A0A3Q0KQT0_SCHMA Loading...

Putative lim domain

AlphaFold DB , UniProt , Accession A0A3Q0KQT0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 412 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	76.3	Confident	86.3	Confident	187 Å²	187	77.4 Å²	77.4	92%	0.921	40%	0.395	S	S	*	.				0	143.3	0	-76	176.8	171.9	0	0	107.6
2	S	88.4	Confident	85.4	Confident	56 Å²	56	72 Å²	72	39%	0.392	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	151.2	169.3	62.7	0	0	0	0	110.4	E82 V83	S2-E82 VanDerWaalsContact CB-OE1 3.3Å; S2-E82 WeakPolarHBondContact CB-OE1 3.35Å; S2-E82 PolarHBondContact OG-OE1 2.64Å; S2-V83 CarbonylContact C-O 3.49Å; S2-V83 WeakPolarHBondContact CA-O 3.45Å; S2-V83 WeakPolarHBondContact CB-O 3.24Å
3	F	91.3	Very high	84.3	Confident	80 Å²	80	70 Å²	70	35%	0.351	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	159.4	175.8	60.2	-85.3	0	0	0	109.9	I5 M50 V83 D85	F3-I5 HydrophobicContact CD2-CD1 4.45Å; F3-I5 HydrophobicContact CD2-CG1 3.9Å; F3-I5 HydrophobicContact CE2-CD1 3.64Å; F3-I5 HydrophobicContact CE2-CG1 3.54Å; F3-I5 HydrophobicContact CZ-CD1 4.3Å; F3-M50 HydrophobicContact CE1-CE 4.25Å; F3-M50 HydrophobicContact CZ-CE 3.62Å; F3-M50 HydrophobicContact CZ-SD 4.1Å; F3-V83 HydrophobicContact CD1-CG2 4.37Å; F3-V83 HydrophobicContact CD2-CG2 4.04Å; F3-V83 HydrophobicContact CE1-CG2 3.99Å; F3-V83 HydrophobicContact CE2-CG2 3.66Å; F3-V83 HydrophobicContact CG-CG2 4.39Å; F3-V83 HydrophobicContact CZ-CG2 3.62Å; F3-V83 PolarHBondContact N-O 3.06Å; F3-V83 PolarHBondContact O-N 3.41Å; F3-D85 HydrophobicContact CE1-CB 4.3Å
4	F	92.8	Very high	83.7	Confident	126 Å²	126	67.2 Å²	67.2	55%	0.553	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	135.8	178.8	-68.6	-85.7	0	0	0	110.9	E80 M81 E82	F4-E80 HydrophobicContact CD1-CG 4.33Å; F4-M81 CarbonylContact C-O 3.41Å; F4-M81 WeakPolarHBondContact CA-O 3.4Å; F4-E82 HydrophobicContact CD1-CB 3.94Å; F4-E82 HydrophobicContact CD1-CG 4.36Å; F4-E82 HydrophobicContact CE1-CB 3.67Å; F4-E82 HydrophobicContact CE1-CG 4.03Å; F4-E82 HydrophobicContact CE2-CG 4.47Å; F4-E82 HydrophobicContact CZ-CB 4.21Å; F4-E82 HydrophobicContact CZ-CG 4.08Å
5	I	91.5	Very high	83.7	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.036	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131	168	-62.9	177.8	0	0	0	107.4	F3 L7 L46 E80 M81 V83	F3-I5 HydrophobicContact CD2-CD1 4.45Å; F3-I5 HydrophobicContact CD2-CG1 3.9Å; F3-I5 HydrophobicContact CE2-CD1 3.64Å; F3-I5 HydrophobicContact CE2-CG1 3.54Å; F3-I5 HydrophobicContact CZ-CD1 4.3Å; I5-L7 HydrophobicContact CG2-CD1 3.61Å; I5-L7 HydrophobicContact CG2-CG 4.21Å; I5-L46 HydrophobicContact CD1-CB 4.19Å; I5-L46 HydrophobicContact CD1-CD1 3.6Å; I5-E80 WeakPolarHBondContact O-CA 3.34Å; I5-M81 PolarHBondContact N-O 3.28Å; I5-M81 PolarHBondContact O-N 2.9Å; I5-V83 HydrophobicContact CD1-CG2 3.59Å; I5-V83 HydrophobicContact CG1-CG2 3.94Å
6	R	92.6	Very high	84.1	Confident	165 Å²	165	62 Å²	62	62%	0.623	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.8	171.5	-172.5	175.7	177.8	-172.8	-0.8	109.1	D78 L79	R6-D78 VanDerWaalsContact CG-OD1 3.31Å; R6-D78 WeakPolarHBondContact CG-OD1 3.33Å; R6-D78 IonicContact CZ-OD1 3.54Å; R6-D78 IonicContact CZ-OD2 3.98Å; R6-D78 IonicContact NE-OD1 3.89Å; R6-D78 PolarHBondContact NE-OD1 3.43Å; R6-D78 IonicContact NE-OD2 2.77Å; R6-D78 PolarHBondContact NE-OD2 3.24Å; R6-D78 IonicContact NH2-OD1 3.14Å; R6-D78 IonicContact NH2-OD2 3.21Å; R6-D78 PolarHBondContact NH2-OD2 3.26Å; R6-L79 CarbonylContact C-O 3.58Å; R6-L79 VanDerWaalsContact CA-O 3.3Å; R6-L79 WeakPolarHBondContact CA-O 3.47Å
7	L	91.6	Very high	84.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.6	174.8	-58	87.1	0	0	0	108.1	I5 W16 F18 L40 A41 D78 L79 M81	I5-L7 HydrophobicContact CG2-CD1 3.61Å; I5-L7 HydrophobicContact CG2-CG 4.21Å; L7-W16 HydrophobicContact CB-CE3 3.63Å; L7-W16 HydrophobicContact CB-CH2 4.49Å; L7-W16 HydrophobicContact CB-CZ3 3.46Å; L7-W16 VanDerWaalsContact CB-CZ3 3.46Å; L7-W16 HydrophobicContact CD2-CE3 3.99Å; L7-W16 HydrophobicContact CG-CE3 4.46Å; L7-W16 WeakPolarHBondContact O-CZ3 3.32Å; L7-F18 HydrophobicContact CD2-CD1 4.5Å; L7-F18 HydrophobicContact CD2-CE1 4.34Å; L7-L40 HydrophobicContact CD2-CB 4.46Å; L7-A41 VanDerWaalsContact CD2-CA 3.49Å; L7-A41 HydrophobicContact CD2-CB 3.86Å; L7-D78 WeakPolarHBondContact O-CA 3.46Å; L7-L79 HydrophobicContact CB-CB 4.41Å; L7-L79 HydrophobicContact CD1-CD2 4.12Å; L7-L79 HydrophobicContact CD1-CG 4.24Å; L7-L79 PolarHBondContact N-O 3.22Å; L7-L79 PolarHBondContact O-N 3.29Å; L7-M81 HydrophobicContact CD1-CE 3.82Å
8	S	89.6	Confident	85	Confident	81 Å²	81	55.8 Å²	55.8	57%	0.566	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.7	172.1	-170.1	0	0	0	0	109.7	N77	S8-N77 WeakPolarHBondContact CA-O 3.44Å
9	R	86.1	Confident	85.3	Confident	6 Å²	6	53.4 Å²	53.4	2%	0.023	29%	0.292	C	S	.	.			trans	-111.7	146.2	176.2	60.7	-176.8	178.5	155.9	8.1	110.5	D11 S12 S14 W16 L40 C76 N77 Q106	R9-D11 VanDerWaalsContact C-N 3.26Å; R9-D11 WeakPolarHBondContact CD-O 3.49Å; R9-D11 VanDerWaalsContact CG-O 3.25Å; R9-D11 WeakPolarHBondContact CG-O 3.46Å; R9-D11 PolarHBondContact O-N 2.94Å; R9-S12 PolarHBondContact NH1-O 2.86Å; R9-S12 PolarHBondContact NH2-O 3.14Å; R9-S14 WeakPolarHBondContact CD-O 3.4Å; R9-S14 PolarHBondContact NH1-O 3.19Å; R9-W16 HydrophobicContact CB-CE3 4.49Å; R9-W16 HydrophobicContact CB-CH2 4.47Å; R9-W16 HydrophobicContact CB-CZ3 4.08Å; R9-W16 HydrophobicContact CG-CE3 4.42Å; R9-W16 HydrophobicContact CG-CH2 3.75Å; R9-W16 HydrophobicContact CG-CZ2 4.19Å; R9-W16 HydrophobicContact CG-CZ3 3.85Å; R9-L40 HydrophobicContact CB-CD1 3.34Å; R9-C76 VanDerWaalsContact CZ-O 3.29Å; R9-C76 PolarHBondContact NE-O 3.38Å; R9-C76 PolarHBondContact NH2-O 3.02Å; R9-N77 HydrophobicContact CG-CB 4.12Å; R9-N77 PolarHBondContact N-O 3.35Å; R9-N77 WeakPolarHBondContact O-CB 3.28Å; R9-Q106 VanDerWaalsContact NH2-CD 3.26Å
10	P	75.2	Confident	85.7	Confident	104 Å²	104	51.6 Å²	51.6	68%	0.675	28%	0.281	S	S	*	.	S	Bend	trans	-65.6	-31.9	-179.2	25	-32.1	0	0	0	112.4
11	D	73.5	Confident	86	Confident	39 Å²	39	55.1 Å²	55.1	21%	0.209	29%	0.29	C	S	.	.	S	Bend	trans	-150.3	168	-175.2	69.7	81.5	0	0	0	111.7	R9 A13 S14 L298	R9-D11 VanDerWaalsContact C-N 3.26Å; R9-D11 WeakPolarHBondContact CD-O 3.49Å; R9-D11 VanDerWaalsContact CG-O 3.25Å; R9-D11 WeakPolarHBondContact CG-O 3.46Å; R9-D11 PolarHBondContact O-N 2.94Å; D11-A13 VanDerWaalsContact C-N 3.35Å; D11-A13 PolarHBondContact O-N 3.46Å; D11-A13 VanDerWaalsContact OD1-CA 3.26Å; D11-A13 WeakPolarHBondContact OD1-CA 3.4Å; D11-A13 VanDerWaalsContact OD1-CB 3.25Å; D11-A13 WeakPolarHBondContact OD1-CB 3.45Å; D11-A13 PolarHBondContact OD1-N 2.98Å; D11-S14 WeakPolarHBondContact O-CB 3.32Å; D11-S14 PolarHBondContact OD1-N 3.43Å; D11-S14 PolarHBondContact OD2-OG 3.48Å; D11-L298 HydrophobicContact CB-CD1 3.74Å; D11-L298 HydrophobicContact CB-CD2 4.15Å
12	S	75.4	Confident	86.8	Confident	13 Å²	13	46.5 Å²	46.5	9%	0.091	25%	0.249	C	C	.	.	S	Bend	trans	-73.9	-19.5	-177.3	51.1	0	0	0	0	115.3	R9 Q106 Y315	R9-S12 PolarHBondContact NH1-O 2.86Å; R9-S12 PolarHBondContact NH2-O 3.14Å; S12-Q106 VanDerWaalsContact CB-OE1 3.27Å; S12-Y315 VanDerWaalsContact CB-OH 3.24Å; S12-Y315 WeakPolarHBondContact CB-OH 3.28Å; S12-Y315 PolarHBondContact OG-OH 3.04Å
13	A	71.1	Confident	87	Confident	46 Å²	46	43.9 Å²	43.9	38%	0.38	23%	0.231	S	C	.	.	S	Bend	trans	-81.8	-30.7	178.3	0	0	0	0	0	111.2	D11 P15	D11-A13 VanDerWaalsContact C-N 3.35Å; D11-A13 PolarHBondContact O-N 3.46Å; D11-A13 VanDerWaalsContact OD1-CA 3.26Å; D11-A13 WeakPolarHBondContact OD1-CA 3.4Å; D11-A13 VanDerWaalsContact OD1-CB 3.25Å; D11-A13 WeakPolarHBondContact OD1-CB 3.45Å; D11-A13 PolarHBondContact OD1-N 2.98Å; A13-P15 WeakPolarHBondContact O-CD 3.2Å; A13-P15 VanDerWaalsContact O-N 3.17Å
14	S	76.9	Confident	87	Confident	31 Å²	31	47.9 Å²	47.9	22%	0.217	24%	0.244	C	C	.	.	S	Bend	trans	-55.4	115.5	172.4	-77	0	0	0	0	110.8	R9 D11	R9-S14 WeakPolarHBondContact CD-O 3.4Å; R9-S14 PolarHBondContact NH1-O 3.19Å; D11-S14 WeakPolarHBondContact O-CB 3.32Å; D11-S14 PolarHBondContact OD1-N 3.43Å; D11-S14 PolarHBondContact OD2-OG 3.48Å
15	P	83.5	Confident	87	Confident	47 Å²	47	46 Å²	46	31%	0.305	24%	0.24	S	C	.	.			trans	-70	144.2	-179.5	28.2	-33.8	0	0	0	110.3	A13 G17 T105 P179	A13-P15 WeakPolarHBondContact O-CD 3.2Å; A13-P15 VanDerWaalsContact O-N 3.17Å; P15-G17 PolarHBondContact O-N 3.46Å; P15-T105 HydrophobicContact CB-CG2 3.93Å; P15-P179 HydrophobicContact CG-CG 4.15Å
16	W	89.1	Confident	87	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.015	26%	0.263	C	S	.	.			trans	-64	-31.5	170.3	-60	113	0	0	0	112.2	L7 R9 F18 L40 A41 C76 L79	L7-W16 HydrophobicContact CB-CE3 3.63Å; L7-W16 HydrophobicContact CB-CH2 4.49Å; L7-W16 HydrophobicContact CB-CZ3 3.46Å; L7-W16 VanDerWaalsContact CB-CZ3 3.46Å; L7-W16 HydrophobicContact CD2-CE3 3.99Å; L7-W16 HydrophobicContact CG-CE3 4.46Å; L7-W16 WeakPolarHBondContact O-CZ3 3.32Å; R9-W16 HydrophobicContact CB-CE3 4.49Å; R9-W16 HydrophobicContact CB-CH2 4.47Å; R9-W16 HydrophobicContact CB-CZ3 4.08Å; R9-W16 HydrophobicContact CG-CE3 4.42Å; R9-W16 HydrophobicContact CG-CH2 3.75Å; R9-W16 HydrophobicContact CG-CZ2 4.19Å; R9-W16 HydrophobicContact CG-CZ3 3.85Å; W16-F18 HydrophobicContact CB-CD1 3.48Å; W16-F18 VanDerWaalsContact CB-CD1 3.48Å; W16-F18 HydrophobicContact CB-CE1 3.36Å; W16-F18 HydrophobicContact CG-CD1 4.45Å; W16-F18 AromaticContact CG-CE1 3.86Å; W16-F18 HydrophobicContact CG-CE1 3.86Å; W16-L40 HydrophobicContact CE3-CD1 4.39Å; W16-A41 VanDerWaalsContact O-CB 3.24Å; W16-A41 WeakPolarHBondContact O-CB 3.38Å; W16-A41 PolarHBondContact O-N 2.94Å; W16-C76 WeakPolarHBondContact CZ2-O 3.26Å; W16-L79 HydrophobicContact CD2-CD2 4.16Å; W16-L79 HydrophobicContact CE3-CB 4.49Å; W16-L79 HydrophobicContact CE3-CD2 4.5Å; W16-L79 HydrophobicContact CH2-CB 3.55Å; W16-L79 HydrophobicContact CZ2-CB 3.72Å; W16-L79 HydrophobicContact CZ2-CD2 4.42Å; W16-L79 HydrophobicContact CZ3-CB 4Å
17	G	90.8	Very high	86.9	Confident	10 Å²	10	51 Å²	51	10%	0.103	27%	0.273	C	S	.	.			trans	78.5	35.1	178.6	0	0	0	0	0	114.5	P15 V35 S36 S39	P15-G17 PolarHBondContact O-N 3.46Å; G17-V35 CarbonylContact O-C 3.52Å; G17-V35 WeakPolarHBondContact O-CA 3.33Å; G17-S36 PolarHBondContact O-N 3.36Å; G17-S39 PolarHBondContact O-OG 3.01Å
18	F	93.5	Very high	86.9	Confident	3 Å²	3	56.2 Å²	56.2	1%	0.013	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158.9	167.9	70.7	-83.2	0	0	0	110.9	L7 W16 I20 I32 S34 V35 A41 L46 I72 L79 M81 I104	L7-F18 HydrophobicContact CD2-CD1 4.5Å; L7-F18 HydrophobicContact CD2-CE1 4.34Å; W16-F18 HydrophobicContact CB-CD1 3.48Å; W16-F18 VanDerWaalsContact CB-CD1 3.48Å; W16-F18 HydrophobicContact CB-CE1 3.36Å; W16-F18 HydrophobicContact CG-CD1 4.45Å; W16-F18 AromaticContact CG-CE1 3.86Å; W16-F18 HydrophobicContact CG-CE1 3.86Å; F18-I20 HydrophobicContact CD2-CG2 3.82Å; F18-I20 HydrophobicContact CE2-CG2 3.53Å; F18-I32 HydrophobicContact CB-CG2 4.4Å; F18-I32 HydrophobicContact CD2-CD1 3.9Å; F18-I32 HydrophobicContact CE2-CD1 4.19Å; F18-S34 CarbonylContact C-O 3.5Å; F18-S34 VanDerWaalsContact CA-O 3.24Å; F18-S34 WeakPolarHBondContact CA-O 3.5Å; F18-S34 WeakPolarHBondContact CB-O 3.46Å; F18-V35 HydrophobicContact CB-CG2 4.23Å; F18-A41 HydrophobicContact CB-CB 3.84Å; F18-A41 HydrophobicContact CD1-CB 3.76Å; F18-A41 HydrophobicContact CG-CB 4.2Å; F18-L46 HydrophobicContact CB-CD2 3.69Å; F18-L46 HydrophobicContact CD1-CD2 3.92Å; F18-L46 HydrophobicContact CD2-CD2 3.86Å; F18-L46 HydrophobicContact CE1-CD2 4.49Å; F18-L46 HydrophobicContact CE2-CD2 4.45Å; F18-L46 HydrophobicContact CG-CD2 3.55Å; F18-I72 HydrophobicContact CE2-CD1 4.11Å; F18-I72 HydrophobicContact CZ-CD1 4.1Å; F18-I72 HydrophobicContact CZ-CG2 4.47Å; F18-L79 HydrophobicContact CE1-CD2 3.83Å; F18-L79 HydrophobicContact CZ-CD2 3.74Å; F18-M81 HydrophobicContact CE1-CE 4.35Å; F18-M81 HydrophobicContact CE2-CE 4.34Å; F18-M81 HydrophobicContact CZ-CE 3.91Å; F18-M81 HydrophobicContact CZ-SD 4.25Å; F18-I104 HydrophobicContact CD2-CD1 4.49Å; F18-I104 HydrophobicContact CE2-CD1 4Å; F18-I104 HydrophobicContact CZ-CD1 4.32Å
19	C	92.1	Very high	87	Confident	10 Å²	10	55.3 Å²	55.3	7%	0.068	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	149.6	169.6	-61.7	0	0	0	0	109.5	I32 S33 S34 M102	C19-I32 WeakPolarHBondContact O-CA 3.38Å; C19-S33 VanDerWaalsContact C-OG 3.28Å; C19-S33 WeakPolarHBondContact CB-OG 3.48Å; C19-S33 PolarHBondContact O-N 2.96Å; C19-S33 PolarHBondContact O-OG 3.14Å; C19-S34 WeakPolarHBondContact CB-OG 3.33Å; C19-S34 PolarHBondContact N-O 3.29Å; C19-S34 PolarHBondContact SG-OG 3.07Å; C19-M102 PolarHBondContact SG-O 3.49Å
20	I	93.4	Very high	87.4	Confident	16 Å²	16	55.4 Å²	55.4	8%	0.082	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	159.2	172.4	64	177.3	0	0	0	110.1	F18 L30 T31 I32 A68 I69 I72 I104	F18-I20 HydrophobicContact CD2-CG2 3.82Å; F18-I20 HydrophobicContact CE2-CG2 3.53Å; I20-L30 HydrophobicContact CD1-CD2 4.07Å; I20-T31 CarbonylContact C-O 3.57Å; I20-T31 VanDerWaalsContact CA-O 3.29Å; I20-T31 WeakPolarHBondContact CA-O 2.97Å; I20-I32 HydrophobicContact CG2-CD1 3.96Å; I20-A68 HydrophobicContact CD1-CB 4.05Å; I20-I69 HydrophobicContact CD1-CG1 4.05Å; I20-I72 HydrophobicContact CD1-CD1 3.85Å; I20-I72 HydrophobicContact CG2-CD1 4.31Å; I20-I104 HydrophobicContact CD1-CD1 4.35Å; I20-I104 HydrophobicContact CG1-CD1 4.16Å; I20-I104 HydrophobicContact CG2-CD1 4.34Å
21	R	91.7	Very high	88.3	Confident	126 Å²	126	51 Å²	51	48%	0.475	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	167	170.1	68.4	177.2	-178.7	176.5	-0.5	110.3	L30 T31	R21-L30 WeakPolarHBondContact O-CA 3.35Å; R21-T31 WeakPolarHBondContact CG-OG1 3.3Å; R21-T31 PolarHBondContact N-O 2.79Å; R21-T31 PolarHBondContact NE-OG1 3Å; R21-T31 VanDerWaalsContact NE-OG1 3.08Å; R21-T31 PolarHBondContact O-N 3.47Å
22	G	92.9	Very high	89.3	Confident	6 Å²	6	49.1 Å²	49.1	6%	0.062	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.4	-166.6	-177.6	0	0	0	0	0	111.9	H65	G22-H65 WeakPolarHBondContact O-CB 3.47Å; G22-H65 PolarHBondContact O-ND1 2.91Å
23	G	92.7	Very high	90.1	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	132.2	160.9	-167.3	0	0	0	0	0	110.1	D25 F26 D27 Q28	G23-D25 PolarHBondContact O-N 3.27Å; G23-F26 CarbonylContact O-C 3.56Å; G23-F26 PolarHBondContact O-N 2.79Å; G23-D27 PolarHBondContact O-N 3.15Å; G23-Q28 CarbonylContact C-O 3.49Å; G23-Q28 PolarHBondContact N-O 2.85Å; G23-Q28 PolarHBondContact O-N 3.29Å; G23-Q28 VanDerWaalsContact O-O 3.08Å
24	R	91	Very high	91.1	Very high	165 Å²	165	49.3 Å²	49.3	62%	0.623	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-59	-34.9	-179.5	-176.8	178.2	-179.9	-167.6	-2.1	113.2	F26 D27 K62 M63	R24-F26 PolarHBondContact O-N 2.84Å; R24-D27 PolarHBondContact O-N 2.85Å; R24-K62 WeakPolarHBondContact CD-O 3.5Å; R24-M63 WeakPolarHBondContact CB-O 3.31Å; R24-M63 PolarHBondContact N-O 2.93Å
25	D	92.4	Very high	91.8	Very high	86 Å²	86	49.3 Å²	49.3	46%	0.46	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-65.3	-19.7	174.9	50.9	-30.9	0	0	0	113.8	G23 T64 H65	G23-D25 PolarHBondContact O-N 3.27Å; D25-T64 HydrophobicContact CB-CG2 4.21Å; D25-T64 VanDerWaalsContact OD1-CA 3.29Å; D25-T64 WeakPolarHBondContact OD1-CA 3.48Å; D25-H65 PolarHBondContact OD1-N 3.32Å; D25-H65 PolarHBondContact OD2-N 3.39Å
26	F	91.5	Very high	92	Very high	120 Å²	120	50.4 Å²	50.4	53%	0.526	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-105.4	3.6	175.3	-64.2	-82.4	0	0	0	113.2	G23 R24 Q28 H65	G23-F26 CarbonylContact O-C 3.56Å; G23-F26 PolarHBondContact O-N 2.79Å; R24-F26 PolarHBondContact O-N 2.84Å; F26-Q28 HydrophobicContact CB-CB 4.44Å; F26-Q28 WeakPolarHBondContact O-CG 3.22Å; F26-Q28 PolarHBondContact O-N 3.35Å; F26-Q28 VanDerWaalsContact O-N 3.12Å; F26-H65 HydrophobicContact CD2-CB 3.96Å; F26-H65 HydrophobicContact CE2-CB 3.55Å
27	D	91.6	Very high	92	Very high	157 Å²	157	57.4 Å²	57.4	84%	0.84	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	36.3	-171.9	-155.3	25.6	0	0	0	113.1	G23 R24	G23-D27 PolarHBondContact O-N 3.15Å; R24-D27 PolarHBondContact O-N 2.85Å
28	Q	90.9	Very high	91.7	Very high	110 Å²	110	59.4 Å²	59.4	51%	0.514	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.9	-178.4	-75.6	-177.9	17.5	0	0	110.5	G23 F26	G23-Q28 CarbonylContact C-O 3.49Å; G23-Q28 PolarHBondContact N-O 2.85Å; G23-Q28 PolarHBondContact O-N 3.29Å; G23-Q28 VanDerWaalsContact O-O 3.08Å; F26-Q28 HydrophobicContact CB-CB 4.44Å; F26-Q28 WeakPolarHBondContact O-CG 3.22Å; F26-Q28 PolarHBondContact O-N 3.35Å; F26-Q28 VanDerWaalsContact O-N 3.12Å
29	P	92.2	Very high	91.6	Very high	62 Å²	62	60.1 Å²	60.1	40%	0.403	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	144.5	174.1	27.9	-34	0	0	0	110.5	T31	P29-T31 PolarHBondContact O-N 3.19Å
30	L	94.3	Very high	91.4	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.037	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	121.8	172.6	-84.1	154.6	0	0	0	109.7	I20 R21 R51 V52 T60 M63 A68	I20-L30 HydrophobicContact CD1-CD2 4.07Å; R21-L30 WeakPolarHBondContact O-CA 3.35Å; L30-R51 CarbonylContact O-C 3.52Å; L30-R51 WeakPolarHBondContact O-CA 3.15Å; L30-V52 HydrophobicContact CB-CB 4.25Å; L30-V52 PolarHBondContact O-N 3.05Å; L30-T60 HydrophobicContact CD1-CG2 4.14Å; L30-M63 HydrophobicContact CD1-CB 4.33Å; L30-A68 HydrophobicContact CD1-CB 3.58Å; L30-A68 HydrophobicContact CD2-CB 3.79Å; L30-A68 HydrophobicContact CG-CB 4.36Å
31	T	94.4	Very high	91.4	Very high	12 Å²	12	61 Å²	61	7%	0.074	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.4	-177.4	49	0	0	0	0	111.3	I20 R21 P29 S33 M50 R51	I20-T31 CarbonylContact C-O 3.57Å; I20-T31 VanDerWaalsContact CA-O 3.29Å; I20-T31 WeakPolarHBondContact CA-O 2.97Å; R21-T31 WeakPolarHBondContact CG-OG1 3.3Å; R21-T31 PolarHBondContact N-O 2.79Å; R21-T31 PolarHBondContact NE-OG1 3Å; R21-T31 VanDerWaalsContact NE-OG1 3.08Å; R21-T31 PolarHBondContact O-N 3.47Å; P29-T31 PolarHBondContact O-N 3.19Å; T31-S33 PolarHBondContact O-N 3Å; T31-M50 CarbonylContact C-O 3.51Å; T31-M50 VanDerWaalsContact CA-O 3.29Å; T31-M50 WeakPolarHBondContact CA-O 3.13Å; T31-R51 HydrophobicContact CG2-CB 4.49Å; T31-R51 HydrophobicContact CG2-CG 3.68Å
32	I	94.3	Very high	91.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	117.1	170.6	-52.2	-52	0	0	0	108.5	F18 C19 I20 V35 L46 R47 G49 M50 V52	F18-I32 HydrophobicContact CB-CG2 4.4Å; F18-I32 HydrophobicContact CD2-CD1 3.9Å; F18-I32 HydrophobicContact CE2-CD1 4.19Å; C19-I32 WeakPolarHBondContact O-CA 3.38Å; I20-I32 HydrophobicContact CG2-CD1 3.96Å; I32-V35 HydrophobicContact CG2-CG2 3.49Å; I32-V35 VanDerWaalsContact CG2-CG2 3.49Å; I32-L46 HydrophobicContact CD1-CD1 4.13Å; I32-L46 HydrophobicContact CD1-CD2 3.83Å; I32-L46 HydrophobicContact CD1-CG 4.26Å; I32-L46 HydrophobicContact CG1-CD1 3.87Å; I32-L46 HydrophobicContact CG1-CD2 4.02Å; I32-L46 HydrophobicContact CG1-CG 3.94Å; I32-L46 HydrophobicContact CG2-CD2 4.14Å; I32-L46 HydrophobicContact CG2-CG 4.29Å; I32-R47 WeakPolarHBondContact CB-O 3.48Å; I32-G49 PolarHBondContact O-N 3.43Å; I32-M50 HydrophobicContact CG1-CB 4.1Å; I32-M50 PolarHBondContact N-O 3.34Å; I32-V52 HydrophobicContact CD1-CG2 3.63Å; I32-V52 HydrophobicContact CG1-CG2 4.34Å
33	S	92.5	Very high	91.3	Very high	22 Å²	22	62.7 Å²	62.7	15%	0.154	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-31.6	-177.9	55.1	0	0	0	0	112.7	C19 T31 T48	C19-S33 VanDerWaalsContact C-OG 3.28Å; C19-S33 WeakPolarHBondContact CB-OG 3.48Å; C19-S33 PolarHBondContact O-N 2.96Å; C19-S33 PolarHBondContact O-OG 3.14Å; T31-S33 PolarHBondContact O-N 3Å; S33-T48 VanDerWaalsContact O-CG2 3.27Å; S33-T48 WeakPolarHBondContact O-CG2 3.34Å
34	S	90.8	Very high	91.2	Very high	41 Å²	41	64.7 Å²	64.7	29%	0.287	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	153.3	175	62.4	0	0	0	0	110.7	F18 C19	F18-S34 CarbonylContact C-O 3.5Å; F18-S34 VanDerWaalsContact CA-O 3.24Å; F18-S34 WeakPolarHBondContact CA-O 3.5Å; F18-S34 WeakPolarHBondContact CB-O 3.46Å; C19-S34 WeakPolarHBondContact CB-OG 3.33Å; C19-S34 PolarHBondContact N-O 3.29Å; C19-S34 PolarHBondContact SG-OG 3.07Å
35	V	92.2	Very high	91.2	Very high	31 Å²	31	58 Å²	58	19%	0.188	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.2	170.8	-177.4	0	0	0	0	107.5	G17 F18 I32 A41 D42 L46	G17-V35 CarbonylContact O-C 3.52Å; G17-V35 WeakPolarHBondContact O-CA 3.33Å; F18-V35 HydrophobicContact CB-CG2 4.23Å; I32-V35 HydrophobicContact CG2-CG2 3.49Å; I32-V35 VanDerWaalsContact CG2-CG2 3.49Å; V35-A41 HydrophobicContact CG1-CB 3.89Å; V35-D42 HydrophobicContact CG1-CB 3.84Å; V35-L46 HydrophobicContact CG2-CB 4.42Å; V35-L46 HydrophobicContact CG2-CD2 4.34Å; V35-L46 HydrophobicContact CG2-CG 4.29Å
36	S	87.8	Confident	91.2	Very high	69 Å²	69	53.9 Å²	53.9	48%	0.483	31%	0.314	S	S	.	.			trans	-76.6	126.5	178.3	-63.7	0	0	0	0	109.9	G17 G38 S39 D42	G17-S36 PolarHBondContact O-N 3.36Å; S36-G38 PolarHBondContact O-N 3.46Å; S36-S39 WeakPolarHBondContact O-CB 3.25Å; S36-S39 PolarHBondContact O-N 3.29Å; S36-S39 VanDerWaalsContact O-N 3.11Å; S36-S39 PolarHBondContact O-OG 3.46Å; S36-D42 WeakPolarHBondContact O-CB 3.19Å
37	L	87.8	Confident	91.2	Very high	151 Å²	151	53.7 Å²	53.7	79%	0.791	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	132	178.3	-172.6	73.7	0	0	0	111	S39 D42	L37-S39 PolarHBondContact O-N 3.04Å; L37-D42 WeakPolarHBondContact CD1-OD2 3.48Å
38	G	85.8	Confident	91.3	Very high	52 Å²	52	50.5 Å²	50.5	54%	0.536	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	3.7	-178.7	0	0	0	0	0	115	S36 D42	S36-G38 PolarHBondContact O-N 3.46Å; G38-D42 PolarHBondContact N-OD2 2.94Å
39	S	90.2	Very high	91.3	Very high	18 Å²	18	46.8 Å²	46.8	13%	0.126	29%	0.288	C	S	.	.	S	Bend	trans	-78.1	169.6	174.1	69.8	0	0	0	0	113	G17 S36 L37 A41 D42 I43	G17-S39 PolarHBondContact O-OG 3.01Å; S36-S39 WeakPolarHBondContact O-CB 3.25Å; S36-S39 PolarHBondContact O-N 3.29Å; S36-S39 VanDerWaalsContact O-N 3.11Å; S36-S39 PolarHBondContact O-OG 3.46Å; L37-S39 PolarHBondContact O-N 3.04Å; S39-A41 PolarHBondContact O-N 3.21Å; S39-A41 PolarHBondContact OG-N 2.89Å; S39-D42 PolarHBondContact O-N 2.71Å; S39-D42 VanDerWaalsContact O-N 3.15Å; S39-D42 PolarHBondContact OG-N 3.23Å; S39-I43 WeakPolarHBondContact O-CD1 3.36Å; S39-I43 VanDerWaalsContact O-CG1 3.26Å; S39-I43 WeakPolarHBondContact O-CG1 3.38Å; S39-I43 PolarHBondContact O-N 2.88Å
40	L	88.6	Confident	91.4	Very high	45 Å²	45	44.1 Å²	44.1	24%	0.236	27%	0.27	C	S	.	.	H	α-helix	trans	-55.7	-39.3	173.8	-67.9	172.5	0	0	0	112.1	L7 R9 W16 S44	L7-L40 HydrophobicContact CD2-CB 4.46Å; R9-L40 HydrophobicContact CB-CD1 3.34Å; W16-L40 HydrophobicContact CE3-CD1 4.39Å; L40-S44 WeakPolarHBondContact O-CB 3.3Å; L40-S44 PolarHBondContact O-N 3.07Å; L40-S44 PolarHBondContact O-OG 3.21Å
41	A	93.1	Very high	91.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-43.6	176.9	0	0	0	0	0	112.9	L7 W16 F18 V35 S39 S44 G45 L46	L7-A41 VanDerWaalsContact CD2-CA 3.49Å; L7-A41 HydrophobicContact CD2-CB 3.86Å; W16-A41 VanDerWaalsContact O-CB 3.24Å; W16-A41 WeakPolarHBondContact O-CB 3.38Å; W16-A41 PolarHBondContact O-N 2.94Å; F18-A41 HydrophobicContact CB-CB 3.84Å; F18-A41 HydrophobicContact CD1-CB 3.76Å; F18-A41 HydrophobicContact CG-CB 4.2Å; V35-A41 HydrophobicContact CG1-CB 3.89Å; S39-A41 PolarHBondContact O-N 3.21Å; S39-A41 PolarHBondContact OG-N 2.89Å; A41-S44 PolarHBondContact O-N 3.23Å; A41-G45 PolarHBondContact O-N 3.28Å; A41-L46 HydrophobicContact CB-CB 4.1Å; A41-L46 HydrophobicContact CB-CD2 3.89Å; A41-L46 WeakPolarHBondContact O-CB 3.36Å; A41-L46 PolarHBondContact O-N 3.19Å
