonylContact O-C 3.23Å; S220-P293 WeakPolarHBondContact O-CA 3.08Å; S220-Y294 PolarHBondContact N-O 2.82Å; S220-Y294 PolarHBondContact O-N 2.97Å
221	N	95.3	Very high	88.9	Confident	53 Å²	53	31.9 Å²	31.9	28%	0.283	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	15.2	172	68.5	-16.5	0	0	0	112.5	K289 L290 P293	N221-K289 WeakPolarHBondContact O-CA 3.14Å; N221-L290 HydrophobicContact CB-CB 4.1Å; N221-L290 PolarHBondContact O-N 3.02Å; N221-P293 HydrophobicContact CB-CB 4.05Å
222	V	96.6	Very high	87.5	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122	-174.9	-172	0	0	0	0	109.8	L212 T214 S220 I287 K289 Q426 L427	L212-V222 HydrophobicContact CB-CB 4.43Å; L212-V222 HydrophobicContact CB-CG1 4.4Å; L212-V222 HydrophobicContact CD1-CG1 4.28Å; L212-V222 PolarHBondContact N-O 3.3Å; T214-V222 HydrophobicContact CG2-CB 4.08Å; T214-V222 HydrophobicContact CG2-CG2 3.56Å; S220-V222 PolarHBondContact OG-N 2.98Å; V222-I287 HydrophobicContact CG1-CG2 3.57Å; V222-K289 HydrophobicContact CG2-CD 3.98Å; V222-Q426 WeakPolarHBondContact CG2-O 3.2Å; V222-L427 HydrophobicContact CB-CD2 4.25Å; V222-L427 HydrophobicContact CG1-CD2 3.97Å; V222-L427 HydrophobicContact CG2-CD2 4.39Å
223	V	96.9	Very high	86	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.8	176	173	0	0	0	0	109.6	V193 S210 L211 V240 I287 L288 L290	V193-V223 HydrophobicContact CG2-CG1 3.55Å; V193-V223 HydrophobicContact CG2-CG2 4.2Å; S210-V223 CarbonylContact O-C 3.45Å; S210-V223 VanDerWaalsContact O-CA 3.24Å; S210-V223 WeakPolarHBondContact O-CA 3.41Å; L211-V223 HydrophobicContact CD1-CG2 4.21Å; V223-V240 HydrophobicContact CG2-CG1 4.13Å; V223-V240 HydrophobicContact CG2-CG2 4.45Å; V223-I287 CarbonylContact O-C 3.18Å; V223-I287 VanDerWaalsContact O-CA 3.29Å; V223-I287 WeakPolarHBondContact O-CA 3.26Å; V223-L288 HydrophobicContact CB-CB 4.15Å; V223-L288 HydrophobicContact CB-CD1 4.33Å; V223-L288 HydrophobicContact CB-CG 4.36Å; V223-L288 HydrophobicContact CG1-CD1 4.04Å; V223-L288 HydrophobicContact CG1-CG 4.4Å; V223-L288 PolarHBondContact N-O 3.27Å; V223-L288 PolarHBondContact O-N 3.07Å; V223-L290 HydrophobicContact CG2-CD1 4.01Å; V223-L290 HydrophobicContact CG2-CD2 4.35Å; V223-L290 HydrophobicContact CG2-CG 4.3Å
224	L	96.9	Very high	85.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	137.9	172.3	-178.8	65.1	0	0	0	110.2	G209 S210 L212 L285 I287 L416	G209-L224 CarbonylContact C-O 3.54Å; G209-L224 WeakPolarHBondContact CA-O 3.34Å; S210-L224 PolarHBondContact N-O 2.66Å; S210-L224 PolarHBondContact O-N 3.35Å; L212-L224 HydrophobicContact CD1-CB 3.81Å; L212-L224 HydrophobicContact CD1-CD2 4.31Å; L212-L224 HydrophobicContact CD2-CB 3.99Å; L212-L224 HydrophobicContact CD2-CD2 4.22Å; L212-L224 HydrophobicContact CG-CB 3.86Å; L224-L285 HydrophobicContact CD1-CB 4.31Å; L224-L285 HydrophobicContact CD1-CD2 4.38Å; L224-I287 HydrophobicContact CD1-CG1 3.93Å; L224-L416 HydrophobicContact CD2-CD1 3.63Å; L224-L416 HydrophobicContact CD2-CD2 3.82Å; L224-L416 HydrophobicContact CD2-CG 4.4Å
225	T	95.1	Very high	85.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	-177.1	177.9	-171.3	0	0	0	0	110.6	I195 S208 C229 A286 L288 G370	I195-T225 HydrophobicContact CD1-CG2 3.62Å; I195-T225 WeakPolarHBondContact CD1-OG1 3.06Å; S208-T225 PolarHBondContact O-OG1 2.84Å; T225-C229 HydrophobicContact CG2-CB 4.36Å; T225-A286 HydrophobicContact CG2-CB 3.94Å; T225-A286 PolarHBondContact N-O 3.01Å; T225-A286 PolarHBondContact O-N 2.96Å; T225-L288 HydrophobicContact CG2-CD1 4.22Å; T225-L288 HydrophobicContact CG2-CD2 4.21Å; T225-L288 HydrophobicContact CG2-CG 4.21Å; T225-G370 WeakPolarHBondContact OG1-CA 3.39Å
226	A	92.3	Very high	85.1	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	144.4	173.8	0	0	0	0	0	111	Q228 C229 G284 T386 M388	A226-Q228 PolarHBondContact O-N 2.78Å; A226-C229 VanDerWaalsContact O-CB 3.3Å; A226-C229 WeakPolarHBondContact O-CB 3.47Å; A226-C229 PolarHBondContact O-N 3.47Å; A226-G284 WeakPolarHBondContact CA-O 3.19Å; A226-T386 HydrophobicContact CB-CG2 4.3Å; A226-M388 HydrophobicContact CB-CE 3.43Å; A226-M388 VanDerWaalsContact CB-CE 3.43Å; A226-M388 HydrophobicContact CB-SD 3.89Å
227	A	87.9	Confident	85.3	Confident	10 Å²	10	27.1 Å²	27.1	8%	0.083	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-60	-26.7	174.5	0	0	0	0	0	112.6	C229 V230 F269 G284	A227-C229 PolarHBondContact O-N 2.84Å; A227-V230 VanDerWaalsContact O-O 3.04Å; A227-F269 HydrophobicContact CB-CB 4.46Å; A227-G284 PolarHBondContact N-O 3.14Å
228	Q	83.6	Confident	86	Confident	26 Å²	26	22 Å²	22	12%	0.121	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-66.2	-14.2	176.4	-64.7	167.4	-40.5	0	0	113.8	A226 A282 M388	A226-Q228 PolarHBondContact O-N 2.78Å; Q228-A282 VanDerWaalsContact CD-O 3.23Å; Q228-A282 WeakPolarHBondContact CG-O 3.46Å; Q228-A282 PolarHBondContact NE2-O 3.42Å; Q228-M388 PolarHBondContact OE1-O 2.84Å
229	C	85.6	Confident	86	Confident	6 Å²	6	18.1 Å²	18.1	4%	0.041	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-88.3	-22.3	-173.4	-69.1	0	0	0	0	114.3	I195 C207 T225 A226 A227 R369	I195-C229 HydrophobicContact CD1-CB 3.97Å; C207-C229 HydrophobicContact CB-CB 3.44Å; C207-C229 VanDerWaalsContact CB-CB 3.44Å; C207-C229 WeakPolarHBondContact CB-SG 3.44Å; C207-C229 WeakPolarHBondContact SG-CA 3.26Å; C207-C229 WeakPolarHBondContact SG-CB 3.34Å; C207-C229 CovalentContact SG-SG 2.03Å; C207-C229 PolarHBondContact SG-SG 3.39Å; T225-C229 HydrophobicContact CG2-CB 4.36Å; A226-C229 VanDerWaalsContact O-CB 3.3Å; A226-C229 WeakPolarHBondContact O-CB 3.47Å; A226-C229 PolarHBondContact O-N 3.47Å; A227-C229 PolarHBondContact O-N 2.84Å; C229-R369 PolarHBondContact SG-O 2.8Å; C229-R369 VanDerWaalsContact SG-O 3.41Å
230	V	81.3	Confident	86	Confident	6 Å²	6	14.8 Å²	14.8	4%	0.036	8%	0.08	C	C	.	.			trans	-145.5	160.3	-169.3	-66.5	0	0	0	0	111	I195 A227 Y238 I267 A286 L288	I195-V230 HydrophobicContact CD1-CG1 4.37Å; I195-V230 HydrophobicContact CG2-CG1 4.07Å; A227-V230 VanDerWaalsContact O-O 3.04Å; V230-Y238 HydrophobicContact CB-CD2 4.35Å; V230-Y238 HydrophobicContact CB-CE2 4.36Å; V230-Y238 HydrophobicContact CG1-CD2 4.21Å; V230-Y238 HydrophobicContact CG1-CG 4.26Å; V230-I267 HydrophobicContact CB-CD1 4.16Å; V230-I267 HydrophobicContact CB-CG2 4.37Å; V230-I267 HydrophobicContact CG2-CG2 3.68Å; V230-A286 HydrophobicContact CG2-CB 3.53Å; V230-L288 HydrophobicContact CB-CD2 4.25Å; V230-L288 HydrophobicContact CG1-CD1 4.45Å; V230-L288 HydrophobicContact CG1-CD2 3.88Å; V230-L288 HydrophobicContact CG2-CD2 3.75Å
231	Y	74.1	Confident	85.7	Confident	18 Å²	18	14.7 Å²	14.7	7%	0.071	8%	0.08	C	C	.	.			trans	-124.9	135.5	175.6	-54.5	-84.5	0	0	0	109.9	M48 N49 R93 G233 L234 Y238 I267	M48-Y231 HydrophobicContact CB-CD1 4Å; M48-Y231 HydrophobicContact CB-CE1 3.67Å; M48-Y231 HydrophobicContact CE-CD1 4.38Å; M48-Y231 HydrophobicContact CE-CE1 4.23Å; M48-Y231 VanDerWaalsContact O-CE1 3.27Å; M48-Y231 WeakPolarHBondContact O-CE1 3.49Å; M48-Y231 VanDerWaalsContact O-CZ 3.31Å; M48-Y231 PolarHBondContact O-OH 2.99Å; N49-Y231 HydrophobicContact CB-CD1 4.32Å; N49-Y231 HydrophobicContact CB-CE1 3.82Å; N49-Y231 HydrophobicContact CB-CE2 4.07Å; N49-Y231 VanDerWaalsContact ND2-CD2 3.29Å; N49-Y231 WeakPolarHBondContact ND2-CD2 3.36Å; N49-Y231 WeakPolarHBondContact ND2-CE2 3.43Å; R93-Y231 PolarHBondContact NH2-OH 2.94Å; Y231-G233 VanDerWaalsContact C-N 3.28Å; Y231-G233 PolarHBondContact O-N 2.79Å; Y231-L234 HydrophobicContact CD2-CD1 3.91Å; Y231-L234 HydrophobicContact CG-CD1 4.16Å; Y231-L234 PolarHBondContact O-N 3.4Å; Y231-Y238 HydrophobicContact CD2-CE2 4.18Å; Y231-Y238 WeakPolarHBondContact CD2-OH 2.92Å; Y231-Y238 WeakPolarHBondContact CE2-OH 3.22Å; Y231-I267 WeakPolarHBondContact O-CD1 3.21Å
232	S	64.2	Low	85.3	Confident	32 Å²	32	12.4 Å²	12.4	22%	0.224	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-35	-169.8	46.9	0	0	0	0	114.7	F269	S232-F269 VanDerWaalsContact CB-CE1 3.4Å; S232-F269 WeakPolarHBondContact OG-CE1 3.46Å
233	G	65.5	Low	84.2	Confident	16 Å²	16	13 Å²	13	17%	0.165	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-3.4	178.4	0	0	0	0	0	115.3	K9 Y231	K9-G233 WeakPolarHBondContact CA-O 3.28Å; Y231-G233 VanDerWaalsContact C-N 3.28Å; Y231-G233 PolarHBondContact O-N 2.79Å
234	L	75.8	Confident	82.7	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.087	C	C	.	.			trans	-115.3	37.9	-169	-53.5	-179.3	0	0	0	113.2	K9 L51 Y231 Y236 R237 Y238	K9-L234 HydrophobicContact CB-CD2 3.76Å; K9-L234 HydrophobicContact CD-CD2 3.94Å; K9-L234 HydrophobicContact CG-CD2 3.95Å; L51-L234 HydrophobicContact CD1-CD2 4.43Å; L51-L234 HydrophobicContact CD2-CD1 3.49Å; L51-L234 VanDerWaalsContact CD2-CD1 3.49Å; L51-L234 HydrophobicContact CD2-CD2 3.8Å; L51-L234 HydrophobicContact CD2-CG 4.25Å; Y231-L234 HydrophobicContact CD2-CD1 3.91Å; Y231-L234 HydrophobicContact CG-CD1 4.16Å; Y231-L234 PolarHBondContact O-N 3.4Å; L234-Y236 HydrophobicContact CB-CE1 4.21Å; L234-Y236 HydrophobicContact CD2-CE1 3.62Å; L234-Y236 PolarHBondContact O-N 3.18Å; L234-R237 HydrophobicContact CB-CB 4.01Å; L234-R237 WeakPolarHBondContact O-CB 3.19Å; L234-R237 PolarHBondContact O-N 3Å; L234-Y238 HydrophobicContact CB-CD2 4.37Å; L234-Y238 HydrophobicContact CB-CE2 3.94Å; L234-Y238 VanDerWaalsContact O-CD2 3.24Å; L234-Y238 WeakPolarHBondContact O-CD2 3.22Å
235	T	83.2	Confident	80.9	Confident	36 Å²	36	19.6 Å²	19.6	22%	0.221	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-54.5	-37.2	177.8	57.4	0	0	0	0	112.5	R237 Y238 I264 I267	T235-R237 PolarHBondContact O-N 2.98Å; T235-Y238 PolarHBondContact O-N 2.03Å; T235-I264 HydrophobicContact CG2-CG2 4.22Å; T235-I267 HydrophobicContact CG2-CD1 3.93Å; T235-I267 HydrophobicContact CG2-CG1 4.04Å
236	Y	82.5	Confident	78.7	Confident	77 Å²	77	22.2 Å²	22.2	30%	0.302	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-63.4	-27	178.5	76.3	-86.3	0	0	0	113.3	K9 K198 L234	K9-Y236 HydrophobicContact CD-CD1 4.46Å; K9-Y236 HydrophobicContact CD-CE1 3.42Å; K9-Y236 VanDerWaalsContact CD-CE1 3.42Å; K9-Y236 WeakPolarHBondContact CD-OH 3.4Å; K9-Y236 VanDerWaalsContact CE-OH 3.32Å; K9-Y236 WeakPolarHBondContact CE-OH 3.45Å; K9-Y236 HydrophobicContact CG-CD1 4.37Å; K9-Y236 HydrophobicContact CG-CE1 3.63Å; K9-Y236 PolarHBondContact NZ-OH 3.18Å; K198-Y236 VanDerWaalsContact CD-O 3.25Å; K198-Y236 WeakPolarHBondContact CD-O 3.35Å; L234-Y236 HydrophobicContact CB-CE1 4.21Å; L234-Y236 HydrophobicContact CD2-CE1 3.62Å; L234-Y236 PolarHBondContact O-N 3.18Å
237	R	81.9	Confident	76.6	Confident	17 Å²	17	26.8 Å²	26.8	6%	0.064	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-78.9	-28.3	-177.3	-179.7	172.4	174.8	166.3	2.4	112.1	N49 D197 K198 D199 L234 T235	N49-R237 PolarHBondContact ND2-NH1 3.5Å; D197-R237 WeakPolarHBondContact OD1-CG 3.47Å; D197-R237 IonicContact OD1-NE 3.52Å; D197-R237 PolarHBondContact OD1-NE 2.93Å; D197-R237 IonicContact OD2-CZ 3.74Å; D197-R237 IonicContact OD2-NE 2.95Å; D197-R237 PolarHBondContact OD2-NE 2.9Å; D197-R237 IonicContact OD2-NH2 2.8Å; D197-R237 PolarHBondContact OD2-NH2 3.25Å; K198-R237 VanDerWaalsContact CB-O 3.27Å; K198-R237 WeakPolarHBondContact CB-O 3.48Å; K198-R237 WeakPolarHBondContact CG-O 3.36Å; K198-R237 PolarHBondContact N-O 3.13Å; D199-R237 WeakPolarHBondContact OD2-CD 3.28Å; D199-R237 WeakPolarHBondContact OD2-CG 3.03Å; D199-R237 IonicContact OD2-CZ 3.68Å; D199-R237 IonicContact OD2-NE 3.99Å; D199-R237 PolarHBondContact OD2-NE 2.73Å; L234-R237 HydrophobicContact CB-CB 4.01Å; L234-R237 WeakPolarHBondContact O-CB 3.19Å; L234-R237 PolarHBondContact O-N 3Å; T235-R237 PolarHBondContact O-N 2.98Å
238	Y	88.2	Confident	74.7	Confident	6 Å²	6	29.6 Å²	29.6	2%	0.024	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	151.6	-172.5	-61	-67.3	0	0	0	112.1	I195 M196 D197 K198 V206 V230 Y231 L234 T235 I267	I195-Y238 HydrophobicContact CG2-CD1 4.1Å; M196-Y238 CarbonylContact O-C 3.47Å; M196-Y238 WeakPolarHBondContact O-CA 3.3Å; D197-Y238 HydrophobicContact CB-CD1 4.4Å; D197-Y238 HydrophobicContact CB-CE1 4.22Å; K198-Y238 VanDerWaalsContact CE-O 3.26Å; K198-Y238 WeakPolarHBondContact CE-O 3.46Å; K198-Y238 PolarHBondContact NZ-O 3.48Å; K198-Y238 VanDerWaalsContact NZ-O 3.13Å; V206-Y238 HydrophobicContact CG2-CE1 4.48Å; V230-Y238 HydrophobicContact CB-CD2 4.35Å; V230-Y238 HydrophobicContact CB-CE2 4.36Å; V230-Y238 HydrophobicContact CG1-CD2 4.21Å; V230-Y238 HydrophobicContact CG1-CG 4.26Å; Y231-Y238 HydrophobicContact CD2-CE2 4.18Å; Y231-Y238 WeakPolarHBondContact CD2-OH 2.92Å; Y231-Y238 WeakPolarHBondContact CE2-OH 3.22Å; L234-Y238 HydrophobicContact CB-CD2 4.37Å; L234-Y238 HydrophobicContact CB-CE2 3.94Å; L234-Y238 VanDerWaalsContact O-CD2 3.24Å; L234-Y238 WeakPolarHBondContact O-CD2 3.22Å; T235-Y238 PolarHBondContact O-N 2.03Å; Y238-I267 HydrophobicContact CD2-CD1 4.4Å
239	S	91.4	Very high	73	Confident	4 Å²	4	34 Å²	34	3%	0.028	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	154.4	163	44.2	0	0	0	0	109.9	M196 K198 R262	M196-S239 PolarHBondContact N-O 2.61Å; M196-S239 PolarHBondContact O-N 2.59Å; K198-S239 VanDerWaalsContact CE-CB 3.46Å; S239-R262 WeakPolarHBondContact CA-O 3.15Å; S239-R262 WeakPolarHBondContact CB-O 3.18Å
240	V	93.1	Very high	71.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	129.5	170.9	179	0	0	0	0	108.8	V193 I194 V223 K261 R262 I264 L288 L290 Y294	V193-V240 HydrophobicContact CB-CG1 3.6Å; V193-V240 HydrophobicContact CG1-CG1 4.04Å; V193-V240 HydrophobicContact CG2-CG1 3.75Å; I194-V240 CarbonylContact O-C 3.4Å; I194-V240 WeakPolarHBondContact O-CA 3.05Å; V223-V240 HydrophobicContact CG2-CG1 4.13Å; V223-V240 HydrophobicContact CG2-CG2 4.45Å; V240-K261 CarbonylContact O-C 3.51Å; V240-K261 WeakPolarHBondContact O-CA 3.22Å; V240-R262 PolarHBondContact N-O 3Å; V240-R262 PolarHBondContact O-N 2.87Å; V240-I264 HydrophobicContact CG2-CD1 4.12Å; V240-I264 HydrophobicContact CG2-CG1 4.18Å; V240-L288 HydrophobicContact CG2-CD1 3.68Å; V240-L290 HydrophobicContact CB-CD2 3.85Å; V240-L290 HydrophobicContact CG2-CD2 3.63Å; V240-Y294 HydrophobicContact CG1-CE2 4.23Å; V240-Y294 PolarHBondContact O-OH 3.05Å
241	G	89.4	Confident	69.5	Low	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.6	174.1	0	0	0	0	0	110.8	I194 M196	I194-G241 WeakPolarHBondContact CG1-O 3.4Å; I194-G241 PolarHBondContact N-O 3.03Å; I194-G241 PolarHBondContact O-N 2.92Å; M196-G241 VanDerWaalsContact CE-CA 3.47Å
242	A	86.5	Confident	68.4	Low	4 Å²	4	42.6 Å²	42.6	3%	0.033	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.7	163.3	0	0	0	0	0	108.5	K244 E260 Y294 R300	A242-K244 PolarHBondContact O-N 3.2Å; A242-E260 PolarHBondContact N-O 3.48Å; A242-E260 PolarHBondContact O-N 3.43Å; A242-E260 VanDerWaalsContact O-N 3.08Å; A242-Y294 HydrophobicContact CB-CD1 4.32Å; A242-Y294 HydrophobicContact CB-CE1 3.67Å; A242-Y294 HydrophobicContact CB-CE2 4.28Å; A242-Y294 PolarHBondContact N-OH 3.45Å; A242-R300 VanDerWaalsContact CB-NE 3.27Å
243	V	73.2	Confident	67.8	Low	13 Å²	13	45.9 Å²	45.9	8%	0.079	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-67.2	123.2	178.1	-176.4	0	0	0	0	107.9	I194 F245 G327 I329	I194-V243 HydrophobicContact CD1-CG2 4.49Å; V243-F245 PolarHBondContact O-N 3.36Å; V243-G327 WeakPolarHBondContact CG2-O 3.24Å; V243-I329 HydrophobicContact CB-CD1 4.35Å; V243-I329 HydrophobicContact CB-CG1 4Å; V243-I329 HydrophobicContact CG2-CD1 3.87Å; V243-I329 HydrophobicContact CG2-CG1 4.03Å
244	K	64.7	Low	67.1	Low	76 Å²	76	46.7 Å²	46.7	33%	0.33	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-75.9	117.8	165.8	-72.2	-175.9	-164.7	-179.8	0	106.2	A242 T246 K258	A242-K244 PolarHBondContact O-N 3.2Å; K244-T246 PolarHBondContact O-N 3.24Å; K244-K258 WeakPolarHBondContact CB-O 3.37Å; K244-K258 HydrophobicContact CD-CB 3.8Å; K244-K258 VanDerWaalsContact CD-O 3.25Å; K244-K258 WeakPolarHBondContact CD-O 3.49Å; K244-K258 WeakPolarHBondContact CG-O 3.34Å
245	F	59.5	Low	65.8	Low	63 Å²	63	52.6 Å²	52.6	28%	0.276	28%	0.283	S	S	.	.			trans	-60.9	101.3	171.9	-64.3	-83.9	0	0	0	108.2	V243 T299 I329	V243-F245 PolarHBondContact O-N 3.36Å; F245-T299 HydrophobicContact CD2-CG2 4.18Å; F245-I329 HydrophobicContact CE1-CB 4.02Å; F245-I329 HydrophobicContact CE1-CG1 4.29Å; F245-I329 HydrophobicContact CE1-CG2 4.37Å; F245-I329 HydrophobicContact CZ-CB 4.32Å; F245-I329 HydrophobicContact CZ-CG1 4.3Å; F245-I329 HydrophobicContact CZ-CG2 4.36Å
246	T	48	Very low	64.3	Low	56 Å²	56	57.4 Å²	57.4	34%	0.344	30%	0.302	S	S	.	.			trans	-92.5	151.1	161.8	46.5	0	0	0	0	107.5	K244 I252	K244-T246 PolarHBondContact O-N 3.24Å; T246-I252 HydrophobicContact CG2-CD1 4.21Å
247	D	49.6	Very low	63.3	Low	96 Å²	96	55.9 Å²	55.9	51%	0.513	30%	0.296	S	S	.	.			trans	-38.3	124.1	-177.4	-171.8	-18.3	0	0	0	112.2	L249 S250	D247-L249 PolarHBondContact O-N 3.15Å; D247-L249 WeakPolarHBondContact OD1-CB 3.27Å; D247-L249 PolarHBondContact OD1-N 3.47Å; D247-S250 PolarHBondContact O-N 3.19Å
248	P	48.1	Very low	62.5	Low	68 Å²	68	62.3 Å²	62.3	44%	0.442	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-16.2	178.8	21	-32.3	0	0	0	113.9	I186	I186-P248 HydrophobicContact CB-CB 4.34Å; I186-P248 HydrophobicContact CD1-CB 3.71Å; I186-P248 HydrophobicContact CG2-CB 4.26Å