42	D	92.5	Very high	91.5	Very high	38 Å²	38	48.5 Å²	48.5	20%	0.203	29%	0.285	C	S	.	.	H	α-helix	trans	-62.8	-48.2	177.5	-177.1	28.9	0	0	0	111.6	V35 S36 L37 G38 S39 S44 G45 R47	V35-D42 HydrophobicContact CG1-CB 3.84Å; S36-D42 WeakPolarHBondContact O-CB 3.19Å; L37-D42 WeakPolarHBondContact CD1-OD2 3.48Å; G38-D42 PolarHBondContact N-OD2 2.94Å; S39-D42 PolarHBondContact O-N 2.71Å; S39-D42 VanDerWaalsContact O-N 3.15Å; S39-D42 PolarHBondContact OG-N 3.23Å; D42-S44 VanDerWaalsContact C-N 3.28Å; D42-S44 PolarHBondContact O-N 2.79Å; D42-G45 PolarHBondContact O-N 2.84Å; D42-R47 PolarHBondContact O-NH1 3.43Å; D42-R47 IonicContact OD1-CZ 3.33Å; D42-R47 IonicContact OD1-NH1 2.7Å; D42-R47 PolarHBondContact OD1-NH1 2.88Å
43	I	89.8	Confident	91.5	Very high	130 Å²	130	51.7 Å²	51.7	67%	0.667	30%	0.302	S	S	*	.	H	α-helix	trans	-63.5	-34.6	179.1	-62.6	163.4	0	0	0	111.2	S39 G45	S39-I43 WeakPolarHBondContact O-CD1 3.36Å; S39-I43 VanDerWaalsContact O-CG1 3.26Å; S39-I43 WeakPolarHBondContact O-CG1 3.38Å; S39-I43 PolarHBondContact O-N 2.88Å; I43-G45 PolarHBondContact O-N 2.89Å
44	S	91.5	Very high	91.6	Very high	42 Å²	42	51 Å²	51	29%	0.294	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	1	177.4	-52.9	0	0	0	0	113.4	L40 A41 D42	L40-S44 WeakPolarHBondContact O-CB 3.3Å; L40-S44 PolarHBondContact O-N 3.07Å; L40-S44 PolarHBondContact O-OG 3.21Å; A41-S44 PolarHBondContact O-N 3.23Å; D42-S44 VanDerWaalsContact C-N 3.28Å; D42-S44 PolarHBondContact O-N 2.79Å
45	G	90.7	Very high	91.7	Very high	24 Å²	24	49.2 Å²	49.2	25%	0.247	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	9.9	176.1	0	0	0	0	0	115	A41 D42 I43	A41-G45 PolarHBondContact O-N 3.28Å; D42-G45 PolarHBondContact O-N 2.84Å; I43-G45 PolarHBondContact O-N 2.89Å
46	L	92.7	Very high	91.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.293	C	S	.	.			trans	-69.8	138.3	175.3	-160.8	70.1	0	0	0	109.6	I5 F18 I32 V35 A41 M50 M81 V83	I5-L46 HydrophobicContact CD1-CB 4.19Å; I5-L46 HydrophobicContact CD1-CD1 3.6Å; F18-L46 HydrophobicContact CB-CD2 3.69Å; F18-L46 HydrophobicContact CD1-CD2 3.92Å; F18-L46 HydrophobicContact CD2-CD2 3.86Å; F18-L46 HydrophobicContact CE1-CD2 4.49Å; F18-L46 HydrophobicContact CE2-CD2 4.45Å; F18-L46 HydrophobicContact CG-CD2 3.55Å; I32-L46 HydrophobicContact CD1-CD1 4.13Å; I32-L46 HydrophobicContact CD1-CD2 3.83Å; I32-L46 HydrophobicContact CD1-CG 4.26Å; I32-L46 HydrophobicContact CG1-CD1 3.87Å; I32-L46 HydrophobicContact CG1-CD2 4.02Å; I32-L46 HydrophobicContact CG1-CG 3.94Å; I32-L46 HydrophobicContact CG2-CD2 4.14Å; I32-L46 HydrophobicContact CG2-CG 4.29Å; V35-L46 HydrophobicContact CG2-CB 4.42Å; V35-L46 HydrophobicContact CG2-CD2 4.34Å; V35-L46 HydrophobicContact CG2-CG 4.29Å; A41-L46 HydrophobicContact CB-CB 4.1Å; A41-L46 HydrophobicContact CB-CD2 3.89Å; A41-L46 WeakPolarHBondContact O-CB 3.36Å; A41-L46 PolarHBondContact O-N 3.19Å; L46-M50 HydrophobicContact CD1-SD 4.25Å; L46-M81 HydrophobicContact CD1-CE 4.34Å; L46-M81 HydrophobicContact CD2-CE 4.37Å; L46-V83 HydrophobicContact CD1-CG1 4.02Å
47	R	92.2	Very high	91.3	Very high	117 Å²	117	56.3 Å²	56.3	44%	0.442	31%	0.305	S	S	.	.			trans	-130.6	150.2	178.8	-56.3	-67	177.1	-105.6	6.3	110.8	I32 D42 G49 M50	I32-R47 WeakPolarHBondContact CB-O 3.48Å; D42-R47 PolarHBondContact O-NH1 3.43Å; D42-R47 IonicContact OD1-CZ 3.33Å; D42-R47 IonicContact OD1-NH1 2.7Å; D42-R47 PolarHBondContact OD1-NH1 2.88Å; R47-G49 PolarHBondContact O-N 3.15Å; R47-M50 HydrophobicContact CB-CE 3.73Å; R47-M50 HydrophobicContact CB-CG 4.24Å; R47-M50 HydrophobicContact CB-SD 4.02Å; R47-M50 HydrophobicContact CG-CE 3.68Å; R47-M50 HydrophobicContact CG-SD 4.45Å; R47-M50 PolarHBondContact N-SD 3.07Å; R47-M50 WeakPolarHBondContact O-CB 3.3Å; R47-M50 WeakPolarHBondContact O-CG 3.47Å; R47-M50 PolarHBondContact O-N 3.49Å
48	T	92.2	Very high	91.4	Very high	89 Å²	89	52.3 Å²	52.3	55%	0.546	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	137.3	170.2	-56.7	0	0	0	0	110.3	S33	S33-T48 VanDerWaalsContact O-CG2 3.27Å; S33-T48 WeakPolarHBondContact O-CG2 3.34Å
49	G	91.7	Very high	91.8	Very high	32 Å²	32	53.6 Å²	53.6	33%	0.33	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	-14.6	-180	0	0	0	0	0	114.9	I32 R47 R51	I32-G49 PolarHBondContact O-N 3.43Å; R47-G49 PolarHBondContact O-N 3.15Å; G49-R51 PolarHBondContact O-N 3.18Å
50	M	94.4	Very high	92	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.03	28%	0.281	C	S	.	.			trans	-61	135.5	173.6	-71.6	-179.5	170.8	0	0	110.8	F3 T31 I32 L46 R47 V83 D85	F3-M50 HydrophobicContact CE1-CE 4.25Å; F3-M50 HydrophobicContact CZ-CE 3.62Å; F3-M50 HydrophobicContact CZ-SD 4.1Å; T31-M50 CarbonylContact C-O 3.51Å; T31-M50 VanDerWaalsContact CA-O 3.29Å; T31-M50 WeakPolarHBondContact CA-O 3.13Å; I32-M50 HydrophobicContact CG1-CB 4.1Å; I32-M50 PolarHBondContact N-O 3.34Å; L46-M50 HydrophobicContact CD1-SD 4.25Å; R47-M50 HydrophobicContact CB-CE 3.73Å; R47-M50 HydrophobicContact CB-CG 4.24Å; R47-M50 HydrophobicContact CB-SD 4.02Å; R47-M50 HydrophobicContact CG-CE 3.68Å; R47-M50 HydrophobicContact CG-SD 4.45Å; R47-M50 PolarHBondContact N-SD 3.07Å; R47-M50 WeakPolarHBondContact O-CB 3.3Å; R47-M50 WeakPolarHBondContact O-CG 3.47Å; R47-M50 PolarHBondContact O-N 3.49Å; M50-V83 HydrophobicContact CB-CB 4.41Å; M50-V83 HydrophobicContact SD-CG2 4.12Å; M50-D85 HydrophobicContact CE-CB 4.16Å; M50-D85 HydrophobicContact CG-CB 4.41Å
51	R	94.6	Very high	92.1	Very high	105 Å²	105	56.8 Å²	56.8	40%	0.396	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	131.2	175.3	-74.3	178.1	172.5	-164.1	-0.6	109.5	L30 T31 G49 V83 Y84 N86	L30-R51 CarbonylContact O-C 3.52Å; L30-R51 WeakPolarHBondContact O-CA 3.15Å; T31-R51 HydrophobicContact CG2-CB 4.49Å; T31-R51 HydrophobicContact CG2-CG 3.68Å; G49-R51 PolarHBondContact O-N 3.18Å; R51-V83 CarbonylContact O-C 3.6Å; R51-V83 WeakPolarHBondContact O-CA 3.48Å; R51-Y84 PolarHBondContact N-O 3.06Å; R51-Y84 PolarHBondContact O-N 2.93Å; R51-N86 PolarHBondContact NE-ND2 3.04Å; R51-N86 VanDerWaalsContact NE-ND2 3.15Å
52	V	95.1	Very high	91.9	Very high	6 Å²	6	63.6 Å²	63.6	4%	0.036	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.3	177.3	-171.8	0	0	0	0	108.6	L30 I32 I55 T60 M81	L30-V52 HydrophobicContact CB-CB 4.25Å; L30-V52 PolarHBondContact O-N 3.05Å; I32-V52 HydrophobicContact CD1-CG2 3.63Å; I32-V52 HydrophobicContact CG1-CG2 4.34Å; V52-I55 HydrophobicContact CG1-CD1 4.29Å; V52-I55 HydrophobicContact CG1-CG1 3.77Å; V52-T60 HydrophobicContact CG1-CG2 3.95Å; V52-T60 PolarHBondContact O-OG1 3.14Å; V52-M81 HydrophobicContact CG1-SD 4.24Å
53	L	94.4	Very high	91.9	Very high	67 Å²	67	62.8 Å²	62.8	35%	0.351	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-37.2	-178.2	-58.8	-175.8	0	0	0	112.7	T60 E82	L53-T60 PolarHBondContact O-N 3.41Å; L53-T60 PolarHBondContact O-OG1 2.77Å; L53-E82 HydrophobicContact CB-CB 4.27Å; L53-E82 HydrophobicContact CB-CG 4.32Å; L53-E82 HydrophobicContact CD1-CG 4.28Å; L53-E82 PolarHBondContact N-O 2.8Å
54	S	94.8	Very high	92.1	Very high	9 Å²	9	58.4 Å²	58.4	6%	0.063	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	151.7	175	69.1	0	0	0	0	111.8	D58 M81 E82	S54-D58 CarbonylContact C-O 3.59Å; S54-D58 WeakPolarHBondContact CA-O 3.48Å; S54-D58 WeakPolarHBondContact CB-O 2.98Å; S54-M81 VanDerWaalsContact O-CA 3.28Å; S54-M81 WeakPolarHBondContact O-CA 2.88Å; S54-E82 PolarHBondContact N-O 3.04Å; S54-E82 PolarHBondContact O-N 2.88Å; S54-E82 WeakPolarHBondContact OG-CB 3.33Å
55	I	93.3	Very high	92.1	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119.3	173.9	-60.8	161.4	0	0	0	107	V52 R57 D58 T60 A68 A71 I72 L79 M81	V52-I55 HydrophobicContact CG1-CD1 4.29Å; V52-I55 HydrophobicContact CG1-CG1 3.77Å; I55-R57 PolarHBondContact O-N 2.79Å; I55-D58 PolarHBondContact N-O 3.3Å; I55-D58 WeakPolarHBondContact O-CB 2.93Å; I55-D58 PolarHBondContact O-N 2.66Å; I55-T60 HydrophobicContact CD1-CG2 3.84Å; I55-T60 HydrophobicContact CG1-CG2 3.86Å; I55-A68 HydrophobicContact CD1-CB 4.04Å; I55-A71 HydrophobicContact CB-CB 4.19Å; I55-A71 HydrophobicContact CD1-CB 4.28Å; I55-A71 HydrophobicContact CG2-CB 3.83Å; I55-I72 HydrophobicContact CD1-CD1 4.35Å; I55-I72 HydrophobicContact CD1-CG1 4.05Å; I55-I72 HydrophobicContact CG2-CG1 4.07Å; I55-L79 HydrophobicContact CG2-CD1 3.97Å; I55-M81 HydrophobicContact CG1-CG 4.23Å; I55-M81 HydrophobicContact CG1-SD 4.41Å
56	S	86.4	Confident	91.9	Very high	51 Å²	51	61.3 Å²	61.3	36%	0.357	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	41.7	-173.7	-72	0	0	0	0	113.5	D58 C75 E80	S56-D58 PolarHBondContact O-N 2.87Å; S56-C75 PolarHBondContact OG-SG 2.84Å; S56-E80 PolarHBondContact N-O 3.23Å
57	R	85.2	Confident	91.8	Very high	197 Å²	197	65.5 Å²	65.5	74%	0.743	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-3.9	-177.2	-48.1	172.8	-178.5	-169.9	-3.2	115.4	I55 P59 E80	I55-R57 PolarHBondContact O-N 2.79Å; R57-P59 WeakPolarHBondContact O-CD 3.05Å; R57-E80 IonicContact NE-OE2 3.75Å
58	D	90.7	Very high	91.8	Very high	68 Å²	68	60 Å²	60	36%	0.364	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.5	171.2	-68.4	-27.5	0	0	0	109.1	S54 I55 S56 M63 R74	S54-D58 CarbonylContact C-O 3.59Å; S54-D58 WeakPolarHBondContact CA-O 3.48Å; S54-D58 WeakPolarHBondContact CB-O 2.98Å; I55-D58 PolarHBondContact N-O 3.3Å; I55-D58 WeakPolarHBondContact O-CB 2.93Å; I55-D58 PolarHBondContact O-N 2.66Å; S56-D58 PolarHBondContact O-N 2.87Å; D58-M63 HydrophobicContact CB-CE 3.31Å; D58-R74 IonicContact OD2-NH1 3.95Å
59	P	93.4	Very high	91.6	Very high	79 Å²	79	57.1 Å²	57.1	51%	0.513	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	136.8	179.9	26.8	-33.8	0	0	0	111.4	R57	R57-P59 WeakPolarHBondContact O-CD 3.05Å
60	T	94.3	Very high	91.2	Very high	12 Å²	12	60.3 Å²	60.3	7%	0.074	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-85.2	-10.9	-174.2	59.6	0	0	0	0	114.1	L30 V52 L53 I55 K62 M63	L30-T60 HydrophobicContact CD1-CG2 4.14Å; V52-T60 HydrophobicContact CG1-CG2 3.95Å; V52-T60 PolarHBondContact O-OG1 3.14Å; L53-T60 PolarHBondContact O-N 3.41Å; L53-T60 PolarHBondContact O-OG1 2.77Å; I55-T60 HydrophobicContact CD1-CG2 3.84Å; I55-T60 HydrophobicContact CG1-CG2 3.86Å; T60-K62 PolarHBondContact O-N 2.84Å; T60-M63 HydrophobicContact CG2-SD 4.25Å; T60-M63 WeakPolarHBondContact O-CB 3.37Å; T60-M63 PolarHBondContact O-N 2.77Å
61	N	90.6	Very high	90.9	Very high	118 Å²	118	60.2 Å²	60.2	63%	0.631	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-55.3	-28.1	-173.5	64.9	-18.2	0	0	0	114.7
62	K	90.3	Very high	90.7	Very high	143 Å²	143	55.2 Å²	55.2	62%	0.622	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-107.9	-1.4	178.4	-67.6	-177.8	-178.1	178.5	0	113.6	R24 T60	R24-K62 WeakPolarHBondContact CD-O 3.5Å; T60-K62 PolarHBondContact O-N 2.84Å
63	M	91.9	Very high	90	Very high	20 Å²	20	57.4 Å²	57.4	10%	0.099	29%	0.285	C	S	.	.			trans	-79.6	134.3	-175.8	-66.3	-171.6	178.5	0	0	111.4	R24 L30 D58 T60 Q67 A71	R24-M63 WeakPolarHBondContact CB-O 3.31Å; R24-M63 PolarHBondContact N-O 2.93Å; L30-M63 HydrophobicContact CD1-CB 4.33Å; D58-M63 HydrophobicContact CB-CE 3.31Å; T60-M63 HydrophobicContact CG2-SD 4.25Å; T60-M63 WeakPolarHBondContact O-CB 3.37Å; T60-M63 PolarHBondContact O-N 2.77Å; M63-Q67 HydrophobicContact CB-CB 4.18Å; M63-A71 HydrophobicContact SD-CB 4.43Å
64	T	93.9	Very high	89.5	Confident	39 Å²	39	60.6 Å²	60.6	24%	0.239	29%	0.293	C	S	.	.			trans	-69.9	163.6	162.8	67.7	0	0	0	0	110.5	D25 Q66 Q67 A68	D25-T64 HydrophobicContact CB-CG2 4.21Å; D25-T64 VanDerWaalsContact OD1-CA 3.29Å; D25-T64 WeakPolarHBondContact OD1-CA 3.48Å; T64-Q66 VanDerWaalsContact C-N 3.26Å; T64-Q66 PolarHBondContact O-N 2.77Å; T64-Q67 PolarHBondContact O-N 2.88Å; T64-Q67 VanDerWaalsContact O-N 3.12Å; T64-Q67 WeakPolarHBondContact OG1-CB 3.38Å; T64-Q67 VanDerWaalsContact OG1-CG 3.26Å; T64-Q67 WeakPolarHBondContact OG1-CG 2.86Å; T64-Q67 PolarHBondContact OG1-N 3.45Å; T64-A68 PolarHBondContact O-N 2.64Å
65	H	90.5	Very high	88.9	Confident	41 Å²	41	60.9 Å²	60.9	19%	0.19	29%	0.294	C	S	.	.	H	α-helix	trans	-54.1	-45.7	175.7	-170.8	81.9	0	0	0	111.6	G22 D25 F26 Q67 A68 I69	G22-H65 WeakPolarHBondContact O-CB 3.47Å; G22-H65 PolarHBondContact O-ND1 2.91Å; D25-H65 PolarHBondContact OD1-N 3.32Å; D25-H65 PolarHBondContact OD2-N 3.39Å; F26-H65 HydrophobicContact CD2-CB 3.96Å; F26-H65 HydrophobicContact CE2-CB 3.55Å; H65-Q67 PolarHBondContact O-N 2.77Å; H65-A68 WeakPolarHBondContact O-CB 3.38Å; H65-A68 PolarHBondContact O-N 3.2Å; H65-I69 WeakPolarHBondContact O-CG1 2.89Å; H65-I69 PolarHBondContact O-N 3.14Å
66	Q	86.5	Confident	88.4	Confident	85 Å²	85	62.4 Å²	62.4	40%	0.397	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-38.6	178.1	-173.7	68.2	-21.2	0	0	112.5	T64 A68 I69 Q70	T64-Q66 VanDerWaalsContact C-N 3.26Å; T64-Q66 PolarHBondContact O-N 2.77Å; Q66-A68 VanDerWaalsContact C-N 3.31Å; Q66-A68 PolarHBondContact O-N 3.04Å; Q66-I69 PolarHBondContact O-N 2.77Å; Q66-Q70 WeakPolarHBondContact O-CB 3.3Å; Q66-Q70 VanDerWaalsContact O-CG 3.3Å; Q66-Q70 WeakPolarHBondContact O-CG 3.48Å; Q66-Q70 PolarHBondContact O-N 3.24Å
67	Q	91.3	Very high	88.4	Confident	89 Å²	89	62.3 Å²	62.3	42%	0.416	30%	0.3	S	S	.	.	H	α-helix	trans	-64.6	-36.7	175.2	-75.4	171.5	-19.4	0	0	111.8	M63 T64 H65 Q70 A71	M63-Q67 HydrophobicContact CB-CB 4.18Å; T64-Q67 PolarHBondContact O-N 2.88Å; T64-Q67 VanDerWaalsContact O-N 3.12Å; T64-Q67 WeakPolarHBondContact OG1-CB 3.38Å; T64-Q67 VanDerWaalsContact OG1-CG 3.26Å; T64-Q67 WeakPolarHBondContact OG1-CG 2.86Å; T64-Q67 PolarHBondContact OG1-N 3.45Å; H65-Q67 PolarHBondContact O-N 2.77Å; Q67-Q70 PolarHBondContact O-N 3.34Å; Q67-A71 WeakPolarHBondContact O-CB 3.28Å; Q67-A71 PolarHBondContact O-N 3.01Å
68	A	91.6	Very high	88.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.8	-44.1	174.9	0	0	0	0	0	111.9	I20 L30 I55 T64 H65 Q66 Q70 A71 I72	I20-A68 HydrophobicContact CD1-CB 4.05Å; L30-A68 HydrophobicContact CD1-CB 3.58Å; L30-A68 HydrophobicContact CD2-CB 3.79Å; L30-A68 HydrophobicContact CG-CB 4.36Å; I55-A68 HydrophobicContact CD1-CB 4.04Å; T64-A68 PolarHBondContact O-N 2.64Å; H65-A68 WeakPolarHBondContact O-CB 3.38Å; H65-A68 PolarHBondContact O-N 3.2Å; Q66-A68 VanDerWaalsContact C-N 3.31Å; Q66-A68 PolarHBondContact O-N 3.04Å; A68-Q70 VanDerWaalsContact C-N 3.34Å; A68-Q70 PolarHBondContact O-N 2.87Å; A68-A71 WeakPolarHBondContact O-CB 3.38Å; A68-A71 PolarHBondContact O-N 3.23Å; A68-I72 WeakPolarHBondContact O-CG1 3.2Å; A68-I72 PolarHBondContact O-N 2.8Å
69	I	88.6	Confident	88.5	Confident	30 Å²	30	52.6 Å²	52.6	15%	0.154	26%	0.263	C	S	.	.	H	α-helix	trans	-57.9	-47.8	172.7	-68.4	174.5	0	0	0	110.3	I20 H65 Q66 A71 I72 I73	I20-I69 HydrophobicContact CD1-CG1 4.05Å; H65-I69 WeakPolarHBondContact O-CG1 2.89Å; H65-I69 PolarHBondContact O-N 3.14Å; Q66-I69 PolarHBondContact O-N 2.77Å; I69-A71 VanDerWaalsContact C-N 3.3Å; I69-A71 PolarHBondContact O-N 3.23Å; I69-I72 PolarHBondContact O-N 3.42Å; I69-I73 HydrophobicContact CG2-CD1 3.66Å; I69-I73 HydrophobicContact CG2-CG1 4.34Å; I69-I73 VanDerWaalsContact O-CG1 3.3Å; I69-I73 WeakPolarHBondContact O-CG1 3.41Å; I69-I73 PolarHBondContact O-N 3.23Å
70	Q	83.6	Confident	88.5	Confident	98 Å²	98	51.6 Å²	51.6	46%	0.458	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-36.2	177.1	-73.1	176	-8.2	0	0	112.5	Q66 Q67 A68 I73 R74	Q66-Q70 WeakPolarHBondContact O-CB 3.3Å; Q66-Q70 VanDerWaalsContact O-CG 3.3Å; Q66-Q70 WeakPolarHBondContact O-CG 3.48Å; Q66-Q70 PolarHBondContact O-N 3.24Å; Q67-Q70 PolarHBondContact O-N 3.34Å; A68-Q70 VanDerWaalsContact C-N 3.34Å; A68-Q70 PolarHBondContact O-N 2.87Å; Q70-I73 PolarHBondContact O-N 2.95Å; Q70-R74 WeakPolarHBondContact O-CB 3.21Å; Q70-R74 VanDerWaalsContact O-CG 3.24Å; Q70-R74 WeakPolarHBondContact O-CG 3.31Å; Q70-R74 PolarHBondContact O-N 3Å; Q70-R74 PolarHBondContact O-NE 3.01Å
71	A	88.3	Confident	88.4	Confident	4 Å²	4	51 Å²	51	3%	0.033	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-46.8	173.9	0	0	0	0	0	111.4	I55 M63 Q67 A68 I69 I73 R74 C75	I55-A71 HydrophobicContact CB-CB 4.19Å; I55-A71 HydrophobicContact CD1-CB 4.28Å; I55-A71 HydrophobicContact CG2-CB 3.83Å; M63-A71 HydrophobicContact SD-CB 4.43Å; Q67-A71 WeakPolarHBondContact O-CB 3.28Å; Q67-A71 PolarHBondContact O-N 3.01Å; A68-A71 WeakPolarHBondContact O-CB 3.38Å; A68-A71 PolarHBondContact O-N 3.23Å; I69-A71 VanDerWaalsContact C-N 3.3Å; I69-A71 PolarHBondContact O-N 3.23Å; A71-I73 VanDerWaalsContact C-N 3.35Å; A71-I73 PolarHBondContact O-N 2.69Å; A71-R74 WeakPolarHBondContact O-CB 3.43Å; A71-R74 PolarHBondContact O-N 2.65Å; A71-C75 PolarHBondContact O-N 3.39Å; A71-C75 PolarHBondContact O-SG 2.81Å
72	I	89.9	Confident	88.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-43.2	175.9	-66.9	166.1	0	0	0	110.9	F18 I20 I55 A68 I69 R74 C75 L79 I104	F18-I72 HydrophobicContact CE2-CD1 4.11Å; F18-I72 HydrophobicContact CZ-CD1 4.1Å; F18-I72 HydrophobicContact CZ-CG2 4.47Å; I20-I72 HydrophobicContact CD1-CD1 3.85Å; I20-I72 HydrophobicContact CG2-CD1 4.31Å; I55-I72 HydrophobicContact CD1-CD1 4.35Å; I55-I72 HydrophobicContact CD1-CG1 4.05Å; I55-I72 HydrophobicContact CG2-CG1 4.07Å; A68-I72 WeakPolarHBondContact O-CG1 3.2Å; A68-I72 PolarHBondContact O-N 2.8Å; I69-I72 PolarHBondContact O-N 3.42Å; I72-R74 VanDerWaalsContact C-N 3.34Å; I72-R74 PolarHBondContact O-N 2.98Å; I72-C75 VanDerWaalsContact O-CB 3.26Å; I72-C75 WeakPolarHBondContact O-CB 3.21Å; I72-C75 PolarHBondContact O-N 3.01Å; I72-L79 HydrophobicContact CG1-CD1 4.27Å; I72-L79 HydrophobicContact CG2-CD1 4.37Å; I72-L79 HydrophobicContact CG2-CD2 3.99Å; I72-I104 HydrophobicContact CD1-CD1 3.79Å; I72-I104 HydrophobicContact CG2-CG2 3.91Å
73	I	81.6	Confident	88.9	Confident	52 Å²	52	40.8 Å²	40.8	27%	0.267	20%	0.199	S	C	.	.	H	α-helix	trans	-62.3	-40.5	178	-70.3	169.9	0	0	0	111.5	I69 Q70 A71 C75 C76 Q106	I69-I73 HydrophobicContact CG2-CD1 3.66Å; I69-I73 HydrophobicContact CG2-CG1 4.34Å; I69-I73 VanDerWaalsContact O-CG1 3.3Å; I69-I73 WeakPolarHBondContact O-CG1 3.41Å; I69-I73 PolarHBondContact O-N 3.23Å; Q70-I73 PolarHBondContact O-N 2.95Å; A71-I73 VanDerWaalsContact C-N 3.35Å; A71-I73 PolarHBondContact O-N 2.69Å; I73-C75 PolarHBondContact O-N 2.87Å; I73-C76 PolarHBondContact O-N 3.19Å; I73-C76 VanDerWaalsContact O-N 3.16Å; I73-Q106 HydrophobicContact CG1-CG 4.46Å; I73-Q106 HydrophobicContact CG2-CG 4.21Å; I73-Q106 PolarHBondContact O-NE2 3.32Å
74	R	83.2	Confident	88.9	Confident	134 Å²	134	44.2 Å²	44.2	51%	0.506	21%	0.211	S	C	.	.	H	α-helix	trans	-61.8	-21.3	177.6	-80.2	-177.7	-72.7	145.6	-4	113.6	D58 Q70 A71 I72 C76	D58-R74 IonicContact OD2-NH1 3.95Å; Q70-R74 WeakPolarHBondContact O-CB 3.21Å; Q70-R74 VanDerWaalsContact O-CG 3.24Å; Q70-R74 WeakPolarHBondContact O-CG 3.31Å; Q70-R74 PolarHBondContact O-N 3Å; Q70-R74 PolarHBondContact O-NE 3.01Å; A71-R74 WeakPolarHBondContact O-CB 3.43Å; A71-R74 PolarHBondContact O-N 2.65Å; I72-R74 VanDerWaalsContact C-N 3.34Å; I72-R74 PolarHBondContact O-N 2.98Å; R74-C76 PolarHBondContact O-N 2.78Å
75	C	81.8	Confident	88.6	Confident	15 Å²	15	45.8 Å²	45.8	10%	0.101	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-12.1	177.4	-58	0	0	0	0	113.2	S56 A71 I72 I73 N77 D78 L79	S56-C75 PolarHBondContact OG-SG 2.84Å; A71-C75 PolarHBondContact O-N 3.39Å; A71-C75 PolarHBondContact O-SG 2.81Å; I72-C75 VanDerWaalsContact O-CB 3.26Å; I72-C75 WeakPolarHBondContact O-CB 3.21Å; I72-C75 PolarHBondContact O-N 3.01Å; I73-C75 PolarHBondContact O-N 2.87Å; C75-N77 PolarHBondContact O-N 2.93Å; C75-D78 WeakPolarHBondContact CB-O 3.11Å; C75-D78 PolarHBondContact O-N 2.98Å; C75-D78 VanDerWaalsContact O-N 3.09Å; C75-D78 VanDerWaalsContact O-O 3.06Å; C75-L79 HydrophobicContact CB-CB 4.13Å; C75-L79 HydrophobicContact CB-CD1 3.92Å; C75-L79 WeakPolarHBondContact SG-CD1 3.33Å
76	C	83.2	Confident	87.8	Confident	35 Å²	35	46.7 Å²	46.7	24%	0.236	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	-103.3	-179	-61.3	0	0	0	0	113.2	R9 W16 I73 R74	R9-C76 VanDerWaalsContact CZ-O 3.29Å; R9-C76 PolarHBondContact NE-O 3.38Å; R9-C76 PolarHBondContact NH2-O 3.02Å; W16-C76 WeakPolarHBondContact CZ2-O 3.26Å; I73-C76 PolarHBondContact O-N 3.19Å; I73-C76 VanDerWaalsContact O-N 3.16Å; R74-C76 PolarHBondContact O-N 2.78Å
77	N	85.8	Confident	86.6	Confident	49 Å²	49	45.3 Å²	45.3	26%	0.262	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-1.4	-174.9	-69.3	-1.4	0	0	0	113	S8 R9 C75	S8-N77 WeakPolarHBondContact CA-O 3.44Å; R9-N77 HydrophobicContact CG-CB 4.12Å; R9-N77 PolarHBondContact N-O 3.35Å; R9-N77 WeakPolarHBondContact O-CB 3.28Å; C75-N77 PolarHBondContact O-N 2.93Å
78	D	87.9	Confident	84.8	Confident	61 Å²	61	48.1 Å²	48.1	33%	0.326	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	103.4	-175.4	-171	5.9	0	0	0	109.9	R6 L7 C75	R6-D78 VanDerWaalsContact CG-OD1 3.31Å; R6-D78 WeakPolarHBondContact CG-OD1 3.33Å; R6-D78 IonicContact CZ-OD1 3.54Å; R6-D78 IonicContact CZ-OD2 3.98Å; R6-D78 IonicContact NE-OD1 3.89Å; R6-D78 PolarHBondContact NE-OD1 3.43Å; R6-D78 IonicContact NE-OD2 2.77Å; R6-D78 PolarHBondContact NE-OD2 3.24Å; R6-D78 IonicContact NH2-OD1 3.14Å; R6-D78 IonicContact NH2-OD2 3.21Å; R6-D78 PolarHBondContact NH2-OD2 3.26Å; L7-D78 WeakPolarHBondContact O-CA 3.46Å; C75-D78 WeakPolarHBondContact CB-O 3.11Å; C75-D78 PolarHBondContact O-N 2.98Å; C75-D78 VanDerWaalsContact O-N 3.09Å; C75-D78 VanDerWaalsContact O-O 3.06Å
79	L	90.7	Very high	82.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.6	-174.1	171.9	63.6	0	0	0	109.7	R6 L7 W16 F18 I55 I72 C75 M81	R6-L79 CarbonylContact C-O 3.58Å; R6-L79 VanDerWaalsContact CA-O 3.3Å; R6-L79 WeakPolarHBondContact CA-O 3.47Å; L7-L79 HydrophobicContact CB-CB 4.41Å; L7-L79 HydrophobicContact CD1-CD2 4.12Å; L7-L79 HydrophobicContact CD1-CG 4.24Å; L7-L79 PolarHBondContact N-O 3.22Å; L7-L79 PolarHBondContact O-N 3.29Å; W16-L79 HydrophobicContact CD2-CD2 4.16Å; W16-L79 HydrophobicContact CE3-CB 4.49Å; W16-L79 HydrophobicContact CE3-CD2 4.5Å; W16-L79 HydrophobicContact CH2-CB 3.55Å; W16-L79 HydrophobicContact CZ2-CB 3.72Å; W16-L79 HydrophobicContact CZ2-CD2 4.42Å; W16-L79 HydrophobicContact CZ3-CB 4Å; F18-L79 HydrophobicContact CE1-CD2 3.83Å; F18-L79 HydrophobicContact CZ-CD2 3.74Å; I55-L79 HydrophobicContact CG2-CD1 3.97Å; I72-L79 HydrophobicContact CG1-CD1 4.27Å; I72-L79 HydrophobicContact CG2-CD1 4.37Å; I72-L79 HydrophobicContact CG2-CD2 3.99Å; C75-L79 HydrophobicContact CB-CB 4.13Å; C75-L79 HydrophobicContact CB-CD1 3.92Å; C75-L79 WeakPolarHBondContact SG-CD1 3.33Å; L79-M81 HydrophobicContact CD1-CG 3.83Å; L79-M81 HydrophobicContact CD1-SD 4.22Å; L79-M81 HydrophobicContact CD2-CE 3.9Å; L79-M81 HydrophobicContact CD2-CG 4.49Å; L79-M81 HydrophobicContact CD2-SD 4.09Å; L79-M81 HydrophobicContact CG-CE 4.28Å; L79-M81 HydrophobicContact CG-CG 4.02Å; L79-M81 HydrophobicContact CG-SD 4.27Å
80	E	92.4	Very high	80.1	Confident	57 Å²	57	61.4 Å²	61.4	27%	0.266	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.4	170.7	-176.2	174.2	-109.5	0	0	109.5	F4 I5 S56 R57	F4-E80 HydrophobicContact CD1-CG 4.33Å; I5-E80 WeakPolarHBondContact O-CA 3.34Å; S56-E80 PolarHBondContact N-O 3.23Å; R57-E80 IonicContact NE-OE2 3.75Å
81	M	93.9	Very high	77.7	Confident	1 Å²	1	62 Å²	62	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.7	175.6	-64.9	-175.4	-64.8	0	0	110.5	F4 I5 L7 F18 L46 V52 S54 I55 L79 V83	F4-M81 CarbonylContact C-O 3.41Å; F4-M81 WeakPolarHBondContact CA-O 3.4Å; I5-M81 PolarHBondContact N-O 3.28Å; I5-M81 PolarHBondContact O-N 2.9Å; L7-M81 HydrophobicContact CD1-CE 3.82Å; F18-M81 HydrophobicContact CE1-CE 4.35Å; F18-M81 HydrophobicContact CE2-CE 4.34Å; F18-M81 HydrophobicContact CZ-CE 3.91Å; F18-M81 HydrophobicContact CZ-SD 4.25Å; L46-M81 HydrophobicContact CD1-CE 4.34Å; L46-M81 HydrophobicContact CD2-CE 4.37Å; V52-M81 HydrophobicContact CG1-SD 4.24Å; S54-M81 VanDerWaalsContact O-CA 3.28Å; S54-M81 WeakPolarHBondContact O-CA 2.88Å; I55-M81 HydrophobicContact CG1-CG 4.23Å; I55-M81 HydrophobicContact CG1-SD 4.41Å; L79-M81 HydrophobicContact CD1-CG 3.83Å; L79-M81 HydrophobicContact CD1-SD 4.22Å; L79-M81 HydrophobicContact CD2-CE 3.9Å; L79-M81 HydrophobicContact CD2-CG 4.49Å; L79-M81 HydrophobicContact CD2-SD 4.09Å; L79-M81 HydrophobicContact CG-CE 4.28Å; L79-M81 HydrophobicContact CG-CG 4.02Å; L79-M81 HydrophobicContact CG-SD 4.27Å; M81-V83 HydrophobicContact CB-CG1 4.34Å