249	L	47.1	Very low	62	Low	119 Å²	119	63.1 Å²	63.1	62%	0.623	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.6	176.6	-64	172.9	0	0	0	114.2	F181 D247 P251	F181-L249 HydrophobicContact CD2-CD2 4.48Å; F181-L249 HydrophobicContact CE2-CD2 3.76Å; F181-L249 HydrophobicContact CZ-CD2 4.19Å; D247-L249 PolarHBondContact O-N 3.15Å; D247-L249 WeakPolarHBondContact OD1-CB 3.27Å; D247-L249 PolarHBondContact OD1-N 3.47Å; L249-P251 VanDerWaalsContact O-CD 3.28Å; L249-P251 WeakPolarHBondContact O-CD 3.4Å
250	S	47.2	Very low	61.8	Low	52 Å²	52	65 Å²	65	36%	0.364	34%	0.338	S	S	.	.	S	Bend	trans	-92.4	113.5	179.2	-162.8	0	0	0	0	109.5	D247 I252	D247-S250 PolarHBondContact O-N 3.19Å; S250-I252 PolarHBondContact O-N 3.2Å; S250-I252 WeakPolarHBondContact OG-CD1 3.32Å; S250-I252 WeakPolarHBondContact OG-CG1 2.91Å
251	P	47.3	Very low	61.6	Low	129 Å²	129	69.8 Å²	69.8	84%	0.838	36%	0.358	S	S	*	.			trans	-73.4	70	174.1	31.3	-33.1	0	0	0	108.9	L249	L249-P251 VanDerWaalsContact O-CD 3.28Å; L249-P251 WeakPolarHBondContact O-CD 3.4Å
252	I	49.6	Very low	61.9	Low	29 Å²	29	71.8 Å²	71.8	15%	0.149	37%	0.366	C	S	.	.			trans	-87	117.9	-179.3	-56.2	-175.6	0	0	0	107.2	T246 S250 E256 R257	T246-I252 HydrophobicContact CG2-CD1 4.21Å; S250-I252 PolarHBondContact O-N 3.2Å; S250-I252 WeakPolarHBondContact OG-CD1 3.32Å; S250-I252 WeakPolarHBondContact OG-CG1 2.91Å; I252-E256 VanDerWaalsContact CG2-C 3.48Å; I252-E256 HydrophobicContact CG2-CB 3.24Å; I252-E256 HydrophobicContact CG2-CG 4.49Å; I252-R257 HydrophobicContact CB-CG 4.13Å; I252-R257 HydrophobicContact CG2-CG 3.68Å; I252-R257 PolarHBondContact O-NE 3.17Å; I252-R257 VanDerWaalsContact O-NE 3.16Å
253	D	51.3	Low	62.2	Low	101 Å²	101	75.1 Å²	75.1	54%	0.54	38%	0.383	S	S	.	.			trans	-51.5	145.8	170.1	-173.8	5.5	0	0	0	109.3	M255 E256 R257	D253-M255 PolarHBondContact O-N 3.05Å; D253-E256 HydrophobicContact CB-CG 4.45Å; D253-E256 PolarHBondContact O-N 3.41Å; D253-R257 PolarHBondContact O-N 3.18Å; D253-R257 VanDerWaalsContact O-N 3.14Å
254	F	52.4	Low	63.2	Low	33 Å²	33	74.7 Å²	74.7	15%	0.145	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-31.8	177.4	178.9	-91.3	0	0	0	112	I194 M196 P203 R257 I259 R326	I194-F254 HydrophobicContact CD1-CE2 4.06Å; I194-F254 HydrophobicContact CD1-CZ 4.24Å; M196-F254 HydrophobicContact SD-CZ 4.25Å; P203-F254 HydrophobicContact CB-CE1 4.25Å; P203-F254 WeakPolarHBondContact O-CE1 3.36Å; P203-F254 WeakPolarHBondContact O-CZ 3.25Å; F254-R257 PolarHBondContact O-N 2.9Å; F254-I259 HydrophobicContact CD2-CD1 3.94Å; F254-I259 HydrophobicContact CE1-CD1 3.94Å; F254-I259 HydrophobicContact CE2-CD1 3.34Å; F254-I259 HydrophobicContact CZ-CD1 3.34Å; F254-R326 VanDerWaalsContact CD2-O 3.32Å; F254-R326 WeakPolarHBondContact CD2-O 3.45Å
255	M	48.5	Very low	64.6	Low	126 Å²	126	74.3 Å²	74.3	62%	0.621	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-32.5	176.6	-66.4	-59.1	-64.5	0	0	114	D253	D253-M255 PolarHBondContact O-N 3.05Å
256	E	50.8	Low	66.1	Low	136 Å²	136	72.1 Å²	72.1	64%	0.636	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.1	178.3	-70.4	-179	173.5	0	0	112.2	I252 D253 K258	I252-E256 VanDerWaalsContact CG2-C 3.48Å; I252-E256 HydrophobicContact CG2-CB 3.24Å; I252-E256 HydrophobicContact CG2-CG 4.49Å; D253-E256 HydrophobicContact CB-CG 4.45Å; D253-E256 PolarHBondContact O-N 3.41Å; E256-K258 PolarHBondContact O-N 3.49Å
257	R	61.3	Low	68.1	Low	46 Å²	46	69.6 Å²	69.6	17%	0.174	36%	0.362	C	S	.	.	S	Bend	trans	-67.6	125.1	176.1	-68.3	-178.5	-175.1	-155	-4.5	110	I252 D253 F254 I259 D328	I252-R257 HydrophobicContact CB-CG 4.13Å; I252-R257 HydrophobicContact CG2-CG 3.68Å; I252-R257 PolarHBondContact O-NE 3.17Å; I252-R257 VanDerWaalsContact O-NE 3.16Å; D253-R257 PolarHBondContact O-N 3.18Å; D253-R257 VanDerWaalsContact O-N 3.14Å; F254-R257 PolarHBondContact O-N 2.9Å; R257-I259 HydrophobicContact CB-CG1 4.23Å; R257-I259 PolarHBondContact O-N 3.31Å; R257-D328 IonicContact CZ-OD1 2.72Å; R257-D328 IonicContact NH1-OD1 3.19Å; R257-D328 PolarHBondContact NH1-OD1 3.49Å; R257-D328 IonicContact NH2-OD1 3.77Å; R257-D328 PolarHBondContact NH2-OD1 3.41Å
258	K	65.3	Low	70	Confident	152 Å²	152	71 Å²	71	66%	0.661	36%	0.36	S	S	*	.			trans	-71.1	70.5	172.9	-69.3	-177.2	-179.5	177.1	0	110.4	K244 E256 E260	K244-K258 WeakPolarHBondContact CB-O 3.37Å; K244-K258 HydrophobicContact CD-CB 3.8Å; K244-K258 VanDerWaalsContact CD-O 3.25Å; K244-K258 WeakPolarHBondContact CD-O 3.49Å; K244-K258 WeakPolarHBondContact CG-O 3.34Å; E256-K258 PolarHBondContact O-N 3.49Å; K258-E260 PolarHBondContact O-N 3.13Å
259	I	78.3	Confident	71.7	Confident	23 Å²	23	70.1 Å²	70.1	12%	0.118	35%	0.349	C	S	.	.			trans	-72.1	118.6	171.4	-61.9	166.1	0	0	0	107.5	I194 M196 F254 R257 K261	I194-I259 HydrophobicContact CD1-CD1 4.1Å; I194-I259 HydrophobicContact CD1-CG2 4.45Å; M196-I259 HydrophobicContact CE-CG2 4.2Å; M196-I259 HydrophobicContact SD-CG2 4.36Å; F254-I259 HydrophobicContact CD2-CD1 3.94Å; F254-I259 HydrophobicContact CE1-CD1 3.94Å; F254-I259 HydrophobicContact CE2-CD1 3.34Å; F254-I259 HydrophobicContact CZ-CD1 3.34Å; R257-I259 HydrophobicContact CB-CG1 4.23Å; R257-I259 PolarHBondContact O-N 3.31Å; I259-K261 HydrophobicContact CG2-CG 4.09Å; I259-K261 PolarHBondContact O-N 3.45Å
260	E	86.3	Confident	73.4	Confident	44 Å²	44	67.2 Å²	67.2	21%	0.206	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	109.7	174	-170.5	178	159.8	0	0	108.2	A242 K258 R262 Y294 K297 R300	A242-E260 PolarHBondContact N-O 3.48Å; A242-E260 PolarHBondContact O-N 3.43Å; A242-E260 VanDerWaalsContact O-N 3.08Å; K258-E260 PolarHBondContact O-N 3.13Å; E260-R262 VanDerWaalsContact CG-NH1 3.27Å; E260-R262 IonicContact OE1-CZ 2.87Å; E260-R262 IonicContact OE1-NH1 2.64Å; E260-R262 PolarHBondContact OE1-NH1 3.44Å; E260-R262 IonicContact OE1-NH2 3.18Å; E260-R262 PolarHBondContact OE1-NH2 3.43Å; E260-Y294 HydrophobicContact CB-CE1 4.33Å; E260-Y294 HydrophobicContact CG-CE1 4.09Å; E260-Y294 PolarHBondContact O-OH 3.08Å; E260-K297 IonicContact OE2-NZ 2.69Å; E260-R300 VanDerWaalsContact CD-NH1 3.31Å; E260-R300 IonicContact OE1-NH1 3.48Å; E260-R300 PolarHBondContact OE1-NH1 3.01Å; E260-R300 IonicContact OE2-CZ 2.99Å; E260-R300 IonicContact OE2-NH1 3.14Å; E260-R300 PolarHBondContact OE2-NH1 2.94Å; E260-R300 IonicContact OE2-NH2 3.49Å; E260-R300 PolarHBondContact OE2-NH2 3.28Å
261	K	90	Very high	74.7	Confident	100 Å²	100	66.6 Å²	66.6	44%	0.435	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	151.8	-175.9	-55.3	-170.6	179.4	175	0	111.8	M196 V240 I259	M196-K261 HydrophobicContact CE-CB 4.43Å; M196-K261 HydrophobicContact CE-CD 3.85Å; M196-K261 HydrophobicContact CE-CG 3.76Å; M196-K261 HydrophobicContact SD-CD 4.4Å; V240-K261 CarbonylContact O-C 3.51Å; V240-K261 WeakPolarHBondContact O-CA 3.22Å; I259-K261 HydrophobicContact CG2-CG 4.09Å; I259-K261 PolarHBondContact O-N 3.45Å
262	R	94	Very high	75.9	Confident	41 Å²	41	60.7 Å²	60.7	16%	0.155	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	134.8	172.5	-68.1	-63.3	-170	-89.1	-3.2	110.9	S239 V240 E260 L290 K292 P293 Y294	S239-R262 WeakPolarHBondContact CA-O 3.15Å; S239-R262 WeakPolarHBondContact CB-O 3.18Å; V240-R262 PolarHBondContact N-O 3Å; V240-R262 PolarHBondContact O-N 2.87Å; E260-R262 VanDerWaalsContact CG-NH1 3.27Å; E260-R262 IonicContact OE1-CZ 2.87Å; E260-R262 IonicContact OE1-NH1 2.64Å; E260-R262 PolarHBondContact OE1-NH1 3.44Å; E260-R262 IonicContact OE1-NH2 3.18Å; E260-R262 PolarHBondContact OE1-NH2 3.43Å; R262-L290 HydrophobicContact CB-CB 4.35Å; R262-L290 HydrophobicContact CB-CD1 4.05Å; R262-L290 HydrophobicContact CB-CD2 4.18Å; R262-L290 HydrophobicContact CB-CG 4.42Å; R262-L290 HydrophobicContact CG-CD1 4.24Å; R262-K292 VanDerWaalsContact CD-O 3.22Å; R262-K292 WeakPolarHBondContact CD-O 3.11Å; R262-K292 PolarHBondContact NE-O 2.82Å; R262-P293 PolarHBondContact NE-O 3.25Å; R262-P293 VanDerWaalsContact NE-O 3.16Å; R262-P293 PolarHBondContact NH2-O 2.87Å; R262-P293 VanDerWaalsContact NH2-O 3.15Å; R262-Y294 HydrophobicContact CB-CE2 4.31Å; R262-Y294 HydrophobicContact CG-CD1 4.17Å; R262-Y294 HydrophobicContact CG-CD2 4.31Å; R262-Y294 HydrophobicContact CG-CE1 3.57Å; R262-Y294 HydrophobicContact CG-CE2 3.72Å; R262-Y294 WeakPolarHBondContact CG-OH 3.27Å
263	D	94.1	Very high	77	Confident	74 Å²	74	59.8 Å²	59.8	40%	0.396	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	150.1	171.2	-67.2	-40.6	0	0	0	111.3	K198 L290 R291	K198-D263 IonicContact NZ-OD1 3.92Å; K198-D263 PolarHBondContact NZ-OD1 2.92Å; D263-L290 CarbonylContact O-C 3.57Å; D263-L290 WeakPolarHBondContact O-CA 3.31Å; D263-R291 HydrophobicContact CB-CB 4.21Å; D263-R291 PolarHBondContact O-N 2.87Å
264	I	94.2	Very high	78.1	Confident	5 Å²	5	56 Å²	56	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.5	176.9	-58.4	170.6	0	0	0	108.1	T235 V240 A266 I267 L288 K289 L290	T235-I264 HydrophobicContact CG2-CG2 4.22Å; V240-I264 HydrophobicContact CG2-CD1 4.12Å; V240-I264 HydrophobicContact CG2-CG1 4.18Å; I264-A266 VanDerWaalsContact CG2-O 3.31Å; I264-A266 WeakPolarHBondContact CG2-O 3.24Å; I264-I267 HydrophobicContact CG2-CD1 4.36Å; I264-I267 HydrophobicContact CG2-CG1 3.73Å; I264-L288 HydrophobicContact CD1-CB 4.31Å; I264-L288 HydrophobicContact CD1-CD1 3.92Å; I264-L288 HydrophobicContact CD1-CD2 4.46Å; I264-L288 HydrophobicContact CD1-CG 4.46Å; I264-L288 HydrophobicContact CG1-CB 4.43Å; I264-L288 HydrophobicContact CG2-CB 4.26Å; I264-K289 WeakPolarHBondContact CA-O 3.32Å; I264-L290 HydrophobicContact CG1-CD2 4.22Å
265	V	93.3	Very high	79.3	Confident	68 Å²	68	57 Å²	57	41%	0.412	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-28.1	174.8	-68.1	0	0	0	0	112.4	K289 R291	V265-K289 HydrophobicContact CG2-CB 3.9Å; V265-K289 VanDerWaalsContact CG2-O 3.28Å; V265-K289 WeakPolarHBondContact CG2-O 3.36Å; V265-K289 PolarHBondContact N-O 2.85Å; V265-R291 HydrophobicContact CG1-CB 3.56Å; V265-R291 HydrophobicContact CG1-CG 3.87Å
266	A	91.1	Very high	80.9	Confident	16 Å²	16	51 Å²	51	13%	0.132	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	144.1	177.7	0	0	0	0	0	110.8	I264 K289	I264-A266 VanDerWaalsContact CG2-O 3.31Å; I264-A266 WeakPolarHBondContact CG2-O 3.24Å; A266-K289 HydrophobicContact CB-CB 4.14Å; A266-K289 HydrophobicContact CB-CG 4.46Å; A266-K289 PolarHBondContact O-N 2.84Å
267	I	89.5	Confident	82.4	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.1	169.9	-64.6	162.6	0	0	0	106.4	V230 Y231 T235 Y238 I264 L288	V230-I267 HydrophobicContact CB-CD1 4.16Å; V230-I267 HydrophobicContact CB-CG2 4.37Å; V230-I267 HydrophobicContact CG2-CG2 3.68Å; Y231-I267 WeakPolarHBondContact O-CD1 3.21Å; T235-I267 HydrophobicContact CG2-CD1 3.93Å; T235-I267 HydrophobicContact CG2-CG1 4.04Å; Y238-I267 HydrophobicContact CD2-CD1 4.4Å; I264-I267 HydrophobicContact CG2-CD1 4.36Å; I264-I267 HydrophobicContact CG2-CG1 3.73Å; I267-L288 HydrophobicContact CG1-CD2 3.91Å; I267-L288 HydrophobicContact CG2-CD2 4.25Å
268	R	89.9	Confident	83	Confident	125 Å²	125	46.1 Å²	46.1	47%	0.472	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.9	176.4	-61.5	-65.6	179.6	-109.7	5.1	107.3	A286 I287 F422	R268-A286 CarbonylContact O-C 3.5Å; R268-A286 WeakPolarHBondContact O-CA 2.93Å; R268-I287 HydrophobicContact CB-CB 4.47Å; R268-I287 PolarHBondContact N-O 3.12Å; R268-I287 PolarHBondContact O-N 2.92Å; R268-F422 HydrophobicContact CB-CZ 4.35Å
269	F	84.5	Confident	83.1	Confident	51 Å²	51	39.1 Å²	39.1	22%	0.224	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	150.3	-178.1	67.5	-75.9	0	0	0	110.5	L14 A227 S232 P271 L285 A286	L14-F269 HydrophobicContact CD1-CE1 4.28Å; L14-F269 HydrophobicContact CD1-CZ 4.27Å; A227-F269 HydrophobicContact CB-CB 4.46Å; S232-F269 VanDerWaalsContact CB-CE1 3.4Å; S232-F269 WeakPolarHBondContact OG-CE1 3.46Å; F269-P271 HydrophobicContact CD2-CB 4.07Å; F269-P271 VanDerWaalsContact CD2-CD 3.5Å; F269-P271 HydrophobicContact CD2-CG 3.89Å; F269-P271 HydrophobicContact CE2-CB 4.27Å; F269-P271 HydrophobicContact CE2-CG 3.81Å; F269-L285 CarbonylContact C-O 3.44Å; F269-L285 WeakPolarHBondContact CA-O 3.39Å; F269-A286 HydrophobicContact CB-CB 4.19Å
270	K	81.9	Confident	82.7	Confident	58 Å²	58	40.4 Å²	40.4	25%	0.252	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	93	167	-180	159.1	179.6	175	0	106.4	E74 G284 L285 F422	E74-K270 IonicContact OE1-NZ 2.96Å; K270-G284 CarbonylContact O-C 3.5Å; K270-G284 VanDerWaalsContact O-CA 3.23Å; K270-G284 WeakPolarHBondContact O-CA 3.39Å; K270-L285 PolarHBondContact N-O 3.45Å; K270-L285 PolarHBondContact O-N 3.15Å; K270-F422 HydrophobicContact CB-CD1 4.1Å; K270-F422 HydrophobicContact CB-CD2 4.25Å; K270-F422 HydrophobicContact CB-CE1 3.93Å; K270-F422 HydrophobicContact CB-CE2 4.09Å; K270-F422 HydrophobicContact CB-CG 4.26Å; K270-F422 HydrophobicContact CB-CZ 3.93Å; K270-F422 HydrophobicContact CD-CB 4.36Å; K270-F422 HydrophobicContact CD-CG 4.3Å
271	P	74.2	Confident	82	Confident	38 Å²	38	39.1 Å²	39.1	25%	0.247	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	155.6	-178.6	33.4	-33	0	0	0	109.6	I71 F269	I71-P271 HydrophobicContact CG1-CG 4.27Å; F269-P271 HydrophobicContact CD2-CB 4.07Å; F269-P271 VanDerWaalsContact CD2-CD 3.5Å; F269-P271 HydrophobicContact CD2-CG 3.89Å; F269-P271 HydrophobicContact CE2-CB 4.27Å; F269-P271 HydrophobicContact CE2-CG 3.81Å
272	L	74.1	Confident	81.1	Confident	6 Å²	6	35.1 Å²	35.1	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	128.3	171.4	171.6	68.1	0	0	0	107.7	M283 K354 M414	L272-M283 PolarHBondContact N-O 2.6Å; L272-M283 CarbonylContact O-C 3.5Å; L272-M283 WeakPolarHBondContact O-CA 2.89Å; L272-M283 PolarHBondContact O-N 3.5Å; L272-K354 HydrophobicContact CD1-CD 3.9Å; L272-K354 HydrophobicContact CD2-CB 4.09Å; L272-K354 HydrophobicContact CD2-CD 3.79Å; L272-K354 HydrophobicContact CD2-CG 4.34Å; L272-M414 HydrophobicContact CB-CE 3.98Å; L272-M414 HydrophobicContact CD2-CE 3.62Å; L272-M414 HydrophobicContact CD2-SD 3.77Å; L272-M414 HydrophobicContact CG-CE 4.43Å
273	M	72.2	Confident	80.5	Confident	9 Å²	9	33.2 Å²	33.2	4%	0.044	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140	166.6	-55.1	-65.5	-59	0	0	108.9	V46 I71 L75 L280 V281 A282	V46-M273 HydrophobicContact CG1-CE 4.45Å; V46-M273 HydrophobicContact CG2-CE 3.99Å; V46-M273 HydrophobicContact CG2-SD 4.22Å; I71-M273 HydrophobicContact CG2-CB 4.13Å; I71-M273 HydrophobicContact CG2-CG 3.25Å; L75-M273 HydrophobicContact CD1-CB 4.16Å; L75-M273 HydrophobicContact CD2-CB 4.07Å; L75-M273 WeakPolarHBondContact CD2-O 3.14Å; M273-L280 HydrophobicContact CB-CD1 4.15Å; M273-L280 HydrophobicContact CB-CG 4.44Å; M273-L280 HydrophobicContact CE-CD1 4.48Å; M273-L280 HydrophobicContact CE-CD2 3.77Å; M273-L280 HydrophobicContact CE-CG 3.6Å; M273-V281 WeakPolarHBondContact CA-O 3.1Å; M273-A282 HydrophobicContact CE-CB 3.96Å; M273-A282 WeakPolarHBondContact SD-CA 3.2Å; M273-A282 HydrophobicContact SD-CB 3.47Å; M273-A282 WeakPolarHBondContact SD-CB 3.49Å
274	T	73.3	Confident	80.1	Confident	22 Å²	22	29.7 Å²	29.7	14%	0.135	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.5	178.2	-179.5	0	0	0	0	108.8	H276 V281 M283 E355	T274-H276 VanDerWaalsContact CG2-CD2 3.46Å; T274-H276 WeakPolarHBondContact CG2-CD2 3.5Å; T274-H276 PolarHBondContact OG1-NE2 2.02Å; T274-V281 PolarHBondContact N-O 2.91Å; T274-V281 VanDerWaalsContact N-O 3.08Å; T274-V281 PolarHBondContact O-N 3.05Å; T274-M283 HydrophobicContact CG2-CB 4.28Å; T274-M283 HydrophobicContact CG2-CE 3.62Å; T274-M283 HydrophobicContact CG2-CG 3.66Å; T274-M283 HydrophobicContact CG2-SD 3.4Å; T274-M283 WeakPolarHBondContact CG2-SD 3.25Å; T274-E355 PolarHBondContact OG1-OE1 2.82Å; T274-E355 VanDerWaalsContact OG1-OE1 3.05Å
275	L	78.5	Confident	80	Confident	53 Å²	53	29.5 Å²	29.5	28%	0.277	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.6	176.8	-170.1	72.1	0	0	0	107.8	C279 E349	L275-C279 WeakPolarHBondContact CA-O 3.4Å; L275-E349 HydrophobicContact CD2-CG 4.27Å; L275-E349 WeakPolarHBondContact CD2-OE1 3.27Å; L275-E349 HydrophobicContact CG-CG 4.38Å; L275-E349 WeakPolarHBondContact O-CB 3.13Å
276	H	81.5	Confident	79.9	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	139.3	173.3	-80	-83.1	0	0	0	110.4	T274 H278 C279 V281 M283 E349 E355 M389 I412	T274-H276 VanDerWaalsContact CG2-CD2 3.46Å; T274-H276 WeakPolarHBondContact CG2-CD2 3.5Å; T274-H276 PolarHBondContact OG1-NE2 2.02Å; H276-H278 PolarHBondContact O-N 3.18Å; H276-C279 PolarHBondContact N-O 3.35Å; H276-C279 WeakPolarHBondContact O-CA 3.48Å; H276-C279 VanDerWaalsContact O-CB 3.25Å; H276-C279 WeakPolarHBondContact O-CB 3.5Å; H276-C279 PolarHBondContact O-N 3.02Å; H276-V281 HydrophobicContact CB-CG2 4.34Å; H276-M283 HydrophobicContact CB-CE 4.47Å; H276-M283 WeakPolarHBondContact CD2-CE 3.25Å; H276-E349 WeakPolarHBondContact CA-OE2 3.3Å; H276-E349 PolarHBondContact CE1-O 2.89Å; H276-E349 PolarHBondContact ND1-O 2.93Å; H276-E355 IonicContact CD2-OE1 2.66Å; H276-E355 IonicContact CE1-OE1 3.9Å; H276-E355 IonicContact CE1-OE2 2.84Å; H276-E355 VanDerWaalsContact NE2-CD 3.3Å; H276-E355 IonicContact NE2-OE1 2.71Å; H276-E355 PolarHBondContact NE2-OE1 3.01Å; H276-E355 IonicContact NE2-OE2 2.66Å; H276-E355 PolarHBondContact NE2-OE2 3.01Å; H276-M389 HydrophobicContact CB-CE 3.99Å; H276-M389 HydrophobicContact CB-SD 3.95Å; H276-I412 WeakPolarHBondContact ND1-CD1 3.25Å
277	D	82.1	Confident	80.1	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.016	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	37.8	-171.8	-63.3	-19.4	0	0	0	112	P89 C279 E349 S391 T392 R393	P89-D277 HydrophobicContact CG-CB 4.47Å; D277-C279 PolarHBondContact O-N 3Å; D277-C279 PolarHBondContact O-SG 3.49Å; D277-E349 WeakPolarHBondContact CA-OE2 3.5Å; D277-E349 PolarHBondContact N-OE2 3.42Å; D277-S391 PolarHBondContact OD1-OG 2.95Å; D277-T392 PolarHBondContact OD1-N 3.23Å; D277-T392 PolarHBondContact OD2-N 2.96Å; D277-T392 PolarHBondContact OD2-OG1 3.03Å; D277-R393 HydrophobicContact CB-CG 4.02Å; D277-R393 PolarHBondContact O-NE 2.88Å; D277-R393 PolarHBondContact O-NH2 2.8Å; D277-R393 PolarHBondContact OD1-N 2.83Å
278	H	74.6	Confident	80.4	Confident	77 Å²	77	25.3 Å²	25.3	36%	0.356	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	21.3	-170.5	-50.8	-34	0	0	0	115.4	H276 E347 E349 R393	H276-H278 PolarHBondContact O-N 3.18Å; H278-E347 IonicContact CE1-OE2 2.69Å; H278-E349 WeakPolarHBondContact CA-OE1 3.47Å; H278-E349 IonicContact CE1-OE1 3.97Å; H278-E349 IonicContact CG-OE1 3.65Å; H278-E349 PolarHBondContact N-OE1 3.12Å; H278-E349 PolarHBondContact N-OE2 3.5Å; H278-E349 IonicContact ND1-OE1 3.69Å; H278-E349 PolarHBondContact ND1-OE1 3.12Å; H278-E349 IonicContact ND1-OE2 2.65Å; H278-R393 PolarHBondContact CD2-NH1 3.07Å
279	C	67.3	Low	80.7	Confident	5 Å²	5	20.8 Å²	20.8	3%	0.034	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.7	-176.4	-61.8	0	0	0	0	111.4	C88 L275 H276 D277 V281	C88-C279 WeakPolarHBondContact CA-SG 3.02Å; C88-C279 HydrophobicContact CB-CB 3.74Å; C88-C279 WeakPolarHBondContact CB-SG 3.28Å; C88-C279 WeakPolarHBondContact SG-CB 3.43Å; C88-C279 CovalentContact SG-SG 2Å; C88-C279 PolarHBondContact SG-SG 2.55Å; L275-C279 WeakPolarHBondContact CA-O 3.4Å; H276-C279 PolarHBondContact N-O 3.35Å; H276-C279 WeakPolarHBondContact O-CA 3.48Å; H276-C279 VanDerWaalsContact O-CB 3.25Å; H276-C279 WeakPolarHBondContact O-CB 3.5Å; H276-C279 PolarHBondContact O-N 3.02Å; D277-C279 PolarHBondContact O-N 3Å; D277-C279 PolarHBondContact O-SG 3.49Å; C279-V281 HydrophobicContact CB-CG2 4.24Å; C279-V281 PolarHBondContact O-N 3.11Å; C279-V281 VanDerWaalsContact O-N 3.08Å
280	L	70.8	Confident	81.2	Confident	50 Å²	50	18.5 Å²	18.5	26%	0.262	10%	0.097	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	102.8	172.3	-167.7	71.2	0	0	0	108.7	I82 M273	I82-L280 HydrophobicContact CD1-CD1 4.46Å; I82-L280 HydrophobicContact CD1-CD2 4.29Å; I82-L280 HydrophobicContact CG2-CB 4.36Å; M273-L280 HydrophobicContact CB-CD1 4.15Å; M273-L280 HydrophobicContact CB-CG 4.44Å; M273-L280 HydrophobicContact CE-CD1 4.48Å; M273-L280 HydrophobicContact CE-CD2 3.77Å; M273-L280 HydrophobicContact CE-CG 3.6Å
281	V	70.6	Confident	81.8	Confident	17 Å²	17	23.5 Å²	23.5	10%	0.103	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.1	-176.8	-176.7	0	0	0	0	110	M273 T274 H276 C279 M283 M389	M273-V281 WeakPolarHBondContact CA-O 3.1Å; T274-V281 PolarHBondContact N-O 2.91Å; T274-V281 VanDerWaalsContact N-O 3.08Å; T274-V281 PolarHBondContact O-N 3.05Å; H276-V281 HydrophobicContact CB-CG2 4.34Å; C279-V281 HydrophobicContact CB-CG2 4.24Å; C279-V281 PolarHBondContact O-N 3.11Å; C279-V281 VanDerWaalsContact O-N 3.08Å; V281-M283 HydrophobicContact CB-CE 4.37Å; V281-M283 HydrophobicContact CB-CG 4.49Å; V281-M283 HydrophobicContact CG1-CE 4.19Å; V281-M283 HydrophobicContact CG1-CG 3.96Å; V281-M283 PolarHBondContact O-N 3.1Å; V281-M389 HydrophobicContact CG1-SD 4.17Å; V281-M389 HydrophobicContact CG2-SD 4.09Å
282	A	71.7	Confident	82.8	Confident	15 Å²	15	28.5 Å²	28.5	12%	0.124	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	104.6	166.9	0	0	0	0	0	109.7	Q228 M273	Q228-A282 VanDerWaalsContact CD-O 3.23Å; Q228-A282 WeakPolarHBondContact CG-O 3.46Å; Q228-A282 PolarHBondContact NE2-O 3.42Å; M273-A282 HydrophobicContact CE-CB 3.96Å; M273-A282 WeakPolarHBondContact SD-CA 3.2Å; M273-A282 HydrophobicContact SD-CB 3.47Å; M273-A282 WeakPolarHBondContact SD-CB 3.49Å
283	M	80.6	Confident	83.8	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-168.3	171.5	-62	-164.5	-176.8	0	0	110.5	L272 T274 H276 V281 M388 M389 I412	L272-M283 PolarHBondContact N-O 2.6Å; L272-M283 CarbonylContact O-C 3.5Å; L272-M283 WeakPolarHBondContact O-CA 2.89Å; L272-M283 PolarHBondContact O-N 3.5Å; T274-M283 HydrophobicContact CG2-CB 4.28Å; T274-M283 HydrophobicContact CG2-CE 3.62Å; T274-M283 HydrophobicContact CG2-CG 3.66Å; T274-M283 HydrophobicContact CG2-SD 3.4Å; T274-M283 WeakPolarHBondContact CG2-SD 3.25Å; H276-M283 HydrophobicContact CB-CE 4.47Å; H276-M283 WeakPolarHBondContact CD2-CE 3.25Å; V281-M283 HydrophobicContact CB-CE 4.37Å; V281-M283 HydrophobicContact CB-CG 4.49Å; V281-M283 HydrophobicContact CG1-CE 4.19Å; V281-M283 HydrophobicContact CG1-CG 3.96Å; V281-M283 PolarHBondContact O-N 3.1Å; M283-M388 HydrophobicContact CB-CG 4.39Å; M283-M388 HydrophobicContact CB-SD 4.12Å; M283-M388 HydrophobicContact CE-CB 4.34Å; M283-M388 HydrophobicContact CG-CB 4.34Å; M283-M388 HydrophobicContact CG-CG 4.31Å; M283-M388 HydrophobicContact SD-CB 3.94Å; M283-M388 HydrophobicContact SD-CG 3.9Å; M283-M389 HydrophobicContact CE-CG 3.92Å; M283-M389 HydrophobicContact CE-SD 3.54Å; M283-M389 VanDerWaalsContact CE-SD 3.54Å; M283-I412 HydrophobicContact CE-CG2 4.23Å
284	G	86.2	Confident	84.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	130.3	-179.7	171.2	0	0	0	0	0	112.9	A226 A227 K270	A226-G284 WeakPolarHBondContact CA-O 3.19Å; A227-G284 PolarHBondContact N-O 3.14Å; K270-G284 CarbonylContact O-C 3.5Å; K270-G284 VanDerWaalsContact O-CA 3.23Å; K270-G284 WeakPolarHBondContact O-CA 3.39Å
285	L	91.7	Very high	85.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	144.7	-179.4	-60.2	177.7	0	0	0	110.3	L224 F269 K270 M414 L416 H419 F422 I423	L224-L285 HydrophobicContact CD1-CB 4.31Å; L224-L285 HydrophobicContact CD1-CD2 4.38Å; F269-L285 CarbonylContact C-O 3.44Å; F269-L285 WeakPolarHBondContact CA-O 3.39Å; K270-L285 PolarHBondContact N-O 3.45Å; K270-L285 PolarHBondContact O-N 3.15Å; L285-M414 HydrophobicContact CD1-CG 4.44Å; L285-M414 HydrophobicContact CD2-CB 3.89Å; L285-M414 HydrophobicContact CD2-CG 3.63Å; L285-M414 HydrophobicContact CG-CG 3.81Å; L285-L416 HydrophobicContact CD1-CD2 3.76Å; L285-L416 HydrophobicContact CD2-CD2 3.71Å; L285-L416 HydrophobicContact CG-CD2 4.41Å; L285-H419 HydrophobicContact CD1-CB 3.6Å; L285-F422 HydrophobicContact CB-CE1 4.32Å; L285-I423 HydrophobicContact CD1-CD1 4.21Å
286	A	92.6	Very high	86.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.5	164.7	0	0	0	0	0	110.7	T225 V230 R268 F269	T225-A286 HydrophobicContact CG2-CB 3.94Å; T225-A286 PolarHBondContact N-O 3.01Å; T225-A286 PolarHBondContact O-N 2.96Å; V230-A286 HydrophobicContact CG2-CB 3.53Å; R268-A286 CarbonylContact O-C 3.5Å; R268-A286 WeakPolarHBondContact O-CA 2.93Å; F269-A286 HydrophobicContact CB-CB 4.19Å
287	I	94.6	Very high	86.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.5	175.7	-64.5	173.1	0	0	0	107.8	V222 V223 L224 R268 F422 I423 Q426	V222-I287 HydrophobicContact CG1-CG2 3.57Å; V223-I287 CarbonylContact O-C 3.18Å; V223-I287 VanDerWaalsContact O-CA 3.29Å; V223-I287 WeakPolarHBondContact O-CA 3.26Å; L224-I287 HydrophobicContact CD1-CG1 3.93Å; R268-I287 HydrophobicContact CB-CB 4.47Å; R268-I287 PolarHBondContact N-O 3.12Å; R268-I287 PolarHBondContact O-N 2.92Å; I287-F422 HydrophobicContact CD1-CD1 4.03Å; I287-F422 HydrophobicContact CD1-CE1 3.57Å; I287-F422 HydrophobicContact CD1-CZ 4.1Å; I287-F422 HydrophobicContact CG1-CE1 4.02Å; I287-F422 HydrophobicContact CG1-CZ 4.44Å; I287-I423 HydrophobicContact CD1-CB 4.28Å; I287-I423 HydrophobicContact CD1-CG1 4.17Å; I287-I423 HydrophobicContact CD1-CG2 4.3Å; I287-Q426 HydrophobicContact CB-CG 4.27Å; I287-Q426 HydrophobicContact CD1-CB 3.84Å; I287-Q426 HydrophobicContact CD1-CG 3.51Å; I287-Q426 HydrophobicContact CG1-CG 4.48Å; I287-Q426 HydrophobicContact CG2-CB 3.82Å; I287-Q426 HydrophobicContact CG2-CG 4.05Å
288	L	95.8	Very high	86.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.8	178.3	-36.4	176.4	0	0	0	108	I195 V223 T225 V230 V240 I264 I267	I195-L288 HydrophobicContact CD1-CD1 3.95Å; I195-L288 HydrophobicContact CG1-CD1 4.1Å; V223-L288 HydrophobicContact CB-CB 4.15Å; V223-L288 HydrophobicContact CB-CD1 4.33Å; V223-L288 HydrophobicContact CB-CG 4.36Å; V223-L288 HydrophobicContact CG1-CD1 4.04Å; V223-L288 HydrophobicContact CG1-CG 4.4Å; V223-L288 PolarHBondContact N-O 3.27Å; V223-L288 PolarHBondContact O-N 3.07Å; T225-L288 HydrophobicContact CG2-CD1 4.22Å; T225-L288 HydrophobicContact CG2-CD2 4.21Å; T225-L288 HydrophobicContact CG2-CG 4.21Å; V230-L288 HydrophobicContact CB-CD2 4.25Å; V230-L288 HydrophobicContact CG1-CD1 4.45Å; V230-L288 HydrophobicContact CG1-CD2 3.88Å; V230-L288 HydrophobicContact CG2-CD2 3.75Å; V240-L288 HydrophobicContact CG2-CD1 3.68Å; I264-L288 HydrophobicContact CD1-CB 4.31Å; I264-L288 HydrophobicContact CD1-CD1 3.92Å; I264-L288 HydrophobicContact CD1-CD2 4.46Å; I264-L288 HydrophobicContact CD1-CG 4.46Å; I264-L288 HydrophobicContact CG1-CB 4.43Å; I264-L288 HydrophobicContact CG2-CB 4.26Å; I267-L288 HydrophobicContact CG1-CD2 3.91Å; I267-L288 HydrophobicContact CG2-CD2 4.25Å
289	K	95.1	Very high	86.4	Confident	30 Å²	30	36 Å²	36	13%	0.13	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	122.1	168.7	-69	-67.4	-156.7	164.5	0	108.5	N221 V222 I264 V265 A266 Q426 K428	N221-K289 WeakPolarHBondContact O-CA 3.14Å; V222-K289 HydrophobicContact CG2-CD 3.98Å; I264-K289 WeakPolarHBondContact CA-O 3.32Å; V265-K289 HydrophobicContact CG2-CB 3.9Å; V265-K289 VanDerWaalsContact CG2-O 3.28Å; V265-K289 WeakPolarHBondContact CG2-O 3.36Å; V265-K289 PolarHBondContact N-O 2.85Å; A266-K289 HydrophobicContact CB-CB 4.14Å; A266-K289 HydrophobicContact CB-CG 4.46Å; A266-K289 PolarHBondContact O-N 2.84Å; K289-Q426 WeakPolarHBondContact CE-O 3.13Å; K289-Q426 PolarHBondContact NZ-O 3.5Å; K289-K428 PolarHBondContact NZ-OXT 2.74Å; K289-K428 VanDerWaalsContact NZ-OXT 3.09Å
290	L	95.9	Very high	87.3	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	144.2	-179.9	-53.3	-178.9	0	0	0	111.1	N221 V223 V240 R262 D263 I264 K292 Y294	N221-L290 HydrophobicContact CB-CB 4.1Å; N221-L290 PolarHBondContact O-N 3.02Å; V223-L290 HydrophobicContact CG2-CD1 4.01Å; V223-L290 HydrophobicContact CG2-CD2 4.35Å; V223-L290 HydrophobicContact CG2-CG 4.3Å; V240-L290 HydrophobicContact CB-CD2 3.85Å; V240-L290 HydrophobicContact CG2-CD2 3.63Å; R262-L290 HydrophobicContact CB-CB 4.35Å; R262-L290 HydrophobicContact CB-CD1 4.05Å; R262-L290 HydrophobicContact CB-CD2 4.18Å; R262-L290 HydrophobicContact CB-CG 4.42Å; R262-L290 HydrophobicContact CG-CD1 4.24Å; D263-L290 CarbonylContact O-C 3.57Å; D263-L290 WeakPolarHBondContact O-CA 3.31Å; I264-L290 HydrophobicContact CG1-CD2 4.22Å; L290-K292 WeakPolarHBondContact CB-O 3.23Å; L290-Y294 HydrophobicContact CD1-CD2 3.63Å; L290-Y294 HydrophobicContact CD1-CE2 3.54Å
291	R	95.1	Very high	88.2	Confident	162 Å²	162	34 Å²	34	61%	0.611	17%	0.169	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.5	-44.8	175.8	-172.4	175.5	-68.8	-84.6	-0.8	112.1	D263 V265	D263-R291 HydrophobicContact CB-CB 4.21Å; D263-R291 PolarHBondContact O-N 2.87Å; V265-R291 HydrophobicContact CG1-CB 3.56Å; V265-R291 HydrophobicContact CG1-CG 3.87Å
292	K	95	Very high	89.3	Confident	144 Å²	144	34 Å²	34	63%	0.626	17%	0.169	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119	134.7	175.4	-67.6	-175.7	178.8	-176	0	108.2	R262 L290	R262-K292 VanDerWaalsContact CD-O 3.22Å; R262-K292 WeakPolarHBondContact CD-O 3.11Å; R262-K292 PolarHBondContact NE-O 2.82Å; L290-K292 WeakPolarHBondContact CB-O 3.23Å
293	P	95	Very high	90.3	Very high	39 Å²	39	33.2 Å²	33.2	25%	0.253	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	163.5	176.2	29.8	-34.5	0	0	0	111.2	Q219 S220 N221 R262	Q219-P293 HydrophobicContact CB-CB 4.04Å; Q219-P293 HydrophobicContact CB-CG 4.46Å; Q219-P293 HydrophobicContact CG-CB 4.15Å; Q219-P293 HydrophobicContact CG-CG 4.32Å; S220-P293 CarbonylContact O-C 3.23Å; S220-P293 WeakPolarHBondContact O-CA 3.08Å; N221-P293 HydrophobicContact CB-CB 4.05Å; R262-P293 PolarHBondContact NE-O 3.25Å; R262-P293 VanDerWaalsContact NE-O 3.16Å; R262-P293 PolarHBondContact NH2-O 2.87Å; R262-P293 VanDerWaalsContact NH2-O 3.15Å
294	Y	93.9	Very high	90.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.8	162.3	-77.1	-61.5	0	0	0	109.5	L211 Q219 S220 V240 A242 E260 R262 L290 R300	L211-Y294 HydrophobicContact CD1-CD2 4.02Å; Q219-Y294 CarbonylContact C-O 3.56Å; Q219-Y294 WeakPolarHBondContact CA-O 3.23Å; Q219-Y294 WeakPolarHBondContact CB-O 3.29Å; S220-Y294 PolarHBondContact N-O 2.82Å; S220-Y294 PolarHBondContact O-N 2.97Å; V240-Y294 HydrophobicContact CG1-CE2 4.23Å; V240-Y294 PolarHBondContact O-OH 3.05Å; A242-Y294 HydrophobicContact CB-CD1 4.32Å; A242-Y294 HydrophobicContact CB-CE1 3.67Å; A242-Y294 HydrophobicContact CB-CE2 4.28Å; A242-Y294 PolarHBondContact N-OH 3.45Å; E260-Y294 HydrophobicContact CB-CE1 4.33Å; E260-Y294 HydrophobicContact CG-CE1 4.09Å; E260-Y294 PolarHBondContact O-OH 3.08Å; R262-Y294 HydrophobicContact CB-CE2 4.31Å; R262-Y294 HydrophobicContact CG-CD1 4.17Å; R262-Y294 HydrophobicContact CG-CD2 4.31Å; R262-Y294 HydrophobicContact CG-CE1 3.57Å; R262-Y294 HydrophobicContact CG-CE2 3.72Å; R262-Y294 WeakPolarHBondContact CG-OH 3.27Å; L290-Y294 HydrophobicContact CD1-CD2 3.63Å; L290-Y294 HydrophobicContact CD1-CE2 3.54Å; Y294-R300 VanDerWaalsContact CB-CD 3.47Å
295	T	92.1	Very high	91.3	Very high	79 Å²	79	35.6 Å²	35.6	49%	0.485	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	139.2	170.2	-46.3	0	0	0	0	110.2
296	F	89.8	Confident	91.2	Very high	38 Å²	38	36.1 Å²	36.1	17%	0.167	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-71.3	137.8	178.7	-60.2	-16.8	0	0	0	111.2	L211 N218 Q219 R300 L301 P302	L211-F296 HydrophobicContact CD2-CE1 4.38Å; N218-F296 VanDerWaalsContact CA-CD2 3.49Å; N218-F296 WeakPolarHBondContact O-CG 3.27Å; N218-F296 PolarHBondContact O-N 3.03Å; Q219-F296 VanDerWaalsContact O-CZ 3.27Å; Q219-F296 WeakPolarHBondContact O-CZ 3.25Å; F296-R300 WeakPolarHBondContact CA-O 3.5Å; F296-L301 HydrophobicContact CB-CD2 4.12Å; F296-P302 HydrophobicContact CD1-CG 4.4Å; F296-P302 HydrophobicContact CE1-CB 4.23Å; F296-P302 HydrophobicContact CE1-CG 3.74Å; F296-P302 HydrophobicContact CE2-CG 3.92Å; F296-P302 HydrophobicContact CZ-CB 4.24Å; F296-P302 HydrophobicContact CZ-CG 3.48Å; F296-P302 VanDerWaalsContact CZ-CG 3.48Å
297	K	84.6	Confident	90.9	Very high	62 Å²	62	41.4 Å²	41.4	27%	0.27	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-156.5	166.6	174.8	54.8	178.8	173.4	-171.9	0	108.1	E260 T299 R300 L301	E260-K297 IonicContact OE2-NZ 2.69Å; K297-T299 WeakPolarHBondContact CD-OG1 3.09Å; K297-T299 WeakPolarHBondContact CE-OG1 3.4Å; K297-T299 PolarHBondContact O-N 3.08Å; K297-R300 HydrophobicContact CG-CB 3.85Å; K297-R300 PolarHBondContact N-O 3.2Å; K297-R300 CarbonylContact O-C 3.09Å; K297-R300 WeakPolarHBondContact O-CA 3.01Å; K297-R300 PolarHBondContact O-N 2.78Å; K297-L301 WeakPolarHBondContact O-CD2 3.19Å; K297-L301 WeakPolarHBondContact O-CG 3.46Å
298	P	78.9	Confident	90.6	Very high	60 Å²	60	46.7 Å²	46.7	39%	0.39	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-36.8	-177.5	-29	36.8	0	0	0	113.7	I168 V173 R300	I168-P298 HydrophobicContact CD1-CG 3.9Å; V173-P298 WeakPolarHBondContact CG1-O 3.49Å; V173-P298 HydrophobicContact CG2-CB 4.28Å; P298-R300 PolarHBondContact O-N 3.25Å
299	T	77.1	Confident	90.2	Very high	49 Å²	49	54 Å²	54	30%	0.301	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-1.9	177	63.8	0	0	0	0	114.5	F245 K297	F245-T299 HydrophobicContact CD2-CG2 4.18Å; K297-T299 WeakPolarHBondContact CD-OG1 3.09Å; K297-T299 WeakPolarHBondContact CE-OG1 3.4Å; K297-T299 PolarHBondContact O-N 3.08Å
300	R	86.4	Confident	89.8	Confident	8 Å²	8	53.5 Å²	53.5	3%	0.03	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-155.8	96.7	-172.4	-167.3	-179	-58.6	144.4	-6.1	111.3	P190 L211 A242 E260 Y294 F296 K297 P298	P190-R300 VanDerWaalsContact O-CA 3.29Å; P190-R300 WeakPolarHBondContact O-CA 3.16Å; L211-R300 HydrophobicContact CD2-CG 4.12Å; A242-R300 VanDerWaalsContact CB-NE 3.27Å; E260-R300 VanDerWaalsContact CD-NH1 3.31Å; E260-R300 IonicContact OE1-NH1 3.48Å; E260-R300 PolarHBondContact OE1-NH1 3.01Å; E260-R300 IonicContact OE2-CZ 2.99Å; E260-R300 IonicContact OE2-NH1 3.14Å; E260-R300 PolarHBondContact OE2-NH1 2.94Å; E260-R300 IonicContact OE2-NH2 3.49Å; E260-R300 PolarHBondContact OE2-NH2 3.28Å; Y294-R300 VanDerWaalsContact CB-CD 3.47Å; F296-R300 WeakPolarHBondContact CA-O 3.5Å; K297-R300 HydrophobicContact CG-CB 3.85Å; K297-R300 PolarHBondContact N-O 3.2Å; K297-R300 CarbonylContact O-C 3.09Å; K297-R300 WeakPolarHBondContact O-CA 3.01Å; K297-R300 PolarHBondContact O-N 2.78Å; P298-R300 PolarHBondContact O-N 3.25Å