82	E	95	Very high	74.9	Confident	45 Å²	45	64.5 Å²	64.5	21%	0.21	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	124	163.8	-168	-176.4	173.9	0	0	108.7	S2 F4 L53 S54	S2-E82 VanDerWaalsContact CB-OE1 3.3Å; S2-E82 WeakPolarHBondContact CB-OE1 3.35Å; S2-E82 PolarHBondContact OG-OE1 2.64Å; F4-E82 HydrophobicContact CD1-CB 3.94Å; F4-E82 HydrophobicContact CD1-CG 4.36Å; F4-E82 HydrophobicContact CE1-CB 3.67Å; F4-E82 HydrophobicContact CE1-CG 4.03Å; F4-E82 HydrophobicContact CE2-CG 4.47Å; F4-E82 HydrophobicContact CZ-CB 4.21Å; F4-E82 HydrophobicContact CZ-CG 4.08Å; L53-E82 HydrophobicContact CB-CB 4.27Å; L53-E82 HydrophobicContact CB-CG 4.32Å; L53-E82 HydrophobicContact CD1-CG 4.28Å; L53-E82 PolarHBondContact N-O 2.8Å; S54-E82 PolarHBondContact N-O 3.04Å; S54-E82 PolarHBondContact O-N 2.88Å; S54-E82 WeakPolarHBondContact OG-CB 3.33Å
83	V	94.5	Very high	71.9	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	150.7	-179.7	-62.3	0	0	0	0	111.1	S2 F3 I5 L46 M50 R51 M81	S2-V83 CarbonylContact C-O 3.49Å; S2-V83 WeakPolarHBondContact CA-O 3.45Å; S2-V83 WeakPolarHBondContact CB-O 3.24Å; F3-V83 HydrophobicContact CD1-CG2 4.37Å; F3-V83 HydrophobicContact CD2-CG2 4.04Å; F3-V83 HydrophobicContact CE1-CG2 3.99Å; F3-V83 HydrophobicContact CE2-CG2 3.66Å; F3-V83 HydrophobicContact CG-CG2 4.39Å; F3-V83 HydrophobicContact CZ-CG2 3.62Å; F3-V83 PolarHBondContact N-O 3.06Å; F3-V83 PolarHBondContact O-N 3.41Å; I5-V83 HydrophobicContact CD1-CG2 3.59Å; I5-V83 HydrophobicContact CG1-CG2 3.94Å; L46-V83 HydrophobicContact CD1-CG1 4.02Å; M50-V83 HydrophobicContact CB-CB 4.41Å; M50-V83 HydrophobicContact SD-CG2 4.12Å; R51-V83 CarbonylContact O-C 3.6Å; R51-V83 WeakPolarHBondContact O-CA 3.48Å; M81-V83 HydrophobicContact CB-CG1 4.34Å
84	Y	93.2	Very high	69.5	Low	93 Å²	93	78.5 Å²	78.5	37%	0.365	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.9	173	-178.2	-87.5	0	0	0	109.6	R51 N86	R51-Y84 PolarHBondContact N-O 3.06Å; R51-Y84 PolarHBondContact O-N 2.93Å; Y84-N86 WeakPolarHBondContact CD1-OD1 3.35Å; Y84-N86 WeakPolarHBondContact CE1-OD1 3.19Å
85	D	87.3	Confident	67	Low	71 Å²	71	77.4 Å²	77.4	38%	0.38	44%	0.438	S	S	.	.			trans	-85.7	119.4	172.8	-167.2	-11.5	0	0	0	110.2	F3 M50 G87	F3-D85 HydrophobicContact CE1-CB 4.3Å; M50-D85 HydrophobicContact CE-CB 4.16Å; M50-D85 HydrophobicContact CG-CB 4.41Å; D85-G87 PolarHBondContact O-N 3.19Å; D85-G87 PolarHBondContact OD1-N 3.15Å
86	N	73.4	Confident	64.3	Low	61 Å²	61	83.2 Å²	83.2	33%	0.326	48%	0.476	S	S	.	.			trans	-78.9	-1.9	177.3	-85.6	3.2	0	0	0	113.1	R51 Y84 L88	R51-N86 PolarHBondContact NE-ND2 3.04Å; R51-N86 VanDerWaalsContact NE-ND2 3.15Å; Y84-N86 WeakPolarHBondContact CD1-OD1 3.35Å; Y84-N86 WeakPolarHBondContact CE1-OD1 3.19Å; N86-L88 PolarHBondContact O-N 3.21Å
87	G	61.8	Low	61.7	Low	56 Å²	56	88.4 Å²	88.4	58%	0.577	50%	0.5	S	S	*	.			trans	68.9	12.7	175.9	0	0	0	0	0	114.9	D85 N89	D85-G87 PolarHBondContact O-N 3.19Å; D85-G87 PolarHBondContact OD1-N 3.15Å; G87-N89 VanDerWaalsContact C-N 3.31Å; G87-N89 PolarHBondContact O-N 3.07Å
88	L	52.5	Low	58.9	Low	148 Å²	148	95.8 Å²	95.8	78%	0.775	53%	0.533	S	S	*	.			trans	-82.9	77.3	174.6	-77	164.6	0	0	0	110	N86 N90	N86-L88 PolarHBondContact O-N 3.21Å; L88-N90 PolarHBondContact O-N 2.73Å; L88-N90 VanDerWaalsContact O-N 3.16Å
89	N	41.5	Very low	56	Low	162 Å²	162	98.8 Å²	98.8	87%	0.866	55%	0.545	S	S	*	.			trans	-65.2	103.4	156.2	-81.4	-29	0	0	0	107.9	G87	G87-N89 VanDerWaalsContact C-N 3.31Å; G87-N89 PolarHBondContact O-N 3.07Å
90	N	39.8	Very low	53	Low	147 Å²	147	107.6 Å²	107.6	79%	0.786	59%	0.588	S	S	*	*			trans	-130.9	100.4	163.3	-137.9	11.1	0	0	0	110.7	L88	L88-N90 PolarHBondContact O-N 2.73Å; L88-N90 VanDerWaalsContact O-N 3.16Å
91	S	33.6	Very low	50	Low	109 Å²	109	109.4 Å²	109.4	76%	0.762	60%	0.6	S	S	*	*			trans	-47.8	135.7	151.3	47.4	0	0	0	0	111.3
92	G	30.1	Very low	47.1	Very low	57 Å²	57	115.8 Å²	115.8	59%	0.588	63%	0.631	S	S	*	*	S	Bend	trans	115.6	112.3	157.4	0	0	0	0	0	116
93	Y	27.4	Very low	44.3	Very low	241 Å²	241	117.5 Å²	117.5	95%	0.945	65%	0.648	S	S	*	*			trans	27.3	110.1	142.4	-63.8	-87.2	0	0	0	118.8
94	S	31.6	Very low	41.9	Very low	106 Å²	106	118.2 Å²	118.2	74%	0.741	65%	0.652	S	S	*	*			trans	-156.9	101.3	154.4	50.7	0	0	0	0	112.5
95	T	29	Very low	39.3	Very low	112 Å²	112	116.4 Å²	116.4	69%	0.687	65%	0.651	S	S	*	*			trans	54.1	132.2	141	54.1	0	0	0	0	121.3	L97	T95-L97 PolarHBondContact O-N 2.96Å
96	P	26.5	Very low	37.1	Very low	137 Å²	137	114.6 Å²	114.6	89%	0.89	64%	0.64	S	S	*	*			trans	-74.8	95.9	176.2	31.6	-30.5	0	0	0	110
97	L	28.1	Very low	35.3	Very low	143 Å²	143	116.3 Å²	116.3	75%	0.749	65%	0.653	S	S	*	*			trans	-96.3	124.9	162.2	-92.5	155.1	0	0	0	107.6	T95 Q99	T95-L97 PolarHBondContact O-N 2.96Å; L97-Q99 WeakPolarHBondContact O-CB 3.22Å; L97-Q99 PolarHBondContact O-N 2.72Å
98	H	27.6	Very low	34	Very low	204 Å²	204	118 Å²	118	94%	0.944	66%	0.655	S	S	*	*			trans	-35.4	95.1	-178.4	-147.5	69.1	0	0	0	112.2
99	Q	27.5	Very low	32.8	Very low	124 Å²	124	117.7 Å²	117.7	58%	0.579	65%	0.654	S	S	*	*			trans	-108.8	115.2	-168.6	-140.6	171	13.2	0	0	109.4	L97 N101	L97-Q99 WeakPolarHBondContact O-CB 3.22Å; L97-Q99 PolarHBondContact O-N 2.72Å; Q99-N101 VanDerWaalsContact C-N 3.31Å; Q99-N101 PolarHBondContact O-N 3.34Å
100	M	26.2	Very low	32.2	Very low	185 Å²	185	114 Å²	114	91%	0.911	64%	0.641	S	S	*	*			trans	-69.8	91.3	166.5	-67.9	-177.5	179.3	0	0	108.2	M102	M100-M102 PolarHBondContact O-N 2.76Å
101	N	30.2	Very low	31.7	Very low	96 Å²	96	115.3 Å²	115.3	51%	0.513	65%	0.646	S	S	.	*			trans	-83.2	95.6	174.2	-78.1	-19.6	0	0	0	109.1	Q99	Q99-N101 VanDerWaalsContact C-N 3.31Å; Q99-N101 PolarHBondContact O-N 3.34Å
102	M	31.7	Very low	31.3	Very low	135 Å²	135	117.9 Å²	117.9	67%	0.665	65%	0.646	S	S	*	*			trans	-95.7	99.6	166.1	-69.2	-92.3	75.2	0	0	108.4	C19 M100 I104	C19-M102 PolarHBondContact SG-O 3.49Å; M100-M102 PolarHBondContact O-N 2.76Å; M102-I104 PolarHBondContact O-N 3.35Å
103	S	37.3	Very low	31.2	Very low	81 Å²	81	122.8 Å²	122.8	57%	0.566	66%	0.658	S	S	*	*			trans	-59	122	162.5	-61.4	0	0	0	0	107.7	T105	S103-T105 PolarHBondContact O-N 3.43Å
104	I	43	Very low	31.3	Very low	15 Å²	15	118.4 Å²	118.4	8%	0.077	65%	0.646	C	S	.	*			trans	-75.2	83.7	-178.6	-52.8	175.2	0	0	0	108.7	F18 I20 I72 M102	F18-I104 HydrophobicContact CD2-CD1 4.49Å; F18-I104 HydrophobicContact CE2-CD1 4Å; F18-I104 HydrophobicContact CZ-CD1 4.32Å; I20-I104 HydrophobicContact CD1-CD1 4.35Å; I20-I104 HydrophobicContact CG1-CD1 4.16Å; I20-I104 HydrophobicContact CG2-CD1 4.34Å; I72-I104 HydrophobicContact CD1-CD1 3.79Å; I72-I104 HydrophobicContact CG2-CG2 3.91Å; M102-I104 PolarHBondContact O-N 3.35Å
105	T	39.9	Very low	31.2	Very low	55 Å²	55	121.4 Å²	121.4	34%	0.337	65%	0.646	S	S	.	*			trans	-105.1	149.3	161.7	54.8	0	0	0	0	108.1	P15 S103 T107	P15-T105 HydrophobicContact CB-CG2 3.93Å; S103-T105 PolarHBondContact O-N 3.43Å; T105-T107 VanDerWaalsContact C-N 3.25Å; T105-T107 PolarHBondContact O-N 2.65Å; T105-T107 PolarHBondContact OG1-OG1 2.87Å
106	Q	39.8	Very low	31.3	Very low	32 Å²	32	121 Å²	121	15%	0.15	65%	0.645	C	S	.	*	S	Bend	trans	-74.9	77.5	176.8	-76.1	-177.1	-18.2	0	0	110.4	R9 S12 I73 Y315	R9-Q106 VanDerWaalsContact NH2-CD 3.26Å; S12-Q106 VanDerWaalsContact CB-OE1 3.27Å; I73-Q106 HydrophobicContact CG1-CG 4.46Å; I73-Q106 HydrophobicContact CG2-CG 4.21Å; I73-Q106 PolarHBondContact O-NE2 3.32Å; Q106-Y315 HydrophobicContact CB-CE1 4.35Å; Q106-Y315 VanDerWaalsContact OE1-CE1 3.31Å; Q106-Y315 VanDerWaalsContact OE1-CE2 3.29Å
107	T	37.5	Very low	31.6	Very low	97 Å²	97	120.1 Å²	120.1	60%	0.595	64%	0.637	S	S	*	*			trans	-139.3	87.1	178	21.4	0	0	0	0	113.4	T105	T105-T107 VanDerWaalsContact C-N 3.25Å; T105-T107 PolarHBondContact O-N 2.65Å; T105-T107 PolarHBondContact OG1-OG1 2.87Å
108	S	33.7	Very low	31.7	Very low	91 Å²	91	120.5 Å²	120.5	64%	0.636	64%	0.64	S	S	*	*			trans	45	127.6	138.9	35.8	0	0	0	0	125.2
109	L	27.8	Very low	31.9	Very low	142 Å²	142	115.8 Å²	115.8	74%	0.743	63%	0.627	S	S	*	*			trans	-92	137.8	154.7	-80.8	153.3	0	0	0	111	K303	L109-K303 PolarHBondContact O-NZ 3.45Å
110	S	29	Very low	32.3	Very low	84 Å²	84	115.5 Å²	115.5	59%	0.587	64%	0.636	S	S	*	*			trans	-142.9	142.3	173.3	-63.7	0	0	0	0	112.4	K303	S110-K303 WeakPolarHBondContact OG-CE 3.29Å; S110-K303 PolarHBondContact OG-NZ 2.76Å
111	I	28	Very low	32.4	Very low	175 Å²	175	115.8 Å²	115.8	90%	0.897	63%	0.632	S	S	*	*			trans	-136.2	141.8	162	-64.5	179.9	0	0	0	107.9
112	E	26.6	Very low	32.2	Very low	164 Å²	164	117 Å²	117	77%	0.766	65%	0.645	S	S	*	*			trans	-85.6	157.5	-158.4	-57.3	168.3	132.1	0	0	116.5
113	L	26.8	Very low	32	Very low	159 Å²	159	119 Å²	119	83%	0.832	65%	0.653	S	S	*	*				-178.5	107.6	121.2	-102.7	132.7	0	0	0	114.2
114	H	29.8	Very low	31.3	Very low	150 Å²	150	121.7 Å²	121.7	69%	0.694	67%	0.666	S	S	*	*			trans	38.5	109.4	143.9	-54	85.1	0	0	0	121.8
115	K	30.2	Very low	30.4	Very low	169 Å²	169	127.8 Å²	127.8	74%	0.735	70%	0.704	S	S	*	*				78.7	152.9	70.8	-91.4	-166.5	-177.7	179.3	0	116.1
116	P	30.9	Very low	29.6	Very low	104 Å²	104	132.4 Å²	132.4	68%	0.675	73%	0.725	S	S	*	*			cis	-155.3	179.3	-14	41.2	-18.8	0	0	0	120.3
117	V	31.9	Very low	28.7	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.715	75%	0.753	S	S	*	*			trans	79.8	125.4	146.7	-175.5	0	0	0	0	119
118	D	29.8	Very low	28.1	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	77%	0.768	S	S	*	*			cis	-154.3	157.4	43.5	-94.5	-48.2	0	0	0	115.2
119	P	31.6	Very low	27.5	Very low	105 Å²	105	143.3 Å²	143.3	68%	0.682	77%	0.77	S	S	*	*			trans	-117.1	-164.7	170.7	41.7	-28.7	0	0	0	113.5
120	P	36.6	Very low	27.4	Very low	118 Å²	118	142 Å²	142	77%	0.766	77%	0.768	S	S	*	*			cis	-132.8	161.7	-36.5	35	-16.3	0	0	0	116.1
121	K	28.8	Very low	27.1	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.826	78%	0.775	S	S	*	*			trans	174.5	146.2	135.2	-115.6	-177.1	175.4	175.3	0	112.5
122	P	24.8	Very low	26.9	Very low	121 Å²	121	144.8 Å²	144.8	79%	0.786	77%	0.771	S	S	*	*			trans	-89	114.4	-179.9	33.2	-24.7	0	0	0	110.3
123	Q	27.4	Very low	26.8	Very low	178 Å²	178	139.9 Å²	139.9	83%	0.832	76%	0.764	S	S	*	*			trans	-139.6	121.6	162.9	-71	-171.3	-19.4	0	0	109.5
124	T	23.1	Very low	26.8	Very low	137 Å²	137	137.7 Å²	137.7	84%	0.84	76%	0.757	S	S	*	*			trans	-42.9	123.9	167.7	44.1	0	0	0	0	113.2
125	V	25.1	Very low	26.6	Very low	144 Å²	144	134 Å²	134	87%	0.873	75%	0.749	S	S	*	*			trans	-157.3	138	135.5	-175.6	0	0	0	0	109.8
126	I	21.7	Very low	26.5	Very low	152 Å²	152	131.7 Å²	131.7	78%	0.779	75%	0.751	S	S	*	*			trans	-57.6	140.2	-176.8	-63.2	148.9	0	0	0	114.6
127	S	22.1	Very low	26.3	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	75%	0.754	S	S	*	*			trans	145.7	100	130	-63.2	0	0	0	0	112.9
128	K	24.5	Very low	26.1	Very low	210 Å²	210	133 Å²	133	91%	0.913	75%	0.751	S	S	*	*				-166.2	115.4	126.8	-104.6	171.1	-172.5	180	0	109.1
129	I	22.1	Very low	25.9	Very low	134 Å²	134	130.5 Å²	130.5	69%	0.687	75%	0.746	S	S	*	*			trans	-62.8	127.6	-178.9	-62.9	155.2	0	0	0	108.9	H131	I129-H131 VanDerWaalsContact CG2-CD2 3.49Å; I129-H131 WeakPolarHBondContact CG2-CD2 3.33Å; I129-H131 VanDerWaalsContact CG2-NE2 3.29Å; I129-H131 WeakPolarHBondContact CG2-NE2 3.45Å
130	V	24.9	Very low	25.5	Very low	114 Å²	114	137 Å²	137	69%	0.691	76%	0.757	S	S	*	*			trans	-126.6	114.8	152.6	-176.6	0	0	0	0	106.3
131	H	23.3	Very low	25.1	Very low	162 Å²	162	137 Å²	137	75%	0.75	76%	0.76	S	S	*	*			trans	-64.5	137.3	-168.2	-72.8	-87.6	0	0	0	112.3	I129 G133	I129-H131 VanDerWaalsContact CG2-CD2 3.49Å; I129-H131 WeakPolarHBondContact CG2-CD2 3.33Å; I129-H131 VanDerWaalsContact CG2-NE2 3.29Å; I129-H131 WeakPolarHBondContact CG2-NE2 3.45Å; H131-G133 PolarHBondContact O-N 2.83Å; H131-G133 VanDerWaalsContact O-N 3.13Å
132	I	22.9	Very low	25	Very low	155 Å²	155	136.6 Å²	136.6	80%	0.795	76%	0.76	S	S	*	*			trans	-61.5	104.4	163.3	-61.4	160.1	0	0	0	106.5	T134	I132-T134 PolarHBondContact O-N 3.09Å
133	G	25.1	Very low	25	Very low	61 Å²	61	136 Å²	136	63%	0.629	76%	0.759	S	S	*	*			trans	-89.2	79	-179.6	0	0	0	0	0	110.6	H131	H131-G133 PolarHBondContact O-N 2.83Å; H131-G133 VanDerWaalsContact O-N 3.13Å
134	T	25.8	Very low	25.1	Very low	113 Å²	113	132.4 Å²	132.4	69%	0.693	75%	0.751	S	S	*	*			trans	-36.4	132.1	170.1	44.8	0	0	0	0	113.6	I132	I132-T134 PolarHBondContact O-N 3.09Å
135	S	25.8	Very low	25.4	Very low	74 Å²	74	133.9 Å²	133.9	52%	0.517	75%	0.754	S	S	.	*			trans	-45.5	141.2	159.4	-31	0	0	0	0	109.6	T137	S135-T137 VanDerWaalsContact C-N 3.31Å; S135-T137 PolarHBondContact O-N 2.89Å
136	P	28.5	Very low	25.6	Very low	119 Å²	119	129.9 Å²	129.9	77%	0.773	74%	0.742	S	S	*	*			trans	-65.9	98	172	26.4	-30.1	0	0	0	108.4	I138	P136-I138 PolarHBondContact O-N 3.26Å
137	T	26.3	Very low	26.2	Very low	123 Å²	123	127.9 Å²	127.9	76%	0.755	73%	0.731	S	S	*	*			trans	-69.3	97.6	168.5	-54.1	0	0	0	0	106.5	S135 S139	S135-T137 VanDerWaalsContact C-N 3.31Å; S135-T137 PolarHBondContact O-N 2.89Å; T137-S139 PolarHBondContact O-N 3.42Å
138	I	27.7	Very low	26.6	Very low	127 Å²	127	129.9 Å²	129.9	65%	0.651	73%	0.733	S	S	*	*			trans	-81	98.9	173.3	-63.4	174.4	0	0	0	107.8	P136 R140	P136-I138 PolarHBondContact O-N 3.26Å; I138-R140 PolarHBondContact O-N 3.38Å
139	S	25.9	Very low	27.1	Very low	99 Å²	99	121.5 Å²	121.5	69%	0.692	70%	0.697	S	S	*	*			trans	-57.8	120.3	165.4	-34.6	0	0	0	0	109.4	T137 S141	T137-S139 PolarHBondContact O-N 3.42Å; S139-S141 PolarHBondContact O-N 3.08Å
140	R	24.2	Very low	27.9	Very low	241 Å²	241	123.2 Å²	123.2	91%	0.909	70%	0.695	S	S	*	*			trans	-65.6	113.5	168.9	-70.5	178.7	179.7	-172.9	0.3	108.8	I138	I138-R140 PolarHBondContact O-N 3.38Å
141	S	27.7	Very low	28.6	Very low	118 Å²	118	121.3 Å²	121.3	83%	0.825	69%	0.687	S	S	*	*			trans	-119.9	118.9	155.9	55.5	0	0	0	0	109	S139	S139-S141 PolarHBondContact O-N 3.08Å
142	H	25.6	Very low	29.3	Very low	182 Å²	182	118.1 Å²	118.1	84%	0.843	67%	0.669	S	S	*	*			trans	-67.4	127.5	173.3	-74	-82.3	0	0	0	109.3
143	S	26.2	Very low	29.9	Very low	107 Å²	107	115.2 Å²	115.2	75%	0.748	66%	0.662	S	S	*	*			trans	-139.8	119.9	154.1	-174.6	0	0	0	0	108.7
144	P	28	Very low	30.5	Very low	103 Å²	103	115.4 Å²	115.4	67%	0.669	65%	0.652	S	S	*	*			trans	-78.7	138	175.3	31.4	-28.2	0	0	0	109.5
145	N	30.1	Very low	30.5	Very low	168 Å²	168	117.3 Å²	117.3	90%	0.898	66%	0.658	S	S	*	*	S	Bend	trans	88.3	36.7	162.7	-52.3	-25	0	0	0	120.2
146	G	30.3	Very low	30.7	Very low	61 Å²	61	118.4 Å²	118.4	63%	0.629	67%	0.666	S	S	*	*			trans	-172.6	103.6	160	0	0	0	0	0	113.2	I148	G146-I148 PolarHBondContact O-N 3.49Å
147	I	32.5	Very low	30.6	Very low	109 Å²	109	119.4 Å²	119.4	56%	0.559	67%	0.67	S	S	*	*			trans	-75.3	94.2	176.6	-56.4	175.8	0	0	0	108.5	I149 F392	I147-I149 HydrophobicContact CG2-CG1 4.46Å; I147-I149 PolarHBondContact O-N 3.37Å; I147-F392 HydrophobicContact CB-CE1 4.19Å; I147-F392 HydrophobicContact CD1-CE1 4.38Å; I147-F392 HydrophobicContact CD1-CE2 4.41Å; I147-F392 HydrophobicContact CD1-CZ 4.06Å; I147-F392 HydrophobicContact CG2-CE1 3.61Å; I147-F392 HydrophobicContact CG2-CZ 3.73Å
148	I	32.1	Very low	30.8	Very low	148 Å²	148	118.3 Å²	118.3	76%	0.759	66%	0.663	S	S	*	*			trans	-73.1	109.1	167.4	-59.7	179.8	0	0	0	107.5	G146 R150	G146-I148 PolarHBondContact O-N 3.49Å; I148-R150 PolarHBondContact O-N 2.94Å
149	I	35.1	Very low	30.9	Very low	34 Å²	34	117.2 Å²	117.2	17%	0.174	66%	0.662	C	S	.	*			trans	-77.5	116.6	172.5	-54.8	173.2	0	0	0	107.9	I147 I366 F378 F392	I147-I149 HydrophobicContact CG2-CG1 4.46Å; I147-I149 PolarHBondContact O-N 3.37Å; I149-I366 HydrophobicContact CG2-CG1 4.5Å; I149-I366 HydrophobicContact CG2-CG2 3.6Å; I149-F378 HydrophobicContact CD1-CE1 3.68Å; I149-F378 HydrophobicContact CD1-CZ 4.34Å; I149-F392 HydrophobicContact CD1-CD1 3.74Å; I149-F392 HydrophobicContact CD1-CE1 3.52Å; I149-F392 HydrophobicContact CG1-CD1 4.28Å; I149-F392 HydrophobicContact CG1-CE1 3.61Å
150	R	37.8	Very low	31.3	Very low	170 Å²	170	118.8 Å²	118.8	64%	0.642	66%	0.658	S	S	*	*			trans	-86.8	114	167	-65	-175.4	178.9	-153	1	108.3	I148 Y152	I148-R150 PolarHBondContact O-N 2.94Å; R150-Y152 HydrophobicContact CB-CD2 4.4Å; R150-Y152 HydrophobicContact CB-CE1 4.48Å; R150-Y152 HydrophobicContact CB-CE2 3.68Å; R150-Y152 WeakPolarHBondContact CD-OH 3.21Å
151	S	39.7	Very low	31.7	Very low	73 Å²	73	112.1 Å²	112.1	51%	0.51	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.9	128.5	161.6	47.4	0	0	0	0	107.7
152	Y	37.2	Very low	32.2	Very low	96 Å²	96	116.8 Å²	116.8	38%	0.376	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	128.4	175.7	-64.5	-86.5	0	0	0	108.8	R150 F365	R150-Y152 HydrophobicContact CB-CD2 4.4Å; R150-Y152 HydrophobicContact CB-CE1 4.48Å; R150-Y152 HydrophobicContact CB-CE2 3.68Å; R150-Y152 WeakPolarHBondContact CD-OH 3.21Å; Y152-F365 AromaticContact CD2-CE2 3.91Å; Y152-F365 HydrophobicContact CD2-CE2 3.91Å; Y152-F365 HydrophobicContact CD2-CZ 4.02Å; Y152-F365 HydrophobicContact CG-CE2 4.45Å; Y152-F365 HydrophobicContact CG-CZ 4.1Å
153	S	36.1	Very low	33.2	Very low	94 Å²	94	111.2 Å²	111.2	66%	0.657	62%	0.616	S	S	*	*			trans	-108.8	121.7	164.9	-174	0	0	0	0	106.3	N155	S153-N155 VanDerWaalsContact C-N 3.34Å; S153-N155 PolarHBondContact O-N 3.45Å
154	P	37	Very low	34.1	Very low	64 Å²	64	112.3 Å²	112.3	42%	0.416	61%	0.613	S	S	.	*			trans	-80.4	86.9	-179.7	23.6	-16.7	0	0	0	109.4	S156 E361	P154-S156 VanDerWaalsContact C-N 3.32Å; P154-E361 WeakPolarHBondContact CG-O 3.02Å
155	N	27.1	Very low	34.9	Very low	154 Å²	154	107.9 Å²	107.9	82%	0.824	59%	0.585	S	S	*	*			trans	-97.5	67.3	149.9	-76.9	2.3	0	0	0	107.3	S153	S153-N155 VanDerWaalsContact C-N 3.34Å; S153-N155 PolarHBondContact O-N 3.45Å
156	S	29	Very low	35.8	Very low	97 Å²	97	105.9 Å²	105.9	68%	0.678	57%	0.57	S	S	*	*	S	Bend	trans	-148.5	116.9	163.1	-91.5	0	0	0	0	108.1	P154 T158	P154-S156 VanDerWaalsContact C-N 3.32Å; S156-T158 VanDerWaalsContact C-N 3.27Å; S156-T158 PolarHBondContact O-N 2.94Å
157	T	27.1	Very low	36.7	Very low	140 Å²	140	108.1 Å²	108.1	86%	0.859	56%	0.563	S	S	*	*			trans	-58.1	84.6	170.7	25.1	0	0	0	0	110	V159	T157-V159 PolarHBondContact O-N 3.19Å
158	T	30.4	Very low	37.3	Very low	100 Å²	100	105.5 Å²	105.5	61%	0.613	55%	0.549	S	S	*	.			trans	-69.9	90.3	149.1	26.9	0	0	0	0	106.2	S156 H160	S156-T158 VanDerWaalsContact C-N 3.27Å; S156-T158 PolarHBondContact O-N 2.94Å; T158-H160 PolarHBondContact O-N 3.17Å
159	V	30.2	Very low	37.7	Very low	103 Å²	103	103 Å²	103	62%	0.624	54%	0.537	S	S	*	.			trans	-51.9	113.5	168	177.2	0	0	0	0	106.2	T157 N161	T157-V159 PolarHBondContact O-N 3.19Å; V159-N161 VanDerWaalsContact C-N 3.27Å; V159-N161 PolarHBondContact O-N 3.04Å
160	H	34.6	Very low	38	Very low	132 Å²	132	102.8 Å²	102.8	61%	0.611	54%	0.537	S	S	*	.			trans	-49	100.1	160.8	-95.5	56.8	0	0	0	106.4	T158 R162 E361	T158-H160 PolarHBondContact O-N 3.17Å; H160-R162 PolarHBondContact O-N 3.32Å; H160-E361 IonicContact CE1-OE2 3.91Å
161	N	32.8	Very low	37.7	Very low	102 Å²	102	99.9 Å²	99.9	55%	0.545	53%	0.534	S	S	.	.			trans	-72.5	78	170.9	-83.4	-13.9	0	0	0	106.8	V159 I163	V159-N161 VanDerWaalsContact C-N 3.27Å; V159-N161 PolarHBondContact O-N 3.04Å; N161-I163 HydrophobicContact CB-CG1 4.38Å; N161-I163 PolarHBondContact O-N 3.38Å
162	R	38.3	Very low	37.5	Very low	215 Å²	215	101.3 Å²	101.3	81%	0.811	53%	0.532	S	S	*	.			trans	-62.9	90.2	157.8	-75	-177.3	-178.7	159.7	1	106.2	H160 L164	H160-R162 PolarHBondContact O-N 3.32Å; R162-L164 PolarHBondContact O-N 3.38Å
163	I	46.1	Very low	37.3	Very low	66 Å²	66	97 Å²	97	34%	0.338	52%	0.516	S	S	.	.			trans	-84.3	99.9	166.5	-55	179.2	0	0	0	105.1	N161 A165 F330 V332	N161-I163 HydrophobicContact CB-CG1 4.38Å; N161-I163 PolarHBondContact O-N 3.38Å; I163-A165 PolarHBondContact O-N 2.91Å; I163-F330 HydrophobicContact CB-CE2 4.21Å; I163-F330 HydrophobicContact CB-CZ 3.93Å; I163-F330 HydrophobicContact CG2-CE2 4.25Å; I163-F330 HydrophobicContact CG2-CZ 3.75Å; I163-F330 WeakPolarHBondContact O-CE1 3.39Å; I163-F330 VanDerWaalsContact O-CZ 3.28Å; I163-F330 WeakPolarHBondContact O-CZ 3.34Å; I163-V332 HydrophobicContact CD1-CG2 4.17Å
164	L	44.2	Very low	37.1	Very low	130 Å²	130	95.1 Å²	95.1	68%	0.681	50%	0.503	S	S	*	.			trans	-65.9	123.5	169.8	-70.7	166	0	0	0	107.6	R162 E166	R162-L164 PolarHBondContact O-N 3.38Å; L164-E166 PolarHBondContact O-N 3Å
165	A	44.4	Very low	36.9	Very low	10 Å²	10	92.6 Å²	92.6	8%	0.083	49%	0.487	C	S	.	.			trans	-68.3	119.3	166.1	0	0	0	0	0	107.3	I163 K167 I305 A307 F317 F330	I163-A165 PolarHBondContact O-N 2.91Å; A165-K167 PolarHBondContact O-N 2.91Å; A165-I305 HydrophobicContact CB-CG2 4.24Å; A165-A307 HydrophobicContact CB-CB 4.19Å; A165-F317 HydrophobicContact CB-CE1 4.22Å; A165-F330 HydrophobicContact CB-CD1 4.45Å; A165-F330 HydrophobicContact CB-CE1 3.62Å; A165-F330 HydrophobicContact CB-CZ 4.33Å
166	E	49.2	Very low	37.1	Very low	125 Å²	125	86.7 Å²	86.7	58%	0.584	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	104.9	172	-157.8	176.6	-175.7	0	0	107.3	L164 L168 K306	L164-E166 PolarHBondContact O-N 3Å; E166-L168 HydrophobicContact CG-CD2 4.29Å; E166-L168 HydrophobicContact CG-CG 4.17Å; E166-L168 PolarHBondContact O-N 3.09Å; E166-K306 PolarHBondContact N-O 2.89Å; E166-K306 PolarHBondContact O-N 3.03Å
167	K	49	Very low	37.1	Very low	109 Å²	109	85.9 Å²	85.9	47%	0.474	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	109.2	171.9	-68.4	174.8	-178.2	164.8	0	106.9	A165 D327 D328	A165-K167 PolarHBondContact O-N 2.91Å; K167-D327 IonicContact NZ-OD1 3.49Å; K167-D328 IonicContact NZ-OD1 3.55Å; K167-D328 PolarHBondContact NZ-OD1 3.3Å
168	L	45.8	Very low	37.1	Very low	53 Å²	53	81.8 Å²	81.8	28%	0.277	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.8	177.4	-72.5	169.5	0	0	0	109.4	E166 I170 I304 K306	E166-L168 HydrophobicContact CG-CD2 4.29Å; E166-L168 HydrophobicContact CG-CG 4.17Å; E166-L168 PolarHBondContact O-N 3.09Å; L168-I170 PolarHBondContact O-N 2.97Å; L168-I304 PolarHBondContact N-O 3.06Å; L168-I304 VanDerWaalsContact N-O 3.15Å; L168-I304 PolarHBondContact O-N 3.48Å; L168-K306 HydrophobicContact CD1-CB 4.4Å; L168-K306 HydrophobicContact CD1-CD 3.41Å; L168-K306 VanDerWaalsContact CD1-CD 3.41Å; L168-K306 HydrophobicContact CD1-CG 3.88Å; L168-K306 VanDerWaalsContact CD1-NZ 3.31Å
169	D	40.6	Very low	36.9	Very low	95 Å²	95	81.8 Å²	81.8	51%	0.508	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	104.9	166.9	-71	-41	0	0	0	108.5	N171 K303	D169-N171 VanDerWaalsContact C-N 3.28Å; D169-N171 PolarHBondContact O-N 2.98Å; D169-K303 WeakPolarHBondContact OD1-CE 3.49Å; D169-K303 WeakPolarHBondContact OD1-CG 3.45Å
170	I	40.8	Very low	36.9	Very low	30 Å²	30	85.8 Å²	85.8	15%	0.154	43%	0.425	C	S	.	.			trans	-81.5	86.9	168.1	-47.1	-160.3	0	0	0	106.6	L168 Y291 I304	L168-I170 PolarHBondContact O-N 2.97Å; I170-Y291 HydrophobicContact CD1-CD2 3.64Å; I170-Y291 HydrophobicContact CD1-CE2 3.21Å; I170-I304 HydrophobicContact CB-CD1 4.27Å; I170-I304 HydrophobicContact CD1-CB 4.43Å; I170-I304 HydrophobicContact CD1-CD1 3.2Å; I170-I304 HydrophobicContact CD1-CG1 4.34Å; I170-I304 HydrophobicContact CG1-CB 4.39Å; I170-I304 HydrophobicContact CG1-CD1 3.67Å; I170-I304 HydrophobicContact CG1-CG1 4.48Å
171	N	33	Very low	36.6	Very low	109 Å²	109	86.3 Å²	86.3	58%	0.583	43%	0.433	S	S	*	.			trans	-68.7	133.6	172.1	-72.2	-33.5	0	0	0	109	D169	D169-N171 VanDerWaalsContact C-N 3.28Å; D169-N171 PolarHBondContact O-N 2.98Å
172	H	35.4	Very low	36.3	Very low	103 Å²	103	88.7 Å²	88.7	48%	0.477	45%	0.446	S	S	.	.	S	Bend	trans	77.4	64.4	-171	-45.8	-73.5	0	0	0	114.1	E274 Q275	H172-E274 CarbonylContact C-O 3.54Å; H172-Q275 PolarHBondContact O-OE1 3.37Å
173	T	32.8	Very low	35.9	Very low	7 Å²	7	88 Å²	88	4%	0.043	45%	0.449	C	S	.	.			trans	-152.3	105.5	154	-17	0	0	0	0	111.5	E274 Q275 F285 G302	T173-E274 WeakPolarHBondContact CA-O 3.44Å; T173-Q275 HydrophobicContact CG2-CB 4.32Å; T173-Q275 PolarHBondContact OG1-OE1 3Å; T173-F285 HydrophobicContact CG2-CD2 4.29Å; T173-F285 HydrophobicContact CG2-CE1 4.08Å; T173-F285 HydrophobicContact CG2-CE2 3.14Å; T173-F285 HydrophobicContact CG2-CZ 3.03Å; T173-G302 PolarHBondContact O-N 2.82Å