301	L	89.7	Confident	89.4	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.037	29%	0.291	C	S	.	.			trans	-133.1	142.9	-178	-64.9	176.7	0	0	0	107.9	I168 L170 V173 P190 W191 F296 K297	I168-L301 HydrophobicContact CB-CD2 4.33Å; I168-L301 HydrophobicContact CG2-CD1 3.79Å; I168-L301 HydrophobicContact CG2-CD2 4.21Å; L170-L301 HydrophobicContact CD1-CB 3.59Å; L170-L301 HydrophobicContact CD1-CD1 4.08Å; V173-L301 HydrophobicContact CB-CD1 3.99Å; V173-L301 HydrophobicContact CG1-CD1 4.31Å; V173-L301 HydrophobicContact CG2-CD1 3.65Å; P190-L301 CarbonylContact C-O 3.53Å; P190-L301 HydrophobicContact CB-CB 3.96Å; P190-L301 HydrophobicContact CB-CG 4.32Å; P190-L301 HydrophobicContact CG-CB 3.92Å; P190-L301 HydrophobicContact CG-CD1 4.43Å; P190-L301 HydrophobicContact CG-CG 4.46Å; P190-L301 PolarHBondContact O-N 2.67Å; P190-L301 VanDerWaalsContact O-N 3.08Å; P190-L301 VanDerWaalsContact O-O 3.09Å; W191-L301 WeakPolarHBondContact CA-O 3.4Å; W191-L301 WeakPolarHBondContact CB-O 3.37Å; W191-L301 PolarHBondContact N-O 3.14Å; W191-L301 VanDerWaalsContact N-O 3.09Å; F296-L301 HydrophobicContact CB-CD2 4.12Å; K297-L301 WeakPolarHBondContact O-CD2 3.19Å; K297-L301 WeakPolarHBondContact O-CG 3.46Å
302	P	93.7	Very high	89	Confident	15 Å²	15	54.2 Å²	54.2	10%	0.097	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-73.6	158.9	177.1	34.1	-36.2	0	0	0	111.1	L170 L211 L212 K213 F296	L170-P302 WeakPolarHBondContact CD1-O 3.39Å; L211-P302 HydrophobicContact CG-CB 4.44Å; L211-P302 CarbonylContact O-C 3.59Å; L211-P302 WeakPolarHBondContact O-CA 3.44Å; L212-P302 VanDerWaalsContact C-CB 3.43Å; K213-P302 HydrophobicContact CB-CB 3.96Å; K213-P302 HydrophobicContact CB-CG 3.95Å; K213-P302 HydrophobicContact CG-CG 4.14Å; F296-P302 HydrophobicContact CD1-CG 4.4Å; F296-P302 HydrophobicContact CE1-CB 4.23Å; F296-P302 HydrophobicContact CE1-CG 3.74Å; F296-P302 HydrophobicContact CE2-CG 3.92Å; F296-P302 HydrophobicContact CZ-CB 4.24Å; F296-P302 HydrophobicContact CZ-CG 3.48Å; F296-P302 VanDerWaalsContact CZ-CG 3.48Å
303	V	93.6	Very high	88.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-102.3	145.6	164.8	68.9	0	0	0	0	109.9	L170 W191 L211 L212 K213 V374 Q383	L170-V303 HydrophobicContact CD2-CG2 4.5Å; W191-V303 HydrophobicContact CB-CB 3.85Å; W191-V303 HydrophobicContact CB-CG1 3.97Å; W191-V303 HydrophobicContact CD2-CB 4.02Å; W191-V303 HydrophobicContact CD2-CG2 4.44Å; W191-V303 HydrophobicContact CE3-CB 4.2Å; W191-V303 HydrophobicContact CG-CB 3.89Å; W191-V303 HydrophobicContact CG-CG1 4.09Å; L211-V303 PolarHBondContact O-N 3.09Å; L212-V303 HydrophobicContact CD2-CG1 4.25Å; K213-V303 PolarHBondContact N-O 2.83Å; K213-V303 VanDerWaalsContact N-O 3.15Å; V303-V374 HydrophobicContact CG2-CG1 4.17Å; V303-V374 HydrophobicContact CG2-CG2 4.43Å; V303-Q383 HydrophobicContact CG1-CB 4.06Å; V303-Q383 HydrophobicContact CG2-CB 4.1Å
304	S	93.2	Very high	88.1	Confident	40 Å²	40	55.2 Å²	55.2	28%	0.28	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	145.6	171	-63.9	0	0	0	0	109.8	Y382 Q383	S304-Y382 WeakPolarHBondContact O-CA 3.2Å; S304-Q383 PolarHBondContact O-N 3.28Å
305	I	93	Very high	87.8	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.062	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	153.1	168.2	62.3	169.5	0	0	0	109.6	L212 L416 I423	L212-I305 HydrophobicContact CD1-CG2 4.48Å; L212-I305 HydrophobicContact CD2-CG2 3.99Å; I305-L416 HydrophobicContact CB-CD1 4.45Å; I305-L416 HydrophobicContact CG2-CD1 3.85Å; I305-I423 HydrophobicContact CD1-CB 4.15Å; I305-I423 HydrophobicContact CD1-CD1 4.14Å; I305-I423 HydrophobicContact CD1-CG2 3.86Å
306	N	89.3	Confident	87.2	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.053	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-70.4	132.6	169.4	76.8	-69.9	0	0	0	110.3	E308 Q383 Y384	N306-E308 PolarHBondContact ND2-O 3.33Å; N306-Q383 PolarHBondContact N-O 3.22Å; N306-Q383 PolarHBondContact OD1-O 3.04Å; N306-Y384 HydrophobicContact CB-CD1 3.87Å; N306-Y384 HydrophobicContact CB-CE1 3.54Å; N306-Y384 HydrophobicContact CB-CE2 4.44Å; N306-Y384 HydrophobicContact CB-CG 4.44Å
307	E	86.4	Confident	87	Confident	112 Å²	112	57.3 Å²	57.3	52%	0.523	29%	0.287	S	S	.	.			trans	-103.4	-10.4	179.1	-59.6	-158.8	143.1	0	0	113.4	L417 Q424	E307-L417 VanDerWaalsContact C-CD1 3.44Å; E307-L417 VanDerWaalsContact O-CD1 3.25Å; E307-L417 WeakPolarHBondContact O-CD1 3.13Å; E307-Q424 PolarHBondContact OE1-NE2 2.9Å
308	E	88.3	Confident	87.4	Confident	111 Å²	111	54.7 Å²	54.7	52%	0.519	28%	0.276	S	S	.	.	S	Bend	trans	-117.1	152.9	-177.3	-64.4	176.2	173.6	0	0	111	N306 R377	N306-E308 PolarHBondContact ND2-O 3.33Å; E308-R377 IonicContact OE2-CZ 3.3Å; E308-R377 VanDerWaalsContact OE2-CZ 3.3Å; E308-R377 IonicContact OE2-NH1 2.76Å; E308-R377 PolarHBondContact OE2-NH1 3.29Å; E308-R377 IonicContact OE2-NH2 3.78Å; E308-R377 PolarHBondContact OE2-NH2 2.72Å
309	E	87.2	Confident	87.9	Confident	152 Å²	152	52.6 Å²	52.6	71%	0.71	26%	0.26	S	S	*	.			trans	-75.3	126.1	167.8	-171.9	154.2	-146.9	0	0	108.8	L417	E309-L417 HydrophobicContact CB-CD2 3.77Å; E309-L417 HydrophobicContact CG-CD2 4.4Å
310	V	87	Confident	88.5	Confident	21 Å²	21	50.4 Å²	50.4	13%	0.127	25%	0.247	C	C	.	.			trans	-129.8	134.8	-176.7	-177.4	0	0	0	0	107.1	E314 L315 Y384	V310-E314 HydrophobicContact CG1-CB 3.66Å; V310-L315 HydrophobicContact CB-CD2 4.26Å; V310-L315 HydrophobicContact CG1-CD2 3.59Å; V310-L315 HydrophobicContact CG1-CG 4.03Å; V310-Y384 HydrophobicContact CB-CE1 4.4Å
311	R	87.1	Confident	88.5	Confident	153 Å²	153	50 Å²	50	58%	0.577	25%	0.246	S	C	*	.			trans	-68.4	147.8	176.6	-64.3	177.3	54.8	167.9	-6.5	109.7	D313 E314	R311-D313 IonicContact CZ-OD2 2.74Å; R311-D313 IonicContact NE-OD2 2.75Å; R311-D313 IonicContact NH2-OD2 3.62Å; R311-D313 PolarHBondContact NH2-OD2 2.92Å; R311-D313 PolarHBondContact O-N 2.85Å; R311-E314 HydrophobicContact CB-CG 4.16Å; R311-E314 WeakPolarHBondContact CB-OE1 3.4Å; R311-E314 WeakPolarHBondContact CD-OE1 3.12Å; R311-E314 WeakPolarHBondContact CG-OE1 3.13Å; R311-E314 WeakPolarHBondContact O-CB 3.32Å; R311-E314 PolarHBondContact O-N 3.31Å
312	V	86.7	Confident	87.9	Confident	27 Å²	27	49.7 Å²	49.7	16%	0.164	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-56.6	-34.8	177.6	175.4	0	0	0	0	111.4	E314 L315 L336	V312-E314 PolarHBondContact O-N 2.8Å; V312-L315 PolarHBondContact O-N 3.05Å; V312-L336 HydrophobicContact CB-CD2 4.49Å; V312-L336 HydrophobicContact CG1-CB 4.22Å; V312-L336 HydrophobicContact CG1-CD2 4.07Å; V312-L336 HydrophobicContact CG1-CG 3.93Å; V312-L336 HydrophobicContact CG2-CD2 4.07Å; V312-L336 HydrophobicContact CG2-CG 4.24Å
313	D	85.4	Confident	86.9	Confident	108 Å²	108	49.1 Å²	49.1	58%	0.578	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-68.2	-17.2	179.4	-46.9	-40.8	0	0	0	113.7	R311	R311-D313 IonicContact CZ-OD2 2.74Å; R311-D313 IonicContact NE-OD2 2.75Å; R311-D313 IonicContact NH2-OD2 3.62Å; R311-D313 PolarHBondContact NH2-OD2 2.92Å; R311-D313 PolarHBondContact O-N 2.85Å
314	E	86.1	Confident	85.6	Confident	96 Å²	96	49.9 Å²	49.9	45%	0.449	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-93	-1.1	177.9	-64.5	169.8	-135.7	0	0	112.4	V310 R311 V312	V310-E314 HydrophobicContact CG1-CB 3.66Å; R311-E314 HydrophobicContact CB-CG 4.16Å; R311-E314 WeakPolarHBondContact CB-OE1 3.4Å; R311-E314 WeakPolarHBondContact CD-OE1 3.12Å; R311-E314 WeakPolarHBondContact CG-OE1 3.13Å; R311-E314 WeakPolarHBondContact O-CB 3.32Å; R311-E314 PolarHBondContact O-N 3.31Å; V312-E314 PolarHBondContact O-N 2.8Å
315	L	87.9	Confident	84.2	Confident	20 Å²	20	56 Å²	56	11%	0.105	26%	0.263	C	S	.	.			trans	-102.1	116.5	179.8	-59.8	-179.9	0	0	0	109.7	V310 V312 L336 C375 R377 Y384	V310-L315 HydrophobicContact CB-CD2 4.26Å; V310-L315 HydrophobicContact CG1-CD2 3.59Å; V310-L315 HydrophobicContact CG1-CG 4.03Å; V312-L315 PolarHBondContact O-N 3.05Å; L315-L336 HydrophobicContact CD1-CD2 3.59Å; L315-C375 HydrophobicContact CB-CB 4.31Å; L315-C375 HydrophobicContact CD1-CB 4.47Å; L315-R377 HydrophobicContact CD2-CB 4.43Å; L315-Y384 HydrophobicContact CD1-CD1 4.08Å; L315-Y384 HydrophobicContact CD1-CE1 3.87Å; L315-Y384 HydrophobicContact CD1-CE2 4.39Å; L315-Y384 HydrophobicContact CD1-CG 4.44Å; L315-Y384 HydrophobicContact CD2-CE1 3.85Å; L315-Y384 HydrophobicContact CD2-CE2 3.91Å; L315-Y384 WeakPolarHBondContact CD2-OH 3.37Å
316	D	79.6	Confident	82.7	Confident	79 Å²	79	64.7 Å²	64.7	42%	0.422	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	151.3	172.3	-62.2	-40.9	0	0	0	109.5	R376	D316-R376 HydrophobicContact CB-CB 4.42Å; D316-R376 PolarHBondContact N-O 3.08Å; D316-R376 VanDerWaalsContact N-O 3.09Å; D316-R376 WeakPolarHBondContact O-CB 3.17Å; D316-R376 PolarHBondContact O-N 2.77Å
317	D	86.8	Confident	81.5	Confident	62 Å²	62	64.2 Å²	64.2	33%	0.332	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	38.6	87.9	168	-51.5	-42.3	0	0	0	114.8	Y319 R376 W381	D317-Y319 HydrophobicContact CB-CE2 3.9Å; D317-R376 PolarHBondContact O-N 2.86Å; D317-R376 IonicContact OD2-CZ 2.73Å; D317-R376 IonicContact OD2-NE 3.37Å; D317-R376 PolarHBondContact OD2-NE 2.8Å; D317-R376 IonicContact OD2-NH2 3.86Å; D317-R376 PolarHBondContact OD2-NH2 2.72Å; D317-W381 HydrophobicContact CB-CH2 4.2Å; D317-W381 VanDerWaalsContact O-CZ3 3.23Å; D317-W381 WeakPolarHBondContact O-CZ3 3.44Å
318	C	91.9	Very high	80.7	Confident	6 Å²	6	60.6 Å²	60.6	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139	174.6	-68.3	0	0	0	0	110.9	H333 V334 L373 V374 C375	C318-H333 PolarHBondContact O-CD2 2.77Å; C318-H333 VanDerWaalsContact O-CD2 3.25Å; C318-V334 HydrophobicContact CB-CG2 3.87Å; C318-V334 WeakPolarHBondContact CB-O 3.33Å; C318-V334 PolarHBondContact O-N 3.45Å; C318-L373 HydrophobicContact CB-CD1 4.25Å; C318-V374 WeakPolarHBondContact CA-O 3.16Å; C318-C375 HydrophobicContact CB-CB 4.12Å; C318-C375 WeakPolarHBondContact CB-SG 3.33Å; C318-C375 WeakPolarHBondContact SG-CB 3.13Å; C318-C375 CovalentContact SG-SG 2.05Å; C318-C375 PolarHBondContact SG-SG 3.26Å
319	Y	90.2	Very high	80	Confident	16 Å²	16	55.6 Å²	55.6	6%	0.063	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	144.5	175.7	-67.3	-88.6	0	0	0	110.9	F174 P176 D317 Q331 A332 H333 V374 W381	F174-Y319 HydrophobicContact CE1-CD2 4.22Å; F174-Y319 HydrophobicContact CZ-CD2 4.23Å; F174-Y319 HydrophobicContact CZ-CG 4.3Å; P176-Y319 HydrophobicContact CB-CE1 4.41Å; P176-Y319 HydrophobicContact CB-CE2 3.62Å; P176-Y319 VanDerWaalsContact CB-CZ 3.48Å; P176-Y319 WeakPolarHBondContact CB-OH 3.16Å; D317-Y319 HydrophobicContact CB-CE2 3.9Å; Y319-Q331 HydrophobicContact CD1-CG 3.46Å; Y319-Q331 VanDerWaalsContact CD1-CG 3.46Å; Y319-Q331 HydrophobicContact CE1-CG 4.23Å; Y319-Q331 HydrophobicContact CG-CG 3.96Å; Y319-A332 VanDerWaalsContact CA-O 3.28Å; Y319-A332 WeakPolarHBondContact CA-O 3.36Å; Y319-H333 VanDerWaalsContact CD1-CA 3.49Å; Y319-H333 HydrophobicContact CD1-CB 3.95Å; Y319-H333 HydrophobicContact CE1-CB 3.6Å; Y319-H333 AromaticContact CE1-CD2 3.91Å; Y319-H333 AromaticContact CZ-CD2 3.76Å; Y319-V374 PolarHBondContact N-O 2.97Å; Y319-V374 PolarHBondContact O-N 2.88Å; Y319-V374 VanDerWaalsContact O-O 3.12Å; Y319-W381 AromaticContact CD2-CH2 3.84Å; Y319-W381 HydrophobicContact CD2-CH2 3.84Å; Y319-W381 AromaticContact CD2-CZ3 3.77Å; Y319-W381 HydrophobicContact CD2-CZ3 3.77Å; Y319-W381 AromaticContact CE2-CH2 3.8Å; Y319-W381 HydrophobicContact CE2-CH2 3.8Å; Y319-W381 HydrophobicContact CE2-CZ3 4.2Å
320	V	89.3	Confident	79.5	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133	163.4	66.5	0	0	0	0	108.4	Q331 A332 V334 V367 P372 Y413	V320-Q331 WeakPolarHBondContact O-CA 3.49Å; V320-A332 HydrophobicContact CG1-CB 3.89Å; V320-A332 PolarHBondContact N-O 3.31Å; V320-A332 PolarHBondContact O-N 2.79Å; V320-V334 HydrophobicContact CB-CG1 4.3Å; V320-V334 HydrophobicContact CG1-CG1 3.67Å; V320-V367 HydrophobicContact CB-CG2 4.46Å; V320-V367 HydrophobicContact CG1-CG1 4.49Å; V320-V367 HydrophobicContact CG1-CG2 3.57Å; V320-V367 HydrophobicContact CG2-CB 4.37Å; V320-V367 HydrophobicContact CG2-CG1 3.41Å; V320-V367 VanDerWaalsContact CG2-CG1 3.41Å; V320-V367 HydrophobicContact CG2-CG2 4.07Å; V320-P372 WeakPolarHBondContact CA-O 3.04Å; V320-Y413 HydrophobicContact CB-CE1 4.49Å; V320-Y413 HydrophobicContact CG2-CE1 3.94Å
321	T	85.8	Confident	79.1	Confident	0 Å²	0	48 Å²	48	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.2	179.5	60	0	0	0	0	108.8	F174 A189 W191 S192 I330 Q331 S371 P372	F174-T321 HydrophobicContact CE2-CG2 4.19Å; A189-T321 HydrophobicContact CB-CG2 3.56Å; W191-T321 HydrophobicContact CZ2-CG2 4.23Å; W191-T321 PolarHBondContact NE1-OG1 2.91Å; S192-T321 WeakPolarHBondContact OG-CB 3.22Å; S192-T321 PolarHBondContact OG-OG1 2.88Å; T321-I330 CarbonylContact C-O 3.5Å; T321-I330 VanDerWaalsContact CA-O 3.25Å; T321-I330 WeakPolarHBondContact CA-O 3.32Å; T321-Q331 HydrophobicContact CG2-CB 4.11Å; T321-Q331 HydrophobicContact CG2-CG 3.97Å; T321-S371 WeakPolarHBondContact O-CB 2.89Å; T321-S371 PolarHBondContact O-OG 2.96Å; T321-P372 PolarHBondContact N-O 2.79Å; T321-P372 WeakPolarHBondContact O-CD 3.29Å; T321-P372 VanDerWaalsContact OG1-CG 3.3Å; T321-P372 WeakPolarHBondContact OG1-CG 2.99Å
322	G	78.2	Confident	78.8	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	-164.6	-177.5	0	0	0	0	0	110.4	I329 I330 S371	G322-I329 WeakPolarHBondContact O-CA 3.27Å; G322-I330 PolarHBondContact N-O 2.85Å; G322-I330 WeakPolarHBondContact O-CG1 3.28Å; G322-I330 PolarHBondContact O-N 2.85Å; G322-S371 WeakPolarHBondContact CA-OG 3.3Å
323	A	71.1	Confident	78.7	Confident	3 Å²	3	41.8 Å²	41.8	3%	0.025	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	140.2	171.3	0	0	0	0	0	112	I194 S208 D328 I329	I194-A323 HydrophobicContact CG2-CB 3.22Å; S208-A323 PolarHBondContact OG-N 2.88Å; A323-D328 CarbonylContact C-O 3.49Å; A323-D328 WeakPolarHBondContact CA-O 3.27Å; A323-I329 HydrophobicContact CB-CD1 4.32Å
324	S	67.8	Low	78.8	Confident	16 Å²	16	36.8 Å²	36.8	11%	0.112	17%	0.167	C	C	.	.			trans	-61.6	165.1	163.1	83.9	0	0	0	0	109.7	R326 G327 D328	S324-R326 PolarHBondContact O-N 2.83Å; S324-R326 VanDerWaalsContact O-N 3.12Å; S324-R326 PolarHBondContact OG-N 3.1Å; S324-R326 VanDerWaalsContact OG-N 3.13Å; S324-G327 WeakPolarHBondContact O-CA 3.49Å; S324-G327 PolarHBondContact O-N 2.73Å; S324-G327 PolarHBondContact OG-N 3.3Å; S324-D328 PolarHBondContact N-O 2.78Å; S324-D328 WeakPolarHBondContact OG-CB 3.35Å; S324-D328 PolarHBondContact OG-N 3.08Å; S324-D328 VanDerWaalsContact OG-N 3.09Å; S324-D328 PolarHBondContact OG-OD2 3.47Å
325	R	62.5	Low	79.1	Confident	167 Å²	167	37.1 Å²	37.1	63%	0.63	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.9	172.1	-63.8	-175.5	-173.5	179.9	3.2	112.7	G327 E366	R325-G327 VanDerWaalsContact C-N 3.26Å; R325-E366 IonicContact CZ-OE2 3.2Å; R325-E366 IonicContact NE-OE2 3.25Å; R325-E366 IonicContact NH2-OE1 2.82Å; R325-E366 IonicContact NH2-OE2 2.74Å; R325-E366 PolarHBondContact NH2-OE2 2.9Å
326	R	63	Low	79.3	Confident	195 Å²	195	36.7 Å²	36.7	74%	0.736	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	4.5	174.7	-58.7	-179	-176.9	-179.7	0.4	112.8	F254 S324 D328	F254-R326 VanDerWaalsContact CD2-O 3.32Å; F254-R326 WeakPolarHBondContact CD2-O 3.45Å; S324-R326 PolarHBondContact O-N 2.83Å; S324-R326 VanDerWaalsContact O-N 3.12Å; S324-R326 PolarHBondContact OG-N 3.1Å; S324-R326 VanDerWaalsContact OG-N 3.13Å; R326-D328 VanDerWaalsContact C-N 3.29Å; R326-D328 PolarHBondContact O-N 3.39Å
327	G	63.5	Low	80	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.01	15%	0.149	C	C	.	.			trans	75.9	11.4	-179.7	0	0	0	0	0	114.6	V243 S324 R325	V243-G327 WeakPolarHBondContact CG2-O 3.24Å; S324-G327 WeakPolarHBondContact O-CA 3.49Å; S324-G327 PolarHBondContact O-N 2.73Å; S324-G327 PolarHBondContact OG-N 3.3Å; R325-G327 VanDerWaalsContact C-N 3.26Å
328	D	69.4	Low	80.3	Confident	35 Å²	35	35.2 Å²	35.2	19%	0.187	15%	0.154	C	C	.	.			trans	-67.8	130.9	171.7	-57.7	-64.8	0	0	0	109.4	R257 A323 S324 R326 I330	R257-D328 IonicContact CZ-OD1 2.72Å; R257-D328 IonicContact NH1-OD1 3.19Å; R257-D328 PolarHBondContact NH1-OD1 3.49Å; R257-D328 IonicContact NH2-OD1 3.77Å; R257-D328 PolarHBondContact NH2-OD1 3.41Å; A323-D328 CarbonylContact C-O 3.49Å; A323-D328 WeakPolarHBondContact CA-O 3.27Å; S324-D328 PolarHBondContact N-O 2.78Å; S324-D328 WeakPolarHBondContact OG-CB 3.35Å; S324-D328 PolarHBondContact OG-N 3.08Å; S324-D328 VanDerWaalsContact OG-N 3.09Å; S324-D328 PolarHBondContact OG-OD2 3.47Å; R326-D328 VanDerWaalsContact C-N 3.29Å; R326-D328 PolarHBondContact O-N 3.39Å; D328-I330 HydrophobicContact CB-CG2 4.36Å; D328-I330 PolarHBondContact O-N 3.2Å
329	I	74.6	Confident	80.3	Confident	6 Å²	6	36.1 Å²	36.1	3%	0.031	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	123.6	169.5	-58.3	-55.5	0	0	0	108.2	A189 V243 F245 G322 A323	A189-I329 HydrophobicContact CB-CG2 3.84Å; V243-I329 HydrophobicContact CB-CD1 4.35Å; V243-I329 HydrophobicContact CB-CG1 4Å; V243-I329 HydrophobicContact CG2-CD1 3.87Å; V243-I329 HydrophobicContact CG2-CG1 4.03Å; F245-I329 HydrophobicContact CE1-CB 4.02Å; F245-I329 HydrophobicContact CE1-CG1 4.29Å; F245-I329 HydrophobicContact CE1-CG2 4.37Å; F245-I329 HydrophobicContact CZ-CB 4.32Å; F245-I329 HydrophobicContact CZ-CG1 4.3Å; F245-I329 HydrophobicContact CZ-CG2 4.36Å; G322-I329 WeakPolarHBondContact O-CA 3.27Å; A323-I329 HydrophobicContact CB-CD1 4.32Å