174	S	31.7	Very low	34.9	Very low	54 Å²	54	90.2 Å²	90.2	38%	0.378	47%	0.47	S	S	.	.			trans	-142.8	102.1	171.9	-59.6	0	0	0	0	107.6	I176	S174-I176 PolarHBondContact O-N 2.69Å
175	P	31.6	Very low	34	Very low	11 Å²	11	92.1 Å²	92.1	7%	0.071	48%	0.48	C	S	.	.			trans	-70.4	120.7	154.8	1.9	16.3	0	0	0	106.4	Y177 F272 A273 F285 I301	P175-Y177 HydrophobicContact CB-CD2 4.21Å; P175-Y177 HydrophobicContact CB-CE2 3.58Å; P175-Y177 HydrophobicContact CG-CE2 3.96Å; P175-Y177 WeakPolarHBondContact O-CD2 3.46Å; P175-Y177 PolarHBondContact O-N 3.31Å; P175-F272 WeakPolarHBondContact CA-O 3.2Å; P175-A273 HydrophobicContact CB-CB 4.12Å; P175-A273 HydrophobicContact CG-CB 4.1Å; P175-F285 HydrophobicContact CG-CD1 3.65Å; P175-F285 HydrophobicContact CG-CE1 3.62Å; P175-I301 VanDerWaalsContact CD-CG2 3.4Å; P175-I301 HydrophobicContact CG-CD1 3.71Å; P175-I301 HydrophobicContact CG-CG1 3.88Å; P175-I301 HydrophobicContact CG-CG2 4.49Å
176	I	31.4	Very low	33	Very low	29 Å²	29	101.2 Å²	101.2	15%	0.149	52%	0.518	C	S	.	.			trans	-84.5	113.3	169	-79.7	155	0	0	0	107.4	S174 L219 G271	S174-I176 PolarHBondContact O-N 2.69Å; I176-L219 HydrophobicContact CD1-CB 3.4Å; I176-L219 VanDerWaalsContact CD1-CB 3.4Å; I176-L219 WeakPolarHBondContact CD1-O 3.2Å; I176-G271 WeakPolarHBondContact O-CA 3.34Å
177	Y	28.9	Very low	31.9	Very low	80 Å²	80	99.4 Å²	99.4	31%	0.314	52%	0.516	S	S	.	.			trans	-88.4	123.9	171.8	-68.3	-97.3	0	0	0	108.3	P175 E282 E286 I301	P175-Y177 HydrophobicContact CB-CD2 4.21Å; P175-Y177 HydrophobicContact CB-CE2 3.58Å; P175-Y177 HydrophobicContact CG-CE2 3.96Å; P175-Y177 WeakPolarHBondContact O-CD2 3.46Å; P175-Y177 PolarHBondContact O-N 3.31Å; Y177-E282 VanDerWaalsContact CE1-CD 3.47Å; Y177-E282 HydrophobicContact CE1-CG 3.87Å; Y177-E282 WeakPolarHBondContact CE1-OE1 3.24Å; Y177-E286 PolarHBondContact OH-OE1 2.76Å; Y177-I301 HydrophobicContact CE2-CD1 3.6Å
178	T	27	Very low	30.7	Very low	55 Å²	55	99.2 Å²	99.2	34%	0.337	53%	0.529	S	S	.	.			trans	-107.4	123.6	157.4	49.6	0	0	0	0	108.3	Q180 D270	T178-Q180 PolarHBondContact O-N 2.89Å; T178-D270 WeakPolarHBondContact OG1-CB 3.26Å; T178-D270 PolarHBondContact OG1-O 3.47Å
179	P	28.3	Very low	29.9	Very low	99 Å²	99	106.4 Å²	106.4	64%	0.643	55%	0.554	S	S	*	*			trans	-64.2	121.4	175	-15.8	28.5	0	0	0	109.6	P15 N181	P15-P179 HydrophobicContact CG-CG 4.15Å; P179-N181 PolarHBondContact O-N 3.32Å; P179-N181 VanDerWaalsContact O-N 3.15Å
180	Q	29.2	Very low	29.2	Very low	187 Å²	187	108.4 Å²	108.4	87%	0.874	57%	0.57	S	S	*	*			trans	-64.9	111.8	175.1	-73.4	-176.2	-18	0	0	110.2	T178	T178-Q180 PolarHBondContact O-N 2.89Å
181	N	28.4	Very low	28.4	Very low	144 Å²	144	111.3 Å²	111.3	77%	0.77	59%	0.593	S	S	*	*			trans	-87	110.1	164.6	-129.4	-9.4	0	0	0	108	P179 K183	P179-N181 PolarHBondContact O-N 3.32Å; P179-N181 VanDerWaalsContact O-N 3.15Å; N181-K183 PolarHBondContact O-N 3.5Å
182	N	25.5	Very low	28.1	Very low	151 Å²	151	114.2 Å²	114.2	81%	0.807	61%	0.607	S	S	*	*			trans	-53.4	105.9	172.6	-90.9	-28.4	0	0	0	110.9
183	K	30.1	Very low	27.6	Very low	201 Å²	201	119.2 Å²	119.2	87%	0.874	62%	0.624	S	S	*	*			trans	-136.9	100.1	150.7	-75.4	-168.1	178.3	177.3	0	109.7	N181 L185	N181-K183 PolarHBondContact O-N 3.5Å; K183-L185 PolarHBondContact O-N 2.84Å
184	S	24.6	Very low	27.4	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	66%	0.663	S	S	*	*			trans	-39.5	123.1	159	-56.9	0	0	0	0	111.5
185	L	27.4	Very low	27.2	Very low	170 Å²	170	130.1 Å²	130.1	89%	0.89	69%	0.686	S	S	*	*			trans	-176.5	101.2	144.4	-99.8	134.7	0	0	0	107.7	K183	K183-L185 PolarHBondContact O-N 2.84Å
186	K	22.4	Very low	27.4	Very low	202 Å²	202	134 Å²	134	88%	0.878	71%	0.712	S	S	*	*			trans	-54.6	147.4	165.3	-71.4	179.5	174.9	-179.5	0	108.9
187	P	26.2	Very low	27.2	Very low	86 Å²	86	140.7 Å²	140.7	56%	0.558	74%	0.739	S	S	*	*				-134.2	143.6	106.6	9.8	12.1	0	0	0	114.1	Y189	P187-Y189 VanDerWaalsContact O-CE2 3.26Å; P187-Y189 WeakPolarHBondContact O-CE2 3.31Å
188	S	24.1	Very low	27	Very low	106 Å²	106	146.3 Å²	146.3	74%	0.741	76%	0.761	S	S	*	*			trans	-56.4	140.5	166.8	43	0	0	0	0	113.6
189	Y	27.4	Very low	27	Very low	203 Å²	203	147.9 Å²	147.9	80%	0.796	78%	0.775	S	S	*	*			trans	-129.3	100.8	161.9	-55.1	-79	0	0	0	109.9	P187	P187-Y189 VanDerWaalsContact O-CE2 3.26Å; P187-Y189 WeakPolarHBondContact O-CE2 3.31Å
190	T	26.7	Very low	27	Very low	138 Å²	138	149 Å²	149	85%	0.847	78%	0.78	S	S	*	*			trans	-67.1	132.7	160.6	21	0	0	0	0	109.9
191	S	24.4	Very low	26.9	Very low	90 Å²	90	147.3 Å²	147.3	63%	0.629	77%	0.774	S	S	*	*			trans	-38	138.6	162	175.1	0	0	0	0	112.4
192	L	26.8	Very low	26.9	Very low	171 Å²	171	147.5 Å²	147.5	90%	0.895	78%	0.775	S	S	*	*			trans	-165.8	121.5	133.9	-96.9	172.6	0	0	0	110.7
193	Y	24.4	Very low	26.9	Very low	208 Å²	208	148.8 Å²	148.8	82%	0.816	78%	0.776	S	S	*	*			trans	-59.3	134.7	168	-67.4	-99.7	0	0	0	111.6
194	S	28.9	Very low	26.8	Very low	125 Å²	125	143.7 Å²	143.7	87%	0.874	76%	0.764	S	S	*	*			trans	176.2	125.6	133.3	28.9	0	0	0	0	112.9
195	L	27.9	Very low	27	Very low	165 Å²	165	144.8 Å²	144.8	86%	0.864	76%	0.756	S	S	*	*			trans	-78.2	-169.8	171.2	-81.7	136.5	0	0	0	111.6
196	P	35.1	Very low	27.2	Very low	93 Å²	93	141 Å²	141	60%	0.604	74%	0.742	S	S	*	*				-135.8	-174.3	-54.2	33.8	-14.6	0	0	0	112.7
197	K	27.8	Very low	27.4	Very low	168 Å²	168	137.8 Å²	137.8	73%	0.73	73%	0.734	S	S	*	*				147.9	151.1	119.4	-72.2	-168.6	-171.8	174.1	0	117
198	Y	25.2	Very low	27.4	Very low	198 Å²	198	139.8 Å²	139.8	78%	0.776	74%	0.739	S	S	*	*			trans	77.2	108.1	160.9	-76	-84.8	0	0	0	118.1
199	S	26.6	Very low	27.4	Very low	89 Å²	89	145 Å²	145	62%	0.622	74%	0.743	S	S	*	*				103.8	138.3	73.3	-78.2	0	0	0	0	109.4
200	T	28.2	Very low	27.2	Very low	121 Å²	121	141.8 Å²	141.8	74%	0.742	74%	0.744	S	S	*	*			cis	-174	148.4	29.5	12.3	0	0	0	0	110
201	M	26.9	Very low	27.1	Very low	153 Å²	153	142.4 Å²	142.4	75%	0.754	74%	0.742	S	S	*	*			trans	62.9	106.3	138.1	-57.8	-102.1	76.7	0	0	121.9
202	N	29.1	Very low	27.3	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	75%	0.752	S	S	*	*				149.7	132.3	100	-88.3	-21.1	0	0	0	115.6
203	Q	25.6	Very low	27.3	Very low	177 Å²	177	145.8 Å²	145.8	83%	0.827	75%	0.75	S	S	*	*			trans	-88	-169.8	178.6	-84.7	-178.4	-2.3	0	0	112.4
204	P	27.8	Very low	27.5	Very low	95 Å²	95	142.3 Å²	142.3	62%	0.617	75%	0.752	S	S	*	*			cis	-139.5	151.8	-27	25.4	-3.2	0	0	0	117.1
205	Q	27.9	Very low	27.5	Very low	134 Å²	134	143.4 Å²	143.4	63%	0.626	75%	0.749	S	S	*	*			trans	55.1	177.5	130.6	-54.1	-168.2	28.2	0	0	123.4
206	P	31.7	Very low	27.6	Very low	90 Å²	90	143.7 Å²	143.7	58%	0.584	75%	0.751	S	S	*	*				-138.7	-175.5	-74.2	43.5	-25.4	0	0	0	113.4
207	N	27.1	Very low	27.6	Very low	136 Å²	136	143.2 Å²	143.2	73%	0.727	75%	0.75	S	S	*	*			trans	170.2	112.6	139.1	-83.8	-26.9	0	0	0	110.7
208	I	26	Very low	28.3	Very low	127 Å²	127	139.4 Å²	139.4	65%	0.651	75%	0.745	S	S	*	*				69.6	122.8	84.1	-65.3	177	0	0	0	111
209	R	23.5	Very low	29.3	Very low	217 Å²	217	132.2 Å²	132.2	82%	0.819	72%	0.719	S	S	*	*			cis	-171.5	152.4	42.3	-126.3	153.3	-148.5	-155.7	6.2	110.1
210	T	24.7	Very low	30.4	Very low	134 Å²	134	133.8 Å²	133.8	82%	0.822	71%	0.711	S	S	*	*				168	128.2	115.7	37.9	0	0	0	0	114.6
211	N	23.1	Very low	31.8	Very low	152 Å²	152	128.1 Å²	128.1	81%	0.813	68%	0.678	S	S	*	*			trans	16	130.5	153.2	-78.7	-21.6	0	0	0	121.9
212	T	29.1	Very low	33.6	Very low	136 Å²	136	123.9 Å²	123.9	83%	0.834	66%	0.66	S	S	*	*				-176	129	117.7	22.4	0	0	0	0	113.6
213	K	27	Very low	35.3	Very low	196 Å²	196	120.4 Å²	120.4	85%	0.852	64%	0.641	S	S	*	*			trans	21.8	143.7	151.9	-60.1	179.6	179.5	-179.8	0	122.2
214	P	28.9	Very low	37.2	Very low	134 Å²	134	116.5 Å²	116.5	87%	0.87	62%	0.619	S	S	*	*			trans	-79.2	129.4	-178	33.9	-31	0	0	0	110.9
215	D	29.1	Very low	38.7	Very low	148 Å²	148	115.9 Å²	115.9	79%	0.791	62%	0.617	S	S	*	*			trans	-96.6	139.8	175	-150	-6	0	0	0	109.6	S217	D215-S217 PolarHBondContact O-N 2.85Å; D215-S217 VanDerWaalsContact O-N 3.07Å
216	N	28.5	Very low	39.8	Very low	172 Å²	172	118.3 Å²	118.3	92%	0.92	63%	0.625	S	S	*	*			trans	-86.2	79	-168.2	-143.8	1.1	0	0	0	108.9
217	S	35.9	Very low	41.1	Very low	82 Å²	82	121.9 Å²	121.9	57%	0.573	64%	0.639	S	S	*	*			trans	-114.3	117.8	-168.4	53.4	0	0	0	0	113.9	D215	D215-S217 PolarHBondContact O-N 2.85Å; D215-S217 VanDerWaalsContact O-N 3.07Å
218	S	41.9	Very low	42.5	Very low	89 Å²	89	120.5 Å²	120.5	62%	0.622	63%	0.627	S	S	*	*			trans	-2.1	116.1	160.7	-58.5	0	0	0	0	117.3	R220	S218-R220 PolarHBondContact O-N 3.16Å
219	L	46.1	Very low	44.3	Very low	46 Å²	46	122.6 Å²	122.6	24%	0.241	63%	0.631	C	S	.	*			trans	-54.1	61.9	161.5	-77	157.5	0	0	0	114.2	I176 T248	I176-L219 HydrophobicContact CD1-CB 3.4Å; I176-L219 VanDerWaalsContact CD1-CB 3.4Å; I176-L219 WeakPolarHBondContact CD1-O 3.2Å; L219-T248 WeakPolarHBondContact CD2-O 3.43Å
220	R	51.4	Low	46.5	Very low	122 Å²	122	118.8 Å²	118.8	46%	0.46	63%	0.626	S	S	.	*			trans	-85.3	130.7	169.7	-147.4	177.5	-175.6	-152.9	-0.2	108	S218 V222 D270	S218-R220 PolarHBondContact O-N 3.16Å; R220-V222 PolarHBondContact O-N 3.24Å; R220-V222 VanDerWaalsContact O-N 3.08Å; R220-D270 IonicContact CZ-OD1 3.38Å; R220-D270 IonicContact NE-OD1 3.02Å; R220-D270 IonicContact NH2-OD1 2.7Å; R220-D270 PolarHBondContact NH2-OD1 2.92Å
221	G	56.1	Low	49.1	Very low	3 Å²	3	115 Å²	115	3%	0.031	60%	0.601	C	S	.	*			trans	-68.8	107.1	172.4	0	0	0	0	0	108.1
222	V	64.4	Low	52.1	Low	63 Å²	63	108.9 Å²	108.9	38%	0.382	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	113.8	179.2	-175.9	0	0	0	0	108.5	R220 R224 D247	R220-V222 PolarHBondContact O-N 3.24Å; R220-V222 VanDerWaalsContact O-N 3.08Å; V222-R224 HydrophobicContact CG1-CG 4.02Å; V222-R224 PolarHBondContact O-N 2.91Å; V222-D247 PolarHBondContact N-O 2.92Å; V222-D247 VanDerWaalsContact N-O 3.09Å; V222-D247 PolarHBondContact O-N 3.16Å
223	L	65.1	Low	54.9	Low	75 Å²	75	107.1 Å²	107.1	39%	0.393	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.3	115.2	165.9	-94.7	179.2	0	0	0	109.3	P244 F245 I246 E269	L223-P244 HydrophobicContact CD2-CB 4.06Å; L223-F245 WeakPolarHBondContact CA-O 3.39Å; L223-I246 HydrophobicContact CD2-CD1 4.5Å; L223-I246 HydrophobicContact CD2-CG1 4.41Å; L223-E269 WeakPolarHBondContact CD1-OE1 3.27Å; L223-E269 HydrophobicContact CG-CG 4.38Å; L223-E269 WeakPolarHBondContact CG-OE1 3.33Å
224	R	65.7	Low	57.8	Low	95 Å²	95	97.8 Å²	97.8	36%	0.358	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135	175.5	-70.3	-178.5	172.3	175	-5.9	110.1	V222 F228 F245 D247	V222-R224 HydrophobicContact CG1-CG 4.02Å; V222-R224 PolarHBondContact O-N 2.91Å; R224-F228 HydrophobicContact CB-CE2 4.43Å; R224-F245 HydrophobicContact CB-CD1 4.23Å; R224-F245 HydrophobicContact CB-CE1 3.57Å; R224-F245 HydrophobicContact CB-CE2 3.97Å; R224-F245 HydrophobicContact CB-CZ 3.43Å; R224-F245 VanDerWaalsContact CB-CZ 3.43Å; R224-F245 HydrophobicContact CG-CE2 4.47Å; R224-F245 HydrophobicContact CG-CZ 4.21Å; R224-F245 PolarHBondContact N-O 2.95Å; R224-F245 VanDerWaalsContact N-O 3.13Å; R224-F245 WeakPolarHBondContact O-CD1 3.39Å; R224-F245 PolarHBondContact O-N 3.32Å; R224-D247 IonicContact CZ-OD2 3.69Å; R224-D247 IonicContact NE-OD2 3.75Å; R224-D247 IonicContact NH1-OD2 3.21Å; R224-D247 PolarHBondContact NH1-OD2 3.12Å
225	S	58.8	Low	60.7	Low	83 Å²	83	95.1 Å²	95.1	58%	0.58	49%	0.489	S	S	*	.			trans	-133.1	106.8	177.5	-70.7	0	0	0	0	109.7
226	K	51.7	Low	63.6	Low	185 Å²	185	91.9 Å²	91.9	80%	0.804	47%	0.474	S	S	*	.	S	Bend	trans	65.7	100	165.8	-63.5	176.9	176.8	176.7	0	117.9
227	D	58.3	Low	66.5	Low	164 Å²	164	85.5 Å²	85.5	88%	0.877	44%	0.442	S	S	*	.			trans	174.6	38.8	135.4	-85.1	-22	0	0	0	112.6
228	F	57.8	Low	69.2	Low	108 Å²	108	87.9 Å²	87.9	47%	0.474	45%	0.445	S	S	.	.			trans	-95	135.4	175	-70.3	-89.8	0	0	0	111	R224 I230 F245	R224-F228 HydrophobicContact CB-CE2 4.43Å; F228-I230 VanDerWaalsContact CB-O 3.25Å; F228-I230 WeakPolarHBondContact CB-O 3.29Å; F228-I230 PolarHBondContact O-N 3.3Å; F228-F245 HydrophobicContact CD2-CE1 4.16Å; F228-F245 AromaticContact CD2-CZ 3.96Å; F228-F245 HydrophobicContact CD2-CZ 3.96Å; F228-F245 HydrophobicContact CE2-CE1 4.13Å; F228-F245 AromaticContact CE2-CZ 3.62Å; F228-F245 HydrophobicContact CE2-CZ 3.62Å; F228-F245 HydrophobicContact CZ-CZ 4.26Å
229	K	63.7	Low	71.4	Confident	170 Å²	170	90 Å²	90	74%	0.739	45%	0.445	S	S	*	.	S	Bend	trans	-63.3	-17.6	172.9	-70.5	-176.9	-174.7	175.2	0	112.9
230	I	70.1	Confident	73.4	Confident	137 Å²	137	93 Å²	93	70%	0.703	46%	0.457	S	S	*	.	S	Bend	trans	-136.4	128	179.5	-56	176.4	0	0	0	107	F228	F228-I230 VanDerWaalsContact CB-O 3.25Å; F228-I230 WeakPolarHBondContact CB-O 3.29Å; F228-I230 PolarHBondContact O-N 3.3Å
231	N	79.4	Confident	75	Confident	55 Å²	55	87.7 Å²	87.7	29%	0.294	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-68.8	139.1	174.9	-68.2	-5.4	0	0	0	109.8	Q240 H242	N231-Q240 HydrophobicContact CB-CG 3.3Å; N231-Q240 VanDerWaalsContact CB-NE2 3.32Å; N231-Q240 PolarHBondContact ND2-NE2 2.81Å; N231-H242 PolarHBondContact ND2-CE1 2.91Å; N231-H242 VanDerWaalsContact ND2-CE1 3.26Å; N231-H242 PolarHBondContact ND2-ND1 2.84Å
232	P	85	Confident	76.3	Confident	23 Å²	23	94.4 Å²	94.4	15%	0.149	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-68	154	-179.4	26.6	-30.8	0	0	0	111.6	I241 F245 C252	P232-I241 HydrophobicContact CB-CD1 4.49Å; P232-I241 HydrophobicContact CG-CB 4.25Å; P232-I241 HydrophobicContact CG-CD1 4.3Å; P232-I241 PolarHBondContact O-N 2.88Å; P232-F245 HydrophobicContact CB-CD2 4.26Å; P232-F245 HydrophobicContact CB-CE2 4.3Å; P232-F245 HydrophobicContact CG-CB 4.12Å; P232-F245 HydrophobicContact CG-CD1 3.55Å; P232-F245 HydrophobicContact CG-CD2 3.72Å; P232-F245 HydrophobicContact CG-CE1 3.73Å; P232-F245 HydrophobicContact CG-CE2 3.88Å; P232-F245 HydrophobicContact CG-CG 3.53Å; P232-F245 HydrophobicContact CG-CZ 3.87Å; P232-C252 HydrophobicContact CB-CB 3.86Å
233	I	87.6	Confident	77.1	Confident	100 Å²	100	93.4 Å²	93.4	51%	0.513	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-99.9	131.4	176	-61.3	173.4	0	0	0	108.6	H235 Q239 C252	I233-H235 PolarHBondContact O-N 3.21Å; I233-Q239 WeakPolarHBondContact CA-O 3.37Å; I233-C252 WeakPolarHBondContact O-CB 3.42Å
234	C	89.3	Confident	77.9	Confident	0 Å²	0	93 Å²	93	0%	0	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-69.4	127.2	175.3	178.9	0	0	0	0	110.7	V236 C237 Q238 Q239 I241 C252 C254 H257	C234-V236 PolarHBondContact O-N 2.89Å; C234-V236 PolarHBondContact SG-N 3.22Å; C234-C237 WeakPolarHBondContact CB-SG 3.47Å; C234-C237 VanDerWaalsContact SG-SG 3.67Å; C234-Q238 VanDerWaalsContact O-CA 3.23Å; C234-Q238 WeakPolarHBondContact O-CA 3.45Å; C234-Q238 PolarHBondContact O-N 3.38Å; C234-Q239 PolarHBondContact N-O 3.25Å; C234-I241 HydrophobicContact CB-CD1 3.85Å; C234-I241 HydrophobicContact CB-CG1 3.78Å; C234-C252 CarbonylContact C-O 3.53Å; C234-C252 WeakPolarHBondContact CA-O 3.34Å; C234-C254 HydrophobicContact CB-CB 4.4Å; C234-C254 PolarHBondContact SG-N 3.38Å; C234-H257 PolarHBondContact SG-ND1 2.64Å
235	H	89.9	Confident	78.9	Confident	78 Å²	78	88.9 Å²	88.9	36%	0.361	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.1	178.7	-177.6	73.7	0	0	0	113.6	I233 Q238 R251 C252 F253	I233-H235 PolarHBondContact O-N 3.21Å; H235-Q238 PolarHBondContact O-NE2 2.89Å; H235-R251 HydrophobicContact CB-CB 4.12Å; H235-R251 HydrophobicContact CB-CG 4.42Å; H235-R251 PolarHBondContact NE2-NH1 3.13Å; H235-C252 PolarHBondContact N-O 3.15Å; H235-F253 HydrophobicContact CB-CD1 4.4Å; H235-F253 HydrophobicContact CB-CE1 3.99Å; H235-F253 HydrophobicContact CB-CZ 4.3Å
236	V	88.5	Confident	80.2	Confident	79 Å²	79	85.2 Å²	85.2	48%	0.479	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-57.4	-176.9	-179.7	0	0	0	0	111.7	C234 F253 H257	C234-V236 PolarHBondContact O-N 2.89Å; C234-V236 PolarHBondContact SG-N 3.22Å; V236-F253 HydrophobicContact CG2-CD1 3.97Å; V236-F253 HydrophobicContact CG2-CE1 4.01Å; V236-H257 HydrophobicContact CB-CB 3.69Å; V236-H257 HydrophobicContact CG1-CB 4.11Å; V236-H257 HydrophobicContact CG2-CB 3.89Å
237	C	91	Very high	81.7	Confident	38 Å²	38	77.3 Å²	77.3	26%	0.257	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.2	-178.7	60	0	0	0	0	115.4	C234 Q239 H257	C234-C237 WeakPolarHBondContact CB-SG 3.47Å; C234-C237 VanDerWaalsContact SG-SG 3.67Å; C237-Q239 HydrophobicContact CB-CG 4.44Å; C237-Q239 PolarHBondContact O-N 2.85Å; C237-Q239 VanDerWaalsContact O-N 3.07Å; C237-H257 WeakPolarHBondContact CB-CE1 3.45Å; C237-H257 VanDerWaalsContact SG-CE1 3.53Å; C237-H257 PolarHBondContact SG-ND1 3.19Å
238	Q	91.3	Very high	82.5	Confident	133 Å²	133	69.5 Å²	69.5	62%	0.621	36%	0.356	S	S	*	.			trans	58.6	20.1	-178.7	-56.8	-64.4	-26.4	0	0	113.9	C234 H235	C234-Q238 VanDerWaalsContact O-CA 3.23Å; C234-Q238 WeakPolarHBondContact O-CA 3.45Å; C234-Q238 PolarHBondContact O-N 3.38Å; H235-Q238 PolarHBondContact O-NE2 2.89Å
239	Q	88.3	Confident	83.2	Confident	134 Å²	134	68.4 Å²	68.4	63%	0.626	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-102.6	150.4	177.9	-67	172.9	10.9	0	0	111.1	I233 C234 C237 I241	I233-Q239 WeakPolarHBondContact CA-O 3.37Å; C234-Q239 PolarHBondContact N-O 3.25Å; C237-Q239 HydrophobicContact CB-CG 4.44Å; C237-Q239 PolarHBondContact O-N 2.85Å; C237-Q239 VanDerWaalsContact O-N 3.07Å; Q239-I241 PolarHBondContact O-N 2.99Å
240	Q	88.8	Confident	83.7	Confident	107 Å²	107	65.9 Å²	65.9	50%	0.5	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-62.7	124	171.6	-171.2	170.4	-28.3	0	0	109.9	N231 H242	N231-Q240 HydrophobicContact CB-CG 3.3Å; N231-Q240 VanDerWaalsContact CB-NE2 3.32Å; N231-Q240 PolarHBondContact ND2-NE2 2.81Å; Q240-H242 PolarHBondContact O-CD2 2.97Å; Q240-H242 VanDerWaalsContact O-CD2 3.32Å; Q240-H242 PolarHBondContact O-N 2.97Å
241	I	85.1	Confident	84.5	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.062	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-83.2	116.2	-178.7	-50.9	169.3	0	0	0	108.3	P232 C234 Q239 F245 C252 C254	P232-I241 HydrophobicContact CB-CD1 4.49Å; P232-I241 HydrophobicContact CG-CB 4.25Å; P232-I241 HydrophobicContact CG-CD1 4.3Å; P232-I241 PolarHBondContact O-N 2.88Å; C234-I241 HydrophobicContact CB-CD1 3.85Å; C234-I241 HydrophobicContact CB-CG1 3.78Å; Q239-I241 PolarHBondContact O-N 2.99Å; I241-F245 HydrophobicContact CB-CB 4.39Å; I241-F245 HydrophobicContact CD1-CB 3.79Å; I241-F245 HydrophobicContact CG2-CB 3.9Å; I241-C252 HydrophobicContact CD1-CB 4.21Å; I241-C254 HydrophobicContact CD1-CB 4.32Å; I241-C254 HydrophobicContact CG1-CB 4.18Å; I241-C254 HydrophobicContact CG2-CB 4.19Å
242	H	83.3	Confident	84.9	Confident	144 Å²	144	61 Å²	61	67%	0.667	32%	0.322	S	S	*	.			trans	-98.4	111.7	172.4	-68.8	-95.4	0	0	0	109.1	N231 Q240	N231-H242 PolarHBondContact ND2-CE1 2.91Å; N231-H242 VanDerWaalsContact ND2-CE1 3.26Å; N231-H242 PolarHBondContact ND2-ND1 2.84Å; Q240-H242 PolarHBondContact O-CD2 2.97Å; Q240-H242 VanDerWaalsContact O-CD2 3.32Å; Q240-H242 PolarHBondContact O-N 2.97Å
243	G	81.4	Confident	85.1	Confident	41 Å²	41	60.1 Å²	60.1	42%	0.423	32%	0.316	S	S	.	.	S	Bend	trans	109.5	-152.5	-179.4	0	0	0	0	0	113
244	P	81.7	Confident	85.1	Confident	66 Å²	66	56.2 Å²	56.2	43%	0.429	30%	0.297	S	S	.	.			trans	-60.7	141.5	178.9	-20.8	32.4	0	0	0	112	L223 P255	L223-P244 HydrophobicContact CD2-CB 4.06Å; P244-P255 WeakPolarHBondContact O-CD 3.46Å
245	F	86.3	Confident	84.9	Confident	9 Å²	9	59.5 Å²	59.5	4%	0.039	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	156.3	175.9	65.8	-84.4	0	0	0	110.6	L223 R224 F228 P232 I241 D247 C252	L223-F245 WeakPolarHBondContact CA-O 3.39Å; R224-F245 HydrophobicContact CB-CD1 4.23Å; R224-F245 HydrophobicContact CB-CE1 3.57Å; R224-F245 HydrophobicContact CB-CE2 3.97Å; R224-F245 HydrophobicContact CB-CZ 3.43Å; R224-F245 VanDerWaalsContact CB-CZ 3.43Å; R224-F245 HydrophobicContact CG-CE2 4.47Å; R224-F245 HydrophobicContact CG-CZ 4.21Å; R224-F245 PolarHBondContact N-O 2.95Å; R224-F245 VanDerWaalsContact N-O 3.13Å; R224-F245 WeakPolarHBondContact O-CD1 3.39Å; R224-F245 PolarHBondContact O-N 3.32Å; F228-F245 HydrophobicContact CD2-CE1 4.16Å; F228-F245 AromaticContact CD2-CZ 3.96Å; F228-F245 HydrophobicContact CD2-CZ 3.96Å; F228-F245 HydrophobicContact CE2-CE1 4.13Å; F228-F245 AromaticContact CE2-CZ 3.62Å; F228-F245 HydrophobicContact CE2-CZ 3.62Å; F228-F245 HydrophobicContact CZ-CZ 4.26Å; P232-F245 HydrophobicContact CB-CD2 4.26Å; P232-F245 HydrophobicContact CB-CE2 4.3Å; P232-F245 HydrophobicContact CG-CB 4.12Å; P232-F245 HydrophobicContact CG-CD1 3.55Å; P232-F245 HydrophobicContact CG-CD2 3.72Å; P232-F245 HydrophobicContact CG-CE1 3.73Å; P232-F245 HydrophobicContact CG-CE2 3.88Å; P232-F245 HydrophobicContact CG-CG 3.53Å; P232-F245 HydrophobicContact CG-CZ 3.87Å; I241-F245 HydrophobicContact CB-CB 4.39Å; I241-F245 HydrophobicContact CD1-CB 3.79Å; I241-F245 HydrophobicContact CG2-CB 3.9Å; F245-D247 HydrophobicContact CD2-CB 4.29Å; F245-D247 HydrophobicContact CE2-CB 4.01Å; F245-C252 HydrophobicContact CD2-CB 4.46Å
246	I	86	Confident	84.9	Confident	7 Å²	7	62.2 Å²	62.2	4%	0.036	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.3	175.4	-58.3	82.3	0	0	0	107.6	L223 T248 C252 F253 P255 F258	L223-I246 HydrophobicContact CD2-CD1 4.5Å; L223-I246 HydrophobicContact CD2-CG1 4.41Å; I246-T248 HydrophobicContact CG2-CG2 4.25Å; I246-C252 CarbonylContact O-C 3.55Å; I246-C252 WeakPolarHBondContact O-CA 3.37Å; I246-F253 HydrophobicContact CB-CB 4.39Å; I246-F253 PolarHBondContact N-O 3.28Å; I246-F253 PolarHBondContact O-N 3.34Å; I246-P255 HydrophobicContact CD1-CB 4.47Å; I246-P255 HydrophobicContact CD1-CG 4.31Å; I246-F258 HydrophobicContact CB-CD2 4.26Å; I246-F258 HydrophobicContact CB-CG 4.21Å; I246-F258 HydrophobicContact CD1-CB 3.89Å; I246-F258 HydrophobicContact CD1-CD1 4.46Å; I246-F258 HydrophobicContact CD1-CG 4.25Å; I246-F258 HydrophobicContact CG1-CB 4.18Å; I246-F258 HydrophobicContact CG1-CD1 3.97Å; I246-F258 HydrophobicContact CG1-CG 3.97Å; I246-F258 HydrophobicContact CG2-CD1 4.26Å; I246-F258 HydrophobicContact CG2-CD2 3.89Å; I246-F258 HydrophobicContact CG2-CE1 4.14Å; I246-F258 HydrophobicContact CG2-CE2 3.79Å; I246-F258 HydrophobicContact CG2-CG 4.13Å; I246-F258 HydrophobicContact CG2-CZ 3.91Å
247	D	83.3	Confident	84.9	Confident	18 Å²	18	61.3 Å²	61.3	10%	0.096	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.9	175.7	-169.5	-8.9	0	0	0	109.3	V222 R224 F245 N249	V222-D247 PolarHBondContact N-O 2.92Å; V222-D247 VanDerWaalsContact N-O 3.09Å; V222-D247 PolarHBondContact O-N 3.16Å; R224-D247 IonicContact CZ-OD2 3.69Å; R224-D247 IonicContact NE-OD2 3.75Å; R224-D247 IonicContact NH1-OD2 3.21Å; R224-D247 PolarHBondContact NH1-OD2 3.12Å; F245-D247 HydrophobicContact CD2-CB 4.29Å; F245-D247 HydrophobicContact CE2-CB 4.01Å; D247-N249 PolarHBondContact OD1-N 2.83Å
248	T	75.8	Confident	84.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.315	C	S	.	.			trans	-104.3	31.2	176.3	69.8	0	0	0	0	111.6	L219 I246 D250 R251 F253 F258 F272	L219-T248 WeakPolarHBondContact CD2-O 3.43Å; I246-T248 HydrophobicContact CG2-CG2 4.25Å; T248-D250 PolarHBondContact O-N 3.28Å; T248-R251 PolarHBondContact N-O 2.84Å; T248-R251 PolarHBondContact OG1-O 2.98Å; T248-F253 HydrophobicContact CG2-CD2 3.99Å; T248-F253 HydrophobicContact CG2-CE2 3.78Å; T248-F258 HydrophobicContact CG2-CE2 4.07Å; T248-F272 HydrophobicContact CG2-CE2 3.99Å; T248-F272 HydrophobicContact CG2-CZ 3.61Å
249	N	70.8	Confident	85	Confident	86 Å²	86	55.6 Å²	55.6	46%	0.46	30%	0.298	S	S	.	.	S	Bend	trans	66.5	-38.1	-174.9	-60	-32.3	0	0	0	115.1	D247	D247-N249 PolarHBondContact OD1-N 2.83Å
250	D	75.2	Confident	85.2	Confident	117 Å²	117	49.2 Å²	49.2	63%	0.626	27%	0.269	S	S	*	.	S	Bend	trans	-102.8	-26.2	-179.5	-67.8	-37.3	0	0	0	113.1	T248	T248-D250 PolarHBondContact O-N 3.28Å