330	I	75.1	Confident	80.3	Confident	8 Å²	8	38.6 Å²	38.6	4%	0.041	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	148.7	-177.6	59.4	173.5	0	0	0	108.8	T184 T321 G322 D328 P365	T184-I330 HydrophobicContact CG2-CG2 4.05Å; T321-I330 CarbonylContact C-O 3.5Å; T321-I330 VanDerWaalsContact CA-O 3.25Å; T321-I330 WeakPolarHBondContact CA-O 3.32Å; G322-I330 PolarHBondContact N-O 2.85Å; G322-I330 WeakPolarHBondContact O-CG1 3.28Å; G322-I330 PolarHBondContact O-N 2.85Å; D328-I330 HydrophobicContact CB-CG2 4.36Å; D328-I330 PolarHBondContact O-N 3.2Å; I330-P365 HydrophobicContact CB-CG 4.16Å; I330-P365 HydrophobicContact CD1-CB 3.54Å; I330-P365 HydrophobicContact CD1-CG 3.6Å; I330-P365 WeakPolarHBondContact CD1-O 3.28Å; I330-P365 HydrophobicContact CG1-CG 4.46Å; I330-P365 HydrophobicContact CG2-CB 4.47Å; I330-P365 HydrophobicContact CG2-CG 3.83Å
331	Q	79.8	Confident	80.5	Confident	7 Å²	7	41 Å²	41	3%	0.033	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.6	172.5	178.3	172.9	-20	0	0	109	F174 T187 Y319 V320 T321	F174-Q331 VanDerWaalsContact CZ-CD 3.4Å; T187-Q331 VanDerWaalsContact CB-OE1 3.27Å; T187-Q331 WeakPolarHBondContact OG1-CB 3.25Å; T187-Q331 VanDerWaalsContact OG1-CD 3.31Å; T187-Q331 PolarHBondContact OG1-OE1 2.91Å; Y319-Q331 HydrophobicContact CD1-CG 3.46Å; Y319-Q331 VanDerWaalsContact CD1-CG 3.46Å; Y319-Q331 HydrophobicContact CE1-CG 4.23Å; Y319-Q331 HydrophobicContact CG-CG 3.96Å; V320-Q331 WeakPolarHBondContact O-CA 3.49Å; T321-Q331 HydrophobicContact CG2-CB 4.11Å; T321-Q331 HydrophobicContact CG2-CG 3.97Å
332	A	79.8	Confident	80.8	Confident	8 Å²	8	41 Å²	41	7%	0.066	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.9	173.7	0	0	0	0	0	109.5	Y319 V320 F364	Y319-A332 VanDerWaalsContact CA-O 3.28Å; Y319-A332 WeakPolarHBondContact CA-O 3.36Å; V320-A332 HydrophobicContact CG1-CB 3.89Å; V320-A332 PolarHBondContact N-O 3.31Å; V320-A332 PolarHBondContact O-N 2.79Å; A332-F364 HydrophobicContact CB-CB 4.16Å; A332-F364 HydrophobicContact CB-CD1 3.47Å; A332-F364 VanDerWaalsContact CB-CD1 3.47Å; A332-F364 HydrophobicContact CB-CE1 4.05Å; A332-F364 HydrophobicContact CB-CG 3.87Å
333	H	84.9	Confident	81.5	Confident	41 Å²	41	46.2 Å²	46.2	19%	0.19	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	135.6	170.1	-178.1	-111.4	0	0	0	109.2	L130 C318 Y319	L130-H333 HydrophobicContact CD1-CB 3.93Å; L130-H333 HydrophobicContact CD2-CB 4.06Å; C318-H333 PolarHBondContact O-CD2 2.77Å; C318-H333 VanDerWaalsContact O-CD2 3.25Å; Y319-H333 VanDerWaalsContact CD1-CA 3.49Å; Y319-H333 HydrophobicContact CD1-CB 3.95Å; Y319-H333 HydrophobicContact CE1-CB 3.6Å; Y319-H333 AromaticContact CE1-CD2 3.91Å; Y319-H333 AromaticContact CZ-CD2 3.76Å
334	V	88.6	Confident	82.5	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.4	-177.9	-58.2	0	0	0	0	109.9	C318 V320 T358 L373	C318-V334 HydrophobicContact CB-CG2 3.87Å; C318-V334 WeakPolarHBondContact CB-O 3.33Å; C318-V334 PolarHBondContact O-N 3.45Å; V320-V334 HydrophobicContact CB-CG1 4.3Å; V320-V334 HydrophobicContact CG1-CG1 3.67Å; V334-T358 HydrophobicContact CB-CG2 4.38Å; V334-T358 HydrophobicContact CG2-CG2 4Å; V334-L373 HydrophobicContact CG2-CD1 3.54Å
335	K	90.7	Very high	83.6	Confident	104 Å²	104	49.8 Å²	49.8	45%	0.452	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.2	171.9	-175.7	66.9	177.1	179.4	0	109.3	V123 L337 T358 L359	V123-K335 HydrophobicContact CG1-CG 4.05Å; K335-L337 HydrophobicContact CG-CD2 4.23Å; K335-L337 PolarHBondContact O-N 3.1Å; K335-T358 CarbonylContact O-C 3.53Å; K335-T358 WeakPolarHBondContact O-CA 3.33Å; K335-T358 WeakPolarHBondContact O-CB 3.42Å; K335-L359 HydrophobicContact CB-CB 4.41Å; K335-L359 PolarHBondContact N-O 3.06Å; K335-L359 PolarHBondContact O-N 3.29Å
336	L	93.2	Very high	84.9	Confident	11 Å²	11	42.2 Å²	42.2	6%	0.058	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	128.7	168.8	-174.1	63.6	0	0	0	109.6	V312 L315 L356 T358 L373	V312-L336 HydrophobicContact CB-CD2 4.49Å; V312-L336 HydrophobicContact CG1-CB 4.22Å; V312-L336 HydrophobicContact CG1-CD2 4.07Å; V312-L336 HydrophobicContact CG1-CG 3.93Å; V312-L336 HydrophobicContact CG2-CD2 4.07Å; V312-L336 HydrophobicContact CG2-CG 4.24Å; L315-L336 HydrophobicContact CD1-CD2 3.59Å; L336-L356 HydrophobicContact CD1-CB 4.14Å; L336-T358 HydrophobicContact CD1-CG2 4.04Å; L336-L373 HydrophobicContact CD1-CD2 4.21Å
337	L	92.9	Very high	86	Confident	16 Å²	16	37.1 Å²	37.1	8%	0.084	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-97.8	150.1	-178	-60.7	-177.9	0	0	0	111.2	K335 I345 C357 L359 I399 I410	K335-L337 HydrophobicContact CG-CD2 4.23Å; K335-L337 PolarHBondContact O-N 3.1Å; L337-I345 HydrophobicContact CD1-CD1 3.7Å; L337-C357 PolarHBondContact N-O 3.43Å; L337-L359 HydrophobicContact CD1-CB 4.24Å; L337-L359 HydrophobicContact CD2-CB 4.18Å; L337-L359 HydrophobicContact CG-CB 4.36Å; L337-I399 HydrophobicContact CD1-CD1 4.09Å; L337-I410 HydrophobicContact CD1-CD1 3.83Å
338	H	93.1	Very high	86.7	Confident	93 Å²	93	42.6 Å²	42.6	43%	0.431	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-65.7	140.7	175.2	-162.5	-91.9	0	0	0	110.3	A340 K341 C342	H338-A340 PolarHBondContact O-N 2.99Å; H338-A340 VanDerWaalsContact O-N 3.11Å; H338-K341 WeakPolarHBondContact O-CA 3.44Å; H338-K341 PolarHBondContact O-N 3.24Å; H338-C342 PolarHBondContact O-N 2.82Å
339	P	92.3	Very high	87.5	Confident	25 Å²	25	42.1 Å²	42.1	16%	0.162	21%	0.213	C	C	.	.	H	α-helix	trans	-55	-34.3	-177	-30.3	35.9	0	0	0	115.3	K341 C342 K343 F350 N352	P339-K341 VanDerWaalsContact C-N 3.32Å; P339-K341 PolarHBondContact O-N 3.05Å; P339-C342 PolarHBondContact O-N 2.99Å; P339-K343 PolarHBondContact O-N 3.04Å; P339-F350 HydrophobicContact CB-CE1 4.13Å; P339-N352 HydrophobicContact CB-CB 3.95Å; P339-N352 WeakPolarHBondContact CB-OD1 3.42Å; P339-N352 WeakPolarHBondContact CG-OD1 3.36Å
340	A	91.2	Very high	88.2	Confident	68 Å²	68	42.9 Å²	42.9	56%	0.562	22%	0.216	S	C	*	.	H	α-helix	trans	-60.3	-43.1	175.2	0	0	0	0	0	111.6	H338 K343 E344	H338-A340 PolarHBondContact O-N 2.99Å; H338-A340 VanDerWaalsContact O-N 3.11Å; A340-K343 PolarHBondContact O-N 2.74Å; A340-E344 PolarHBondContact O-N 3.05Å
341	K	92.1	Very high	88.9	Confident	54 Å²	54	44 Å²	44	24%	0.235	23%	0.225	C	C	.	.	H	α-helix	trans	-70.7	-39	177.4	-167.3	62	177.6	178.1	0	111.5	H338 P339 K343 E344 I345 E398	H338-K341 WeakPolarHBondContact O-CA 3.44Å; H338-K341 PolarHBondContact O-N 3.24Å; P339-K341 VanDerWaalsContact C-N 3.32Å; P339-K341 PolarHBondContact O-N 3.05Å; K341-K343 VanDerWaalsContact C-N 3.29Å; K341-K343 PolarHBondContact O-N 2.82Å; K341-E344 WeakPolarHBondContact CD-OE2 3.27Å; K341-E344 IonicContact NZ-OE1 3.5Å; K341-E344 PolarHBondContact NZ-OE1 3.39Å; K341-E344 IonicContact NZ-OE2 3.95Å; K341-E344 PolarHBondContact NZ-OE2 3.07Å; K341-E344 PolarHBondContact O-N 3.38Å; K341-I345 HydrophobicContact CD-CG2 4.09Å; K341-I345 HydrophobicContact CG-CG2 4.22Å; K341-I345 VanDerWaalsContact O-CG1 3.27Å; K341-I345 WeakPolarHBondContact O-CG1 3.46Å; K341-I345 WeakPolarHBondContact O-CG2 3.18Å; K341-I345 PolarHBondContact O-N 3.2Å; K341-E398 WeakPolarHBondContact CE-O 3.34Å; K341-E398 PolarHBondContact NZ-O 3.29Å
342	C	93.9	Very high	89.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-43.3	173.1	-63.3	0	0	0	0	112	H338 P339 I345 L346 F350 C357	H338-C342 PolarHBondContact O-N 2.82Å; P339-C342 PolarHBondContact O-N 2.99Å; C342-I345 WeakPolarHBondContact O-CG1 3.37Å; C342-L346 WeakPolarHBondContact O-CB 3.08Å; C342-L346 WeakPolarHBondContact O-CG 3.4Å; C342-L346 PolarHBondContact O-N 3.48Å; C342-F350 HydrophobicContact CB-CD1 3.58Å; C342-F350 HydrophobicContact CB-CD2 3.85Å; C342-F350 HydrophobicContact CB-CE1 3.49Å; C342-F350 VanDerWaalsContact CB-CE1 3.49Å; C342-F350 HydrophobicContact CB-CE2 3.75Å; C342-F350 HydrophobicContact CB-CG 3.76Å; C342-F350 HydrophobicContact CB-CZ 3.58Å; C342-C357 WeakPolarHBondContact CA-SG 3.23Å; C342-C357 HydrophobicContact CB-CB 3.92Å; C342-C357 WeakPolarHBondContact CB-SG 3.19Å; C342-C357 WeakPolarHBondContact SG-CB 3.46Å; C342-C357 CovalentContact SG-SG 2.02Å; C342-C357 PolarHBondContact SG-SG 3.39Å
343	K	92.4	Very high	89.8	Confident	110 Å²	110	51.5 Å²	51.5	48%	0.478	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-39.6	179.8	-173.7	177.4	175.3	-179.8	0	112.8	P339 A340 K341 E347 N348 F350	P339-K343 PolarHBondContact O-N 3.04Å; A340-K343 PolarHBondContact O-N 2.74Å; K341-K343 VanDerWaalsContact C-N 3.29Å; K341-K343 PolarHBondContact O-N 2.82Å; K343-E347 PolarHBondContact O-N 3.11Å; K343-N348 WeakPolarHBondContact CE-OD1 3.22Å; K343-N348 PolarHBondContact O-N 3.1Å; K343-F350 HydrophobicContact CB-CD1 4.34Å
344	E	91.1	Very high	90.1	Very high	93 Å²	93	51.4 Å²	51.4	44%	0.435	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-53.9	176.7	-176.9	-168.9	144.2	0	0	111.2	A340 K341 L346 E347	A340-E344 PolarHBondContact O-N 3.05Å; K341-E344 WeakPolarHBondContact CD-OE2 3.27Å; K341-E344 IonicContact NZ-OE1 3.5Å; K341-E344 PolarHBondContact NZ-OE1 3.39Å; K341-E344 IonicContact NZ-OE2 3.95Å; K341-E344 PolarHBondContact NZ-OE2 3.07Å; K341-E344 PolarHBondContact O-N 3.38Å; E344-L346 VanDerWaalsContact C-N 3.34Å; E344-L346 PolarHBondContact O-N 2.98Å; E344-E347 PolarHBondContact O-N 3.39Å
345	I	91.9	Very high	90.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-76.4	-22.1	-170.8	70.9	-171.2	0	0	0	113	L337 K341 C342 A394 R395 I399 I410	L337-I345 HydrophobicContact CD1-CD1 3.7Å; K341-I345 HydrophobicContact CD-CG2 4.09Å; K341-I345 HydrophobicContact CG-CG2 4.22Å; K341-I345 VanDerWaalsContact O-CG1 3.27Å; K341-I345 WeakPolarHBondContact O-CG1 3.46Å; K341-I345 WeakPolarHBondContact O-CG2 3.18Å; K341-I345 PolarHBondContact O-N 3.2Å; C342-I345 WeakPolarHBondContact O-CG1 3.37Å; I345-A394 WeakPolarHBondContact O-CA 3.42Å; I345-R395 PolarHBondContact O-N 3.42Å; I345-I399 HydrophobicContact CB-CD1 4.08Å; I345-I399 HydrophobicContact CD1-CD1 3.39Å; I345-I399 HydrophobicContact CG1-CD1 4.26Å; I345-I399 HydrophobicContact CG2-CD1 3.55Å; I345-I399 HydrophobicContact CG2-CG1 3.64Å; I345-I410 HydrophobicContact CD1-CD1 3.87Å; I345-I410 HydrophobicContact CD1-CG1 4.01Å; I345-I410 HydrophobicContact CD1-CG2 4.39Å
346	L	90.4	Very high	90.5	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.042	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	17.8	175.9	-61.6	171.1	0	0	0	112	C342 E344 N348 E349 F350 C357 A394 I410 I412	C342-L346 WeakPolarHBondContact O-CB 3.08Å; C342-L346 WeakPolarHBondContact O-CG 3.4Å; C342-L346 PolarHBondContact O-N 3.48Å; E344-L346 VanDerWaalsContact C-N 3.34Å; E344-L346 PolarHBondContact O-N 2.98Å; L346-N348 VanDerWaalsContact C-N 3.27Å; L346-N348 PolarHBondContact O-N 3.49Å; L346-N348 VanDerWaalsContact O-N 3.11Å; L346-E349 WeakPolarHBondContact O-CA 3.25Å; L346-E349 VanDerWaalsContact O-CB 3.28Å; L346-E349 WeakPolarHBondContact O-CB 3.49Å; L346-E349 PolarHBondContact O-N 2.59Å; L346-F350 HydrophobicContact CB-CB 4.15Å; L346-F350 HydrophobicContact CD1-CB 3.86Å; L346-F350 HydrophobicContact CD1-CD2 3.72Å; L346-F350 HydrophobicContact CD1-CG 4.09Å; L346-C357 HydrophobicContact CD1-CB 4.36Å; L346-A394 HydrophobicContact CD2-CB 3.96Å; L346-I410 HydrophobicContact CD2-CG2 4.14Å; L346-I412 HydrophobicContact CD1-CD1 4.45Å; L346-I412 HydrophobicContact CD1-CG1 4.19Å; L346-I412 HydrophobicContact CD2-CD1 4.38Å
347	E	85.8	Confident	90.5	Very high	88 Å²	88	46.7 Å²	46.7	41%	0.411	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	37.8	171.5	-56.6	-174.5	177.5	0	0	114.7	H278 K343 E344 E349 R395	H278-E347 IonicContact CE1-OE2 2.69Å; K343-E347 PolarHBondContact O-N 3.11Å; E344-E347 PolarHBondContact O-N 3.39Å; E347-E349 PolarHBondContact O-N 2.75Å; E347-R395 HydrophobicContact CG-CG 4.43Å; E347-R395 WeakPolarHBondContact OE1-CD 3.46Å
348	N	78.6	Confident	90.5	Very high	117 Å²	117	46 Å²	46	63%	0.626	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	3.6	-173.6	-50.9	-73.7	0	0	0	116.4	K343 L346 F350	K343-N348 WeakPolarHBondContact CE-OD1 3.22Å; K343-N348 PolarHBondContact O-N 3.1Å; L346-N348 VanDerWaalsContact C-N 3.27Å; L346-N348 PolarHBondContact O-N 3.49Å; L346-N348 VanDerWaalsContact O-N 3.11Å; N348-F350 PolarHBondContact O-N 2.79Å
349	E	85.7	Confident	90.4	Very high	25 Å²	25	41.5 Å²	41.5	12%	0.117	22%	0.218	C	C	.	.			trans	-79.9	48.2	167.8	-60.9	-169.7	165.5	0	0	110.4	L275 H276 D277 H278 L346 E347	L275-E349 HydrophobicContact CD2-CG 4.27Å; L275-E349 WeakPolarHBondContact CD2-OE1 3.27Å; L275-E349 HydrophobicContact CG-CG 4.38Å; L275-E349 WeakPolarHBondContact O-CB 3.13Å; H276-E349 WeakPolarHBondContact CA-OE2 3.3Å; H276-E349 PolarHBondContact CE1-O 2.89Å; H276-E349 PolarHBondContact ND1-O 2.93Å; D277-E349 WeakPolarHBondContact CA-OE2 3.5Å; D277-E349 PolarHBondContact N-OE2 3.42Å; H278-E349 WeakPolarHBondContact CA-OE1 3.47Å; H278-E349 IonicContact CE1-OE1 3.97Å; H278-E349 IonicContact CG-OE1 3.65Å; H278-E349 PolarHBondContact N-OE1 3.12Å; H278-E349 PolarHBondContact N-OE2 3.5Å; H278-E349 IonicContact ND1-OE1 3.69Å; H278-E349 PolarHBondContact ND1-OE1 3.12Å; H278-E349 IonicContact ND1-OE2 2.65Å; L346-E349 WeakPolarHBondContact O-CA 3.25Å; L346-E349 VanDerWaalsContact O-CB 3.28Å; L346-E349 WeakPolarHBondContact O-CB 3.49Å; L346-E349 PolarHBondContact O-N 2.59Å; E347-E349 PolarHBondContact O-N 2.75Å
350	F	89.9	Confident	90.1	Very high	21 Å²	21	40.7 Å²	40.7	9%	0.092	21%	0.213	C	C	.	.			trans	-147.1	132.8	-179.5	177.3	-99.3	0	0	0	111.9	P339 C342 K343 L346 N348 N352 E355 C357	P339-F350 HydrophobicContact CB-CE1 4.13Å; C342-F350 HydrophobicContact CB-CD1 3.58Å; C342-F350 HydrophobicContact CB-CD2 3.85Å; C342-F350 HydrophobicContact CB-CE1 3.49Å; C342-F350 VanDerWaalsContact CB-CE1 3.49Å; C342-F350 HydrophobicContact CB-CE2 3.75Å; C342-F350 HydrophobicContact CB-CG 3.76Å; C342-F350 HydrophobicContact CB-CZ 3.58Å; K343-F350 HydrophobicContact CB-CD1 4.34Å; L346-F350 HydrophobicContact CB-CB 4.15Å; L346-F350 HydrophobicContact CD1-CB 3.86Å; L346-F350 HydrophobicContact CD1-CD2 3.72Å; L346-F350 HydrophobicContact CD1-CG 4.09Å; N348-F350 PolarHBondContact O-N 2.79Å; F350-N352 HydrophobicContact CE1-CB 4.06Å; F350-E355 WeakPolarHBondContact CA-OE2 3.4Å; F350-E355 HydrophobicContact CD2-CB 3.94Å; F350-E355 HydrophobicContact CE2-CB 3.54Å; F350-E355 HydrophobicContact CZ-CB 4.26Å; F350-E355 WeakPolarHBondContact CZ-O 3.44Å; F350-C357 HydrophobicContact CE2-CB 4.19Å
351	S	89.5	Confident	89.6	Confident	32 Å²	32	38.7 Å²	38.7	22%	0.224	19%	0.191	C	C	.	.			trans	-117.1	96.1	-175.9	-162.1	0	0	0	0	111	N353 K354 E355	S351-N353 PolarHBondContact O-N 2.62Å; S351-N353 PolarHBondContact OG-OD1 2.8Å; S351-K354 CarbonylContact O-C 3.43Å; S351-K354 PolarHBondContact O-N 3.02Å; S351-E355 PolarHBondContact N-OE2 2.87Å; S351-E355 PolarHBondContact O-N 2.03Å
352	N	89	Confident	88.8	Confident	74 Å²	74	41.1 Å²	41.1	40%	0.396	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-31.3	-178.3	179.5	29.4	0	0	0	114.7	P339 F350 K354 K415	P339-N352 HydrophobicContact CB-CB 3.95Å; P339-N352 WeakPolarHBondContact CB-OD1 3.42Å; P339-N352 WeakPolarHBondContact CG-OD1 3.36Å; F350-N352 HydrophobicContact CE1-CB 4.06Å; N352-K354 VanDerWaalsContact C-N 3.29Å; N352-K354 PolarHBondContact O-N 3.36Å; N352-K415 PolarHBondContact O-NZ 3.2Å
353	N	89	Confident	87.1	Confident	98 Å²	98	44 Å²	44	52%	0.524	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.9	177.4	65.8	-19.9	0	0	0	114.1	S351 P418	S351-N353 PolarHBondContact O-N 2.62Å; S351-N353 PolarHBondContact OG-OD1 2.8Å; N353-P418 WeakPolarHBondContact O-CB 3.21Å; N353-P418 WeakPolarHBondContact O-CG 3.25Å
354	K	90	Very high	85.5	Confident	39 Å²	39	40.1 Å²	40.1	17%	0.17	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-24	-176.4	-65.5	175.6	-177.7	-173.6	0	112.9	E74 L272 S351 N352 K415	E74-K354 PolarHBondContact O-NZ 2.98Å; L272-K354 HydrophobicContact CD1-CD 3.9Å; L272-K354 HydrophobicContact CD2-CB 4.09Å; L272-K354 HydrophobicContact CD2-CD 3.79Å; L272-K354 HydrophobicContact CD2-CG 4.34Å; S351-K354 CarbonylContact O-C 3.43Å; S351-K354 PolarHBondContact O-N 3.02Å; N352-K354 VanDerWaalsContact C-N 3.29Å; N352-K354 PolarHBondContact O-N 3.36Å; K354-K415 VanDerWaalsContact O-CB 3.3Å; K354-K415 WeakPolarHBondContact O-CB 2.89Å; K354-K415 PolarHBondContact O-N 3.28Å
355	E	93.3	Very high	83.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	155.8	-166	-64	165.5	171.2	0	0	111.9	T274 H276 F350 S351 I412 Y413	T274-E355 PolarHBondContact OG1-OE1 2.82Å; T274-E355 VanDerWaalsContact OG1-OE1 3.05Å; H276-E355 IonicContact CD2-OE1 2.66Å; H276-E355 IonicContact CE1-OE1 3.9Å; H276-E355 IonicContact CE1-OE2 2.84Å; H276-E355 VanDerWaalsContact NE2-CD 3.3Å; H276-E355 IonicContact NE2-OE1 2.71Å; H276-E355 PolarHBondContact NE2-OE1 3.01Å; H276-E355 IonicContact NE2-OE2 2.66Å; H276-E355 PolarHBondContact NE2-OE2 3.01Å; F350-E355 WeakPolarHBondContact CA-OE2 3.4Å; F350-E355 HydrophobicContact CD2-CB 3.94Å; F350-E355 HydrophobicContact CE2-CB 3.54Å; F350-E355 HydrophobicContact CZ-CB 4.26Å; F350-E355 WeakPolarHBondContact CZ-O 3.44Å; S351-E355 PolarHBondContact N-OE2 2.87Å; S351-E355 PolarHBondContact O-N 2.03Å; E355-I412 HydrophobicContact CG-CG2 4.43Å; E355-Y413 CarbonylContact C-O 3.54Å; E355-Y413 VanDerWaalsContact CA-O 3.27Å; E355-Y413 WeakPolarHBondContact CA-O 3.46Å