251	R	86.2	Confident	85.4	Confident	61 Å²	61	47.1 Å²	47.1	23%	0.23	26%	0.261	C	S	.	.			trans	-144.5	144.4	-171	-64.1	175.6	-168.2	172.6	29.5	110.8	H235 T248 F253 E274 G277	H235-R251 HydrophobicContact CB-CB 4.12Å; H235-R251 HydrophobicContact CB-CG 4.42Å; H235-R251 PolarHBondContact NE2-NH1 3.13Å; T248-R251 PolarHBondContact N-O 2.84Å; T248-R251 PolarHBondContact OG1-O 2.98Å; R251-F253 HydrophobicContact CB-CD2 4.44Å; R251-F253 HydrophobicContact CB-CE2 3.54Å; R251-F253 HydrophobicContact CB-CZ 3.72Å; R251-E274 IonicContact CZ-OE1 3.33Å; R251-E274 IonicContact NE-OE1 2.72Å; R251-E274 IonicContact NH1-OE1 3.82Å; R251-E274 IonicContact NH2-OE1 4Å; R251-E274 PolarHBondContact NH2-OE1 3.37Å; R251-G277 VanDerWaalsContact NH1-CA 3.31Å; R251-G277 PolarHBondContact NH1-O 3.48Å
252	C	87.6	Confident	85.7	Confident	28 Å²	28	52.1 Å²	52.1	19%	0.189	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.9	173	-69	0	0	0	0	110.1	P232 I233 C234 H235 I241 F245 I246	P232-C252 HydrophobicContact CB-CB 3.86Å; I233-C252 WeakPolarHBondContact O-CB 3.42Å; C234-C252 CarbonylContact C-O 3.53Å; C234-C252 WeakPolarHBondContact CA-O 3.34Å; H235-C252 PolarHBondContact N-O 3.15Å; I241-C252 HydrophobicContact CD1-CB 4.21Å; F245-C252 HydrophobicContact CD2-CB 4.46Å; I246-C252 CarbonylContact O-C 3.55Å; I246-C252 WeakPolarHBondContact O-CA 3.37Å
253	F	89.1	Confident	86.1	Confident	5 Å²	5	47.3 Å²	47.3	2%	0.022	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.2	177.7	-57.9	-93.3	0	0	0	109.9	H235 V236 I246 T248 R251 F258 L279	H235-F253 HydrophobicContact CB-CD1 4.4Å; H235-F253 HydrophobicContact CB-CE1 3.99Å; H235-F253 HydrophobicContact CB-CZ 4.3Å; V236-F253 HydrophobicContact CG2-CD1 3.97Å; V236-F253 HydrophobicContact CG2-CE1 4.01Å; I246-F253 HydrophobicContact CB-CB 4.39Å; I246-F253 PolarHBondContact N-O 3.28Å; I246-F253 PolarHBondContact O-N 3.34Å; T248-F253 HydrophobicContact CG2-CD2 3.99Å; T248-F253 HydrophobicContact CG2-CE2 3.78Å; R251-F253 HydrophobicContact CB-CD2 4.44Å; R251-F253 HydrophobicContact CB-CE2 3.54Å; R251-F253 HydrophobicContact CB-CZ 3.72Å; F253-F258 HydrophobicContact CB-CB 4.07Å; F253-F258 HydrophobicContact CB-CD2 4.2Å; F253-F258 HydrophobicContact CD2-CD2 4.16Å; F253-F258 HydrophobicContact CG-CD2 4.15Å; F253-L279 HydrophobicContact CD1-CD1 4.21Å; F253-L279 HydrophobicContact CD2-CD1 4.48Å; F253-L279 HydrophobicContact CE1-CD1 3.81Å; F253-L279 HydrophobicContact CE2-CD1 4.1Å; F253-L279 HydrophobicContact CZ-CD1 3.76Å; F253-L279 HydrophobicContact CZ-CG 4.34Å
254	C	87.9	Confident	86.6	Confident	18 Å²	18	51.6 Å²	51.6	12%	0.122	27%	0.271	C	S	.	.			trans	-74.6	157.3	164.4	74.1	0	0	0	0	108.9	C234 I241 N256 H257 F258	C234-C254 HydrophobicContact CB-CB 4.4Å; C234-C254 PolarHBondContact SG-N 3.38Å; I241-C254 HydrophobicContact CD1-CB 4.32Å; I241-C254 HydrophobicContact CG1-CB 4.18Å; I241-C254 HydrophobicContact CG2-CB 4.19Å; C254-N256 PolarHBondContact O-N 2.92Å; C254-H257 PolarHBondContact O-N 3.16Å; C254-H257 PolarHBondContact SG-ND1 3.49Å; C254-F258 PolarHBondContact O-N 3.43Å
255	P	86.6	Confident	87.1	Confident	69 Å²	69	54.4 Å²	54.4	45%	0.448	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-52.5	-32.6	-179.6	-29.3	36.2	0	0	0	114.2	P244 I246	P244-P255 WeakPolarHBondContact O-CD 3.46Å; I246-P255 HydrophobicContact CD1-CB 4.47Å; I246-P255 HydrophobicContact CD1-CG 4.31Å
256	N	88.1	Confident	87.3	Confident	134 Å²	134	58.6 Å²	58.6	72%	0.717	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-78	-18.5	-179.7	-62.6	-17	0	0	0	114.1	C254	C254-N256 PolarHBondContact O-N 2.92Å
257	H	89.7	Confident	87.4	Confident	61 Å²	61	58.9 Å²	58.9	28%	0.282	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-108.9	3.3	-179.7	-67	132.3	0	0	0	113.3	C234 V236 C237 C254 T259	C234-H257 PolarHBondContact SG-ND1 2.64Å; V236-H257 HydrophobicContact CB-CB 3.69Å; V236-H257 HydrophobicContact CG1-CB 4.11Å; V236-H257 HydrophobicContact CG2-CB 3.89Å; C237-H257 WeakPolarHBondContact CB-CE1 3.45Å; C237-H257 VanDerWaalsContact SG-CE1 3.53Å; C237-H257 PolarHBondContact SG-ND1 3.19Å; C254-H257 PolarHBondContact O-N 3.16Å; C254-H257 PolarHBondContact SG-ND1 3.49Å; H257-T259 PolarHBondContact O-N 3.22Å
258	F	91.1	Very high	87.3	Confident	7 Å²	7	61.2 Å²	61.2	3%	0.031	33%	0.326	C	S	.	.			trans	-89.4	67.3	169.9	-167.1	-115.3	0	0	0	109.4	I246 T248 F253 C254 L267 F272 L279	I246-F258 HydrophobicContact CB-CD2 4.26Å; I246-F258 HydrophobicContact CB-CG 4.21Å; I246-F258 HydrophobicContact CD1-CB 3.89Å; I246-F258 HydrophobicContact CD1-CD1 4.46Å; I246-F258 HydrophobicContact CD1-CG 4.25Å; I246-F258 HydrophobicContact CG1-CB 4.18Å; I246-F258 HydrophobicContact CG1-CD1 3.97Å; I246-F258 HydrophobicContact CG1-CG 3.97Å; I246-F258 HydrophobicContact CG2-CD1 4.26Å; I246-F258 HydrophobicContact CG2-CD2 3.89Å; I246-F258 HydrophobicContact CG2-CE1 4.14Å; I246-F258 HydrophobicContact CG2-CE2 3.79Å; I246-F258 HydrophobicContact CG2-CG 4.13Å; I246-F258 HydrophobicContact CG2-CZ 3.91Å; T248-F258 HydrophobicContact CG2-CE2 4.07Å; F253-F258 HydrophobicContact CB-CB 4.07Å; F253-F258 HydrophobicContact CB-CD2 4.2Å; F253-F258 HydrophobicContact CD2-CD2 4.16Å; F253-F258 HydrophobicContact CG-CD2 4.15Å; C254-F258 PolarHBondContact O-N 3.43Å; F258-L267 HydrophobicContact CD1-CB 3.65Å; F258-L267 WeakPolarHBondContact CD1-O 3.26Å; F258-L267 HydrophobicContact CD2-CD1 4.33Å; F258-L267 HydrophobicContact CE1-CB 3.42Å; F258-L267 VanDerWaalsContact CE1-CB 3.42Å; F258-L267 WeakPolarHBondContact CE1-O 3.25Å; F258-L267 HydrophobicContact CE2-CB 4.46Å; F258-L267 HydrophobicContact CE2-CD1 4.2Å; F258-L267 HydrophobicContact CG-CB 4.28Å; F258-L267 HydrophobicContact CZ-CB 3.87Å; F258-L267 HydrophobicContact CZ-CD1 4.33Å; F258-L267 PolarHBondContact O-N 2.85Å; F258-F272 HydrophobicContact CE1-CD1 4.44Å; F258-F272 HydrophobicContact CE2-CD1 4.3Å; F258-F272 HydrophobicContact CE2-CD2 4.34Å; F258-F272 HydrophobicContact CE2-CE1 4.24Å; F258-F272 HydrophobicContact CE2-CE2 4.27Å; F258-F272 HydrophobicContact CE2-CG 4.35Å; F258-F272 HydrophobicContact CE2-CZ 4.22Å; F258-F272 AromaticContact CZ-CD1 3.52Å; F258-F272 HydrophobicContact CZ-CD1 3.52Å; F258-F272 HydrophobicContact CZ-CD2 4.3Å; F258-F272 AromaticContact CZ-CE1 3.66Å; F258-F272 HydrophobicContact CZ-CE1 3.66Å; F258-F272 HydrophobicContact CZ-CE2 4.41Å; F258-F272 AromaticContact CZ-CG 3.86Å; F258-F272 HydrophobicContact CZ-CG 3.86Å; F258-F272 HydrophobicContact CZ-CZ 4.11Å; F258-L279 HydrophobicContact CD2-CD1 3.64Å; F258-L279 HydrophobicContact CE2-CD1 3.76Å
259	T	92.8	Very high	87	Confident	43 Å²	43	65.2 Å²	65.2	26%	0.264	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-128.2	151	-172.4	53.9	0	0	0	0	110.9	H257 D261 Q265	H257-T259 PolarHBondContact O-N 3.22Å; T259-D261 PolarHBondContact O-N 3.4Å; T259-Q265 CarbonylContact C-O 3.57Å; T259-Q265 VanDerWaalsContact CA-O 3.31Å; T259-Q265 WeakPolarHBondContact CA-O 3.47Å
260	C	92.5	Very high	86.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.342	C	S	.	.			trans	-64.7	132.1	175.4	-179.3	0	0	0	0	111.4	Y262 C263 H264 Q265 L267 L279 C281 D284	C260-Y262 PolarHBondContact O-N 3.45Å; C260-Y262 PolarHBondContact SG-N 3.47Å; C260-C263 WeakPolarHBondContact CB-SG 3.4Å; C260-C263 VanDerWaalsContact SG-SG 3.7Å; C260-H264 WeakPolarHBondContact O-CA 3.28Å; C260-H264 PolarHBondContact O-N 2.89Å; C260-H264 PolarHBondContact O-ND1 2.93Å; C260-Q265 PolarHBondContact N-O 3.39Å; C260-L267 HydrophobicContact CB-CD2 3.8Å; C260-L267 HydrophobicContact CB-CG 4.49Å; C260-L279 CarbonylContact C-O 3.53Å; C260-L279 WeakPolarHBondContact CA-O 3.49Å; C260-C281 HydrophobicContact CB-CB 4.17Å; C260-C281 PolarHBondContact SG-N 3.18Å; C260-D284 PolarHBondContact SG-OD2 3.25Å
261	D	92.4	Very high	86.7	Confident	63 Å²	63	59.5 Å²	59.5	34%	0.337	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-22.3	176.5	-170.2	81.1	0	0	0	112.5	T259 H264 K278 L279 Y280	T259-D261 PolarHBondContact O-N 3.4Å; D261-H264 PolarHBondContact O-CE1 3.22Å; D261-H264 VanDerWaalsContact O-CE1 3.26Å; D261-K278 HydrophobicContact CB-CB 4.13Å; D261-K278 IonicContact OD1-NZ 3.61Å; D261-K278 PolarHBondContact OD1-NZ 3.26Å; D261-K278 WeakPolarHBondContact OD2-CD 3.08Å; D261-K278 WeakPolarHBondContact OD2-CE 3.4Å; D261-K278 IonicContact OD2-NZ 3.32Å; D261-K278 PolarHBondContact OD2-NZ 2.97Å; D261-L279 WeakPolarHBondContact CB-O 3.49Å; D261-L279 PolarHBondContact N-O 2.95Å; D261-Y280 HydrophobicContact CB-CD1 4.33Å; D261-Y280 HydrophobicContact CB-CE1 3.97Å
262	Y	91.1	Very high	86.7	Confident	117 Å²	117	56.9 Å²	56.9	46%	0.459	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-62.3	-179.9	-167.1	-90.7	0	0	0	112.9	C260 D284 Y288	C260-Y262 PolarHBondContact O-N 3.45Å; C260-Y262 PolarHBondContact SG-N 3.47Å; Y262-D284 HydrophobicContact CD1-CB 4.05Å; Y262-D284 VanDerWaalsContact CD1-CG 3.47Å; Y262-D284 HydrophobicContact CG-CB 4.19Å; Y262-Y288 HydrophobicContact CD1-CD2 4.13Å; Y262-Y288 HydrophobicContact CD1-CE2 4.27Å; Y262-Y288 AromaticContact CE1-CD2 3.67Å; Y262-Y288 HydrophobicContact CE1-CD2 3.67Å; Y262-Y288 AromaticContact CE1-CE2 3.55Å; Y262-Y288 HydrophobicContact CE1-CE2 3.55Å; Y262-Y288 HydrophobicContact CE1-CG 4.46Å; Y262-Y288 HydrophobicContact CE2-CD2 4.23Å; Y262-Y288 HydrophobicContact CE2-CG 4.31Å; Y262-Y288 AromaticContact CZ-CD2 3.73Å; Y262-Y288 AromaticContact CZ-CE2 3.84Å
263	C	93.2	Very high	86.4	Confident	43 Å²	43	55.6 Å²	55.6	29%	0.291	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-6.2	-178.5	68.2	0	0	0	0	115.4	C260 Q265 D284	C260-C263 WeakPolarHBondContact CB-SG 3.4Å; C260-C263 VanDerWaalsContact SG-SG 3.7Å; C263-Q265 HydrophobicContact CB-CG 4.35Å; C263-Q265 PolarHBondContact O-N 2.96Å; C263-D284 WeakPolarHBondContact CB-OD2 3.44Å; C263-D284 PolarHBondContact N-OD2 3.22Å; C263-D284 PolarHBondContact SG-OD2 2.97Å
264	H	92	Very high	86.1	Confident	132 Å²	132	55.7 Å²	55.7	61%	0.611	30%	0.297	S	S	*	.			trans	60.8	9.3	-178.1	-50.4	-48.9	0	0	0	115.8	C260 D261	C260-H264 WeakPolarHBondContact O-CA 3.28Å; C260-H264 PolarHBondContact O-N 2.89Å; C260-H264 PolarHBondContact O-ND1 2.93Å; D261-H264 PolarHBondContact O-CE1 3.22Å; D261-H264 VanDerWaalsContact O-CE1 3.26Å
265	Q	92	Very high	85.5	Confident	124 Å²	124	55.8 Å²	55.8	58%	0.579	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-73.3	147.3	173.8	-62.9	-58.4	-46.8	0	0	111	T259 C260 C263 L267	T259-Q265 CarbonylContact C-O 3.57Å; T259-Q265 VanDerWaalsContact CA-O 3.31Å; T259-Q265 WeakPolarHBondContact CA-O 3.47Å; C260-Q265 PolarHBondContact N-O 3.39Å; C263-Q265 HydrophobicContact CB-CG 4.35Å; C263-Q265 PolarHBondContact O-N 2.96Å; Q265-L267 PolarHBondContact O-N 3.18Å
266	P	90	Very high	85.2	Confident	97 Å²	97	58.4 Å²	58.4	63%	0.63	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-54.2	133.1	170	-23.7	33.9	0	0	0	111
267	L	88.7	Confident	84.8	Confident	14 Å²	14	53.3 Å²	53.3	7%	0.073	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-80	141.8	178.6	-65.5	167.6	0	0	0	109.9	F258 C260 Q265 F272 L279 Y280 C281	F258-L267 HydrophobicContact CD1-CB 3.65Å; F258-L267 WeakPolarHBondContact CD1-O 3.26Å; F258-L267 HydrophobicContact CD2-CD1 4.33Å; F258-L267 HydrophobicContact CE1-CB 3.42Å; F258-L267 VanDerWaalsContact CE1-CB 3.42Å; F258-L267 WeakPolarHBondContact CE1-O 3.25Å; F258-L267 HydrophobicContact CE2-CB 4.46Å; F258-L267 HydrophobicContact CE2-CD1 4.2Å; F258-L267 HydrophobicContact CG-CB 4.28Å; F258-L267 HydrophobicContact CZ-CB 3.87Å; F258-L267 HydrophobicContact CZ-CD1 4.33Å; F258-L267 PolarHBondContact O-N 2.85Å; C260-L267 HydrophobicContact CB-CD2 3.8Å; C260-L267 HydrophobicContact CB-CG 4.49Å; Q265-L267 PolarHBondContact O-N 3.18Å; L267-F272 HydrophobicContact CB-CB 4.24Å; L267-F272 HydrophobicContact CD1-CB 4.14Å; L267-F272 HydrophobicContact CD2-CB 4.09Å; L267-F272 HydrophobicContact CG-CB 4.39Å; L267-L279 HydrophobicContact CD1-CB 3.37Å; L267-L279 HydrophobicContact CD1-CD1 3.83Å; L267-L279 HydrophobicContact CD1-CG 4.22Å; L267-Y280 VanDerWaalsContact CD2-C 3.5Å; L267-C281 HydrophobicContact CD2-CB 3.82Å; L267-C281 VanDerWaalsContact CD2-N 3.32Å
268	S	79.7	Confident	84.7	Confident	67 Å²	67	55 Å²	55	47%	0.469	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-73.9	140.4	171.9	44.3	0	0	0	0	110.9	D270 G271	S268-D270 PolarHBondContact O-N 3.36Å; S268-D270 VanDerWaalsContact O-N 3.14Å; S268-G271 PolarHBondContact O-N 3.45Å; S268-G271 PolarHBondContact OG-O 3.43Å
269	E	70.3	Confident	84.6	Confident	84 Å²	84	55.1 Å²	55.1	39%	0.393	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.1	171.8	-70.7	165.3	-129	0	0	112.9	L223	L223-E269 WeakPolarHBondContact CD1-OE1 3.27Å; L223-E269 HydrophobicContact CG-CG 4.38Å; L223-E269 WeakPolarHBondContact CG-OE1 3.33Å
270	D	66.5	Low	84.4	Confident	77 Å²	77	54.1 Å²	54.1	41%	0.412	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-7.5	-173.3	-75.9	-36.6	0	0	0	115.1	T178 R220 S268	T178-D270 WeakPolarHBondContact OG1-CB 3.26Å; T178-D270 PolarHBondContact OG1-O 3.47Å; R220-D270 IonicContact CZ-OD1 3.38Å; R220-D270 IonicContact NE-OD1 3.02Å; R220-D270 IonicContact NH2-OD1 2.7Å; R220-D270 PolarHBondContact NH2-OD1 2.92Å; S268-D270 PolarHBondContact O-N 3.36Å; S268-D270 VanDerWaalsContact O-N 3.14Å
271	G	74.2	Confident	84.2	Confident	5 Å²	5	55.4 Å²	55.4	5%	0.052	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-173.3	107.6	-176.1	0	0	0	0	0	113.8	I176 S268	I176-G271 WeakPolarHBondContact O-CA 3.34Å; S268-G271 PolarHBondContact O-N 3.45Å; S268-G271 PolarHBondContact OG-O 3.43Å
272	F	85.7	Confident	83.8	Confident	7 Å²	7	55.9 Å²	55.9	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	159.8	169.5	65.3	-81.4	0	0	0	108.8	P175 T248 F258 L267 L279 Y280	P175-F272 WeakPolarHBondContact CA-O 3.2Å; T248-F272 HydrophobicContact CG2-CE2 3.99Å; T248-F272 HydrophobicContact CG2-CZ 3.61Å; F258-F272 HydrophobicContact CE1-CD1 4.44Å; F258-F272 HydrophobicContact CE2-CD1 4.3Å; F258-F272 HydrophobicContact CE2-CD2 4.34Å; F258-F272 HydrophobicContact CE2-CE1 4.24Å; F258-F272 HydrophobicContact CE2-CE2 4.27Å; F258-F272 HydrophobicContact CE2-CG 4.35Å; F258-F272 HydrophobicContact CE2-CZ 4.22Å; F258-F272 AromaticContact CZ-CD1 3.52Å; F258-F272 HydrophobicContact CZ-CD1 3.52Å; F258-F272 HydrophobicContact CZ-CD2 4.3Å; F258-F272 AromaticContact CZ-CE1 3.66Å; F258-F272 HydrophobicContact CZ-CE1 3.66Å; F258-F272 HydrophobicContact CZ-CE2 4.41Å; F258-F272 AromaticContact CZ-CG 3.86Å; F258-F272 HydrophobicContact CZ-CG 3.86Å; F258-F272 HydrophobicContact CZ-CZ 4.11Å; L267-F272 HydrophobicContact CB-CB 4.24Å; L267-F272 HydrophobicContact CD1-CB 4.14Å; L267-F272 HydrophobicContact CD2-CB 4.09Å; L267-F272 HydrophobicContact CG-CB 4.39Å; F272-L279 HydrophobicContact CD2-CD2 3.91Å; F272-L279 HydrophobicContact CE2-CD2 3.97Å; F272-Y280 WeakPolarHBondContact CA-O 3.41Å
273	A	81	Confident	83.6	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.1	175.2	0	0	0	0	0	110	P175 L279 Y280 F285	P175-A273 HydrophobicContact CB-CB 4.12Å; P175-A273 HydrophobicContact CG-CB 4.1Å; A273-L279 CarbonylContact O-C 3.56Å; A273-L279 WeakPolarHBondContact O-CA 3.36Å; A273-Y280 PolarHBondContact N-O 3.12Å; A273-Y280 PolarHBondContact O-N 3.48Å; A273-F285 HydrophobicContact CB-CB 3.75Å; A273-F285 HydrophobicContact CB-CD1 3.81Å; A273-F285 HydrophobicContact CB-CD2 3.47Å; A273-F285 VanDerWaalsContact CB-CD2 3.47Å; A273-F285 HydrophobicContact CB-CE1 4.4Å; A273-F285 HydrophobicContact CB-CE2 4.13Å; A273-F285 HydrophobicContact CB-CG 3.33Å
274	E	81.7	Confident	83.5	Confident	7 Å²	7	56.8 Å²	56.8	3%	0.033	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.7	167.9	-173	177.1	164	0	0	109.5	H172 T173 R251 G277 K278 L279	H172-E274 CarbonylContact C-O 3.54Å; T173-E274 WeakPolarHBondContact CA-O 3.44Å; R251-E274 IonicContact CZ-OE1 3.33Å; R251-E274 IonicContact NE-OE1 2.72Å; R251-E274 IonicContact NH1-OE1 3.82Å; R251-E274 IonicContact NH2-OE1 4Å; R251-E274 PolarHBondContact NH2-OE1 3.37Å; E274-G277 WeakPolarHBondContact OE1-CA 3.24Å; E274-K278 CarbonylContact C-O 3.55Å; E274-K278 WeakPolarHBondContact CA-O 3.49Å; E274-L279 HydrophobicContact CB-CD2 3.92Å; E274-L279 HydrophobicContact CG-CD2 4.01Å
275	Q	76.9	Confident	83.2	Confident	20 Å²	20	50.6 Å²	50.6	9%	0.093	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.9	171.9	-179.7	74.8	55.6	0	0	109.4	H172 T173 G277 K278 Y280 F285 I289	H172-Q275 PolarHBondContact O-OE1 3.37Å; T173-Q275 HydrophobicContact CG2-CB 4.32Å; T173-Q275 PolarHBondContact OG1-OE1 3Å; Q275-G277 PolarHBondContact O-N 2.84Å; Q275-K278 PolarHBondContact N-O 2.89Å; Q275-K278 PolarHBondContact O-N 3.19Å; Q275-Y280 HydrophobicContact CB-CD2 4.25Å; Q275-Y280 HydrophobicContact CB-CE2 3.88Å; Q275-F285 HydrophobicContact CB-CE2 4.39Å; Q275-I289 HydrophobicContact CB-CG2 4.08Å; Q275-I289 HydrophobicContact CG-CG2 3.93Å
276	N	79.9	Confident	82.9	Confident	125 Å²	125	47.8 Å²	47.8	67%	0.668	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	39	179	-58.2	-14.4	0	0	0	113	K278	N276-K278 VanDerWaalsContact C-N 3.26Å; N276-K278 PolarHBondContact O-N 3.23Å
277	G	80.1	Confident	82.6	Confident	26 Å²	26	48.4 Å²	48.4	27%	0.268	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	5	179.9	0	0	0	0	0	115.8	R251 E274 Q275	R251-G277 VanDerWaalsContact NH1-CA 3.31Å; R251-G277 PolarHBondContact NH1-O 3.48Å; E274-G277 WeakPolarHBondContact OE1-CA 3.24Å; Q275-G277 PolarHBondContact O-N 2.84Å
278	K	86.8	Confident	82.5	Confident	96 Å²	96	53.1 Å²	53.1	42%	0.417	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	144.7	174.4	-69.2	171.4	158.9	-133	0	110.2	D261 E274 Q275 N276 Y280	D261-K278 HydrophobicContact CB-CB 4.13Å; D261-K278 IonicContact OD1-NZ 3.61Å; D261-K278 PolarHBondContact OD1-NZ 3.26Å; D261-K278 WeakPolarHBondContact OD2-CD 3.08Å; D261-K278 WeakPolarHBondContact OD2-CE 3.4Å; D261-K278 IonicContact OD2-NZ 3.32Å; D261-K278 PolarHBondContact OD2-NZ 2.97Å; E274-K278 CarbonylContact C-O 3.55Å; E274-K278 WeakPolarHBondContact CA-O 3.49Å; Q275-K278 PolarHBondContact N-O 2.89Å; Q275-K278 PolarHBondContact O-N 3.19Å; N276-K278 VanDerWaalsContact C-N 3.26Å; N276-K278 PolarHBondContact O-N 3.23Å; K278-Y280 HydrophobicContact CB-CE2 3.6Å; K278-Y280 WeakPolarHBondContact CD-OH 3.47Å; K278-Y280 WeakPolarHBondContact O-CE2 3.24Å
279	L	88.6	Confident	82.7	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.052	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137.4	179.3	-55.2	177.4	0	0	0	110.5	F253 F258 C260 D261 L267 F272 A273 E274	F253-L279 HydrophobicContact CD1-CD1 4.21Å; F253-L279 HydrophobicContact CD2-CD1 4.48Å; F253-L279 HydrophobicContact CE1-CD1 3.81Å; F253-L279 HydrophobicContact CE2-CD1 4.1Å; F253-L279 HydrophobicContact CZ-CD1 3.76Å; F253-L279 HydrophobicContact CZ-CG 4.34Å; F258-L279 HydrophobicContact CD2-CD1 3.64Å; F258-L279 HydrophobicContact CE2-CD1 3.76Å; C260-L279 CarbonylContact C-O 3.53Å; C260-L279 WeakPolarHBondContact CA-O 3.49Å; D261-L279 WeakPolarHBondContact CB-O 3.49Å; D261-L279 PolarHBondContact N-O 2.95Å; L267-L279 HydrophobicContact CD1-CB 3.37Å; L267-L279 HydrophobicContact CD1-CD1 3.83Å; L267-L279 HydrophobicContact CD1-CG 4.22Å; F272-L279 HydrophobicContact CD2-CD2 3.91Å; F272-L279 HydrophobicContact CE2-CD2 3.97Å; A273-L279 CarbonylContact O-C 3.56Å; A273-L279 WeakPolarHBondContact O-CA 3.36Å; E274-L279 HydrophobicContact CB-CD2 3.92Å; E274-L279 HydrophobicContact CG-CD2 4.01Å
280	Y	88.9	Confident	83.4	Confident	22 Å²	22	49 Å²	49	9%	0.086	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145.4	-179.9	-58.4	-89.7	0	0	0	110	D261 L267 F272 A273 Q275 K278 I289	D261-Y280 HydrophobicContact CB-CD1 4.33Å; D261-Y280 HydrophobicContact CB-CE1 3.97Å; L267-Y280 VanDerWaalsContact CD2-C 3.5Å; F272-Y280 WeakPolarHBondContact CA-O 3.41Å; A273-Y280 PolarHBondContact N-O 3.12Å; A273-Y280 PolarHBondContact O-N 3.48Å; Q275-Y280 HydrophobicContact CB-CD2 4.25Å; Q275-Y280 HydrophobicContact CB-CE2 3.88Å; K278-Y280 HydrophobicContact CB-CE2 3.6Å; K278-Y280 WeakPolarHBondContact CD-OH 3.47Å; K278-Y280 WeakPolarHBondContact O-CE2 3.24Å; Y280-I289 HydrophobicContact CD1-CD1 4.02Å; Y280-I289 HydrophobicContact CD1-CG1 3.74Å; Y280-I289 HydrophobicContact CD2-CG1 4.49Å; Y280-I289 HydrophobicContact CE1-CD1 3.59Å; Y280-I289 HydrophobicContact CE1-CG1 3.81Å; Y280-I289 HydrophobicContact CE2-CG2 4.39Å; Y280-I289 HydrophobicContact CG-CG1 4.09Å
281	C	89.1	Confident	84.4	Confident	27 Å²	27	50.1 Å²	50.1	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	154.9	167.5	78.9	0	0	0	0	108.8	C260 L267 K283 D284 F285	C260-C281 HydrophobicContact CB-CB 4.17Å; C260-C281 PolarHBondContact SG-N 3.18Å; L267-C281 HydrophobicContact CD2-CB 3.82Å; L267-C281 VanDerWaalsContact CD2-N 3.32Å; C281-K283 VanDerWaalsContact C-N 3.25Å; C281-K283 PolarHBondContact O-N 2.84Å; C281-D284 PolarHBondContact O-N 3.49Å; C281-D284 PolarHBondContact SG-N 2.77Å; C281-D284 VanDerWaalsContact SG-N 3.35Å; C281-D284 PolarHBondContact SG-OD2 3.28Å; C281-F285 VanDerWaalsContact O-CB 3.29Å; C281-F285 WeakPolarHBondContact O-CB 3.45Å; C281-F285 PolarHBondContact O-N 3.32Å
282	E	83.8	Confident	85.2	Confident	74 Å²	74	55.1 Å²	55.1	35%	0.346	26%	0.261	S	S	.	.	H	α-helix	trans	-50.9	-45.9	-179.7	-172.7	-177.3	145.6	0	0	112.1	Y177 F285 E286	Y177-E282 VanDerWaalsContact CE1-CD 3.47Å; Y177-E282 HydrophobicContact CE1-CG 3.87Å; Y177-E282 WeakPolarHBondContact CE1-OE1 3.24Å; E282-F285 PolarHBondContact O-N 3.08Å; E282-E286 WeakPolarHBondContact O-CB 3.46Å; E282-E286 WeakPolarHBondContact O-CG 3.29Å; E282-E286 PolarHBondContact O-N 2.79Å
283	K	86.9	Confident	85.4	Confident	162 Å²	162	54.8 Å²	54.8	70%	0.704	26%	0.26	S	S	*	.	H	α-helix	trans	-60.4	-51.5	-180	-61.9	179.8	-178.1	177.5	0	112.4	C281 F285 Q287	C281-K283 VanDerWaalsContact C-N 3.25Å; C281-K283 PolarHBondContact O-N 2.84Å; K283-F285 VanDerWaalsContact C-N 3.32Å; K283-Q287 WeakPolarHBondContact O-CB 3.47Å; K283-Q287 PolarHBondContact O-N 3.04Å
284	D	89.9	Confident	85.9	Confident	16 Å²	16	56.3 Å²	56.3	9%	0.086	27%	0.271	C	S	.	.	H	α-helix	trans	-69	-37	-178.2	-67.9	-28.1	0	0	0	111.1	C260 Y262 C263 C281 Q287 Y288	C260-D284 PolarHBondContact SG-OD2 3.25Å; Y262-D284 HydrophobicContact CD1-CB 4.05Å; Y262-D284 VanDerWaalsContact CD1-CG 3.47Å; Y262-D284 HydrophobicContact CG-CB 4.19Å; C263-D284 WeakPolarHBondContact CB-OD2 3.44Å; C263-D284 PolarHBondContact N-OD2 3.22Å; C263-D284 PolarHBondContact SG-OD2 2.97Å; C281-D284 PolarHBondContact O-N 3.49Å; C281-D284 PolarHBondContact SG-N 2.77Å; C281-D284 VanDerWaalsContact SG-N 3.35Å; C281-D284 PolarHBondContact SG-OD2 3.28Å; D284-Q287 PolarHBondContact O-N 3.2Å; D284-Y288 HydrophobicContact CB-CD2 4.35Å; D284-Y288 WeakPolarHBondContact O-CB 3.48Å; D284-Y288 PolarHBondContact O-N 2.82Å
285	F	86.8	Confident	86.3	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.009	29%	0.289	C	S	.	.	I	π-helix	trans	-60.7	-54.9	176.7	179.7	-98.5	0	0	0	111	T173 P175 A273 Q275 C281 E282 K283 Q287 I289 A290	T173-F285 HydrophobicContact CG2-CD2 4.29Å; T173-F285 HydrophobicContact CG2-CE1 4.08Å; T173-F285 HydrophobicContact CG2-CE2 3.14Å; T173-F285 HydrophobicContact CG2-CZ 3.03Å; P175-F285 HydrophobicContact CG-CD1 3.65Å; P175-F285 HydrophobicContact CG-CE1 3.62Å; A273-F285 HydrophobicContact CB-CB 3.75Å; A273-F285 HydrophobicContact CB-CD1 3.81Å; A273-F285 HydrophobicContact CB-CD2 3.47Å; A273-F285 VanDerWaalsContact CB-CD2 3.47Å; A273-F285 HydrophobicContact CB-CE1 4.4Å; A273-F285 HydrophobicContact CB-CE2 4.13Å; A273-F285 HydrophobicContact CB-CG 3.33Å; Q275-F285 HydrophobicContact CB-CE2 4.39Å; C281-F285 VanDerWaalsContact O-CB 3.29Å; C281-F285 WeakPolarHBondContact O-CB 3.45Å; C281-F285 PolarHBondContact O-N 3.32Å; E282-F285 PolarHBondContact O-N 3.08Å; K283-F285 VanDerWaalsContact C-N 3.32Å; F285-Q287 VanDerWaalsContact C-N 3.29Å; F285-Q287 PolarHBondContact O-N 3.34Å; F285-I289 HydrophobicContact CD2-CB 3.69Å; F285-I289 HydrophobicContact CD2-CG1 4.4Å; F285-I289 HydrophobicContact CD2-CG2 3.78Å; F285-I289 HydrophobicContact CE2-CB 3.97Å; F285-I289 HydrophobicContact CE2-CG2 3.72Å; F285-I289 HydrophobicContact CG-CB 4.46Å; F285-I289 CarbonylContact O-C 3.59Å; F285-I289 WeakPolarHBondContact O-CA 3.47Å; F285-I289 WeakPolarHBondContact O-CB 3.27Å; F285-I289 PolarHBondContact O-N 3.36Å; F285-A290 HydrophobicContact CD1-CB 4.09Å; F285-A290 HydrophobicContact CE1-CB 3.51Å; F285-A290 HydrophobicContact CE2-CB 4.45Å; F285-A290 HydrophobicContact CZ-CB 3.66Å; F285-A290 WeakPolarHBondContact O-CB 3.26Å; F285-A290 PolarHBondContact O-N 3.48Å
286	E	84.5	Confident	87	Confident	65 Å²	65	61.5 Å²	61.5	30%	0.304	30%	0.297	S	S	.	.	I	π-helix	trans	-61.1	-38	179.2	-70.9	-177.6	178	0	0	112.9	Y177 E282 P299	Y177-E286 PolarHBondContact OH-OE1 2.76Å; E282-E286 WeakPolarHBondContact O-CB 3.46Å; E282-E286 WeakPolarHBondContact O-CG 3.29Å; E282-E286 PolarHBondContact O-N 2.79Å; E286-P299 HydrophobicContact CB-CG 3.99Å; E286-P299 HydrophobicContact CG-CG 3.93Å
287	Q	84.2	Confident	87.5	Confident	111 Å²	111	61.2 Å²	61.2	52%	0.519	30%	0.296	S	S	.	.	I	π-helix	trans	-79.6	-40	-172.1	-170.5	171.6	4.2	0	0	112.7	K283 D284 F285	K283-Q287 WeakPolarHBondContact O-CB 3.47Å; K283-Q287 PolarHBondContact O-N 3.04Å; D284-Q287 PolarHBondContact O-N 3.2Å; F285-Q287 VanDerWaalsContact C-N 3.29Å; F285-Q287 PolarHBondContact O-N 3.34Å
288	Y	86.2	Confident	87.8	Confident	113 Å²	113	62.1 Å²	62.1	44%	0.443	29%	0.294	S	S	.	.	I	π-helix	trans	-123	-20.7	-166.7	-55.1	-67	0	0	0	114.6	Y262 D284	Y262-Y288 HydrophobicContact CD1-CD2 4.13Å; Y262-Y288 HydrophobicContact CD1-CE2 4.27Å; Y262-Y288 AromaticContact CE1-CD2 3.67Å; Y262-Y288 HydrophobicContact CE1-CD2 3.67Å; Y262-Y288 AromaticContact CE1-CE2 3.55Å; Y262-Y288 HydrophobicContact CE1-CE2 3.55Å; Y262-Y288 HydrophobicContact CE1-CG 4.46Å; Y262-Y288 HydrophobicContact CE2-CD2 4.23Å; Y262-Y288 HydrophobicContact CE2-CG 4.31Å; Y262-Y288 AromaticContact CZ-CD2 3.73Å; Y262-Y288 AromaticContact CZ-CE2 3.84Å; D284-Y288 HydrophobicContact CB-CD2 4.35Å; D284-Y288 WeakPolarHBondContact O-CB 3.48Å; D284-Y288 PolarHBondContact O-N 2.82Å
289	I	85.2	Confident	87.6	Confident	48 Å²	48	58.8 Å²	58.8	25%	0.246	28%	0.283	C	S	.	.	I	π-helix	trans	-110.7	-40.2	-170.5	-46.9	-59.3	0	0	0	111.8	Q275 Y280 F285	Q275-I289 HydrophobicContact CB-CG2 4.08Å; Q275-I289 HydrophobicContact CG-CG2 3.93Å; Y280-I289 HydrophobicContact CD1-CD1 4.02Å; Y280-I289 HydrophobicContact CD1-CG1 3.74Å; Y280-I289 HydrophobicContact CD2-CG1 4.49Å; Y280-I289 HydrophobicContact CE1-CD1 3.59Å; Y280-I289 HydrophobicContact CE1-CG1 3.81Å; Y280-I289 HydrophobicContact CE2-CG2 4.39Å; Y280-I289 HydrophobicContact CG-CG1 4.09Å; F285-I289 HydrophobicContact CD2-CB 3.69Å; F285-I289 HydrophobicContact CD2-CG1 4.4Å; F285-I289 HydrophobicContact CD2-CG2 3.78Å; F285-I289 HydrophobicContact CE2-CB 3.97Å; F285-I289 HydrophobicContact CE2-CG2 3.72Å; F285-I289 HydrophobicContact CG-CB 4.46Å; F285-I289 CarbonylContact O-C 3.59Å; F285-I289 WeakPolarHBondContact O-CA 3.47Å; F285-I289 WeakPolarHBondContact O-CB 3.27Å; F285-I289 PolarHBondContact O-N 3.36Å
290	A	84	Confident	87.3	Confident	16 Å²	16	58.5 Å²	58.5	13%	0.132	28%	0.281	C	S	.	.	S	Bend	trans	-71.9	139.7	-174.4	0	0	0	0	0	112.7	F285 P299	F285-A290 HydrophobicContact CD1-CB 4.09Å; F285-A290 HydrophobicContact CE1-CB 3.51Å; F285-A290 HydrophobicContact CE2-CB 4.45Å; F285-A290 HydrophobicContact CZ-CB 3.66Å; F285-A290 WeakPolarHBondContact O-CB 3.26Å; F285-A290 PolarHBondContact O-N 3.48Å; A290-P299 HydrophobicContact CB-CB 3.79Å
291	Y	88.5	Confident	86.7	Confident	101 Å²	101	60 Å²	60	40%	0.396	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-66.9	142.5	166.4	-70.2	-82.1	0	0	0	110.4	I170 P299 I300 I304 T311	I170-Y291 HydrophobicContact CD1-CD2 3.64Å; I170-Y291 HydrophobicContact CD1-CE2 3.21Å; Y291-P299 CarbonylContact O-C 3.47Å; Y291-P299 WeakPolarHBondContact O-CA 3.36Å; Y291-I300 PolarHBondContact O-N 2.8Å; Y291-I304 HydrophobicContact CD2-CD1 3.49Å; Y291-I304 VanDerWaalsContact CD2-CD1 3.49Å; Y291-I304 HydrophobicContact CE2-CD1 4.26Å; Y291-I304 HydrophobicContact CG-CD1 4.05Å; Y291-T311 HydrophobicContact CD1-CG2 3.65Å; Y291-T311 HydrophobicContact CE1-CG2 4.26Å; Y291-T311 HydrophobicContact CG-CG2 4.1Å
292	K	89.8	Confident	86	Confident	109 Å²	109	59.6 Å²	59.6	47%	0.474	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-101	136.1	176.3	-64.1	-175.2	-179.2	-179.6	0	110.6	T311	K292-T311 PolarHBondContact O-OG1 3.42Å
293	C	91.6	Very high	85.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.6	130.6	176.7	174.7	0	0	0	0	111.4	K295 C296 N297 L298 I300 T311 H313 C316	C293-K295 PolarHBondContact O-N 2.81Å; C293-K295 PolarHBondContact SG-N 2.76Å; C293-C296 VanDerWaalsContact CB-SG 3.52Å; C293-N297 WeakPolarHBondContact O-CA 3.1Å; C293-N297 PolarHBondContact O-N 2.97Å; C293-N297 PolarHBondContact O-OD1 3.43Å; C293-L298 PolarHBondContact N-O 2.93Å; C293-I300 HydrophobicContact CB-CD1 4.03Å; C293-I300 HydrophobicContact CB-CG1 3.8Å; C293-T311 CarbonylContact C-O 3.55Å; C293-T311 WeakPolarHBondContact CA-O 3.07Å; C293-H313 WeakPolarHBondContact CB-CE1 3.49Å; C293-H313 WeakPolarHBondContact CB-ND1 3.19Å; C293-H313 PolarHBondContact SG-ND1 3.02Å; C293-H313 VanDerWaalsContact SG-ND1 3.43Å; C293-C316 WeakPolarHBondContact SG-CB 3.19Å
294	S	91.1	Very high	85.6	Confident	32 Å²	32	51.4 Å²	51.4	22%	0.224	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-14.2	179.5	-70	0	0	0	0	114.9	R310 T311	S294-R310 VanDerWaalsContact OG-CB 3.26Å; S294-R310 WeakPolarHBondContact OG-CB 3.08Å; S294-R310 WeakPolarHBondContact OG-CD 3.42Å; S294-R310 WeakPolarHBondContact OG-CG 3.26Å; S294-T311 PolarHBondContact N-O 2.73Å
295	K	89.6	Confident	85.5	Confident	95 Å²	95	51.2 Å²	51.2	41%	0.413	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-54	175	-171.6	175.6	170.7	-166.5	0	112.4	C293 W312 C316	C293-K295 PolarHBondContact O-N 2.81Å; C293-K295 PolarHBondContact SG-N 2.76Å; K295-W312 HydrophobicContact CB-CE3 3.84Å; K295-W312 HydrophobicContact CB-CZ3 3.74Å; K295-C316 HydrophobicContact CB-CB 3.92Å; K295-C316 HydrophobicContact CD-CB 3.88Å; K295-C316 WeakPolarHBondContact CD-O 3.48Å; K295-C316 HydrophobicContact CG-CB 4.48Å
296	C	91.4	Very high	85.6	Confident	41 Å²	41	54.5 Å²	54.5	28%	0.277	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-6	-172.7	65.2	0	0	0	0	114	C293 L298 H313	C293-C296 VanDerWaalsContact CB-SG 3.52Å; C296-L298 HydrophobicContact CB-CD1 4.42Å; C296-L298 HydrophobicContact CB-CG 4.39Å; C296-L298 PolarHBondContact O-N 2.93Å; C296-H313 PolarHBondContact SG-CE1 3.31Å; C296-H313 PolarHBondContact SG-ND1 3.31Å
297	N	89.8	Confident	85.6	Confident	119 Å²	119	51.6 Å²	51.6	64%	0.636	26%	0.255	S	S	*	.			trans	58.9	8.1	-175.8	-65.2	-44.7	0	0	0	115.9	C293	C293-N297 WeakPolarHBondContact O-CA 3.1Å; C293-N297 PolarHBondContact O-N 2.97Å; C293-N297 PolarHBondContact O-OD1 3.43Å
298	L	86.4	Confident	85.7	Confident	45 Å²	45	48.1 Å²	48.1	24%	0.236	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-82.2	152	176	-61.7	172.6	0	0	0	111.5	D11 C293 C296 I300	D11-L298 HydrophobicContact CB-CD1 3.74Å; D11-L298 HydrophobicContact CB-CD2 4.15Å; C293-L298 PolarHBondContact N-O 2.93Å; C296-L298 HydrophobicContact CB-CD1 4.42Å; C296-L298 HydrophobicContact CB-CG 4.39Å; C296-L298 PolarHBondContact O-N 2.93Å; L298-I300 PolarHBondContact O-N 2.75Å
299	P	82.6	Confident	85.6	Confident	27 Å²	27	51.1 Å²	51.1	18%	0.175	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-50.9	136.3	168.7	-27.7	36.6	0	0	0	112.1	E286 A290 Y291 H313	E286-P299 HydrophobicContact CB-CG 3.99Å; E286-P299 HydrophobicContact CG-CG 3.93Å; A290-P299 HydrophobicContact CB-CB 3.79Å; Y291-P299 CarbonylContact O-C 3.47Å; Y291-P299 WeakPolarHBondContact O-CA 3.36Å; P299-H313 PolarHBondContact O-NE2 3.49Å
300	I	83.8	Confident	85.7	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.015	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-95.7	119.4	173.7	-51.9	162.9	0	0	0	108.3	Y291 C293 L298 K303 I304 H313	Y291-I300 PolarHBondContact O-N 2.8Å; C293-I300 HydrophobicContact CB-CD1 4.03Å; C293-I300 HydrophobicContact CB-CG1 3.8Å; L298-I300 PolarHBondContact O-N 2.75Å; I300-K303 VanDerWaalsContact CG2-O 3.26Å; I300-K303 WeakPolarHBondContact CG2-O 3.29Å; I300-I304 HydrophobicContact CB-CD1 4.25Å; I300-I304 HydrophobicContact CB-CG1 3.75Å; I300-I304 HydrophobicContact CD1-CG1 4.14Å; I300-I304 HydrophobicContact CD1-CG2 4.33Å; I300-I304 HydrophobicContact CG2-CB 4.38Å; I300-I304 HydrophobicContact CG2-CD1 4.18Å; I300-I304 HydrophobicContact CG2-CG1 3.27Å; I300-H313 WeakPolarHBondContact CA-NE2 3.13Å
301	I	75.7	Confident	86	Confident	53 Å²	53	54 Å²	54	27%	0.272	27%	0.27	S	S	.	.			trans	-109.6	130.6	178.3	-62.8	163.3	0	0	0	107.7	P175 Y177	P175-I301 VanDerWaalsContact CD-CG2 3.4Å; P175-I301 HydrophobicContact CG-CD1 3.71Å; P175-I301 HydrophobicContact CG-CG1 3.88Å; P175-I301 HydrophobicContact CG-CG2 4.49Å; Y177-I301 HydrophobicContact CE2-CD1 3.6Å
302	G	74.3	Confident	86.1	Confident	20 Å²	20	50 Å²	50	21%	0.206	25%	0.254	C	S	.	.	S	Bend	trans	77.7	-121.9	-176.1	0	0	0	0	0	112.7	T173	T173-G302 PolarHBondContact O-N 2.82Å
303	K	78.5	Confident	86	Confident	59 Å²	59	45.2 Å²	45.2	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	132.7	-171.9	-67.7	-168.4	172	178	0	112.1	L109 S110 D169 I300 P314	L109-K303 PolarHBondContact O-NZ 3.45Å; S110-K303 WeakPolarHBondContact OG-CE 3.29Å; S110-K303 PolarHBondContact OG-NZ 2.76Å; D169-K303 WeakPolarHBondContact OD1-CE 3.49Å; D169-K303 WeakPolarHBondContact OD1-CG 3.45Å; I300-K303 VanDerWaalsContact CG2-O 3.26Å; I300-K303 WeakPolarHBondContact CG2-O 3.29Å; K303-P314 HydrophobicContact CB-CG 3.69Å; K303-P314 VanDerWaalsContact O-CD 3.29Å; K303-P314 WeakPolarHBondContact O-CD 3.24Å
304	I	84	Confident	85.8	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.7	177.8	-70.9	157.8	0	0	0	109.1	L168 I170 Y291 I300 K306 T311	L168-I304 PolarHBondContact N-O 3.06Å; L168-I304 VanDerWaalsContact N-O 3.15Å; L168-I304 PolarHBondContact O-N 3.48Å; I170-I304 HydrophobicContact CB-CD1 4.27Å; I170-I304 HydrophobicContact CD1-CB 4.43Å; I170-I304 HydrophobicContact CD1-CD1 3.2Å; I170-I304 HydrophobicContact CD1-CG1 4.34Å; I170-I304 HydrophobicContact CG1-CB 4.39Å; I170-I304 HydrophobicContact CG1-CD1 3.67Å; I170-I304 HydrophobicContact CG1-CG1 4.48Å; Y291-I304 HydrophobicContact CD2-CD1 3.49Å; Y291-I304 VanDerWaalsContact CD2-CD1 3.49Å; Y291-I304 HydrophobicContact CE2-CD1 4.26Å; Y291-I304 HydrophobicContact CG-CD1 4.05Å; I300-I304 HydrophobicContact CB-CD1 4.25Å; I300-I304 HydrophobicContact CB-CG1 3.75Å; I300-I304 HydrophobicContact CD1-CG1 4.14Å; I300-I304 HydrophobicContact CD1-CG2 4.33Å; I300-I304 HydrophobicContact CG2-CB 4.38Å; I300-I304 HydrophobicContact CG2-CD1 4.18Å; I300-I304 HydrophobicContact CG2-CG1 3.27Å; I304-K306 HydrophobicContact CG2-CG 4.18Å; I304-T311 HydrophobicContact CG2-CG2 3.7Å
305	I	87.6	Confident	85.7	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.062	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.1	167	-62	-173.4	0	0	0	107.6	A165 A307 T311 W312 P314 F317	A165-I305 HydrophobicContact CB-CG2 4.24Å; I305-A307 HydrophobicContact CG2-CB 4.26Å; I305-T311 CarbonylContact O-C 3.58Å; I305-T311 WeakPolarHBondContact O-CA 3.28Å; I305-W312 HydrophobicContact CB-CB 4.31Å; I305-W312 PolarHBondContact N-O 2.81Å; I305-W312 PolarHBondContact O-N 3.37Å; I305-P314 HydrophobicContact CD1-CB 4.2Å; I305-P314 HydrophobicContact CG1-CG 4.43Å; I305-F317 HydrophobicContact CD1-CB 3.86Å; I305-F317 HydrophobicContact CD1-CD1 4.09Å; I305-F317 HydrophobicContact CD1-CG 4.27Å; I305-F317 HydrophobicContact CG2-CB 4.47Å; I305-F317 HydrophobicContact CG2-CD1 3.97Å; I305-F317 HydrophobicContact CG2-CD2 4.49Å; I305-F317 HydrophobicContact CG2-CE1 4.35Å; I305-F317 HydrophobicContact CG2-CG 4.06Å
306	K	88.8	Confident	85.7	Confident	72 Å²	72	44.2 Å²	44.2	31%	0.313	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.3	168.1	-67.4	-161.3	-164.5	161.4	0	109	E166 L168 I304 R310 T311	E166-K306 PolarHBondContact N-O 2.89Å; E166-K306 PolarHBondContact O-N 3.03Å; L168-K306 HydrophobicContact CD1-CB 4.4Å; L168-K306 HydrophobicContact CD1-CD 3.41Å; L168-K306 VanDerWaalsContact CD1-CD 3.41Å; L168-K306 HydrophobicContact CD1-CG 3.88Å; L168-K306 VanDerWaalsContact CD1-NZ 3.31Å; I304-K306 HydrophobicContact CG2-CG 4.18Å; K306-R310 WeakPolarHBondContact CA-O 3.25Å; K306-T311 HydrophobicContact CG-CG2 4.05Å
307	A	85.2	Confident	85.8	Confident	4 Å²	4	42.3 Å²	42.3	3%	0.033	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	141.2	177.9	0	0	0	0	0	108.6	A165 I305 N309 R310 W312 F317 F330	A165-A307 HydrophobicContact CB-CB 4.19Å; I305-A307 HydrophobicContact CG2-CB 4.26Å; A307-N309 VanDerWaalsContact C-N 3.29Å; A307-N309 PolarHBondContact O-N 2.99Å; A307-R310 PolarHBondContact N-O 3.11Å; A307-R310 CarbonylContact O-C 3.4Å; A307-R310 WeakPolarHBondContact O-CB 3.47Å; A307-R310 PolarHBondContact O-N 3.31Å; A307-W312 PolarHBondContact O-NE1 3.2Å; A307-W312 VanDerWaalsContact O-NE1 3.13Å; A307-F317 HydrophobicContact CB-CD2 4.48Å; A307-F317 HydrophobicContact CB-CE1 4.47Å; A307-F317 HydrophobicContact CB-CE2 3.65Å; A307-F317 HydrophobicContact CB-CZ 3.65Å; A307-F330 HydrophobicContact CB-CZ 3.92Å
308	I	85.2	Confident	85.9	Confident	38 Å²	38	37.4 Å²	37.4	20%	0.195	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	40.4	174.4	-36.6	166.2	0	0	0	111.5	R310 F330 V332 V338	I308-R310 WeakPolarHBondContact O-CG 3.48Å; I308-R310 PolarHBondContact O-N 3.41Å; I308-F330 HydrophobicContact CD1-CE2 4.01Å; I308-F330 HydrophobicContact CG1-CE2 3.86Å; I308-F330 HydrophobicContact CG1-CZ 4.46Å; I308-V332 HydrophobicContact CD1-CB 4.41Å; I308-V332 HydrophobicContact CD1-CG1 4.05Å; I308-V332 HydrophobicContact CD1-CG2 3.44Å; I308-V332 VanDerWaalsContact CD1-CG2 3.44Å; I308-V332 HydrophobicContact CG1-CG2 3.77Å; I308-V332 HydrophobicContact CG2-CG1 4.26Å; I308-V332 HydrophobicContact CG2-CG2 4.48Å; I308-V338 HydrophobicContact CD1-CG1 3.24Å
309	N	83.8	Confident	86.2	Confident	175 Å²	175	35.2 Å²	35.2	94%	0.936	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	28.3	-175.7	-159.7	37.8	0	0	0	113.9	A307	A307-N309 VanDerWaalsContact C-N 3.29Å; A307-N309 PolarHBondContact O-N 2.99Å
310	R	89	Confident	86.6	Confident	104 Å²	104	39.8 Å²	39.8	39%	0.392	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	157.5	-174.1	-78	174.9	-171.3	-112	10	110.2	S294 K306 A307 I308 W312 N336	S294-R310 VanDerWaalsContact OG-CB 3.26Å; S294-R310 WeakPolarHBondContact OG-CB 3.08Å; S294-R310 WeakPolarHBondContact OG-CD 3.42Å; S294-R310 WeakPolarHBondContact OG-CG 3.26Å; K306-R310 WeakPolarHBondContact CA-O 3.25Å; A307-R310 PolarHBondContact N-O 3.11Å; A307-R310 CarbonylContact O-C 3.4Å; A307-R310 WeakPolarHBondContact O-CB 3.47Å; A307-R310 PolarHBondContact O-N 3.31Å; I308-R310 WeakPolarHBondContact O-CG 3.48Å; I308-R310 PolarHBondContact O-N 3.41Å; R310-W312 HydrophobicContact CB-CZ2 4.13Å; R310-N336 PolarHBondContact NH2-ND2 2.87Å
311	T	90.2	Very high	86.9	Confident	21 Å²	21	44.6 Å²	44.6	13%	0.129	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	141.9	176.8	43.3	0	0	0	0	111.4	Y291 K292 C293 S294 I304 I305 K306	Y291-T311 HydrophobicContact CD1-CG2 3.65Å; Y291-T311 HydrophobicContact CE1-CG2 4.26Å; Y291-T311 HydrophobicContact CG-CG2 4.1Å; K292-T311 PolarHBondContact O-OG1 3.42Å; C293-T311 CarbonylContact C-O 3.55Å; C293-T311 WeakPolarHBondContact CA-O 3.07Å; S294-T311 PolarHBondContact N-O 2.73Å; I304-T311 HydrophobicContact CG2-CG2 3.7Å; I305-T311 CarbonylContact O-C 3.58Å; I305-T311 WeakPolarHBondContact O-CA 3.28Å; K306-T311 HydrophobicContact CG-CG2 4.05Å
312	W	90.7	Very high	87.7	Confident	17 Å²	17	43.9 Å²	43.9	6%	0.064	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	147	-176.4	-48.8	80.8	0	0	0	111.2	K295 I305 A307 R310 F317	K295-W312 HydrophobicContact CB-CE3 3.84Å; K295-W312 HydrophobicContact CB-CZ3 3.74Å; I305-W312 HydrophobicContact CB-CB 4.31Å; I305-W312 PolarHBondContact N-O 2.81Å; I305-W312 PolarHBondContact O-N 3.37Å; A307-W312 PolarHBondContact O-NE1 3.2Å; A307-W312 VanDerWaalsContact O-NE1 3.13Å; R310-W312 HydrophobicContact CB-CZ2 4.13Å; W312-F317 HydrophobicContact CB-CB 4.03Å; W312-F317 HydrophobicContact CB-CD2 4.29Å; W312-F317 AromaticContact CD1-CD2 3.95Å; W312-F317 AromaticContact CD2-CD2 3.91Å; W312-F317 HydrophobicContact CD2-CD2 3.91Å; W312-F317 HydrophobicContact CE3-CD2 4.44Å; W312-F317 HydrophobicContact CG-CB 4.45Å; W312-F317 AromaticContact CG-CD2 3.81Å; W312-F317 HydrophobicContact CG-CD2 3.81Å
313	H	85.9	Confident	88.6	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.037	23%	0.229	C	C	.	.			trans	-64.9	147.7	159.4	-57.1	97.9	0	0	0	109.5	C293 C296 P299 I300 Y315 C316 F317	C293-H313 WeakPolarHBondContact CB-CE1 3.49Å; C293-H313 WeakPolarHBondContact CB-ND1 3.19Å; C293-H313 PolarHBondContact SG-ND1 3.02Å; C293-H313 VanDerWaalsContact SG-ND1 3.43Å; C296-H313 PolarHBondContact SG-CE1 3.31Å; C296-H313 PolarHBondContact SG-ND1 3.31Å; P299-H313 PolarHBondContact O-NE2 3.49Å; I300-H313 WeakPolarHBondContact CA-NE2 3.13Å; H313-Y315 HydrophobicContact CB-CD1 3.82Å; H313-Y315 HydrophobicContact CB-CD2 4.16Å; H313-Y315 HydrophobicContact CB-CE1 3.45Å; H313-Y315 VanDerWaalsContact CB-CE1 3.45Å; H313-Y315 HydrophobicContact CB-CE2 3.8Å; H313-Y315 HydrophobicContact CB-CG 4.16Å; H313-Y315 VanDerWaalsContact CB-CZ 3.43Å; H313-Y315 AromaticContact CD2-CE1 3.85Å; H313-Y315 AromaticContact CD2-CZ 3.67Å; H313-Y315 PolarHBondContact CD2-OH 3.28Å; H313-Y315 PolarHBondContact CE1-OH 3.43Å; H313-Y315 AromaticContact CG-CE1 3.73Å; H313-Y315 AromaticContact CG-CE2 3.98Å; H313-Y315 AromaticContact CG-CZ 3.38Å; H313-Y315 AromaticContact ND1-CZ 3.84Å; H313-Y315 PolarHBondContact ND1-OH 3.49Å; H313-Y315 PolarHBondContact NE2-OH 2.89Å; H313-Y315 PolarHBondContact O-N 2.75Å; H313-C316 HydrophobicContact CB-CB 3.84Å; H313-C316 WeakPolarHBondContact O-CA 3.45Å; H313-C316 WeakPolarHBondContact O-CB 3.3Å; H313-C316 PolarHBondContact O-N 2.99Å; H313-F317 PolarHBondContact O-N 3.05Å
314	P	88.3	Confident	89	Confident	52 Å²	52	51.3 Å²	51.3	34%	0.338	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-38.1	175.2	-27.5	34.2	0	0	0	113.7	K303 I305 C316	K303-P314 HydrophobicContact CB-CG 3.69Å; K303-P314 VanDerWaalsContact O-CD 3.29Å; K303-P314 WeakPolarHBondContact O-CD 3.24Å; I305-P314 HydrophobicContact CD1-CB 4.2Å; I305-P314 HydrophobicContact CG1-CG 4.43Å; P314-C316 VanDerWaalsContact C-N 3.34Å
315	Y	89	Confident	89.2	Confident	49 Å²	49	55 Å²	55	19%	0.192	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.8	177	60.9	-99.2	0	0	0	113.6	S12 Q106 H313 V318	S12-Y315 VanDerWaalsContact CB-OH 3.24Å; S12-Y315 WeakPolarHBondContact CB-OH 3.28Å; S12-Y315 PolarHBondContact OG-OH 3.04Å; Q106-Y315 HydrophobicContact CB-CE1 4.35Å; Q106-Y315 VanDerWaalsContact OE1-CE1 3.31Å; Q106-Y315 VanDerWaalsContact OE1-CE2 3.29Å; H313-Y315 HydrophobicContact CB-CD1 3.82Å; H313-Y315 HydrophobicContact CB-CD2 4.16Å; H313-Y315 HydrophobicContact CB-CE1 3.45Å; H313-Y315 VanDerWaalsContact CB-CE1 3.45Å; H313-Y315 HydrophobicContact CB-CE2 3.8Å; H313-Y315 HydrophobicContact CB-CG 4.16Å; H313-Y315 VanDerWaalsContact CB-CZ 3.43Å; H313-Y315 AromaticContact CD2-CE1 3.85Å; H313-Y315 AromaticContact CD2-CZ 3.67Å; H313-Y315 PolarHBondContact CD2-OH 3.28Å; H313-Y315 PolarHBondContact CE1-OH 3.43Å; H313-Y315 AromaticContact CG-CE1 3.73Å; H313-Y315 AromaticContact CG-CE2 3.98Å; H313-Y315 AromaticContact CG-CZ 3.38Å; H313-Y315 AromaticContact ND1-CZ 3.84Å; H313-Y315 PolarHBondContact ND1-OH 3.49Å; H313-Y315 PolarHBondContact NE2-OH 2.89Å; H313-Y315 PolarHBondContact O-N 2.75Å; Y315-V318 VanDerWaalsContact O-CG1 3.27Å; Y315-V318 WeakPolarHBondContact O-CG1 3.3Å
316	C	90.3	Very high	89.3	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.041	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-28.1	174.4	-80.9	0	0	0	0	111.6	C293 K295 H313 P314 V318	C293-C316 WeakPolarHBondContact SG-CB 3.19Å; K295-C316 HydrophobicContact CB-CB 3.92Å; K295-C316 HydrophobicContact CD-CB 3.88Å; K295-C316 WeakPolarHBondContact CD-O 3.48Å; K295-C316 HydrophobicContact CG-CB 4.48Å; H313-C316 HydrophobicContact CB-CB 3.84Å; H313-C316 WeakPolarHBondContact O-CA 3.45Å; H313-C316 WeakPolarHBondContact O-CB 3.3Å; H313-C316 PolarHBondContact O-N 2.99Å; P314-C316 VanDerWaalsContact C-N 3.34Å; C316-V318 VanDerWaalsContact C-N 3.3Å; C316-V318 PolarHBondContact O-N 3.07Å
317	F	91.7	Very high	88.8	Confident	1 Å²	1	56.5 Å²	56.5	0%	0.004	28%	0.278	C	S	.	.	S	Bend	trans	-79.5	78.8	177.8	-162.2	-114.2	0	0	0	110.7	A165 I305 A307 W312 H313 L326 F330 V338	A165-F317 HydrophobicContact CB-CE1 4.22Å; I305-F317 HydrophobicContact CD1-CB 3.86Å; I305-F317 HydrophobicContact CD1-CD1 4.09Å; I305-F317 HydrophobicContact CD1-CG 4.27Å; I305-F317 HydrophobicContact CG2-CB 4.47Å; I305-F317 HydrophobicContact CG2-CD1 3.97Å; I305-F317 HydrophobicContact CG2-CD2 4.49Å; I305-F317 HydrophobicContact CG2-CE1 4.35Å; I305-F317 HydrophobicContact CG2-CG 4.06Å; A307-F317 HydrophobicContact CB-CD2 4.48Å; A307-F317 HydrophobicContact CB-CE1 4.47Å; A307-F317 HydrophobicContact CB-CE2 3.65Å; A307-F317 HydrophobicContact CB-CZ 3.65Å; W312-F317 HydrophobicContact CB-CB 4.03Å; W312-F317 HydrophobicContact CB-CD2 4.29Å; W312-F317 AromaticContact CD1-CD2 3.95Å; W312-F317 AromaticContact CD2-CD2 3.91Å; W312-F317 HydrophobicContact CD2-CD2 3.91Å; W312-F317 HydrophobicContact CE3-CD2 4.44Å; W312-F317 HydrophobicContact CG-CB 4.45Å; W312-F317 AromaticContact CG-CD2 3.81Å; W312-F317 HydrophobicContact CG-CD2 3.81Å; H313-F317 PolarHBondContact O-N 3.05Å; F317-L326 HydrophobicContact CD1-CB 3.63Å; F317-L326 HydrophobicContact CD1-CD1 4.34Å; F317-L326 HydrophobicContact CE1-CB 3.55Å; F317-L326 HydrophobicContact CE1-CD1 4.07Å; F317-L326 HydrophobicContact CE1-CG 4.46Å; F317-L326 HydrophobicContact CE2-CD1 4.42Å; F317-L326 HydrophobicContact CZ-CB 4.39Å; F317-L326 HydrophobicContact CZ-CD1 4.11Å; F317-L326 PolarHBondContact O-N 2.98Å; F317-F330 AromaticContact CE1-CD1 3.93Å; F317-F330 HydrophobicContact CE1-CD1 3.93Å; F317-F330 HydrophobicContact CE1-CE1 4.11Å; F317-F330 HydrophobicContact CE1-CG 4.31Å; F317-F330 AromaticContact CZ-CD1 3.78Å; F317-F330 HydrophobicContact CZ-CD1 3.78Å; F317-F330 AromaticContact CZ-CD2 3.94Å; F317-F330 HydrophobicContact CZ-CD2 3.94Å; F317-F330 AromaticContact CZ-CE1 3.77Å; F317-F330 HydrophobicContact CZ-CE1 3.77Å; F317-F330 AromaticContact CZ-CE2 3.92Å; F317-F330 HydrophobicContact CZ-CE2 3.92Å; F317-F330 AromaticContact CZ-CG 3.88Å; F317-F330 HydrophobicContact CZ-CG 3.88Å; F317-F330 AromaticContact CZ-CZ 3.84Å; F317-F330 HydrophobicContact CZ-CZ 3.84Å; F317-V338 HydrophobicContact CE2-CG1 4.15Å; F317-V338 HydrophobicContact CE2-CG2 4.46Å
318	V	92.4	Very high	88.5	Confident	15 Å²	15	60.1 Å²	60.1	9%	0.091	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-129.1	151.2	-174.6	-61.7	0	0	0	0	110.1	Y315 C316 Y320 K324 V338	Y315-V318 VanDerWaalsContact O-CG1 3.27Å; Y315-V318 WeakPolarHBondContact O-CG1 3.3Å; C316-V318 VanDerWaalsContact C-N 3.3Å; C316-V318 PolarHBondContact O-N 3.07Å; V318-Y320 PolarHBondContact O-N 3.13Å; V318-K324 CarbonylContact C-O 3.54Å; V318-K324 WeakPolarHBondContact CA-O 3.36Å; V318-K324 WeakPolarHBondContact CB-O 3.33Å; V318-V338 WeakPolarHBondContact O-CG2 3.29Å
319	C	93	Very high	88.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.314	C	S	.	.			trans	-56.3	131.8	174.8	175.2	0	0	0	0	110.2	H321 C322 K323 K324 L326 V338 C340 H343	C319-H321 PolarHBondContact O-N 3.36Å; C319-H321 PolarHBondContact SG-N 3.49Å; C319-H321 VanDerWaalsContact SG-N 3.42Å; C319-C322 VanDerWaalsContact CB-SG 3.51Å; C319-C322 VanDerWaalsContact SG-SG 3.68Å; C319-K323 WeakPolarHBondContact O-CA 3.18Å; C319-K323 PolarHBondContact O-N 3.41Å; C319-K324 PolarHBondContact N-O 2.88Å; C319-L326 HydrophobicContact CB-CD2 3.85Å; C319-L326 HydrophobicContact CB-CG 4.46Å; C319-V338 CarbonylContact C-O 3.48Å; C319-V338 WeakPolarHBondContact CA-O 3.37Å; C319-C340 HydrophobicContact CB-CB 4.07Å; C319-C340 PolarHBondContact SG-N 3.36Å; C319-C340 VanDerWaalsContact SG-N 3.37Å; C319-H343 PolarHBondContact SG-ND1 2.98Å