356	L	94.5	Very high	82.2	Confident	19 Å²	19	44 Å²	44	10%	0.099	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.3	167	-60.3	171	0	0	0	107.9	L336 L373 Y413 K415	L336-L356 HydrophobicContact CD1-CB 4.14Å; L356-L373 HydrophobicContact CD1-CD2 4.08Å; L356-Y413 PolarHBondContact N-O 3.23Å; L356-Y413 PolarHBondContact O-N 2.73Å; L356-K415 HydrophobicContact CD1-CB 4.49Å; L356-K415 HydrophobicContact CD1-CG 4.25Å; L356-K415 HydrophobicContact CD2-CD 3.95Å; L356-K415 HydrophobicContact CD2-CG 4.04Å; L356-K415 HydrophobicContact CG-CB 4.02Å; L356-K415 HydrophobicContact CG-CD 4.34Å; L356-K415 HydrophobicContact CG-CG 3.95Å
357	C	94	Very high	80.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144.8	173.2	90.2	0	0	0	0	111.9	L337 C342 L346 F350 I410 S411	L337-C357 PolarHBondContact N-O 3.43Å; C342-C357 WeakPolarHBondContact CA-SG 3.23Å; C342-C357 HydrophobicContact CB-CB 3.92Å; C342-C357 WeakPolarHBondContact CB-SG 3.19Å; C342-C357 WeakPolarHBondContact SG-CB 3.46Å; C342-C357 CovalentContact SG-SG 2.02Å; C342-C357 PolarHBondContact SG-SG 3.39Å; L346-C357 HydrophobicContact CD1-CB 4.36Å; F350-C357 HydrophobicContact CE2-CB 4.19Å; C357-I410 HydrophobicContact CB-CG2 4.14Å; C357-S411 CarbonylContact C-O 3.54Å; C357-S411 VanDerWaalsContact CA-O 3.26Å; C357-S411 WeakPolarHBondContact CA-O 3.45Å
358	T	93.2	Very high	80.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.3	178.9	71.5	0	0	0	0	111.5	V334 K335 L336 L373 I410 S411 Y413	V334-T358 HydrophobicContact CB-CG2 4.38Å; V334-T358 HydrophobicContact CG2-CG2 4Å; K335-T358 CarbonylContact O-C 3.53Å; K335-T358 WeakPolarHBondContact O-CA 3.33Å; K335-T358 WeakPolarHBondContact O-CB 3.42Å; L336-T358 HydrophobicContact CD1-CG2 4.04Å; T358-L373 HydrophobicContact CG2-CD1 4.12Å; T358-L373 HydrophobicContact CG2-CD2 4.06Å; T358-I410 WeakPolarHBondContact O-CA 3.42Å; T358-S411 PolarHBondContact N-O 3.3Å; T358-S411 PolarHBondContact O-N 3.24Å; T358-Y413 HydrophobicContact CG2-CD2 4.01Å; T358-Y413 HydrophobicContact CG2-CE2 3.46Å; T358-Y413 VanDerWaalsContact CG2-CE2 3.46Å; T358-Y413 VanDerWaalsContact OG1-CE2 3.25Å; T358-Y413 WeakPolarHBondContact OG1-CE2 3.43Å; T358-Y413 PolarHBondContact OG1-OH 3.38Å
359	L	90.4	Very high	81	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.4	165.4	-176.4	71.1	0	0	0	109.9	V123 L127 K335 L337 L396 I399 V400 F408 I410	V123-L359 HydrophobicContact CG1-CD2 3.87Å; L127-L359 HydrophobicContact CD1-CB 4.4Å; L127-L359 HydrophobicContact CD1-CD2 3.72Å; L127-L359 HydrophobicContact CD1-CG 3.8Å; K335-L359 HydrophobicContact CB-CB 4.41Å; K335-L359 PolarHBondContact N-O 3.06Å; K335-L359 PolarHBondContact O-N 3.29Å; L337-L359 HydrophobicContact CD1-CB 4.24Å; L337-L359 HydrophobicContact CD2-CB 4.18Å; L337-L359 HydrophobicContact CG-CB 4.36Å; L359-L396 HydrophobicContact CD1-CD2 3.93Å; L359-I399 HydrophobicContact CD2-CG2 3.93Å; L359-V400 HydrophobicContact CD1-CG2 4.18Å; L359-V400 HydrophobicContact CD2-CG2 4.19Å; L359-F408 HydrophobicContact CD1-CB 3.93Å; L359-F408 HydrophobicContact CD1-CD1 4.2Å; L359-F408 HydrophobicContact CD1-CG 4.41Å; L359-F408 HydrophobicContact CD2-CD1 4.48Å; L359-F408 HydrophobicContact CG-CD1 4.23Å; L359-I410 HydrophobicContact CB-CD1 4.2Å; L359-I410 HydrophobicContact CD1-CD1 3.69Å
360	S	86.2	Confident	81.3	Confident	8 Å²	8	38.8 Å²	38.8	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	163.7	175.8	60.7	0	0	0	0	110.5	F408 Q409	S360-F408 CarbonylContact O-C 3.52Å; S360-F408 VanDerWaalsContact O-CA 3.32Å; S360-F408 WeakPolarHBondContact O-CA 3.42Å; S360-Q409 PolarHBondContact N-O 3.49Å; S360-Q409 VanDerWaalsContact N-O 3.1Å; S360-Q409 PolarHBondContact O-N 3.2Å; S360-Q409 WeakPolarHBondContact OG-CG 3.45Å
361	R	80.4	Confident	81.4	Confident	26 Å²	26	37.8 Å²	37.8	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	140.2	172.6	-61.2	-176	71.4	176.3	6.2	110.3	L130 I132 F364 D407 F408	L130-R361 PolarHBondContact O-NH1 3.02Å; I132-R361 VanDerWaalsContact CG1-NH1 3.31Å; R361-F364 HydrophobicContact CB-CD2 3.95Å; R361-F364 HydrophobicContact CB-CE2 4.01Å; R361-D407 CarbonylContact C-O 3.51Å; R361-D407 VanDerWaalsContact CA-O 3.27Å; R361-D407 WeakPolarHBondContact CA-O 3.06Å; R361-D407 IonicContact NH2-OD2 3.08Å; R361-F408 HydrophobicContact CG-CD1 4.16Å; R361-F408 HydrophobicContact CG-CE1 3.83Å; R361-F408 HydrophobicContact CG-CZ 4.43Å
362	K	74.9	Confident	81.7	Confident	104 Å²	104	36.2 Å²	36.2	45%	0.452	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	158.5	164.9	-69.8	-163.3	-171.9	135.3	0	110	F364 E406 D407 F408 Q409	K362-F364 PolarHBondContact O-N 2.76Å; K362-E406 WeakPolarHBondContact CD-O 3.38Å; K362-E406 WeakPolarHBondContact CE-O 3.34Å; K362-E406 PolarHBondContact NZ-O 2.73Å; K362-D407 PolarHBondContact N-O 3.11Å; K362-F408 WeakPolarHBondContact CE-O 3.48Å; K362-Q409 HydrophobicContact CG-CB 3.92Å; K362-Q409 HydrophobicContact CG-CG 4.26Å
363	G	58.7	Low	81.9	Confident	61 Å²	61	32.7 Å²	32.7	63%	0.629	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	-7.7	178.8	0	0	0	0	0	114.9
364	F	58.2	Low	82.2	Confident	30 Å²	30	28 Å²	28	13%	0.132	15%	0.148	C	C	.	.	S	Bend	trans	-60.4	133.5	155.8	-87.2	-86.5	0	0	0	107.7	L130 A332 R361 K362 E366	L130-F364 HydrophobicContact CB-CZ 4.43Å; A332-F364 HydrophobicContact CB-CB 4.16Å; A332-F364 HydrophobicContact CB-CD1 3.47Å; A332-F364 VanDerWaalsContact CB-CD1 3.47Å; A332-F364 HydrophobicContact CB-CE1 4.05Å; A332-F364 HydrophobicContact CB-CG 3.87Å; R361-F364 HydrophobicContact CB-CD2 3.95Å; R361-F364 HydrophobicContact CB-CE2 4.01Å; K362-F364 PolarHBondContact O-N 2.76Å; F364-E366 PolarHBondContact O-N 3.2Å; F364-E366 VanDerWaalsContact O-N 3.08Å
365	P	54.7	Low	82.4	Confident	35 Å²	35	26.2 Å²	26.2	23%	0.227	14%	0.14	C	C	.	.			trans	-54.7	127.5	-168.1	1.7	-3.3	0	0	0	108.5	T184 I330 V367	T184-P365 HydrophobicContact CG2-CG 3.21Å; I330-P365 HydrophobicContact CB-CG 4.16Å; I330-P365 HydrophobicContact CD1-CB 3.54Å; I330-P365 HydrophobicContact CD1-CG 3.6Å; I330-P365 WeakPolarHBondContact CD1-O 3.28Å; I330-P365 HydrophobicContact CG1-CG 4.46Å; I330-P365 HydrophobicContact CG2-CB 4.47Å; I330-P365 HydrophobicContact CG2-CG 3.83Å; P365-V367 PolarHBondContact O-N 3.5Å
366	E	58.8	Low	82.2	Confident	140 Å²	140	29.6 Å²	29.6	65%	0.654	15%	0.153	S	C	*	.			trans	-44.4	104.1	-169.6	-70.9	176	161.9	0	0	109.2	R325 F364 S368	R325-E366 IonicContact CZ-OE2 3.2Å; R325-E366 IonicContact NE-OE2 3.25Å; R325-E366 IonicContact NH2-OE1 2.82Å; R325-E366 IonicContact NH2-OE2 2.74Å; R325-E366 PolarHBondContact NH2-OE2 2.9Å; F364-E366 PolarHBondContact O-N 3.2Å; F364-E366 VanDerWaalsContact O-N 3.08Å; E366-S368 PolarHBondContact O-N 2.9Å
367	V	64	Low	82	Confident	20 Å²	20	32.6 Å²	32.6	12%	0.121	16%	0.163	C	C	.	.			trans	-53.6	113.5	176.6	171.6	0	0	0	0	105.7	V320 P365 S371 F387	V320-V367 HydrophobicContact CB-CG2 4.46Å; V320-V367 HydrophobicContact CG1-CG1 4.49Å; V320-V367 HydrophobicContact CG1-CG2 3.57Å; V320-V367 HydrophobicContact CG2-CB 4.37Å; V320-V367 HydrophobicContact CG2-CG1 3.41Å; V320-V367 VanDerWaalsContact CG2-CG1 3.41Å; V320-V367 HydrophobicContact CG2-CG2 4.07Å; P365-V367 PolarHBondContact O-N 3.5Å; V367-S371 VanDerWaalsContact CG1-OG 3.25Å; V367-S371 WeakPolarHBondContact CG1-OG 3.36Å; V367-F387 HydrophobicContact CB-CD1 4.24Å; V367-F387 HydrophobicContact CB-CE1 4.37Å; V367-F387 HydrophobicContact CG1-CB 4.02Å; V367-F387 HydrophobicContact CG1-CD1 3.72Å; V367-F387 HydrophobicContact CG1-CD2 4.47Å; V367-F387 HydrophobicContact CG1-CE1 4.33Å; V367-F387 HydrophobicContact CG1-CG 3.8Å; V367-F387 VanDerWaalsContact O-CD1 3.3Å; V367-F387 WeakPolarHBondContact O-CD1 3.27Å; V367-F387 WeakPolarHBondContact O-CE1 3.21Å
368	S	78.6	Confident	81.6	Confident	23 Å²	23	34.9 Å²	34.9	16%	0.161	19%	0.186	C	C	.	.			trans	-65.5	148.8	-179	63.7	0	0	0	0	109.9	S208 E366 G370 S371	S208-S368 WeakPolarHBondContact CB-OG 3.33Å; S208-S368 PolarHBondContact N-OG 3.21Å; S208-S368 VanDerWaalsContact N-OG 3.13Å; S208-S368 PolarHBondContact OG-OG 2.76Å; E366-S368 PolarHBondContact O-N 2.9Å; S368-G370 PolarHBondContact O-N 3.15Å; S368-S371 VanDerWaalsContact O-CB 3.25Å; S368-S371 WeakPolarHBondContact O-CB 3.32Å; S368-S371 PolarHBondContact O-N 2.79Å; S368-S371 PolarHBondContact O-OG 3.47Å; S368-S371 PolarHBondContact OG-OG 2.84Å
369	R	88	Confident	81.1	Confident	84 Å²	84	41 Å²	41	32%	0.317	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	144.9	174	-61.7	-174.1	-176.8	94.2	2.5	110.6	C207 S208 C229 S371 M388	C207-R369 WeakPolarHBondContact CB-O 3.41Å; C207-R369 PolarHBondContact SG-O 2.83Å; S208-R369 PolarHBondContact N-O 3.47Å; C229-R369 PolarHBondContact SG-O 2.8Å; C229-R369 VanDerWaalsContact SG-O 3.41Å; R369-S371 VanDerWaalsContact C-N 3.29Å; R369-S371 PolarHBondContact O-N 2.82Å; R369-M388 WeakPolarHBondContact CG-O 3.4Å
370	G	92	Very high	80.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-5.3	-177	0	0	0	0	0	115.2	S208 G209 T225 S368 T386 F387	S208-G370 CarbonylContact O-C 3.53Å; S208-G370 VanDerWaalsContact O-C 3.23Å; S208-G370 VanDerWaalsContact O-CA 3.27Å; S208-G370 WeakPolarHBondContact O-CA 3.33Å; G209-G370 WeakPolarHBondContact CA-O 3.42Å; T225-G370 WeakPolarHBondContact OG1-CA 3.39Å; S368-G370 PolarHBondContact O-N 3.15Å; G370-T386 VanDerWaalsContact CA-CG2 3.49Å; G370-T386 WeakPolarHBondContact O-CG2 2.95Å; G370-F387 PolarHBondContact N-O 3.11Å
371	S	92.2	Very high	81.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.			trans	-61.4	132.6	177.2	-67.1	0	0	0	0	112	S208 T321 G322 V367 S368 R369 F387	S208-S371 WeakPolarHBondContact CB-OG 3.4Å; T321-S371 WeakPolarHBondContact O-CB 2.89Å; T321-S371 PolarHBondContact O-OG 2.96Å; G322-S371 WeakPolarHBondContact CA-OG 3.3Å; V367-S371 VanDerWaalsContact CG1-OG 3.25Å; V367-S371 WeakPolarHBondContact CG1-OG 3.36Å; S368-S371 VanDerWaalsContact O-CB 3.25Å; S368-S371 WeakPolarHBondContact O-CB 3.32Å; S368-S371 PolarHBondContact O-N 2.79Å; S368-S371 PolarHBondContact O-OG 3.47Å; S368-S371 PolarHBondContact OG-OG 2.84Å; R369-S371 VanDerWaalsContact C-N 3.29Å; R369-S371 PolarHBondContact O-N 2.82Å; S371-F387 WeakPolarHBondContact O-CB 3.32Å; S371-F387 PolarHBondContact O-N 2.67Å
372	P	95.1	Very high	81.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	135.6	178.4	29.6	-39.8	0	0	0	112.5	V320 T321 V374 Q383	V320-P372 WeakPolarHBondContact CA-O 3.04Å; T321-P372 PolarHBondContact N-O 2.79Å; T321-P372 WeakPolarHBondContact O-CD 3.29Å; T321-P372 VanDerWaalsContact OG1-CG 3.3Å; T321-P372 WeakPolarHBondContact OG1-CG 2.99Å; P372-V374 HydrophobicContact CB-CG2 3.98Å; P372-V374 HydrophobicContact CG-CG2 4.41Å; P372-Q383 VanDerWaalsContact CB-CD 3.41Å; P372-Q383 HydrophobicContact CB-CG 3.79Å
373	L	94.4	Very high	82.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.9	161	175.8	66.3	0	0	0	108.3	C318 V334 L336 L356 T358 Q383 Y384 G385 Y413	C318-L373 HydrophobicContact CB-CD1 4.25Å; V334-L373 HydrophobicContact CG2-CD1 3.54Å; L336-L373 HydrophobicContact CD1-CD2 4.21Å; L356-L373 HydrophobicContact CD1-CD2 4.08Å; T358-L373 HydrophobicContact CG2-CD1 4.12Å; T358-L373 HydrophobicContact CG2-CD2 4.06Å; L373-Q383 CarbonylContact O-C 3.52Å; L373-Q383 WeakPolarHBondContact O-CA 2.99Å; L373-Q383 WeakPolarHBondContact O-CG 3.1Å; L373-Y384 PolarHBondContact O-N 2.98Å; L373-G385 PolarHBondContact N-O 3.34Å; L373-G385 PolarHBondContact O-N 2.68Å; L373-Y413 HydrophobicContact CB-CD1 3.59Å; L373-Y413 HydrophobicContact CB-CE1 3.7Å; L373-Y413 HydrophobicContact CB-CG 4.31Å; L373-Y413 HydrophobicContact CD1-CE1 4.38Å; L373-Y413 HydrophobicContact CD2-CD1 4.19Å; L373-Y413 HydrophobicContact CD2-CD2 4.26Å; L373-Y413 HydrophobicContact CD2-CE1 4.47Å; L373-Y413 HydrophobicContact CD2-CG 4.1Å; L373-Y413 HydrophobicContact CG-CD1 4.42Å; L373-Y413 HydrophobicContact CG-CE1 4.41Å
374	V	94.2	Very high	84.5	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131	-177.5	-169.3	0	0	0	0	108.4	W191 V303 C318 Y319 P372 W381 Y382 Q383	W191-V374 HydrophobicContact CH2-CG1 4.18Å; W191-V374 HydrophobicContact CZ2-CB 4.1Å; W191-V374 HydrophobicContact CZ2-CG1 4.03Å; W191-V374 HydrophobicContact CZ2-CG2 3.78Å; V303-V374 HydrophobicContact CG2-CG1 4.17Å; V303-V374 HydrophobicContact CG2-CG2 4.43Å; C318-V374 WeakPolarHBondContact CA-O 3.16Å; Y319-V374 PolarHBondContact N-O 2.97Å; Y319-V374 PolarHBondContact O-N 2.88Å; Y319-V374 VanDerWaalsContact O-O 3.12Å; P372-V374 HydrophobicContact CB-CG2 3.98Å; P372-V374 HydrophobicContact CG-CG2 4.41Å; V374-W381 HydrophobicContact CG1-CB 3.87Å; V374-W381 HydrophobicContact CG1-CE3 3.93Å; V374-Y382 CarbonylContact C-O 3.59Å; V374-Y382 VanDerWaalsContact CA-O 3.25Å; V374-Y382 WeakPolarHBondContact CA-O 3.45Å; V374-Y382 VanDerWaalsContact CG1-O 3.3Å; V374-Y382 WeakPolarHBondContact CG1-O 3.4Å; V374-Q383 HydrophobicContact CG2-CB 4.47Å
375	C	93.6	Very high	86.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	156	176.8	-55.5	0	0	0	0	109.7	L315 C318 Y382 Y384	L315-C375 HydrophobicContact CB-CB 4.31Å; L315-C375 HydrophobicContact CD1-CB 4.47Å; C318-C375 HydrophobicContact CB-CB 4.12Å; C318-C375 WeakPolarHBondContact CB-SG 3.33Å; C318-C375 WeakPolarHBondContact SG-CB 3.13Å; C318-C375 CovalentContact SG-SG 2.05Å; C318-C375 PolarHBondContact SG-SG 3.26Å; C375-Y382 PolarHBondContact N-O 2.83Å; C375-Y382 PolarHBondContact O-N 2.95Å; C375-Y382 VanDerWaalsContact O-N 3.07Å; C375-Y384 HydrophobicContact CB-CD2 3.72Å; C375-Y384 HydrophobicContact CB-CE2 3.75Å
376	R	91	Very high	88.2	Confident	71 Å²	71	36 Å²	36	27%	0.268	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.7	176.1	-169.3	162.7	62.9	97.7	-3.3	109.6	D316 D317 G378 W381	D316-R376 HydrophobicContact CB-CB 4.42Å; D316-R376 PolarHBondContact N-O 3.08Å; D316-R376 VanDerWaalsContact N-O 3.09Å; D316-R376 WeakPolarHBondContact O-CB 3.17Å; D316-R376 PolarHBondContact O-N 2.77Å; D317-R376 PolarHBondContact O-N 2.86Å; D317-R376 IonicContact OD2-CZ 2.73Å; D317-R376 IonicContact OD2-NE 3.37Å; D317-R376 PolarHBondContact OD2-NE 2.8Å; D317-R376 IonicContact OD2-NH2 3.86Å; D317-R376 PolarHBondContact OD2-NH2 2.72Å; R376-G378 WeakPolarHBondContact CG-O 3.42Å; R376-G378 PolarHBondContact NH1-O 2.9Å; R376-W381 HydrophobicContact CB-CD2 4.3Å; R376-W381 HydrophobicContact CB-CE3 4.03Å; R376-W381 HydrophobicContact CB-CH2 3.83Å; R376-W381 HydrophobicContact CB-CZ2 4.12Å; R376-W381 HydrophobicContact CB-CZ3 3.8Å; R376-W381 HydrophobicContact CG-CH2 4.47Å; R376-W381 HydrophobicContact CG-CZ2 4.28Å
377	R	89.2	Confident	89.9	Confident	83 Å²	83	30 Å²	30	31%	0.313	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	106.6	169.8	-173.9	-174.6	-177.3	-164.1	0.5	107.8	E308 L315 N379 D380 Y382	E308-R377 IonicContact OE2-CZ 3.3Å; E308-R377 VanDerWaalsContact OE2-CZ 3.3Å; E308-R377 IonicContact OE2-NH1 2.76Å; E308-R377 PolarHBondContact OE2-NH1 3.29Å; E308-R377 IonicContact OE2-NH2 3.78Å; E308-R377 PolarHBondContact OE2-NH2 2.72Å; L315-R377 HydrophobicContact CD2-CB 4.43Å; R377-N379 PolarHBondContact O-N 2.86Å; R377-N379 VanDerWaalsContact O-N 3.17Å; R377-D380 PolarHBondContact N-O 3.2Å; R377-D380 PolarHBondContact O-N 3.03Å; R377-Y382 HydrophobicContact CB-CD2 4.05Å; R377-Y382 HydrophobicContact CB-CE2 4.18Å
378	G	85.1	Confident	91.1	Very high	47 Å²	47	29 Å²	29	49%	0.485	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	-114.5	-168.8	0	0	0	0	0	110.8	R376	R376-G378 WeakPolarHBondContact CG-O 3.42Å; R376-G378 PolarHBondContact NH1-O 2.9Å
379	N	83.7	Confident	91.5	Very high	130 Å²	130	28.7 Å²	28.7	70%	0.695	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-11.1	179.9	-71.1	-20.9	0	0	0	113.8	N171 R377	N171-N379 PolarHBondContact ND2-O 2.66Å; N171-N379 PolarHBondContact OD1-O 3.27Å; N171-N379 VanDerWaalsContact OD1-O 3.08Å; R377-N379 PolarHBondContact O-N 2.86Å; R377-N379 VanDerWaalsContact O-N 3.17Å
380	D	86.7	Confident	91.6	Very high	71 Å²	71	26.3 Å²	26.3	38%	0.38	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	152.7	-171.3	-65.3	-43.5	0	0	0	112.4	N171 R377 Y382	N171-D380 PolarHBondContact ND2-OD1 3.36Å; R377-D380 PolarHBondContact N-O 3.2Å; R377-D380 PolarHBondContact O-N 3.03Å; D380-Y382 HydrophobicContact CB-CD2 4.33Å; D380-Y382 HydrophobicContact CB-CE2 3.45Å; D380-Y382 VanDerWaalsContact CB-CE2 3.45Å