320	Y	91.3	Very high	88.5	Confident	122 Å²	122	55.4 Å²	55.4	48%	0.478	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.5	179.4	-179.4	-111.1	0	0	0	112.3	V318 K323 H337 V338	V318-Y320 PolarHBondContact O-N 3.13Å; Y320-K323 WeakPolarHBondContact O-CE 3.33Å; Y320-K323 PolarHBondContact O-NZ 3.18Å; Y320-H337 HydrophobicContact CD1-CB 4.24Å; Y320-H337 AromaticContact CD1-CD2 3.87Å; Y320-H337 AromaticContact CD1-CG 3.96Å; Y320-H337 AromaticContact CD2-CD2 3.11Å; Y320-H337 WeakPolarHBondContact CD2-CD2 3.4Å; Y320-H337 AromaticContact CD2-CG 3.98Å; Y320-H337 AromaticContact CD2-NE2 3.64Å; Y320-H337 AromaticContact CE1-CD2 3.98Å; Y320-H337 AromaticContact CE2-CD2 3.26Å; Y320-H337 WeakPolarHBondContact CE2-CD2 3.48Å; Y320-H337 AromaticContact CE2-NE2 3.21Å; Y320-H337 WeakPolarHBondContact CE2-NE2 3.37Å; Y320-H337 HydrophobicContact CG-CB 4.05Å; Y320-H337 AromaticContact CG-CD2 3.43Å; Y320-H337 VanDerWaalsContact CG-CD2 3.43Å; Y320-H337 AromaticContact CG-CG 3.83Å; Y320-H337 AromaticContact CZ-CD2 3.69Å; Y320-H337 AromaticContact CZ-CE1 3.95Å; Y320-H337 AromaticContact CZ-NE2 3.43Å; Y320-V338 PolarHBondContact N-O 2.94Å
321	H	90.4	Very high	88.5	Confident	104 Å²	104	52.5 Å²	52.5	48%	0.481	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-59	-178.1	-163.5	-97.5	0	0	0	113	C319 L339 H343 F347	C319-H321 PolarHBondContact O-N 3.36Å; C319-H321 PolarHBondContact SG-N 3.49Å; C319-H321 VanDerWaalsContact SG-N 3.42Å; H321-L339 HydrophobicContact CB-CD2 4.25Å; H321-H343 HydrophobicContact CB-CB 4.24Å; H321-H343 AromaticContact CE1-CD2 3.88Å; H321-H343 AromaticContact CE1-NE2 3.91Å; H321-H343 AromaticContact CG-CD2 3.53Å; H321-H343 AromaticContact CG-NE2 3.84Å; H321-H343 AromaticContact ND1-CD2 3.01Å; H321-H343 PolarHBondContact ND1-CD2 2.87Å; H321-H343 AromaticContact ND1-CE1 3.93Å; H321-H343 AromaticContact ND1-CG 3.91Å; H321-H343 AromaticContact ND1-NE2 2.98Å; H321-H343 PolarHBondContact ND1-NE2 3.02Å; H321-F347 HydrophobicContact CB-CE2 4.35Å; H321-F347 AromaticContact CD2-CE2 3.96Å; H321-F347 AromaticContact CD2-CZ 3.55Å; H321-F347 AromaticContact NE2-CZ 3.72Å
322	C	92.2	Very high	88.3	Confident	38 Å²	38	53.7 Å²	53.7	26%	0.257	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-4.3	-175.7	62.7	0	0	0	0	116.1	C319 K324 H343	C319-C322 VanDerWaalsContact CB-SG 3.51Å; C319-C322 VanDerWaalsContact SG-SG 3.68Å; C322-K324 HydrophobicContact CB-CD 4.47Å; C322-K324 HydrophobicContact CB-CG 4.23Å; C322-K324 PolarHBondContact O-N 2.98Å; C322-H343 WeakPolarHBondContact CB-CE1 3.48Å; C322-H343 PolarHBondContact SG-CE1 3.36Å
323	K	92.2	Very high	88	Confident	114 Å²	114	55.5 Å²	55.5	50%	0.496	28%	0.278	S	S	.	.			trans	58	13.5	-177.7	-45.4	-55.1	-175.3	-170	0	114.9	C319 Y320	C319-K323 WeakPolarHBondContact O-CA 3.18Å; C319-K323 PolarHBondContact O-N 3.41Å; Y320-K323 WeakPolarHBondContact O-CE 3.33Å; Y320-K323 PolarHBondContact O-NZ 3.18Å
324	K	88.4	Confident	87.6	Confident	122 Å²	122	60.9 Å²	60.9	53%	0.53	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-73	143.1	171.5	-64.5	178.9	-175.3	172.9	0	109.8	V318 C319 C322	V318-K324 CarbonylContact C-O 3.54Å; V318-K324 WeakPolarHBondContact CA-O 3.36Å; V318-K324 WeakPolarHBondContact CB-O 3.33Å; C319-K324 PolarHBondContact N-O 2.88Å; C322-K324 HydrophobicContact CB-CD 4.47Å; C322-K324 HydrophobicContact CB-CG 4.23Å; C322-K324 PolarHBondContact O-N 2.98Å
325	P	88.5	Confident	87.1	Confident	81 Å²	81	64.3 Å²	64.3	53%	0.526	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-51.1	139.6	171.2	-25.1	34.7	0	0	0	111.5
326	L	88.1	Confident	86.6	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.037	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-92.4	135.3	174.5	-66.1	170.6	0	0	0	109.5	F317 C319 F330 V338 C340	F317-L326 HydrophobicContact CD1-CB 3.63Å; F317-L326 HydrophobicContact CD1-CD1 4.34Å; F317-L326 HydrophobicContact CE1-CB 3.55Å; F317-L326 HydrophobicContact CE1-CD1 4.07Å; F317-L326 HydrophobicContact CE1-CG 4.46Å; F317-L326 HydrophobicContact CE2-CD1 4.42Å; F317-L326 HydrophobicContact CZ-CB 4.39Å; F317-L326 HydrophobicContact CZ-CD1 4.11Å; F317-L326 PolarHBondContact O-N 2.98Å; C319-L326 HydrophobicContact CB-CD2 3.85Å; C319-L326 HydrophobicContact CB-CG 4.46Å; L326-F330 HydrophobicContact CB-CB 4.43Å; L326-F330 HydrophobicContact CD1-CB 4.01Å; L326-F330 HydrophobicContact CD2-CB 4.15Å; L326-F330 HydrophobicContact CG-CB 4.43Å; L326-V338 HydrophobicContact CD1-CB 3.55Å; L326-V338 HydrophobicContact CD1-CG2 3.4Å; L326-C340 HydrophobicContact CD2-CB 3.63Å
327	D	79.2	Confident	86.4	Confident	108 Å²	108	68 Å²	68	58%	0.578	34%	0.343	S	S	*	.			trans	-93.1	-149.6	172.2	-68.9	-44.2	0	0	0	110	K167 I329	K167-D327 IonicContact NZ-OD1 3.49Å; D327-I329 PolarHBondContact O-N 2.97Å
328	D	78.3	Confident	86.3	Confident	81 Å²	81	68.3 Å²	68.3	43%	0.433	35%	0.345	S	S	.	.	S	Bend	trans	-74.3	-15.6	-171	-51.4	-25.3	0	0	0	112.8	K167	K167-D328 IonicContact NZ-OD1 3.55Å; K167-D328 PolarHBondContact NZ-OD1 3.3Å
329	I	81.3	Confident	86.2	Confident	107 Å²	107	68 Å²	68	55%	0.549	34%	0.342	S	S	.	.			trans	-111.5	116.6	177.8	-54	176.1	0	0	0	109.7	D327 E341	D327-I329 PolarHBondContact O-N 2.97Å; I329-E341 HydrophobicContact CG2-CB 4.32Å
330	F	88.8	Confident	86.1	Confident	7 Å²	7	69 Å²	69	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	163	174.9	60.8	-84.4	0	0	0	110.1	I163 A165 A307 I308 F317 L326 V332 V338 L339	I163-F330 HydrophobicContact CB-CE2 4.21Å; I163-F330 HydrophobicContact CB-CZ 3.93Å; I163-F330 HydrophobicContact CG2-CE2 4.25Å; I163-F330 HydrophobicContact CG2-CZ 3.75Å; I163-F330 WeakPolarHBondContact O-CE1 3.39Å; I163-F330 VanDerWaalsContact O-CZ 3.28Å; I163-F330 WeakPolarHBondContact O-CZ 3.34Å; A165-F330 HydrophobicContact CB-CD1 4.45Å; A165-F330 HydrophobicContact CB-CE1 3.62Å; A165-F330 HydrophobicContact CB-CZ 4.33Å; A307-F330 HydrophobicContact CB-CZ 3.92Å; I308-F330 HydrophobicContact CD1-CE2 4.01Å; I308-F330 HydrophobicContact CG1-CE2 3.86Å; I308-F330 HydrophobicContact CG1-CZ 4.46Å; F317-F330 AromaticContact CE1-CD1 3.93Å; F317-F330 HydrophobicContact CE1-CD1 3.93Å; F317-F330 HydrophobicContact CE1-CE1 4.11Å; F317-F330 HydrophobicContact CE1-CG 4.31Å; F317-F330 AromaticContact CZ-CD1 3.78Å; F317-F330 HydrophobicContact CZ-CD1 3.78Å; F317-F330 AromaticContact CZ-CD2 3.94Å; F317-F330 HydrophobicContact CZ-CD2 3.94Å; F317-F330 AromaticContact CZ-CE1 3.77Å; F317-F330 HydrophobicContact CZ-CE1 3.77Å; F317-F330 AromaticContact CZ-CE2 3.92Å; F317-F330 HydrophobicContact CZ-CE2 3.92Å; F317-F330 AromaticContact CZ-CG 3.88Å; F317-F330 HydrophobicContact CZ-CG 3.88Å; F317-F330 AromaticContact CZ-CZ 3.84Å; F317-F330 HydrophobicContact CZ-CZ 3.84Å; L326-F330 HydrophobicContact CB-CB 4.43Å; L326-F330 HydrophobicContact CD1-CB 4.01Å; L326-F330 HydrophobicContact CD2-CB 4.15Å; L326-F330 HydrophobicContact CG-CB 4.43Å; F330-V332 HydrophobicContact CD2-CG2 4.07Å; F330-V332 HydrophobicContact CE2-CG2 3.9Å; F330-V338 HydrophobicContact CD2-CG1 4.35Å; F330-L339 WeakPolarHBondContact CA-O 3.4Å
331	H	87.6	Confident	85.9	Confident	42 Å²	42	67 Å²	67	19%	0.194	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	148.4	177.9	-63.1	-100.4	0	0	0	110	V338 L339 W344	H331-V338 CarbonylContact O-C 3.55Å; H331-V338 VanDerWaalsContact O-CA 3.28Å; H331-V338 WeakPolarHBondContact O-CA 3.13Å; H331-L339 PolarHBondContact N-O 3.32Å; H331-L339 PolarHBondContact O-N 3.33Å; H331-W344 HydrophobicContact CB-CB 3.82Å; H331-W344 HydrophobicContact CB-CD2 4.21Å; H331-W344 HydrophobicContact CB-CG 3.47Å; H331-W344 VanDerWaalsContact CB-CG 3.47Å; H331-W344 AromaticContact CD2-CD2 3.89Å; H331-W344 AromaticContact CD2-CG 3.59Å; H331-W344 AromaticContact CE1-CD2 3.43Å; H331-W344 VanDerWaalsContact CE1-CD2 3.43Å; H331-W344 AromaticContact CE1-CE2 3.88Å; H331-W344 AromaticContact CE1-CE3 3.38Å; H331-W344 AromaticContact CE1-CG 3.95Å; H331-W344 AromaticContact CE1-CZ3 3.79Å; H331-W344 AromaticContact CG-CD1 3.52Å; H331-W344 AromaticContact CG-CD2 3.55Å; H331-W344 AromaticContact CG-CE2 3.98Å; H331-W344 AromaticContact CG-CG 3.22Å; H331-W344 AromaticContact CG-NE1 3.92Å; H331-W344 AromaticContact ND1-CD1 3.76Å; H331-W344 AromaticContact ND1-CD2 3.25Å; H331-W344 VanDerWaalsContact ND1-CD2 3.25Å; H331-W344 AromaticContact ND1-CE2 3.4Å; H331-W344 AromaticContact ND1-CE3 3.73Å; H331-W344 AromaticContact ND1-CG 3.49Å; H331-W344 AromaticContact ND1-CZ2 3.98Å; H331-W344 AromaticContact ND1-NE1 3.68Å; H331-W344 AromaticContact NE2-CD2 3.84Å; H331-W344 AromaticContact NE2-CE3 3.7Å
332	V	87.7	Confident	85.8	Confident	47 Å²	47	68.1 Å²	68.1	29%	0.285	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.1	-178.7	-170.1	0	0	0	0	108.2	I163 I308 F330 H337 V338	I163-V332 HydrophobicContact CD1-CG2 4.17Å; I308-V332 HydrophobicContact CD1-CB 4.41Å; I308-V332 HydrophobicContact CD1-CG1 4.05Å; I308-V332 HydrophobicContact CD1-CG2 3.44Å; I308-V332 VanDerWaalsContact CD1-CG2 3.44Å; I308-V332 HydrophobicContact CG1-CG2 3.77Å; I308-V332 HydrophobicContact CG2-CG1 4.26Å; I308-V332 HydrophobicContact CG2-CG2 4.48Å; F330-V332 HydrophobicContact CD2-CG2 4.07Å; F330-V332 HydrophobicContact CE2-CG2 3.9Å; V332-H337 WeakPolarHBondContact CA-O 3.26Å; V332-V338 HydrophobicContact CG2-CG1 4.41Å
333	E	83.9	Confident	85.7	Confident	54 Å²	54	67.1 Å²	67.1	25%	0.252	34%	0.341	S	S	.	.			trans	-84.4	163.1	171.9	-62.1	-66.9	130.8	0	0	110.9	D335 N336 H337 L339 H348	E333-D335 PolarHBondContact O-N 3.33Å; E333-N336 WeakPolarHBondContact O-CA 3.39Å; E333-N336 PolarHBondContact O-N 3.28Å; E333-H337 HydrophobicContact CB-CB 4.28Å; E333-H337 PolarHBondContact N-O 2.81Å; E333-L339 HydrophobicContact CG-CD1 3.78Å; E333-L339 HydrophobicContact CG-CG 4.29Å; E333-H348 VanDerWaalsContact CD-NE2 3.33Å; E333-H348 IonicContact OE1-CD2 3.28Å; E333-H348 IonicContact OE1-CE1 2.8Å; E333-H348 IonicContact OE1-NE2 3.75Å; E333-H348 PolarHBondContact OE1-NE2 3.23Å; E333-H348 IonicContact OE2-CE1 3.23Å; E333-H348 IonicContact OE2-NE2 2.64Å; E333-H348 PolarHBondContact OE2-NE2 3.25Å
334	D	77	Confident	85.5	Confident	121 Å²	121	65 Å²	65	65%	0.647	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-31.5	-179.6	-69.1	-32.6	0	0	0	113.1	N336	D334-N336 PolarHBondContact O-N 2.92Å
335	D	78.9	Confident	85.3	Confident	125 Å²	125	63.1 Å²	63.1	67%	0.668	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	12.1	177.4	-66.4	-26.1	0	0	0	114.1	E333 H337	E333-D335 PolarHBondContact O-N 3.33Å; D335-H337 VanDerWaalsContact CB-ND1 3.31Å; D335-H337 WeakPolarHBondContact CB-ND1 3.42Å; D335-H337 PolarHBondContact O-N 3.15Å
336	N	77.5	Confident	85.1	Confident	71 Å²	71	65.4 Å²	65.4	38%	0.38	33%	0.326	S	S	.	.	S	Bend	trans	59.7	17	-169.8	-65	-55.2	0	0	0	114.7	R310 E333 D334	R310-N336 PolarHBondContact NH2-ND2 2.87Å; E333-N336 WeakPolarHBondContact O-CA 3.39Å; E333-N336 PolarHBondContact O-N 3.28Å; D334-N336 PolarHBondContact O-N 2.92Å
337	H	85.6	Confident	84.8	Confident	60 Å²	60	70.2 Å²	70.2	28%	0.278	35%	0.347	S	S	.	.			trans	-72.3	131.7	171.2	-69.7	115.7	0	0	0	110	Y320 V332 E333 D335	Y320-H337 HydrophobicContact CD1-CB 4.24Å; Y320-H337 AromaticContact CD1-CD2 3.87Å; Y320-H337 AromaticContact CD1-CG 3.96Å; Y320-H337 AromaticContact CD2-CD2 3.11Å; Y320-H337 WeakPolarHBondContact CD2-CD2 3.4Å; Y320-H337 AromaticContact CD2-CG 3.98Å; Y320-H337 AromaticContact CD2-NE2 3.64Å; Y320-H337 AromaticContact CE1-CD2 3.98Å; Y320-H337 AromaticContact CE2-CD2 3.26Å; Y320-H337 WeakPolarHBondContact CE2-CD2 3.48Å; Y320-H337 AromaticContact CE2-NE2 3.21Å; Y320-H337 WeakPolarHBondContact CE2-NE2 3.37Å; Y320-H337 HydrophobicContact CG-CB 4.05Å; Y320-H337 AromaticContact CG-CD2 3.43Å; Y320-H337 VanDerWaalsContact CG-CD2 3.43Å; Y320-H337 AromaticContact CG-CG 3.83Å; Y320-H337 AromaticContact CZ-CD2 3.69Å; Y320-H337 AromaticContact CZ-CE1 3.95Å; Y320-H337 AromaticContact CZ-NE2 3.43Å; V332-H337 WeakPolarHBondContact CA-O 3.26Å; E333-H337 HydrophobicContact CB-CB 4.28Å; E333-H337 PolarHBondContact N-O 2.81Å; D335-H337 VanDerWaalsContact CB-ND1 3.31Å; D335-H337 WeakPolarHBondContact CB-ND1 3.42Å; D335-H337 PolarHBondContact O-N 3.15Å
338	V	90	Very high	84.8	Confident	8 Å²	8	69.1 Å²	69.1	5%	0.048	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127.5	177.1	-67.7	0	0	0	0	110.5	I308 F317 V318 C319 Y320 L326 F330 H331 V332	I308-V338 HydrophobicContact CD1-CG1 3.24Å; F317-V338 HydrophobicContact CE2-CG1 4.15Å; F317-V338 HydrophobicContact CE2-CG2 4.46Å; V318-V338 WeakPolarHBondContact O-CG2 3.29Å; C319-V338 CarbonylContact C-O 3.48Å; C319-V338 WeakPolarHBondContact CA-O 3.37Å; Y320-V338 PolarHBondContact N-O 2.94Å; L326-V338 HydrophobicContact CD1-CB 3.55Å; L326-V338 HydrophobicContact CD1-CG2 3.4Å; F330-V338 HydrophobicContact CD2-CG1 4.35Å; H331-V338 CarbonylContact O-C 3.55Å; H331-V338 VanDerWaalsContact O-CA 3.28Å; H331-V338 WeakPolarHBondContact O-CA 3.13Å; V332-V338 HydrophobicContact CG2-CG1 4.41Å
339	L	90.2	Very high	84.8	Confident	8 Å²	8	69.8 Å²	69.8	4%	0.042	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.1	179.6	-65.1	177	0	0	0	110.5	H321 F330 H331 E333 H343 W344 F347	H321-L339 HydrophobicContact CB-CD2 4.25Å; F330-L339 WeakPolarHBondContact CA-O 3.4Å; H331-L339 PolarHBondContact N-O 3.32Å; H331-L339 PolarHBondContact O-N 3.33Å; E333-L339 HydrophobicContact CG-CD1 3.78Å; E333-L339 HydrophobicContact CG-CG 4.29Å; L339-H343 HydrophobicContact CD2-CB 4.29Å; L339-W344 HydrophobicContact CB-CB 4.19Å; L339-F347 HydrophobicContact CD1-CD2 4.07Å
340	C	90.8	Very high	84.8	Confident	22 Å²	22	67.9 Å²	67.9	15%	0.149	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	160.2	166	68.5	0	0	0	0	109.2	C319 L326 E342 H343 W344	C319-C340 HydrophobicContact CB-CB 4.07Å; C319-C340 PolarHBondContact SG-N 3.36Å; C319-C340 VanDerWaalsContact SG-N 3.37Å; L326-C340 HydrophobicContact CD2-CB 3.63Å; C340-E342 PolarHBondContact O-N 3.3Å; C340-H343 PolarHBondContact O-N 2.97Å; C340-H343 VanDerWaalsContact O-N 3.17Å; C340-H343 PolarHBondContact SG-ND1 3.47Å; C340-W344 PolarHBondContact O-N 2.51Å
341	E	87.4	Confident	84.8	Confident	80 Å²	80	73.6 Å²	73.6	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-51.4	-41.7	-179.7	-171.9	-177	-175.9	0	0	112.8	I329 W344 K345	I329-E341 HydrophobicContact CG2-CB 4.32Å; E341-W344 PolarHBondContact O-N 2.75Å; E341-K345 HydrophobicContact CG-CD 4.3Å; E341-K345 WeakPolarHBondContact O-CB 3.16Å; E341-K345 WeakPolarHBondContact O-CG 3.33Å; E341-K345 PolarHBondContact O-N 3.01Å; E341-K345 VanDerWaalsContact OE1-CE 3.31Å; E341-K345 WeakPolarHBondContact OE1-CE 3.42Å; E341-K345 IonicContact OE1-NZ 3.32Å; E341-K345 PolarHBondContact OE1-NZ 3.23Å
342	E	88.7	Confident	85	Confident	127 Å²	127	71.6 Å²	71.6	59%	0.593	35%	0.346	S	S	*	.	H	α-helix	trans	-60.9	-48.8	179.2	-174.9	-178.8	-166.9	0	0	112.7	C340 Q346	C340-E342 PolarHBondContact O-N 3.3Å; E342-Q346 WeakPolarHBondContact O-CB 3.04Å; E342-Q346 PolarHBondContact O-N 3.19Å
343	H	89.6	Confident	85.1	Confident	17 Å²	17	70.5 Å²	70.5	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-73.1	-35.3	179.6	-72.7	102.4	0	0	0	112	C319 H321 C322 L339 C340 Q346 F347	C319-H343 PolarHBondContact SG-ND1 2.98Å; H321-H343 HydrophobicContact CB-CB 4.24Å; H321-H343 AromaticContact CE1-CD2 3.88Å; H321-H343 AromaticContact CE1-NE2 3.91Å; H321-H343 AromaticContact CG-CD2 3.53Å; H321-H343 AromaticContact CG-NE2 3.84Å; H321-H343 AromaticContact ND1-CD2 3.01Å; H321-H343 PolarHBondContact ND1-CD2 2.87Å; H321-H343 AromaticContact ND1-CE1 3.93Å; H321-H343 AromaticContact ND1-CG 3.91Å; H321-H343 AromaticContact ND1-NE2 2.98Å; H321-H343 PolarHBondContact ND1-NE2 3.02Å; C322-H343 WeakPolarHBondContact CB-CE1 3.48Å; C322-H343 PolarHBondContact SG-CE1 3.36Å; L339-H343 HydrophobicContact CD2-CB 4.29Å; C340-H343 PolarHBondContact O-N 2.97Å; C340-H343 VanDerWaalsContact O-N 3.17Å; C340-H343 PolarHBondContact SG-ND1 3.47Å; H343-Q346 PolarHBondContact CD2-OE1 3.42Å; H343-Q346 WeakPolarHBondContact O-CB 3.26Å; H343-Q346 PolarHBondContact O-N 3.48Å; H343-F347 HydrophobicContact CB-CD2 4.35Å; H343-F347 HydrophobicContact CB-CE2 4.03Å; H343-F347 WeakPolarHBondContact O-CD2 3.42Å; H343-F347 WeakPolarHBondContact O-CG 3.49Å; H343-F347 PolarHBondContact O-N 3.35Å
344	W	87.3	Confident	85.5	Confident	71 Å²	71	72.1 Å²	72.1	27%	0.269	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-46.8	175	-176.7	80	0	0	0	110.8	H331 L339 C340 E341 Q346 F347 H348	H331-W344 HydrophobicContact CB-CB 3.82Å; H331-W344 HydrophobicContact CB-CD2 4.21Å; H331-W344 HydrophobicContact CB-CG 3.47Å; H331-W344 VanDerWaalsContact CB-CG 3.47Å; H331-W344 AromaticContact CD2-CD2 3.89Å; H331-W344 AromaticContact CD2-CG 3.59Å; H331-W344 AromaticContact CE1-CD2 3.43Å; H331-W344 VanDerWaalsContact CE1-CD2 3.43Å; H331-W344 AromaticContact CE1-CE2 3.88Å; H331-W344 AromaticContact CE1-CE3 3.38Å; H331-W344 AromaticContact CE1-CG 3.95Å; H331-W344 AromaticContact CE1-CZ3 3.79Å; H331-W344 AromaticContact CG-CD1 3.52Å; H331-W344 AromaticContact CG-CD2 3.55Å; H331-W344 AromaticContact CG-CE2 3.98Å; H331-W344 AromaticContact CG-CG 3.22Å; H331-W344 AromaticContact CG-NE1 3.92Å; H331-W344 AromaticContact ND1-CD1 3.76Å; H331-W344 AromaticContact ND1-CD2 3.25Å; H331-W344 VanDerWaalsContact ND1-CD2 3.25Å; H331-W344 AromaticContact ND1-CE2 3.4Å; H331-W344 AromaticContact ND1-CE3 3.73Å; H331-W344 AromaticContact ND1-CG 3.49Å; H331-W344 AromaticContact ND1-CZ2 3.98Å; H331-W344 AromaticContact ND1-NE1 3.68Å; H331-W344 AromaticContact NE2-CD2 3.84Å; H331-W344 AromaticContact NE2-CE3 3.7Å; L339-W344 HydrophobicContact CB-CB 4.19Å; C340-W344 PolarHBondContact O-N 2.51Å; E341-W344 PolarHBondContact O-N 2.75Å; W344-Q346 VanDerWaalsContact C-N 3.34Å; W344-Q346 PolarHBondContact O-N 3.37Å; W344-F347 PolarHBondContact O-N 3.15Å; W344-H348 AromaticContact CD1-CD2 3.41Å; W344-H348 VanDerWaalsContact CD1-CD2 3.41Å; W344-H348 AromaticContact CD1-NE2 3.88Å; W344-H348 HydrophobicContact CD2-CB 4.33Å; W344-H348 AromaticContact CE2-CG 3.97Å; W344-H348 HydrophobicContact CZ2-CB 4.08Å; W344-H348 AromaticContact NE1-CD2 3.35Å; W344-H348 PolarHBondContact NE1-CD2 3.35Å; W344-H348 VanDerWaalsContact NE1-CD2 3.35Å; W344-H348 AromaticContact NE1-CG 3.69Å; W344-H348 AromaticContact NE1-NE2 3.73Å; W344-H348 WeakPolarHBondContact O-CB 2.99Å; W344-H348 PolarHBondContact O-CD2 2.93Å; W344-H348 PolarHBondContact O-N 3.29Å
345	K	85	Confident	86.3	Confident	82 Å²	82	68.5 Å²	68.5	36%	0.357	33%	0.332	S	S	.	.	H	α-helix	trans	-56.9	-47	171.5	-73.8	176.5	-174.9	169.3	0	111.2	E341 F347 H348 E349	E341-K345 HydrophobicContact CG-CD 4.3Å; E341-K345 WeakPolarHBondContact O-CB 3.16Å; E341-K345 WeakPolarHBondContact O-CG 3.33Å; E341-K345 PolarHBondContact O-N 3.01Å; E341-K345 VanDerWaalsContact OE1-CE 3.31Å; E341-K345 WeakPolarHBondContact OE1-CE 3.42Å; E341-K345 IonicContact OE1-NZ 3.32Å; E341-K345 PolarHBondContact OE1-NZ 3.23Å; K345-F347 PolarHBondContact O-N 3.3Å; K345-F347 VanDerWaalsContact O-N 3.14Å; K345-H348 PolarHBondContact O-N 2.99Å; K345-E349 HydrophobicContact CB-CB 4.47Å; K345-E349 WeakPolarHBondContact O-CA 3.39Å; K345-E349 WeakPolarHBondContact O-CB 3.48Å; K345-E349 PolarHBondContact O-N 2.92Å
346	Q	83.3	Confident	86.8	Confident	128 Å²	128	69.2 Å²	69.2	60%	0.598	33%	0.329	S	S	*	.	H	α-helix	trans	-56.9	-34.1	179.1	-171.4	178.9	9.1	0	0	114.1	E342 H343 W344	E342-Q346 WeakPolarHBondContact O-CB 3.04Å; E342-Q346 PolarHBondContact O-N 3.19Å; H343-Q346 PolarHBondContact CD2-OE1 3.42Å; H343-Q346 WeakPolarHBondContact O-CB 3.26Å; H343-Q346 PolarHBondContact O-N 3.48Å; W344-Q346 VanDerWaalsContact C-N 3.34Å; W344-Q346 PolarHBondContact O-N 3.37Å
347	F	82	Confident	87.3	Confident	108 Å²	108	71 Å²	71	47%	0.474	34%	0.335	S	S	.	.	H	α-helix	trans	-93.2	-27.7	-178.5	-63.1	-55.2	0	0	0	114.3	H321 L339 H343 W344 K345	H321-F347 HydrophobicContact CB-CE2 4.35Å; H321-F347 AromaticContact CD2-CE2 3.96Å; H321-F347 AromaticContact CD2-CZ 3.55Å; H321-F347 AromaticContact NE2-CZ 3.72Å; L339-F347 HydrophobicContact CD1-CD2 4.07Å; H343-F347 HydrophobicContact CB-CD2 4.35Å; H343-F347 HydrophobicContact CB-CE2 4.03Å; H343-F347 WeakPolarHBondContact O-CD2 3.42Å; H343-F347 WeakPolarHBondContact O-CG 3.49Å; H343-F347 PolarHBondContact O-N 3.35Å; W344-F347 PolarHBondContact O-N 3.15Å; K345-F347 PolarHBondContact O-N 3.3Å; K345-F347 VanDerWaalsContact O-N 3.14Å
348	H	79.1	Confident	87.4	Confident	86 Å²	86	70.5 Å²	70.5	40%	0.398	34%	0.338	S	S	.	.	H	α-helix	trans	-113.1	-14.2	-173.1	-70.8	-91.6	0	0	0	114.3	E333 W344 K345 I350	E333-H348 VanDerWaalsContact CD-NE2 3.33Å; E333-H348 IonicContact OE1-CD2 3.28Å; E333-H348 IonicContact OE1-CE1 2.8Å; E333-H348 IonicContact OE1-NE2 3.75Å; E333-H348 PolarHBondContact OE1-NE2 3.23Å; E333-H348 IonicContact OE2-CE1 3.23Å; E333-H348 IonicContact OE2-NE2 2.64Å; E333-H348 PolarHBondContact OE2-NE2 3.25Å; W344-H348 AromaticContact CD1-CD2 3.41Å; W344-H348 VanDerWaalsContact CD1-CD2 3.41Å; W344-H348 AromaticContact CD1-NE2 3.88Å; W344-H348 HydrophobicContact CD2-CB 4.33Å; W344-H348 AromaticContact CE2-CG 3.97Å; W344-H348 HydrophobicContact CZ2-CB 4.08Å; W344-H348 AromaticContact NE1-CD2 3.35Å; W344-H348 PolarHBondContact NE1-CD2 3.35Å; W344-H348 VanDerWaalsContact NE1-CD2 3.35Å; W344-H348 AromaticContact NE1-CG 3.69Å; W344-H348 AromaticContact NE1-NE2 3.73Å; W344-H348 WeakPolarHBondContact O-CB 2.99Å; W344-H348 PolarHBondContact O-CD2 2.93Å; W344-H348 PolarHBondContact O-N 3.29Å; K345-H348 PolarHBondContact O-N 2.99Å; H348-I350 PolarHBondContact O-N 2.76Å
349	E	80	Confident	87.3	Confident	95 Å²	95	70.7 Å²	70.7	44%	0.444	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-71.4	117.5	177.6	-167.2	166	-161.2	0	0	109.7	K345 E351 S358	K345-E349 HydrophobicContact CB-CB 4.47Å; K345-E349 WeakPolarHBondContact O-CA 3.39Å; K345-E349 WeakPolarHBondContact O-CB 3.48Å; K345-E349 PolarHBondContact O-N 2.92Å; E349-E351 PolarHBondContact O-N 3.37Å; E349-S358 WeakPolarHBondContact OE1-CB 3.47Å; E349-S358 PolarHBondContact OE1-OG 2.87Å
350	I	81.5	Confident	86.9	Confident	67 Å²	67	72.8 Å²	72.8	34%	0.344	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-79	119.3	-179	-65.3	160	0	0	0	108.3	H348 S358 I359 Q372	H348-I350 PolarHBondContact O-N 2.76Å; I350-S358 CarbonylContact O-C 3.55Å; I350-S358 WeakPolarHBondContact O-CA 3.46Å; I350-I359 HydrophobicContact CB-CB 4.45Å; I350-I359 HydrophobicContact CG2-CB 4.23Å; I350-I359 HydrophobicContact CG2-CD1 3.92Å; I350-I359 HydrophobicContact CG2-CG1 4.38Å; I350-I359 PolarHBondContact O-N 2.79Å; I350-Q372 HydrophobicContact CG2-CB 3.57Å; I350-Q372 VanDerWaalsContact CG2-CD 3.43Å; I350-Q372 HydrophobicContact CG2-CG 3.89Å
351	E	87.7	Confident	86	Confident	126 Å²	126	76.6 Å²	76.6	59%	0.589	37%	0.37	S	S	*	.	B	Isolated β-bridge	trans	-89.6	136.8	173.8	-66.5	-175.7	176	0	0	112.7	E349 A353	E349-E351 PolarHBondContact O-N 3.37Å; E351-A353 PolarHBondContact O-N 2.99Å
352	C	91.9	Very high	85.6	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-68	122.8	170.6	172.5	0	0	0	0	110.9	K354 C355 K356 Q357 I359 Q372 H374 C377	C352-K354 PolarHBondContact O-N 3.01Å; C352-K354 VanDerWaalsContact O-N 3.07Å; C352-K354 PolarHBondContact SG-N 3.48Å; C352-K354 VanDerWaalsContact SG-N 3.43Å; C352-C355 WeakPolarHBondContact CB-SG 3.48Å; C352-K356 VanDerWaalsContact O-CA 3.25Å; C352-K356 WeakPolarHBondContact O-CA 3.29Å; C352-K356 PolarHBondContact O-N 2.63Å; C352-Q357 WeakPolarHBondContact CB-O 3.47Å; C352-Q357 PolarHBondContact N-O 3.07Å; C352-I359 HydrophobicContact CB-CD1 3.97Å; C352-I359 HydrophobicContact CB-CG1 3.89Å; C352-Q372 WeakPolarHBondContact CA-O 3.41Å; C352-H374 VanDerWaalsContact CB-ND1 3.3Å; C352-H374 WeakPolarHBondContact CB-ND1 3.47Å; C352-C377 VanDerWaalsContact SG-CB 3.52Å