381	W	90.4	Very high	91.4	Very high	13 Å²	13	27 Å²	27	5%	0.049	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.4	178.2	-65	90.8	0	0	0	111.3	L170 F174 P176 D317 Y319 V374 R376	L170-W381 HydrophobicContact CD2-CB 3.85Å; F174-W381 AromaticContact CD1-CD2 3.71Å; F174-W381 HydrophobicContact CD1-CD2 3.71Å; F174-W381 AromaticContact CD1-CE2 3.37Å; F174-W381 HydrophobicContact CD1-CE3 4.18Å; F174-W381 HydrophobicContact CD1-CG 4.23Å; F174-W381 HydrophobicContact CD1-CH2 4.09Å; F174-W381 AromaticContact CD1-CZ2 3.58Å; F174-W381 HydrophobicContact CD1-CZ2 3.58Å; F174-W381 HydrophobicContact CD1-CZ3 4.34Å; F174-W381 AromaticContact CD1-NE1 3.69Å; F174-W381 AromaticContact CE1-CD2 3.81Å; F174-W381 HydrophobicContact CE1-CD2 3.81Å; F174-W381 AromaticContact CE1-CE2 3.68Å; F174-W381 AromaticContact CE1-CE3 3.78Å; F174-W381 HydrophobicContact CE1-CE3 3.78Å; F174-W381 AromaticContact CE1-CH2 3.54Å; F174-W381 HydrophobicContact CE1-CH2 3.54Å; F174-W381 AromaticContact CE1-CZ2 3.55Å; F174-W381 HydrophobicContact CE1-CZ2 3.55Å; F174-W381 AromaticContact CE1-CZ3 3.65Å; F174-W381 HydrophobicContact CE1-CZ3 3.65Å; P176-W381 HydrophobicContact CG-CZ2 4.22Å; D317-W381 HydrophobicContact CB-CH2 4.2Å; D317-W381 VanDerWaalsContact O-CZ3 3.23Å; D317-W381 WeakPolarHBondContact O-CZ3 3.44Å; Y319-W381 AromaticContact CD2-CH2 3.84Å; Y319-W381 HydrophobicContact CD2-CH2 3.84Å; Y319-W381 AromaticContact CD2-CZ3 3.77Å; Y319-W381 HydrophobicContact CD2-CZ3 3.77Å; Y319-W381 AromaticContact CE2-CH2 3.8Å; Y319-W381 HydrophobicContact CE2-CH2 3.8Å; Y319-W381 HydrophobicContact CE2-CZ3 4.2Å; V374-W381 HydrophobicContact CG1-CB 3.87Å; V374-W381 HydrophobicContact CG1-CE3 3.93Å; R376-W381 HydrophobicContact CB-CD2 4.3Å; R376-W381 HydrophobicContact CB-CE3 4.03Å; R376-W381 HydrophobicContact CB-CH2 3.83Å; R376-W381 HydrophobicContact CB-CZ2 4.12Å; R376-W381 HydrophobicContact CB-CZ3 3.8Å; R376-W381 HydrophobicContact CG-CH2 4.47Å; R376-W381 HydrophobicContact CG-CZ2 4.28Å
382	Y	93.9	Very high	91.1	Very high	61 Å²	61	31.8 Å²	31.8	24%	0.239	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.5	178.7	-60.9	-90	0	0	0	110.9	S304 V374 C375 R377 D380 Y384	S304-Y382 WeakPolarHBondContact O-CA 3.2Å; V374-Y382 CarbonylContact C-O 3.59Å; V374-Y382 VanDerWaalsContact CA-O 3.25Å; V374-Y382 WeakPolarHBondContact CA-O 3.45Å; V374-Y382 VanDerWaalsContact CG1-O 3.3Å; V374-Y382 WeakPolarHBondContact CG1-O 3.4Å; C375-Y382 PolarHBondContact N-O 2.83Å; C375-Y382 PolarHBondContact O-N 2.95Å; C375-Y382 VanDerWaalsContact O-N 3.07Å; R377-Y382 HydrophobicContact CB-CD2 4.05Å; R377-Y382 HydrophobicContact CB-CE2 4.18Å; D380-Y382 HydrophobicContact CB-CD2 4.33Å; D380-Y382 HydrophobicContact CB-CE2 3.45Å; D380-Y382 VanDerWaalsContact CB-CE2 3.45Å; Y382-Y384 WeakPolarHBondContact O-CD2 3.18Å; Y382-Y384 WeakPolarHBondContact O-CE2 3.3Å
383	Q	95.5	Very high	90.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.5	169.1	-169.6	-178.2	-13.6	0	0	109.8	S210 V303 S304 N306 P372 L373 V374 G385 T386 L416	S210-Q383 VanDerWaalsContact CB-OE1 3.32Å; S210-Q383 PolarHBondContact OG-OE1 3.08Å; V303-Q383 HydrophobicContact CG1-CB 4.06Å; V303-Q383 HydrophobicContact CG2-CB 4.1Å; S304-Q383 PolarHBondContact O-N 3.28Å; N306-Q383 PolarHBondContact N-O 3.22Å; N306-Q383 PolarHBondContact OD1-O 3.04Å; P372-Q383 VanDerWaalsContact CB-CD 3.41Å; P372-Q383 HydrophobicContact CB-CG 3.79Å; L373-Q383 CarbonylContact O-C 3.52Å; L373-Q383 WeakPolarHBondContact O-CA 2.99Å; L373-Q383 WeakPolarHBondContact O-CG 3.1Å; V374-Q383 HydrophobicContact CG2-CB 4.47Å; Q383-G385 WeakPolarHBondContact CG-O 3.43Å; Q383-G385 PolarHBondContact NE2-O 2.93Å; Q383-T386 PolarHBondContact NE2-OG1 2.99Å; Q383-L416 HydrophobicContact CB-CD1 4.13Å; Q383-L416 HydrophobicContact CG-CD1 3.64Å
384	Y	95.8	Very high	90.3	Very high	12 Å²	12	36.5 Å²	36.5	5%	0.047	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-27.8	179.3	-74.7	-92.7	0	0	0	112.9	N306 V310 L315 L373 C375 Y382 L416	N306-Y384 HydrophobicContact CB-CD1 3.87Å; N306-Y384 HydrophobicContact CB-CE1 3.54Å; N306-Y384 HydrophobicContact CB-CE2 4.44Å; N306-Y384 HydrophobicContact CB-CG 4.44Å; V310-Y384 HydrophobicContact CB-CE1 4.4Å; L315-Y384 HydrophobicContact CD1-CD1 4.08Å; L315-Y384 HydrophobicContact CD1-CE1 3.87Å; L315-Y384 HydrophobicContact CD1-CE2 4.39Å; L315-Y384 HydrophobicContact CD1-CG 4.44Å; L315-Y384 HydrophobicContact CD2-CE1 3.85Å; L315-Y384 HydrophobicContact CD2-CE2 3.91Å; L315-Y384 WeakPolarHBondContact CD2-OH 3.37Å; L373-Y384 PolarHBondContact O-N 2.98Å; C375-Y384 HydrophobicContact CB-CD2 3.72Å; C375-Y384 HydrophobicContact CB-CE2 3.75Å; Y382-Y384 WeakPolarHBondContact O-CD2 3.18Å; Y382-Y384 WeakPolarHBondContact O-CE2 3.3Å; Y384-L416 PolarHBondContact O-N 3.33Å
385	G	95.6	Very high	90	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	169.4	-174.5	0	0	0	0	0	114.2	L373 Q383 M414	L373-G385 PolarHBondContact N-O 3.34Å; L373-G385 PolarHBondContact O-N 2.68Å; Q383-G385 WeakPolarHBondContact CG-O 3.43Å; Q383-G385 PolarHBondContact NE2-O 2.93Å; G385-M414 CarbonylContact C-O 3.56Å; G385-M414 WeakPolarHBondContact CA-O 3.18Å
386	T	95.1	Very high	89.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.9	171.9	-59	0	0	0	0	108.8	A226 G370 Q383 M388 Y413 M414	A226-T386 HydrophobicContact CB-CG2 4.3Å; G370-T386 VanDerWaalsContact CA-CG2 3.49Å; G370-T386 WeakPolarHBondContact O-CG2 2.95Å; Q383-T386 PolarHBondContact NE2-OG1 2.99Å; T386-M388 HydrophobicContact CG2-CE 3.5Å; T386-M388 VanDerWaalsContact CG2-CE 3.5Å; T386-M388 WeakPolarHBondContact O-CE 3.37Å; T386-M388 PolarHBondContact O-N 3.25Å; T386-Y413 CarbonylContact O-C 3.58Å; T386-Y413 WeakPolarHBondContact O-CA 3.22Å; T386-Y413 WeakPolarHBondContact O-CB 3.09Å; T386-M414 PolarHBondContact N-O 2.84Å; T386-M414 PolarHBondContact O-N 3.33Å
387	F	93.6	Very high	89.2	Confident	14 Å²	14	45.6 Å²	45.6	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	128.1	-175.9	178.3	-109	0	0	0	111.4	V367 G370 S371 M389 Y413	V367-F387 HydrophobicContact CB-CD1 4.24Å; V367-F387 HydrophobicContact CB-CE1 4.37Å; V367-F387 HydrophobicContact CG1-CB 4.02Å; V367-F387 HydrophobicContact CG1-CD1 3.72Å; V367-F387 HydrophobicContact CG1-CD2 4.47Å; V367-F387 HydrophobicContact CG1-CE1 4.33Å; V367-F387 HydrophobicContact CG1-CG 3.8Å; V367-F387 VanDerWaalsContact O-CD1 3.3Å; V367-F387 WeakPolarHBondContact O-CD1 3.27Å; V367-F387 WeakPolarHBondContact O-CE1 3.21Å; G370-F387 PolarHBondContact N-O 3.11Å; S371-F387 WeakPolarHBondContact O-CB 3.32Å; S371-F387 PolarHBondContact O-N 2.67Å; F387-M389 VanDerWaalsContact CE2-C 3.42Å; F387-M389 VanDerWaalsContact CE2-O 3.24Å; F387-M389 WeakPolarHBondContact CE2-O 3.4Å; F387-M389 VanDerWaalsContact CZ-C 3.47Å; F387-Y413 HydrophobicContact CB-CD1 3.81Å; F387-Y413 HydrophobicContact CB-CE1 3.63Å; F387-Y413 HydrophobicContact CD2-CD1 4.38Å; F387-Y413 AromaticContact CD2-CE1 3.91Å; F387-Y413 HydrophobicContact CD2-CE1 3.91Å; F387-Y413 HydrophobicContact CD2-CE2 4.37Å; F387-Y413 AromaticContact CD2-CZ 3.91Å; F387-Y413 HydrophobicContact CG-CE1 4.24Å
388	M	89.7	Confident	88.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-55.3	179.2	-60.7	-66.4	120.8	0	0	110.9	A226 Q228 M283 R369 T386 I412 M414	A226-M388 HydrophobicContact CB-CE 3.43Å; A226-M388 VanDerWaalsContact CB-CE 3.43Å; A226-M388 HydrophobicContact CB-SD 3.89Å; Q228-M388 PolarHBondContact OE1-O 2.84Å; M283-M388 HydrophobicContact CB-CG 4.39Å; M283-M388 HydrophobicContact CB-SD 4.12Å; M283-M388 HydrophobicContact CE-CB 4.34Å; M283-M388 HydrophobicContact CG-CB 4.34Å; M283-M388 HydrophobicContact CG-CG 4.31Å; M283-M388 HydrophobicContact SD-CB 3.94Å; M283-M388 HydrophobicContact SD-CG 3.9Å; R369-M388 WeakPolarHBondContact CG-O 3.4Å; T386-M388 HydrophobicContact CG2-CE 3.5Å; T386-M388 VanDerWaalsContact CG2-CE 3.5Å; T386-M388 WeakPolarHBondContact O-CE 3.37Å; T386-M388 PolarHBondContact O-N 3.25Å; M388-I412 PolarHBondContact N-O 3.19Å; M388-M414 HydrophobicContact CE-CB 3.66Å; M388-M414 HydrophobicContact CG-CB 4.08Å; M388-M414 HydrophobicContact SD-CB 4.15Å
389	M	87.9	Confident	88.2	Confident	17 Å²	17	43.1 Å²	43.1	8%	0.084	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	165.6	-175.9	62	-177.4	-79.3	0	0	111.7	P89 H276 V281 M283 F387 I412	P89-M389 HydrophobicContact CG-CE 3.88Å; H276-M389 HydrophobicContact CB-CE 3.99Å; H276-M389 HydrophobicContact CB-SD 3.95Å; V281-M389 HydrophobicContact CG1-SD 4.17Å; V281-M389 HydrophobicContact CG2-SD 4.09Å; M283-M389 HydrophobicContact CE-CG 3.92Å; M283-M389 HydrophobicContact CE-SD 3.54Å; M283-M389 VanDerWaalsContact CE-SD 3.54Å; F387-M389 VanDerWaalsContact CE2-C 3.42Å; F387-M389 VanDerWaalsContact CE2-O 3.24Å; F387-M389 WeakPolarHBondContact CE2-O 3.4Å; F387-M389 VanDerWaalsContact CZ-C 3.47Å; M389-I412 HydrophobicContact CG-CB 4.31Å; M389-I412 HydrophobicContact CG-CD1 4.08Å; M389-I412 PolarHBondContact N-O 2.88Å; M389-I412 PolarHBondContact O-N 3.48Å
390	S	88.7	Confident	87.9	Confident	34 Å²	34	37.1 Å²	37.1	24%	0.238	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.3	162.1	-62.1	0	0	0	0	108.9	Q409 I410 S411	S390-Q409 PolarHBondContact OG-NE2 3.42Å; S390-I410 CarbonylContact C-O 3.58Å; S390-I410 WeakPolarHBondContact CA-O 3.25Å; S390-I410 WeakPolarHBondContact CB-O 3.32Å; S390-S411 PolarHBondContact OG-OG 3.41Å; S390-S411 VanDerWaalsContact OG-OG 3.14Å
391	S	89	Confident	87.1	Confident	13 Å²	13	40.3 Å²	40.3	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.6	173.6	170.3	0	0	0	0	109.3	D277 R393 A394 I410	D277-S391 PolarHBondContact OD1-OG 2.95Å; S391-R393 PolarHBondContact OG-N 2.65Å; S391-A394 PolarHBondContact OG-N 3.22Å; S391-I410 PolarHBondContact N-O 2Å
392	T	84.6	Confident	85.8	Confident	102 Å²	102	41.2 Å²	41.2	63%	0.626	21%	0.205	S	C	*	.	S	Bend	trans	-93.4	-16.4	175.6	57.9	0	0	0	0	112.4	D277	D277-T392 PolarHBondContact OD1-N 3.23Å; D277-T392 PolarHBondContact OD2-N 2.96Å; D277-T392 PolarHBondContact OD2-OG1 3.03Å
393	R	85.2	Confident	84.4	Confident	85 Å²	85	46.6 Å²	46.6	32%	0.321	23%	0.233	S	C	.	.	S	Bend	trans	-107.6	-0.5	-178.6	-57.5	-169.4	-166.9	-141.1	1.5	114.6	D85 D277 H278 S391 R395	D85-R393 IonicContact OD2-CZ 3.72Å; D85-R393 IonicContact OD2-NH1 3.89Å; D85-R393 IonicContact OD2-NH2 3.71Å; D85-R393 PolarHBondContact OD2-NH2 2.98Å; D277-R393 HydrophobicContact CB-CG 4.02Å; D277-R393 PolarHBondContact O-NE 2.88Å; D277-R393 PolarHBondContact O-NH2 2.8Å; D277-R393 PolarHBondContact OD1-N 2.83Å; H278-R393 PolarHBondContact CD2-NH1 3.07Å; S391-R393 PolarHBondContact OG-N 2.65Å; R393-R395 PolarHBondContact O-N 2.68Å
394	A	87.6	Confident	83.5	Confident	13 Å²	13	50.8 Å²	50.8	11%	0.107	25%	0.252	C	S	.	.			trans	-55.8	134.5	178.8	0	0	0	0	0	111.8	I345 L346 S391 L396 I410	I345-A394 WeakPolarHBondContact O-CA 3.42Å; L346-A394 HydrophobicContact CD2-CB 3.96Å; S391-A394 PolarHBondContact OG-N 3.22Å; A394-L396 PolarHBondContact O-N 3.26Å; A394-I410 HydrophobicContact CB-CB 3.73Å; A394-I410 HydrophobicContact CB-CG1 3.57Å; A394-I410 HydrophobicContact CB-CG2 4.42Å
395	R	88.7	Confident	82.7	Confident	119 Å²	119	51.3 Å²	51.3	45%	0.449	26%	0.257	S	S	.	.			trans	-76.9	70.9	-177.9	-58.8	-179.7	75.7	-151.1	-6.5	111.1	I345 E347 R393 N397 E398	I345-R395 PolarHBondContact O-N 3.42Å; E347-R395 HydrophobicContact CG-CG 4.43Å; E347-R395 WeakPolarHBondContact OE1-CD 3.46Å; R393-R395 PolarHBondContact O-N 2.68Å; R395-N397 PolarHBondContact O-N 2.76Å; R395-E398 HydrophobicContact CB-CG 4.03Å; R395-E398 IonicContact CZ-OE1 2.96Å; R395-E398 IonicContact NE-OE1 3.92Å; R395-E398 IonicContact NH1-OE1 2.63Å; R395-E398 PolarHBondContact NH1-OE1 2.99Å; R395-E398 IonicContact NH1-OE2 3.97Å; R395-E398 IonicContact NH2-OE1 3.07Å; R395-E398 PolarHBondContact NH2-OE1 3.11Å; R395-E398 WeakPolarHBondContact O-CB 3.21Å; R395-E398 PolarHBondContact O-N 3.18Å
396	L	85.8	Confident	82	Confident	24 Å²	24	56 Å²	56	13%	0.126	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-58.7	-32.5	-175.4	-74.5	168.4	0	0	0	113.6	L359 A394 E398 I399 V400 P405 F408 I410	L359-L396 HydrophobicContact CD1-CD2 3.93Å; A394-L396 PolarHBondContact O-N 3.26Å; L396-E398 PolarHBondContact O-N 2.69Å; L396-E398 VanDerWaalsContact O-N 3.08Å; L396-I399 PolarHBondContact O-N 2.85Å; L396-V400 PolarHBondContact O-N 2.63Å; L396-P405 HydrophobicContact CB-CB 4.29Å; L396-F408 WeakPolarHBondContact CD1-O 3.32Å; L396-F408 HydrophobicContact CD2-CB 4.2Å; L396-I410 HydrophobicContact CD2-CD1 4.04Å; L396-I410 HydrophobicContact CD2-CG1 3.79Å
397	N	81.1	Confident	81.4	Confident	120 Å²	120	59.2 Å²	59.2	64%	0.642	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-60.8	-16.9	177.3	-60.7	-3.6	0	0	0	112.8	R395 P405	R395-N397 PolarHBondContact O-N 2.76Å; N397-P405 VanDerWaalsContact OD1-CB 3.3Å; N397-P405 WeakPolarHBondContact OD1-CB 3.45Å; N397-P405 WeakPolarHBondContact OD1-CG 3.4Å
398	E	77	Confident	81.1	Confident	57 Å²	57	58.7 Å²	58.7	27%	0.266	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-87.8	-4	176.6	-58.8	-173.1	148.3	0	0	113.7	K341 R395 L396	K341-E398 WeakPolarHBondContact CE-O 3.34Å; K341-E398 PolarHBondContact NZ-O 3.29Å; R395-E398 HydrophobicContact CB-CG 4.03Å; R395-E398 IonicContact CZ-OE1 2.96Å; R395-E398 IonicContact NE-OE1 3.92Å; R395-E398 IonicContact NH1-OE1 2.63Å; R395-E398 PolarHBondContact NH1-OE1 2.99Å; R395-E398 IonicContact NH1-OE2 3.97Å; R395-E398 IonicContact NH2-OE1 3.07Å; R395-E398 PolarHBondContact NH2-OE1 3.11Å; R395-E398 WeakPolarHBondContact O-CB 3.21Å; R395-E398 PolarHBondContact O-N 3.18Å; L396-E398 PolarHBondContact O-N 2.69Å; L396-E398 VanDerWaalsContact O-N 3.08Å
399	I	76.7	Confident	81	Confident	21 Å²	21	60.7 Å²	60.7	11%	0.108	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-33.9	-177.9	-52.3	166.5	0	0	0	111.2	L337 I345 L359 L396 I410	L337-I399 HydrophobicContact CD1-CD1 4.09Å; I345-I399 HydrophobicContact CB-CD1 4.08Å; I345-I399 HydrophobicContact CD1-CD1 3.39Å; I345-I399 HydrophobicContact CG1-CD1 4.26Å; I345-I399 HydrophobicContact CG2-CD1 3.55Å; I345-I399 HydrophobicContact CG2-CG1 3.64Å; L359-I399 HydrophobicContact CD2-CG2 3.93Å; L396-I399 PolarHBondContact O-N 2.85Å; I399-I410 HydrophobicContact CD1-CD1 3.85Å
400	V	78.2	Confident	81.2	Confident	4 Å²	4	60 Å²	60	2%	0.024	30%	0.3	C	S	.	.			trans	-111.2	96.2	-172.5	-179.5	0	0	0	0	107.6	A124 L359 L396 Q402 F408	A124-V400 HydrophobicContact CB-CG1 4.1Å; A124-V400 HydrophobicContact CB-CG2 4.46Å; L359-V400 HydrophobicContact CD1-CG2 4.18Å; L359-V400 HydrophobicContact CD2-CG2 4.19Å; L396-V400 PolarHBondContact O-N 2.63Å; V400-Q402 HydrophobicContact CG1-CB 3.63Å; V400-Q402 HydrophobicContact CG1-CG 3.72Å; V400-Q402 PolarHBondContact O-N 2.92Å; V400-F408 HydrophobicContact CG1-CD2 3.74Å; V400-F408 HydrophobicContact CG1-CE2 3.74Å; V400-F408 HydrophobicContact CG1-CG 4.48Å; V400-F408 HydrophobicContact CG1-CZ 4.49Å; V400-F408 HydrophobicContact CG2-CB 4.27Å; V400-F408 HydrophobicContact CG2-CD1 4.5Å; V400-F408 HydrophobicContact CG2-CD2 4.11Å; V400-F408 HydrophobicContact CG2-CG 4.04Å
401	D	68.7	Low	81.4	Confident	137 Å²	137	58.4 Å²	58.4	73%	0.733	29%	0.289	S	S	*	.			trans	-72.7	30.5	177.8	-59	-35	0	0	0	113
402	Q	62.4	Low	81.5	Confident	32 Å²	32	57.8 Å²	57.8	15%	0.15	29%	0.285	C	S	.	.	S	Bend	trans	-112	158.4	-166.5	-59.6	-170.9	-12	0	0	112.2	A124 V400 H404 P405	A124-Q402 VanDerWaalsContact C-NE2 3.3Å; A124-Q402 HydrophobicContact CB-CG 4.08Å; A124-Q402 PolarHBondContact O-NE2 2.83Å; V400-Q402 HydrophobicContact CG1-CB 3.63Å; V400-Q402 HydrophobicContact CG1-CG 3.72Å; V400-Q402 PolarHBondContact O-N 2.92Å; Q402-H404 PolarHBondContact O-N 2.72Å; Q402-H404 VanDerWaalsContact O-N 3.09Å; Q402-P405 WeakPolarHBondContact O-CD 3.32Å
403	E	66.3	Low	82	Confident	174 Å²	174	53 Å²	53	81%	0.813	26%	0.255	S	S	*	.	S	Bend	trans	-62.6	-11.8	174.9	-68.9	-175.8	147.4	0	0	114.3
404	H	76.2	Confident	82.4	Confident	89 Å²	89	49 Å²	49	41%	0.412	24%	0.24	S	C	.	.			trans	-135.8	61.7	-176.2	-60.6	-61	0	0	0	113.4	Q402 E406 D407	Q402-H404 PolarHBondContact O-N 2.72Å; Q402-H404 VanDerWaalsContact O-N 3.09Å; H404-E406 WeakPolarHBondContact CA-OE1 3.4Å; H404-E406 VanDerWaalsContact CA-OE2 3.22Å; H404-E406 WeakPolarHBondContact CA-OE2 3.28Å; H404-E406 WeakPolarHBondContact CB-OE1 3.41Å; H404-E406 IonicContact CE1-OE1 3.47Å; H404-E406 IonicContact CG-OE1 2.73Å; H404-E406 IonicContact ND1-OE1 3.93Å; H404-E406 PolarHBondContact ND1-OE1 2.78Å; H404-E406 PolarHBondContact O-N 3.15Å; H404-D407 HydrophobicContact CB-CB 4.45Å; H404-D407 WeakPolarHBondContact O-CB 3.46Å; H404-D407 PolarHBondContact O-N 3.09Å; H404-D407 VanDerWaalsContact O-N 3.11Å
405	P	78.6	Confident	82.8	Confident	23 Å²	23	49.7 Å²	49.7	15%	0.149	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-59.7	-25.1	175.4	28.3	-35.7	0	0	0	112.2	L396 N397 Q402 D407 F408	L396-P405 HydrophobicContact CB-CB 4.29Å; N397-P405 VanDerWaalsContact OD1-CB 3.3Å; N397-P405 WeakPolarHBondContact OD1-CB 3.45Å; N397-P405 WeakPolarHBondContact OD1-CG 3.4Å; Q402-P405 WeakPolarHBondContact O-CD 3.32Å; P405-D407 PolarHBondContact O-N 3.31Å; P405-F408 PolarHBondContact O-N 3.42Å
406	E	80.2	Confident	83.1	Confident	97 Å²	97	44 Å²	44	45%	0.453	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-60.5	-22.3	175.2	68.8	-80.1	-172.6	0	0	113.6	K362 H404 F408	K362-E406 WeakPolarHBondContact CD-O 3.38Å; K362-E406 WeakPolarHBondContact CE-O 3.34Å; K362-E406 PolarHBondContact NZ-O 2.73Å; H404-E406 WeakPolarHBondContact CA-OE1 3.4Å; H404-E406 VanDerWaalsContact CA-OE2 3.22Å; H404-E406 WeakPolarHBondContact CA-OE2 3.28Å; H404-E406 WeakPolarHBondContact CB-OE1 3.41Å; H404-E406 IonicContact CE1-OE1 3.47Å; H404-E406 IonicContact CG-OE1 2.73Å; H404-E406 IonicContact ND1-OE1 3.93Å; H404-E406 PolarHBondContact ND1-OE1 2.78Å; H404-E406 PolarHBondContact O-N 3.15Å; E406-F408 PolarHBondContact O-N 2.78Å
407	D	83.2	Confident	83.5	Confident	68 Å²	68	43.6 Å²	43.6	36%	0.364	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-74.6	-4.7	175.8	-83.2	-0.7	0	0	0	113.1	R361 K362 H404 P405	R361-D407 CarbonylContact C-O 3.51Å; R361-D407 VanDerWaalsContact CA-O 3.27Å; R361-D407 WeakPolarHBondContact CA-O 3.06Å; R361-D407 IonicContact NH2-OD2 3.08Å; K362-D407 PolarHBondContact N-O 3.11Å; H404-D407 HydrophobicContact CB-CB 4.45Å; H404-D407 WeakPolarHBondContact O-CB 3.46Å; H404-D407 PolarHBondContact O-N 3.09Å; H404-D407 VanDerWaalsContact O-N 3.11Å; P405-D407 PolarHBondContact O-N 3.31Å
408	F	86.6	Confident	84	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.013	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	158.7	-177.3	-64.1	-93.1	0	0	0	112	A124 L127 L359 S360 R361 K362 L396 V400 P405 E406	A124-F408 HydrophobicContact CB-CE1 4.42Å; A124-F408 HydrophobicContact CB-CZ 4.06Å; L127-F408 HydrophobicContact CB-CE1 3.94Å; L127-F408 HydrophobicContact CD1-CD1 4.17Å; L127-F408 HydrophobicContact CD1-CE1 3.89Å; L359-F408 HydrophobicContact CD1-CB 3.93Å; L359-F408 HydrophobicContact CD1-CD1 4.2Å; L359-F408 HydrophobicContact CD1-CG 4.41Å; L359-F408 HydrophobicContact CD2-CD1 4.48Å; L359-F408 HydrophobicContact CG-CD1 4.23Å; S360-F408 CarbonylContact O-C 3.52Å; S360-F408 VanDerWaalsContact O-CA 3.32Å; S360-F408 WeakPolarHBondContact O-CA 3.42Å; R361-F408 HydrophobicContact CG-CD1 4.16Å; R361-F408 HydrophobicContact CG-CE1 3.83Å; R361-F408 HydrophobicContact CG-CZ 4.43Å; K362-F408 WeakPolarHBondContact CE-O 3.48Å; L396-F408 WeakPolarHBondContact CD1-O 3.32Å; L396-F408 HydrophobicContact CD2-CB 4.2Å; V400-F408 HydrophobicContact CG1-CD2 3.74Å; V400-F408 HydrophobicContact CG1-CE2 3.74Å; V400-F408 HydrophobicContact CG1-CG 4.48Å; V400-F408 HydrophobicContact CG1-CZ 4.49Å; V400-F408 HydrophobicContact CG2-CB 4.27Å; V400-F408 HydrophobicContact CG2-CD1 4.5Å; V400-F408 HydrophobicContact CG2-CD2 4.11Å; V400-F408 HydrophobicContact CG2-CG 4.04Å; P405-F408 PolarHBondContact O-N 3.42Å; E406-F408 PolarHBondContact O-N 2.78Å
409	Q	88.7	Confident	84.7	Confident	43 Å²	43	38.8 Å²	38.8	20%	0.201	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.1	174.1	63.2	178.5	39.8	0	0	111.1	S360 K362 S390 S411	S360-Q409 PolarHBondContact N-O 3.49Å; S360-Q409 VanDerWaalsContact N-O 3.1Å; S360-Q409 PolarHBondContact O-N 3.2Å; S360-Q409 WeakPolarHBondContact OG-CG 3.45Å; K362-Q409 HydrophobicContact CG-CB 3.92Å; K362-Q409 HydrophobicContact CG-CG 4.26Å; S390-Q409 PolarHBondContact OG-NE2 3.42Å; Q409-S411 PolarHBondContact NE2-OG 3.13Å
410	I	91.6	Very high	85.4	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	126	166.3	-61.3	-55.4	0	0	0	109.1	L337 I345 L346 C357 T358 L359 S390 S391 A394 L396 I399	L337-I410 HydrophobicContact CD1-CD1 3.83Å; I345-I410 HydrophobicContact CD1-CD1 3.87Å; I345-I410 HydrophobicContact CD1-CG1 4.01Å; I345-I410 HydrophobicContact CD1-CG2 4.39Å; L346-I410 HydrophobicContact CD2-CG2 4.14Å; C357-I410 HydrophobicContact CB-CG2 4.14Å; T358-I410 WeakPolarHBondContact O-CA 3.42Å; L359-I410 HydrophobicContact CB-CD1 4.2Å; L359-I410 HydrophobicContact CD1-CD1 3.69Å; S390-I410 CarbonylContact C-O 3.58Å; S390-I410 WeakPolarHBondContact CA-O 3.25Å; S390-I410 WeakPolarHBondContact CB-O 3.32Å; S391-I410 PolarHBondContact N-O 2Å; A394-I410 HydrophobicContact CB-CB 3.73Å; A394-I410 HydrophobicContact CB-CG1 3.57Å; A394-I410 HydrophobicContact CB-CG2 4.42Å; L396-I410 HydrophobicContact CD2-CD1 4.04Å; L396-I410 HydrophobicContact CD2-CG1 3.79Å; I399-I410 HydrophobicContact CD1-CD1 3.85Å
411	S	92.3	Very high	86	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.5	176.8	-67	0	0	0	0	110	C357 T358 S390 Q409 Y413	C357-S411 CarbonylContact C-O 3.54Å; C357-S411 VanDerWaalsContact CA-O 3.26Å; C357-S411 WeakPolarHBondContact CA-O 3.45Å; T358-S411 PolarHBondContact N-O 3.3Å; T358-S411 PolarHBondContact O-N 3.24Å; S390-S411 PolarHBondContact OG-OG 3.41Å; S390-S411 VanDerWaalsContact OG-OG 3.14Å; Q409-S411 PolarHBondContact NE2-OG 3.13Å; S411-Y413 WeakPolarHBondContact O-CE2 3.09Å
412	I	92.8	Very high	87.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.1	-178.4	-62.1	149.1	0	0	0	108.9	H276 M283 L346 E355 M388 M389	H276-I412 WeakPolarHBondContact ND1-CD1 3.25Å; M283-I412 HydrophobicContact CE-CG2 4.23Å; L346-I412 HydrophobicContact CD1-CD1 4.45Å; L346-I412 HydrophobicContact CD1-CG1 4.19Å; L346-I412 HydrophobicContact CD2-CD1 4.38Å; E355-I412 HydrophobicContact CG-CG2 4.43Å; M388-I412 PolarHBondContact N-O 3.19Å; M389-I412 HydrophobicContact CG-CB 4.31Å; M389-I412 HydrophobicContact CG-CD1 4.08Å; M389-I412 PolarHBondContact N-O 2.88Å; M389-I412 PolarHBondContact O-N 3.48Å
413	Y	94.4	Very high	88.5	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.1	-178.1	-57.7	-106.4	0	0	0	109.8	V320 E355 L356 T358 L373 T386 F387 S411 K415	V320-Y413 HydrophobicContact CB-CE1 4.49Å; V320-Y413 HydrophobicContact CG2-CE1 3.94Å; E355-Y413 CarbonylContact C-O 3.54Å; E355-Y413 VanDerWaalsContact CA-O 3.27Å; E355-Y413 WeakPolarHBondContact CA-O 3.46Å; L356-Y413 PolarHBondContact N-O 3.23Å; L356-Y413 PolarHBondContact O-N 2.73Å; T358-Y413 HydrophobicContact CG2-CD2 4.01Å; T358-Y413 HydrophobicContact CG2-CE2 3.46Å; T358-Y413 VanDerWaalsContact CG2-CE2 3.46Å; T358-Y413 VanDerWaalsContact OG1-CE2 3.25Å; T358-Y413 WeakPolarHBondContact OG1-CE2 3.43Å; T358-Y413 PolarHBondContact OG1-OH 3.38Å; L373-Y413 HydrophobicContact CB-CD1 3.59Å; L373-Y413 HydrophobicContact CB-CE1 3.7Å; L373-Y413 HydrophobicContact CB-CG 4.31Å; L373-Y413 HydrophobicContact CD1-CE1 4.38Å; L373-Y413 HydrophobicContact CD2-CD1 4.19Å; L373-Y413 HydrophobicContact CD2-CD2 4.26Å; L373-Y413 HydrophobicContact CD2-CE1 4.47Å; L373-Y413 HydrophobicContact CD2-CG 4.1Å; L373-Y413 HydrophobicContact CG-CD1 4.42Å; L373-Y413 HydrophobicContact CG-CE1 4.41Å; T386-Y413 CarbonylContact O-C 3.58Å; T386-Y413 WeakPolarHBondContact O-CA 3.22Å; T386-Y413 WeakPolarHBondContact O-CB 3.09Å; F387-Y413 HydrophobicContact CB-CD1 3.81Å; F387-Y413 HydrophobicContact CB-CE1 3.63Å; F387-Y413 HydrophobicContact CD2-CD1 4.38Å; F387-Y413 AromaticContact CD2-CE1 3.91Å; F387-Y413 HydrophobicContact CD2-CE1 3.91Å; F387-Y413 HydrophobicContact CD2-CE2 4.37Å; F387-Y413 AromaticContact CD2-CZ 3.91Å; F387-Y413 HydrophobicContact CG-CE1 4.24Å; S411-Y413 WeakPolarHBondContact O-CE2 3.09Å; Y413-K415 PolarHBondContact O-N 3.13Å
414	M	93.7	Very high	89.7	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	119.9	167.5	-170.5	65.9	166.8	0	0	109.1	L272 L285 G385 T386 M388 H419	L272-M414 HydrophobicContact CB-CE 3.98Å; L272-M414 HydrophobicContact CD2-CE 3.62Å; L272-M414 HydrophobicContact CD2-SD 3.77Å; L272-M414 HydrophobicContact CG-CE 4.43Å; L285-M414 HydrophobicContact CD1-CG 4.44Å; L285-M414 HydrophobicContact CD2-CB 3.89Å; L285-M414 HydrophobicContact CD2-CG 3.63Å; L285-M414 HydrophobicContact CG-CG 3.81Å; G385-M414 CarbonylContact C-O 3.56Å; G385-M414 WeakPolarHBondContact CA-O 3.18Å; T386-M414 PolarHBondContact N-O 2.84Å; T386-M414 PolarHBondContact O-N 3.33Å; M388-M414 HydrophobicContact CE-CB 3.66Å; M388-M414 HydrophobicContact CG-CB 4.08Å; M388-M414 HydrophobicContact SD-CB 4.15Å; M414-H419 WeakPolarHBondContact CE-CE1 3.45Å; M414-H419 WeakPolarHBondContact CE-NE2 3.45Å
415	K	94.7	Very high	90.4	Very high	28 Å²	28	39.1 Å²	39.1	12%	0.122	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	132.4	178.6	-168.1	173.4	178.4	173.3	0	109.4	N352 K354 L356 Y413 P418 H419	N352-K415 PolarHBondContact O-NZ 3.2Å; K354-K415 VanDerWaalsContact O-CB 3.3Å; K354-K415 WeakPolarHBondContact O-CB 2.89Å; K354-K415 PolarHBondContact O-N 3.28Å; L356-K415 HydrophobicContact CD1-CB 4.49Å; L356-K415 HydrophobicContact CD1-CG 4.25Å; L356-K415 HydrophobicContact CD2-CD 3.95Å; L356-K415 HydrophobicContact CD2-CG 4.04Å; L356-K415 HydrophobicContact CG-CB 4.02Å; L356-K415 HydrophobicContact CG-CD 4.34Å; L356-K415 HydrophobicContact CG-CG 3.95Å; Y413-K415 PolarHBondContact O-N 3.13Å; K415-P418 HydrophobicContact CB-CG 4.37Å; K415-P418 HydrophobicContact CD-CG 4.24Å; K415-P418 HydrophobicContact CG-CG 4.25Å; K415-H419 PolarHBondContact O-CD2 2.9Å
416	L	95.3	Very high	90.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-84	-37	-173.6	-63.8	-171.2	0	0	0	114.5	L224 L285 I305 Q383 Y384 P418 H419 R420 I423	L224-L416 HydrophobicContact CD2-CD1 3.63Å; L224-L416 HydrophobicContact CD2-CD2 3.82Å; L224-L416 HydrophobicContact CD2-CG 4.4Å; L285-L416 HydrophobicContact CD1-CD2 3.76Å; L285-L416 HydrophobicContact CD2-CD2 3.71Å; L285-L416 HydrophobicContact CG-CD2 4.41Å; I305-L416 HydrophobicContact CB-CD1 4.45Å; I305-L416 HydrophobicContact CG2-CD1 3.85Å; Q383-L416 HydrophobicContact CB-CD1 4.13Å; Q383-L416 HydrophobicContact CG-CD1 3.64Å; Y384-L416 PolarHBondContact O-N 3.33Å; L416-P418 VanDerWaalsContact C-CD 3.46Å; L416-H419 CarbonylContact O-C 3.56Å; L416-H419 WeakPolarHBondContact O-CA 2.95Å; L416-H419 WeakPolarHBondContact O-CB 3.47Å; L416-H419 PolarHBondContact O-N 2.96Å; L416-R420 PolarHBondContact O-N 3.16Å; L416-I423 HydrophobicContact CB-CD1 4.26Å; L416-I423 HydrophobicContact CD2-CD1 4.28Å
417	L	94.2	Very high	91.1	Very high	15 Å²	15	36 Å²	36	8%	0.079	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-52.9	-44.8	-174.9	-177.1	67.9	0	0	0	114.7	E307 E309 H419 R420	E307-L417 VanDerWaalsContact C-CD1 3.44Å; E307-L417 VanDerWaalsContact O-CD1 3.25Å; E307-L417 WeakPolarHBondContact O-CD1 3.13Å; E309-L417 HydrophobicContact CB-CD2 3.77Å; E309-L417 HydrophobicContact CG-CD2 4.4Å; L417-H419 PolarHBondContact O-N 2.82Å; L417-H419 VanDerWaalsContact O-N 3.08Å; L417-R420 WeakPolarHBondContact O-CB 3.49Å; L417-R420 WeakPolarHBondContact O-CG 3.3Å; L417-R420 PolarHBondContact O-N 2.95Å; L417-R420 VanDerWaalsContact O-N 3.08Å
418	P	92.1	Very high	90.8	Very high	64 Å²	64	42.8 Å²	42.8	42%	0.416	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-60.6	-20.1	175.8	-19	30	0	0	0	113.6	N353 K415 L416	N353-P418 WeakPolarHBondContact O-CB 3.21Å; N353-P418 WeakPolarHBondContact O-CG 3.25Å; K415-P418 HydrophobicContact CB-CG 4.37Å; K415-P418 HydrophobicContact CD-CG 4.24Å; K415-P418 HydrophobicContact CG-CG 4.25Å; L416-P418 VanDerWaalsContact C-CD 3.46Å
419	H	91.5	Very high	91	Very high	12 Å²	12	44.8 Å²	44.8	6%	0.056	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-104.8	9.4	-178.3	-56.7	-90.5	0	0	0	112.5	L285 M414 K415 L416 L417 A421 F422 I423	L285-H419 HydrophobicContact CD1-CB 3.6Å; M414-H419 WeakPolarHBondContact CE-CE1 3.45Å; M414-H419 WeakPolarHBondContact CE-NE2 3.45Å; K415-H419 PolarHBondContact O-CD2 2.9Å; L416-H419 CarbonylContact O-C 3.56Å; L416-H419 WeakPolarHBondContact O-CA 2.95Å; L416-H419 WeakPolarHBondContact O-CB 3.47Å; L416-H419 PolarHBondContact O-N 2.96Å; L417-H419 PolarHBondContact O-N 2.82Å; L417-H419 VanDerWaalsContact O-N 3.08Å; H419-A421 VanDerWaalsContact C-N 3.27Å; H419-A421 PolarHBondContact O-N 3.07Å; H419-F422 WeakPolarHBondContact O-CB 3.35Å; H419-F422 PolarHBondContact O-N 2.88Å; H419-I423 HydrophobicContact CB-CD1 4.38Å; H419-I423 WeakPolarHBondContact O-CG1 3.5Å; H419-I423 PolarHBondContact O-N 3.44Å
420	R	91.9	Very high	91.2	Very high	123 Å²	123	44.9 Å²	44.9	46%	0.464	22%	0.218	S	C	.	.	H	α-helix	trans	-51.9	-42.9	-177.2	71.2	-176.3	-179.4	-140.7	-4.4	113.2	L416 L417 F422 I423 Q424	L416-R420 PolarHBondContact O-N 3.16Å; L417-R420 WeakPolarHBondContact O-CB 3.49Å; L417-R420 WeakPolarHBondContact O-CG 3.3Å; L417-R420 PolarHBondContact O-N 2.95Å; L417-R420 VanDerWaalsContact O-N 3.08Å; R420-F422 VanDerWaalsContact C-N 3.34Å; R420-F422 PolarHBondContact O-N 2.69Å; R420-I423 PolarHBondContact O-N 3.03Å; R420-Q424 VanDerWaalsContact O-CB 3.3Å; R420-Q424 WeakPolarHBondContact O-CB 3.14Å; R420-Q424 VanDerWaalsContact O-CG 3.31Å; R420-Q424 WeakPolarHBondContact O-CG 3.19Å; R420-Q424 PolarHBondContact O-N 3.27Å
421	A	91.2	Very high	91.1	Very high	72 Å²	72	47.3 Å²	47.3	60%	0.595	23%	0.23	S	C	*	.	H	α-helix	trans	-65.4	-38.7	-178.6	0	0	0	0	0	111.9	H419 K425	H419-A421 VanDerWaalsContact C-N 3.27Å; H419-A421 PolarHBondContact O-N 3.07Å; A421-K425 WeakPolarHBondContact O-CB 3.45Å; A421-K425 PolarHBondContact O-N 2.84Å; A421-K425 VanDerWaalsContact O-N 3.16Å
422	F	90.7	Very high	91.1	Very high	39 Å²	39	50 Å²	50	17%	0.171	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-45	173.8	166.7	-103.2	0	0	0	110.9	R268 K270 L285 I287 H419 R420	R268-F422 HydrophobicContact CB-CZ 4.35Å; K270-F422 HydrophobicContact CB-CD1 4.1Å; K270-F422 HydrophobicContact CB-CD2 4.25Å; K270-F422 HydrophobicContact CB-CE1 3.93Å; K270-F422 HydrophobicContact CB-CE2 4.09Å; K270-F422 HydrophobicContact CB-CG 4.26Å; K270-F422 HydrophobicContact CB-CZ 3.93Å; K270-F422 HydrophobicContact CD-CB 4.36Å; K270-F422 HydrophobicContact CD-CG 4.3Å; L285-F422 HydrophobicContact CB-CE1 4.32Å; I287-F422 HydrophobicContact CD1-CD1 4.03Å; I287-F422 HydrophobicContact CD1-CE1 3.57Å; I287-F422 HydrophobicContact CD1-CZ 4.1Å; I287-F422 HydrophobicContact CG1-CE1 4.02Å; I287-F422 HydrophobicContact CG1-CZ 4.44Å; H419-F422 WeakPolarHBondContact O-CB 3.35Å; H419-F422 PolarHBondContact O-N 2.88Å; R420-F422 VanDerWaalsContact C-N 3.34Å; R420-F422 PolarHBondContact O-N 2.69Å
423	I	92.8	Very high	91	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-52	-179.4	-58.8	164.5	0	0	0	111.1	L212 L285 I287 I305 L416 H419 R420 K425 Q426 L427	L212-I423 HydrophobicContact CD1-CG2 3.76Å; L285-I423 HydrophobicContact CD1-CD1 4.21Å; I287-I423 HydrophobicContact CD1-CB 4.28Å; I287-I423 HydrophobicContact CD1-CG1 4.17Å; I287-I423 HydrophobicContact CD1-CG2 4.3Å; I305-I423 HydrophobicContact CD1-CB 4.15Å; I305-I423 HydrophobicContact CD1-CD1 4.14Å; I305-I423 HydrophobicContact CD1-CG2 3.86Å; L416-I423 HydrophobicContact CB-CD1 4.26Å; L416-I423 HydrophobicContact CD2-CD1 4.28Å; H419-I423 HydrophobicContact CB-CD1 4.38Å; H419-I423 WeakPolarHBondContact O-CG1 3.5Å; H419-I423 PolarHBondContact O-N 3.44Å; R420-I423 PolarHBondContact O-N 3.03Å; I423-K425 VanDerWaalsContact C-N 3.27Å; I423-K425 PolarHBondContact O-N 3.13Å; I423-Q426 CarbonylContact O-C 3.5Å; I423-Q426 WeakPolarHBondContact O-CA 3.29Å; I423-Q426 WeakPolarHBondContact O-CB 3.5Å; I423-Q426 PolarHBondContact O-N 3.14Å; I423-L427 HydrophobicContact CG2-CD1 4.26Å; I423-L427 HydrophobicContact CG2-CG 4.3Å; I423-L427 PolarHBondContact O-N 3.25Å
424	Q	91.3	Very high	90.7	Very high	72 Å²	72	56.6 Å²	56.6	34%	0.336	27%	0.274	S	S	.	.	H	α-helix	trans	-59	-35.5	-179.4	-74.6	176.4	-20.9	0	0	112.5	E307 R420 Q426 L427	E307-Q424 PolarHBondContact OE1-NE2 2.9Å; R420-Q424 VanDerWaalsContact O-CB 3.3Å; R420-Q424 WeakPolarHBondContact O-CB 3.14Å; R420-Q424 VanDerWaalsContact O-CG 3.31Å; R420-Q424 WeakPolarHBondContact O-CG 3.19Å; R420-Q424 PolarHBondContact O-N 3.27Å; Q424-Q426 PolarHBondContact O-N 3.47Å; Q424-L427 PolarHBondContact O-N 3.42Å
425	K	90.4	Very high	90.5	Very high	158 Å²	158	60.6 Å²	60.6	69%	0.687	29%	0.294	S	S	*	.	H	α-helix	trans	-57.9	-28.3	172.4	-174.9	177.3	179.3	178.5	0	112.3	A421 I423	A421-K425 WeakPolarHBondContact O-CB 3.45Å; A421-K425 PolarHBondContact O-N 2.84Å; A421-K425 VanDerWaalsContact O-N 3.16Å; I423-K425 VanDerWaalsContact C-N 3.27Å; I423-K425 PolarHBondContact O-N 3.13Å
426	Q	88.3	Confident	90.2	Very high	25 Å²	25	63.2 Å²	63.2	12%	0.117	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-1.2	176.3	-46.5	-48.3	-55.8	0	0	113.9	V222 I287 K289 I423 Q424	V222-Q426 WeakPolarHBondContact CG2-O 3.2Å; I287-Q426 HydrophobicContact CB-CG 4.27Å; I287-Q426 HydrophobicContact CD1-CB 3.84Å; I287-Q426 HydrophobicContact CD1-CG 3.51Å; I287-Q426 HydrophobicContact CG1-CG 4.48Å; I287-Q426 HydrophobicContact CG2-CB 3.82Å; I287-Q426 HydrophobicContact CG2-CG 4.05Å; K289-Q426 WeakPolarHBondContact CE-O 3.13Å; K289-Q426 PolarHBondContact NZ-O 3.5Å; I423-Q426 CarbonylContact O-C 3.5Å; I423-Q426 WeakPolarHBondContact O-CA 3.29Å; I423-Q426 WeakPolarHBondContact O-CB 3.5Å; I423-Q426 PolarHBondContact O-N 3.14Å; Q424-Q426 PolarHBondContact O-N 3.47Å
427	L	86.4	Confident	89.8	Confident	29 Å²	29	68.4 Å²	68.4	15%	0.152	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-18.2	175.1	-64.9	-178.6	0	0	0	112.8	L212 V222 I423 Q424	L212-L427 HydrophobicContact CB-CD2 3.88Å; L212-L427 HydrophobicContact CD1-CD2 3.92Å; V222-L427 HydrophobicContact CB-CD2 4.25Å; V222-L427 HydrophobicContact CG1-CD2 3.97Å; V222-L427 HydrophobicContact CG2-CD2 4.39Å; I423-L427 HydrophobicContact CG2-CD1 4.26Å; I423-L427 HydrophobicContact CG2-CG 4.3Å; I423-L427 PolarHBondContact O-N 3.25Å; Q424-L427 PolarHBondContact O-N 3.42Å
428	K	76.7	Confident	89.4	Confident	212 Å²	212	73.3 Å²	73.3	92%	0.922	36%	0.356	S	S	*	.			trans	-70.4	0	161.6	-56.3	-179.1	-176.2	-176.2	0	109.7	K289	K289-K428 PolarHBondContact NZ-OXT 2.74Å; K289-K428 VanDerWaalsContact NZ-OXT 3.09Å

Retrieved 428 of 428 residues in 580.1 ms (Link to these results)

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