353	A	90.9	Very high	85.4	Confident	25 Å²	25	77 Å²	77	21%	0.207	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-20	-178.5	0	0	0	0	0	115.2	E351 K371 Q372 Y373	E351-A353 PolarHBondContact O-N 2.99Å; A353-K371 HydrophobicContact CB-CB 3.75Å; A353-K371 HydrophobicContact CB-CD 3.65Å; A353-K371 HydrophobicContact CB-CG 4.21Å; A353-Q372 PolarHBondContact N-O 3.21Å; A353-Y373 HydrophobicContact CB-CD1 4.03Å; A353-Y373 HydrophobicContact CB-CE1 3.52Å; A353-Y373 HydrophobicContact CB-CE2 4.23Å
354	K	91.5	Very high	85.4	Confident	88 Å²	88	82.4 Å²	82.4	38%	0.383	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-57.9	176.5	-177.8	180	178	-173.3	0	112.8	C352 Y373 C377 S379 Q384	C352-K354 PolarHBondContact O-N 3.01Å; C352-K354 VanDerWaalsContact O-N 3.07Å; C352-K354 PolarHBondContact SG-N 3.48Å; C352-K354 VanDerWaalsContact SG-N 3.43Å; K354-Y373 HydrophobicContact CB-CD1 3.99Å; K354-Y373 HydrophobicContact CB-CE1 4.26Å; K354-C377 HydrophobicContact CB-CB 4.04Å; K354-C377 HydrophobicContact CD-CB 4.04Å; K354-C377 WeakPolarHBondContact CD-O 3.48Å; K354-S379 PolarHBondContact NZ-OG 3.47Å; K354-Q384 VanDerWaalsContact CE-OE1 3.28Å
355	C	92.9	Very high	85.5	Confident	44 Å²	44	81 Å²	81	30%	0.297	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-9.8	-173.1	65.9	0	0	0	0	114	C352 Q357 H374	C352-C355 WeakPolarHBondContact CB-SG 3.48Å; C355-Q357 HydrophobicContact CB-CG 4.44Å; C355-Q357 PolarHBondContact O-N 2.7Å; C355-Q357 VanDerWaalsContact O-N 3.15Å; C355-Q357 PolarHBondContact SG-N 3.44Å; C355-H374 PolarHBondContact SG-ND1 3.03Å; C355-H374 VanDerWaalsContact SG-ND1 3.39Å
356	K	90.5	Very high	85.7	Confident	140 Å²	140	77 Å²	77	61%	0.609	38%	0.375	S	S	*	.			trans	62	13.5	-177	-52	-58.7	-172.5	170.1	0	114.7	C352	C352-K356 VanDerWaalsContact O-CA 3.25Å; C352-K356 WeakPolarHBondContact O-CA 3.29Å; C352-K356 PolarHBondContact O-N 2.63Å
357	Q	88.5	Confident	85.9	Confident	110 Å²	110	74.8 Å²	74.8	51%	0.514	37%	0.365	S	S	.	.			trans	-89.6	150.2	170.9	-60.4	-179	-40.9	0	0	109.4	C352 C355	C352-Q357 WeakPolarHBondContact CB-O 3.47Å; C352-Q357 PolarHBondContact N-O 3.07Å; C355-Q357 HydrophobicContact CB-CG 4.44Å; C355-Q357 PolarHBondContact O-N 2.7Å; C355-Q357 VanDerWaalsContact O-N 3.15Å; C355-Q357 PolarHBondContact SG-N 3.44Å
358	S	87.8	Confident	86.2	Confident	48 Å²	48	70 Å²	70	34%	0.336	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-63	148.2	174.9	54.5	0	0	0	0	112.3	E349 I350 H374	E349-S358 WeakPolarHBondContact OE1-CB 3.47Å; E349-S358 PolarHBondContact OE1-OG 2.87Å; I350-S358 CarbonylContact O-C 3.55Å; I350-S358 WeakPolarHBondContact O-CA 3.46Å; S358-H374 PolarHBondContact O-CE1 3.26Å; S358-H374 VanDerWaalsContact O-CE1 3.32Å; S358-H374 PolarHBondContact O-NE2 3.36Å
359	I	86.8	Confident	86.4	Confident	12 Å²	12	67.3 Å²	67.3	6%	0.062	34%	0.336	C	S	.	.			trans	-99.3	107.3	174.4	-60.5	178.8	0	0	0	105.3	I350 C352 D363 F365 Q372	I350-I359 HydrophobicContact CB-CB 4.45Å; I350-I359 HydrophobicContact CG2-CB 4.23Å; I350-I359 HydrophobicContact CG2-CD1 3.92Å; I350-I359 HydrophobicContact CG2-CG1 4.38Å; I350-I359 PolarHBondContact O-N 2.79Å; C352-I359 HydrophobicContact CB-CD1 3.97Å; C352-I359 HydrophobicContact CB-CG1 3.89Å; I359-D363 HydrophobicContact CG2-CB 4.09Å; I359-F365 HydrophobicContact CD1-CB 4.17Å; I359-F365 HydrophobicContact CG2-CB 3.63Å; I359-F365 HydrophobicContact CG2-CD1 4.33Å; I359-F365 HydrophobicContact CG2-CG 4.21Å; I359-Q372 HydrophobicContact CD1-CB 3.87Å
360	S	81.6	Confident	86.6	Confident	52 Å²	52	66.5 Å²	66.5	36%	0.364	35%	0.353	S	S	.	.			trans	-70	160.2	178.2	70.9	0	0	0	0	110.8	I362 D363	S360-I362 PolarHBondContact O-N 3.07Å; S360-D363 WeakPolarHBondContact CB-OD2 3.15Å; S360-D363 PolarHBondContact N-OD2 3.13Å; S360-D363 PolarHBondContact O-N 3.03Å; S360-D363 PolarHBondContact OG-N 3.27Å; S360-D363 PolarHBondContact OG-OD2 3.16Å
361	E	72.8	Confident	86.9	Confident	103 Å²	103	67 Å²	67	48%	0.481	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.4	175.5	-64.4	-176	171.7	0	0	113.4	P154 H160	P154-E361 WeakPolarHBondContact CG-O 3.02Å; H160-E361 IonicContact CE1-OE2 3.91Å
362	I	79	Confident	87	Confident	153 Å²	153	63 Å²	63	79%	0.785	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-20.4	-179.2	-52.3	166.7	0	0	0	110.7	S360	S360-I362 PolarHBondContact O-N 3.07Å
363	D	84.6	Confident	87	Confident	62 Å²	62	63.6 Å²	63.6	33%	0.332	34%	0.336	S	S	.	.	S	Bend	trans	-75.3	132.2	-175.8	-71.7	-49.5	0	0	0	111.5	I359 S360 F365 H374	I359-D363 HydrophobicContact CG2-CB 4.09Å; S360-D363 WeakPolarHBondContact CB-OD2 3.15Å; S360-D363 PolarHBondContact N-OD2 3.13Å; S360-D363 PolarHBondContact O-N 3.03Å; S360-D363 PolarHBondContact OG-N 3.27Å; S360-D363 PolarHBondContact OG-OD2 3.16Å; D363-F365 PolarHBondContact O-N 3.22Å; D363-H374 IonicContact OD2-CD2 2.66Å; D363-H374 IonicContact OD2-NE2 3.55Å
364	R	88.6	Confident	87.1	Confident	131 Å²	131	62.7 Å²	62.7	49%	0.494	33%	0.328	S	S	.	.			trans	-63.8	124.8	166.8	-166.9	174.6	77.9	-133.8	-0.5	109	A375 E388	R364-A375 HydrophobicContact CB-CB 4.05Å; R364-A375 HydrophobicContact CG-CB 3.93Å; R364-A375 WeakPolarHBondContact O-CB 3.49Å; R364-A375 PolarHBondContact O-N 2.92Å; R364-E388 IonicContact CZ-OE1 3.54Å; R364-E388 IonicContact CZ-OE2 2.73Å; R364-E388 IonicContact NE-OE1 3.96Å; R364-E388 PolarHBondContact NE-OE1 3.24Å; R364-E388 IonicContact NE-OE2 3.68Å; R364-E388 VanDerWaalsContact NH2-CD 3.27Å; R364-E388 IonicContact NH2-OE1 2.69Å; R364-E388 PolarHBondContact NH2-OE1 3.09Å; R364-E388 VanDerWaalsContact NH2-OE1 3.14Å; R364-E388 IonicContact NH2-OE2 3.68Å; R364-E388 PolarHBondContact NH2-OE2 3.01Å
365	F	89.3	Confident	87	Confident	40 Å²	40	58.8 Å²	58.8	18%	0.175	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	158.7	178.4	72	-87.9	0	0	0	112.3	Y152 I359 D363 Y373	Y152-F365 AromaticContact CD2-CE2 3.91Å; Y152-F365 HydrophobicContact CD2-CE2 3.91Å; Y152-F365 HydrophobicContact CD2-CZ 4.02Å; Y152-F365 HydrophobicContact CG-CE2 4.45Å; Y152-F365 HydrophobicContact CG-CZ 4.1Å; I359-F365 HydrophobicContact CD1-CB 4.17Å; I359-F365 HydrophobicContact CG2-CB 3.63Å; I359-F365 HydrophobicContact CG2-CD1 4.33Å; I359-F365 HydrophobicContact CG2-CG 4.21Å; D363-F365 PolarHBondContact O-N 3.22Å; F365-Y373 CarbonylContact C-O 3.53Å; F365-Y373 WeakPolarHBondContact CA-O 3.48Å; F365-Y373 WeakPolarHBondContact CB-O 3.47Å
366	I	88.7	Confident	87	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	126	177.5	-69.3	174	0	0	0	107.9	I149 A368 Q372 Y373 A375 F378 E388	I149-I366 HydrophobicContact CG2-CG1 4.5Å; I149-I366 HydrophobicContact CG2-CG2 3.6Å; I366-A368 HydrophobicContact CG2-CB 4.16Å; I366-Q372 WeakPolarHBondContact O-CA 3.38Å; I366-Y373 PolarHBondContact N-O 2.89Å; I366-Y373 PolarHBondContact O-N 3.28Å; I366-A375 HydrophobicContact CD1-CB 4.18Å; I366-A375 HydrophobicContact CG1-CB 4.34Å; I366-F378 HydrophobicContact CB-CB 4.16Å; I366-F378 HydrophobicContact CB-CG 4.24Å; I366-F378 HydrophobicContact CD1-CB 3.7Å; I366-F378 HydrophobicContact CD1-CD1 3.84Å; I366-F378 HydrophobicContact CD1-CG 4.02Å; I366-F378 HydrophobicContact CG1-CB 4.48Å; I366-F378 HydrophobicContact CG2-CB 4.26Å; I366-F378 HydrophobicContact CG2-CD1 3.9Å; I366-F378 HydrophobicContact CG2-CD2 4.07Å; I366-F378 HydrophobicContact CG2-CE1 4.28Å; I366-F378 HydrophobicContact CG2-CE2 4.45Å; I366-F378 HydrophobicContact CG2-CG 3.79Å; I366-E388 HydrophobicContact CD1-CB 3.71Å; I366-E388 HydrophobicContact CD1-CG 3.66Å
367	Q	88.9	Confident	87.1	Confident	81 Å²	81	58.3 Å²	58.3	38%	0.379	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.1	170.1	-172.2	172.4	-15.1	0	0	109.3	K371 Q372	Q367-K371 WeakPolarHBondContact CA-O 3.36Å; Q367-Q372 HydrophobicContact CG-CG 4.49Å
368	A	87	Confident	87.4	Confident	8 Å²	8	53 Å²	53	7%	0.066	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	152.9	-179.1	0	0	0	0	0	109.7	I366 G370 K371 Y373 F378 F392	I366-A368 HydrophobicContact CG2-CB 4.16Å; A368-G370 PolarHBondContact O-N 2.89Å; A368-G370 VanDerWaalsContact O-N 3.07Å; A368-K371 PolarHBondContact N-O 3.02Å; A368-K371 CarbonylContact O-C 3.58Å; A368-K371 PolarHBondContact O-N 2.76Å; A368-Y373 HydrophobicContact CB-CE2 4.45Å; A368-Y373 WeakPolarHBondContact O-CE2 3.26Å; A368-F378 HydrophobicContact CB-CD2 4.07Å; A368-F378 HydrophobicContact CB-CE2 3.29Å; A368-F378 HydrophobicContact CB-CZ 3.65Å; A368-F392 HydrophobicContact CB-CE2 4.42Å; A368-F392 HydrophobicContact CB-CZ 4Å
369	C	84.6	Confident	87.7	Confident	28 Å²	28	51 Å²	51	19%	0.189	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	26.2	177.9	-43.8	0	0	0	0	114.2	K371 T394	C369-K371 PolarHBondContact O-N 3.14Å; C369-T394 HydrophobicContact CB-CG2 3.78Å; C369-T394 WeakPolarHBondContact SG-CG2 3.31Å; C369-T394 PolarHBondContact SG-OG1 3.05Å
370	G	83.2	Confident	88	Confident	78 Å²	78	50.5 Å²	50.5	80%	0.804	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	11.2	-173.6	0	0	0	0	0	115	A368	A368-G370 PolarHBondContact O-N 2.89Å; A368-G370 VanDerWaalsContact O-N 3.07Å
371	K	88.3	Confident	88.5	Confident	77 Å²	77	50 Å²	50	34%	0.335	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	166.2	-177.9	-65.1	177.1	-173.8	166.8	0	110.8	A353 Q367 A368 C369 Y373	A353-K371 HydrophobicContact CB-CB 3.75Å; A353-K371 HydrophobicContact CB-CD 3.65Å; A353-K371 HydrophobicContact CB-CG 4.21Å; Q367-K371 WeakPolarHBondContact CA-O 3.36Å; A368-K371 PolarHBondContact N-O 3.02Å; A368-K371 CarbonylContact O-C 3.58Å; A368-K371 PolarHBondContact O-N 2.76Å; C369-K371 PolarHBondContact O-N 3.14Å; K371-Y373 HydrophobicContact CB-CE2 3.87Å
372	Q	90.1	Very high	89.4	Confident	44 Å²	44	47.8 Å²	47.8	21%	0.206	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	145.2	173.9	-56.7	-160	18.9	0	0	111	I350 C352 A353 I359 I366 Q367	I350-Q372 HydrophobicContact CG2-CB 3.57Å; I350-Q372 VanDerWaalsContact CG2-CD 3.43Å; I350-Q372 HydrophobicContact CG2-CG 3.89Å; C352-Q372 WeakPolarHBondContact CA-O 3.41Å; A353-Q372 PolarHBondContact N-O 3.21Å; I359-Q372 HydrophobicContact CD1-CB 3.87Å; I366-Q372 WeakPolarHBondContact O-CA 3.38Å; Q367-Q372 HydrophobicContact CG-CG 4.49Å
373	Y	91.3	Very high	90.1	Very high	11 Å²	11	42.5 Å²	42.5	4%	0.043	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.7	179.7	-59.3	-99.3	0	0	0	109.1	A353 K354 F365 I366 A368 K371 F378	A353-Y373 HydrophobicContact CB-CD1 4.03Å; A353-Y373 HydrophobicContact CB-CE1 3.52Å; A353-Y373 HydrophobicContact CB-CE2 4.23Å; K354-Y373 HydrophobicContact CB-CD1 3.99Å; K354-Y373 HydrophobicContact CB-CE1 4.26Å; F365-Y373 CarbonylContact C-O 3.53Å; F365-Y373 WeakPolarHBondContact CA-O 3.48Å; F365-Y373 WeakPolarHBondContact CB-O 3.47Å; I366-Y373 PolarHBondContact N-O 2.89Å; I366-Y373 PolarHBondContact O-N 3.28Å; A368-Y373 HydrophobicContact CB-CE2 4.45Å; A368-Y373 WeakPolarHBondContact O-CE2 3.26Å; K371-Y373 HydrophobicContact CB-CE2 3.87Å; Y373-F378 AromaticContact CD2-CD2 3.92Å; Y373-F378 HydrophobicContact CD2-CD2 3.92Å; Y373-F378 HydrophobicContact CE2-CD2 4.31Å; Y373-F378 HydrophobicContact CG-CD2 4.07Å
374	H	92.4	Very high	90.5	Very high	7 Å²	7	44.7 Å²	44.7	3%	0.032	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	145.8	158.6	-57.6	103.3	0	0	0	108.6	C352 C355 S358 D363 R376 C377 F378	C352-H374 VanDerWaalsContact CB-ND1 3.3Å; C352-H374 WeakPolarHBondContact CB-ND1 3.47Å; C355-H374 PolarHBondContact SG-ND1 3.03Å; C355-H374 VanDerWaalsContact SG-ND1 3.39Å; S358-H374 PolarHBondContact O-CE1 3.26Å; S358-H374 VanDerWaalsContact O-CE1 3.32Å; S358-H374 PolarHBondContact O-NE2 3.36Å; D363-H374 IonicContact OD2-CD2 2.66Å; D363-H374 IonicContact OD2-NE2 3.55Å; H374-R376 HydrophobicContact CB-CG 3.92Å; H374-R376 PolarHBondContact O-N 3.08Å; H374-C377 HydrophobicContact CB-CB 3.92Å; H374-C377 CarbonylContact O-C 3.58Å; H374-C377 WeakPolarHBondContact O-CA 3.32Å; H374-C377 WeakPolarHBondContact O-CB 3.44Å; H374-C377 PolarHBondContact O-N 2.75Å; H374-F378 PolarHBondContact O-N 3.34Å
375	A	91.1	Very high	90.7	Very high	5 Å²	5	44.5 Å²	44.5	4%	0.041	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-55.1	-42.2	179.9	0	0	0	0	0	112.2	R364 I366 C377 F378	R364-A375 HydrophobicContact CB-CB 4.05Å; R364-A375 HydrophobicContact CG-CB 3.93Å; R364-A375 WeakPolarHBondContact O-CB 3.49Å; R364-A375 PolarHBondContact O-N 2.92Å; I366-A375 HydrophobicContact CD1-CB 4.18Å; I366-A375 HydrophobicContact CG1-CB 4.34Å; A375-C377 PolarHBondContact O-N 3.3Å; A375-F378 PolarHBondContact O-N 3.39Å
376	R	91.4	Very high	90.9	Very high	166 Å²	166	46.2 Å²	46.2	63%	0.626	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-62.5	-25.6	172.8	67.2	-178.1	178.2	102.6	2.4	114.3	H374	H374-R376 HydrophobicContact CB-CG 3.92Å; H374-R376 PolarHBondContact O-N 3.08Å
377	C	93.1	Very high	91	Very high	8 Å²	8	46.4 Å²	46.4	5%	0.054	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-90	-13.5	-178.9	-73.7	0	0	0	0	112.5	C352 K354 H374 A375 S379	C352-C377 VanDerWaalsContact SG-CB 3.52Å; K354-C377 HydrophobicContact CB-CB 4.04Å; K354-C377 HydrophobicContact CD-CB 4.04Å; K354-C377 WeakPolarHBondContact CD-O 3.48Å; H374-C377 HydrophobicContact CB-CB 3.92Å; H374-C377 CarbonylContact O-C 3.58Å; H374-C377 WeakPolarHBondContact O-CA 3.32Å; H374-C377 WeakPolarHBondContact O-CB 3.44Å; H374-C377 PolarHBondContact O-N 2.75Å; A375-C377 PolarHBondContact O-N 3.3Å; C377-S379 PolarHBondContact O-N 2.86Å
378	F	94.2	Very high	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.256	C	S	.	.			trans	-79.2	88.7	175.7	-169.8	-112.7	0	0	0	111	I149 I366 A368 Y373 H374 A375 L387 F392 P399	I149-F378 HydrophobicContact CD1-CE1 3.68Å; I149-F378 HydrophobicContact CD1-CZ 4.34Å; I366-F378 HydrophobicContact CB-CB 4.16Å; I366-F378 HydrophobicContact CB-CG 4.24Å; I366-F378 HydrophobicContact CD1-CB 3.7Å; I366-F378 HydrophobicContact CD1-CD1 3.84Å; I366-F378 HydrophobicContact CD1-CG 4.02Å; I366-F378 HydrophobicContact CG1-CB 4.48Å; I366-F378 HydrophobicContact CG2-CB 4.26Å; I366-F378 HydrophobicContact CG2-CD1 3.9Å; I366-F378 HydrophobicContact CG2-CD2 4.07Å; I366-F378 HydrophobicContact CG2-CE1 4.28Å; I366-F378 HydrophobicContact CG2-CE2 4.45Å; I366-F378 HydrophobicContact CG2-CG 3.79Å; A368-F378 HydrophobicContact CB-CD2 4.07Å; A368-F378 HydrophobicContact CB-CE2 3.29Å; A368-F378 HydrophobicContact CB-CZ 3.65Å; Y373-F378 AromaticContact CD2-CD2 3.92Å; Y373-F378 HydrophobicContact CD2-CD2 3.92Å; Y373-F378 HydrophobicContact CE2-CD2 4.31Å; Y373-F378 HydrophobicContact CG-CD2 4.07Å; H374-F378 PolarHBondContact O-N 3.34Å; A375-F378 PolarHBondContact O-N 3.39Å; F378-L387 HydrophobicContact CD1-CB 3.66Å; F378-L387 HydrophobicContact CE1-CB 3.42Å; F378-L387 VanDerWaalsContact CE1-CB 3.42Å; F378-L387 HydrophobicContact CE1-CD1 4.48Å; F378-L387 HydrophobicContact CZ-CB 4.19Å; F378-L387 HydrophobicContact CZ-CD1 4.47Å; F378-L387 PolarHBondContact O-N 3.21Å; F378-F392 HydrophobicContact CE1-CD1 4.29Å; F378-F392 HydrophobicContact CE1-CE1 4.35Å; F378-F392 HydrophobicContact CE2-CE2 4.41Å; F378-F392 HydrophobicContact CZ-CD1 4.04Å; F378-F392 AromaticContact CZ-CD2 3.94Å; F378-F392 HydrophobicContact CZ-CD2 3.94Å; F378-F392 AromaticContact CZ-CE1 3.9Å; F378-F392 HydrophobicContact CZ-CE1 3.9Å; F378-F392 AromaticContact CZ-CE2 3.78Å; F378-F392 HydrophobicContact CZ-CE2 3.78Å; F378-F392 HydrophobicContact CZ-CG 4.06Å; F378-F392 AromaticContact CZ-CZ 3.76Å; F378-F392 HydrophobicContact CZ-CZ 3.76Å; F378-P399 HydrophobicContact CD2-CB 4.45Å; F378-P399 HydrophobicContact CD2-CG 4.14Å; F378-P399 HydrophobicContact CE2-CB 3.59Å; F378-P399 HydrophobicContact CE2-CG 3.73Å; F378-P399 HydrophobicContact CZ-CB 3.91Å; F378-P399 HydrophobicContact CZ-CG 4.46Å
379	S	94.3	Very high	90.7	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.042	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-139.3	157.8	-174.9	66.3	0	0	0	0	112.1	K354 C377 A381 Q384 K385	K354-S379 PolarHBondContact NZ-OG 3.47Å; C377-S379 PolarHBondContact O-N 2.86Å; S379-A381 PolarHBondContact O-N 3.38Å; S379-Q384 VanDerWaalsContact CB-O 3.3Å; S379-Q384 WeakPolarHBondContact CB-O 3.07Å; S379-Q384 PolarHBondContact OG-OE1 3.35Å; S379-K385 CarbonylContact C-O 3.49Å; S379-K385 WeakPolarHBondContact CA-O 2.89Å; S379-K385 WeakPolarHBondContact CB-O 3.08Å
380	C	94.2	Very high	90.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.305	C	S	.	.			trans	-56.8	127.8	177.4	177	0	0	0	0	111.3	A382 C383 Q384 K385 L387 P399 C401	C380-A382 PolarHBondContact O-N 2.89Å; C380-A382 PolarHBondContact SG-N 2.7Å; C380-C383 VanDerWaalsContact SG-SG 3.63Å; C380-Q384 WeakPolarHBondContact O-CA 3.5Å; C380-Q384 PolarHBondContact O-N 2.75Å; C380-K385 PolarHBondContact N-O 3Å; C380-L387 HydrophobicContact CB-CD1 4.18Å; C380-L387 HydrophobicContact CB-CD2 4.28Å; C380-L387 HydrophobicContact CB-CG 4.35Å; C380-P399 CarbonylContact C-O 3.55Å; C380-P399 WeakPolarHBondContact CA-O 3.49Å; C380-C401 HydrophobicContact CB-CB 4.17Å; C380-C401 PolarHBondContact SG-N 2.72Å
381	A	92	Very high	91	Very high	43 Å²	43	53.7 Å²	53.7	36%	0.355	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.8	-179.6	0	0	0	0	0	113.8	S379 K398 P399 F400	S379-A381 PolarHBondContact O-N 3.38Å; A381-K398 HydrophobicContact CB-CB 4.11Å; A381-K398 HydrophobicContact CB-CD 4.47Å; A381-P399 PolarHBondContact N-O 2.98Å; A381-F400 HydrophobicContact CB-CD1 4.42Å; A381-F400 HydrophobicContact CB-CE1 3.93Å; A381-F400 HydrophobicContact CB-CE2 4.41Å; A381-F400 HydrophobicContact CB-CZ 3.92Å
382	A	91.3	Very high	91	Very high	56 Å²	56	51 Å²	51	46%	0.463	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-47.1	178.2	0	0	0	0	0	113.2	C380 F400 H404	C380-A382 PolarHBondContact O-N 2.89Å; C380-A382 PolarHBondContact SG-N 2.7Å; A382-F400 HydrophobicContact CB-CD1 4.22Å; A382-F400 HydrophobicContact CB-CE1 4.27Å; A382-H404 HydrophobicContact CB-CB 4.03Å; A382-H404 VanDerWaalsContact CB-CG 3.5Å
383	C	94.3	Very high	91	Very high	42 Å²	42	54.1 Å²	54.1	28%	0.284	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	3.3	-174.1	65.9	0	0	0	0	115.9	C380 K385 H404	C380-C383 VanDerWaalsContact SG-SG 3.63Å; C383-K385 PolarHBondContact O-N 3.2Å; C383-H404 WeakPolarHBondContact CB-CE1 3.29Å; C383-H404 PolarHBondContact SG-CE1 3.47Å; C383-H404 PolarHBondContact SG-ND1 3.47Å
384	Q	93.4	Very high	90.8	Very high	108 Å²	108	55.9 Å²	55.9	51%	0.505	31%	0.312	S	S	.	.			trans	60.2	9.3	179	-52.8	-66.4	-4.4	0	0	115.6	K354 S379 C380	K354-Q384 VanDerWaalsContact CE-OE1 3.28Å; S379-Q384 VanDerWaalsContact CB-O 3.3Å; S379-Q384 WeakPolarHBondContact CB-O 3.07Å; S379-Q384 PolarHBondContact OG-OE1 3.35Å; C380-Q384 WeakPolarHBondContact O-CA 3.5Å; C380-Q384 PolarHBondContact O-N 2.75Å
385	K	92.7	Very high	90.5	Very high	127 Å²	127	60.8 Å²	60.8	55%	0.552	33%	0.33	S	S	*	.			trans	-64.5	132.1	174.6	-72.1	-176.4	-179.4	-178.8	0	110.6	S379 C380 C383 L387	S379-K385 CarbonylContact C-O 3.49Å; S379-K385 WeakPolarHBondContact CA-O 2.89Å; S379-K385 WeakPolarHBondContact CB-O 3.08Å; C380-K385 PolarHBondContact N-O 3Å; C383-K385 PolarHBondContact O-N 3.2Å; K385-L387 PolarHBondContact O-N 3.02Å
386	P	92.3	Very high	90.2	Very high	76 Å²	76	66.4 Å²	66.4	49%	0.494	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-57.2	134.7	174.7	-24	33.2	0	0	0	111.5
387	L	91.1	Very high	89.9	Confident	3 Å²	3	64 Å²	64	2%	0.016	36%	0.355	C	S	.	.			trans	-108.5	0.3	-176.3	-66	176.7	0	0	0	113.2	F378 C380 K385 G389 K390 F392 P399 C401	F378-L387 HydrophobicContact CD1-CB 3.66Å; F378-L387 HydrophobicContact CE1-CB 3.42Å; F378-L387 VanDerWaalsContact CE1-CB 3.42Å; F378-L387 HydrophobicContact CE1-CD1 4.48Å; F378-L387 HydrophobicContact CZ-CB 4.19Å; F378-L387 HydrophobicContact CZ-CD1 4.47Å; F378-L387 PolarHBondContact O-N 3.21Å; C380-L387 HydrophobicContact CB-CD1 4.18Å; C380-L387 HydrophobicContact CB-CD2 4.28Å; C380-L387 HydrophobicContact CB-CG 4.35Å; K385-L387 PolarHBondContact O-N 3.02Å; L387-G389 PolarHBondContact O-N 3.13Å; L387-K390 PolarHBondContact O-N 3.21Å; L387-F392 HydrophobicContact CD1-CB 3.94Å; L387-F392 HydrophobicContact CD2-CB 4.3Å; L387-F392 HydrophobicContact CG-CB 4.5Å; L387-P399 HydrophobicContact CD1-CB 3.69Å; L387-P399 HydrophobicContact CD1-CG 4.26Å; L387-C401 HydrophobicContact CD2-CB 3.7Å
388	E	86.5	Confident	89.7	Confident	57 Å²	57	69.5 Å²	69.5	27%	0.266	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	127.2	175.5	-175.3	169	-156.2	0	0	110.9	R364 I366 K390	R364-E388 IonicContact CZ-OE1 3.54Å; R364-E388 IonicContact CZ-OE2 2.73Å; R364-E388 IonicContact NE-OE1 3.96Å; R364-E388 PolarHBondContact NE-OE1 3.24Å; R364-E388 IonicContact NE-OE2 3.68Å; R364-E388 VanDerWaalsContact NH2-CD 3.27Å; R364-E388 IonicContact NH2-OE1 2.69Å; R364-E388 PolarHBondContact NH2-OE1 3.09Å; R364-E388 VanDerWaalsContact NH2-OE1 3.14Å; R364-E388 IonicContact NH2-OE2 3.68Å; R364-E388 PolarHBondContact NH2-OE2 3.01Å; I366-E388 HydrophobicContact CD1-CB 3.71Å; I366-E388 HydrophobicContact CD1-CG 3.66Å; E388-K390 PolarHBondContact O-N 3Å
389	G	83.7	Confident	89.5	Confident	75 Å²	75	69.8 Å²	69.8	77%	0.773	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	5.5	-177.5	0	0	0	0	0	115.6	L387	L387-G389 PolarHBondContact O-N 3.13Å
390	K	85.9	Confident	89.4	Confident	118 Å²	118	70.5 Å²	70.5	51%	0.513	38%	0.383	S	S	.	.	S	Bend	trans	-113.6	148.8	-177.5	-65.2	176.6	-171.9	168.2	0	111.3	L387 E388 F392	L387-K390 PolarHBondContact O-N 3.21Å; E388-K390 PolarHBondContact O-N 3Å; K390-F392 PolarHBondContact O-N 2.82Å
391	P	86.7	Confident	89.3	Confident	99 Å²	99	71.3 Å²	71.3	64%	0.643	39%	0.388	S	S	*	.			trans	-61.8	137.2	171.7	26.8	-33.6	0	0	0	110.2
392	F	90	Very high	89.2	Confident	21 Å²	21	73.9 Å²	73.9	9%	0.092	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	161.2	179.8	75.2	-78.4	0	0	0	110.2	I147 I149 A368 F378 L387 K390 T394 P399 F400	I147-F392 HydrophobicContact CB-CE1 4.19Å; I147-F392 HydrophobicContact CD1-CE1 4.38Å; I147-F392 HydrophobicContact CD1-CE2 4.41Å; I147-F392 HydrophobicContact CD1-CZ 4.06Å; I147-F392 HydrophobicContact CG2-CE1 3.61Å; I147-F392 HydrophobicContact CG2-CZ 3.73Å; I149-F392 HydrophobicContact CD1-CD1 3.74Å; I149-F392 HydrophobicContact CD1-CE1 3.52Å; I149-F392 HydrophobicContact CG1-CD1 4.28Å; I149-F392 HydrophobicContact CG1-CE1 3.61Å; A368-F392 HydrophobicContact CB-CE2 4.42Å; A368-F392 HydrophobicContact CB-CZ 4Å; F378-F392 HydrophobicContact CE1-CD1 4.29Å; F378-F392 HydrophobicContact CE1-CE1 4.35Å; F378-F392 HydrophobicContact CE2-CE2 4.41Å; F378-F392 HydrophobicContact CZ-CD1 4.04Å; F378-F392 AromaticContact CZ-CD2 3.94Å; F378-F392 HydrophobicContact CZ-CD2 3.94Å; F378-F392 AromaticContact CZ-CE1 3.9Å; F378-F392 HydrophobicContact CZ-CE1 3.9Å; F378-F392 AromaticContact CZ-CE2 3.78Å; F378-F392 HydrophobicContact CZ-CE2 3.78Å; F378-F392 HydrophobicContact CZ-CG 4.06Å; F378-F392 AromaticContact CZ-CZ 3.76Å; F378-F392 HydrophobicContact CZ-CZ 3.76Å; L387-F392 HydrophobicContact CD1-CB 3.94Å; L387-F392 HydrophobicContact CD2-CB 4.3Å; L387-F392 HydrophobicContact CG-CB 4.5Å; K390-F392 PolarHBondContact O-N 2.82Å; F392-T394 WeakPolarHBondContact CE2-OG1 3.48Å; F392-P399 HydrophobicContact CD2-CB 3.82Å; F392-P399 HydrophobicContact CE2-CB 4.2Å; F392-F400 CarbonylContact C-O 3.5Å; F392-F400 VanDerWaalsContact CA-O 3.28Å; F392-F400 WeakPolarHBondContact CA-O 3.34Å; F392-F400 WeakPolarHBondContact CB-O 3.34Å
393	H	89	Confident	89.1	Confident	108 Å²	108	77 Å²	77	50%	0.5	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	149.1	173.2	-163.2	72.8	0	0	0	110	P399 F400 A405	H393-P399 CarbonylContact O-C 3.58Å; H393-F400 PolarHBondContact N-O 3.2Å; H393-F400 PolarHBondContact O-N 2.93Å; H393-A405 HydrophobicContact CB-CB 3.4Å; H393-A405 VanDerWaalsContact CB-CB 3.4Å
394	T	88.2	Confident	88.9	Confident	48 Å²	48	77.7 Å²	77.7	29%	0.294	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.4	177.3	-57.9	0	0	0	0	109.2	C369 F392 K398	C369-T394 HydrophobicContact CB-CG2 3.78Å; C369-T394 WeakPolarHBondContact SG-CG2 3.31Å; C369-T394 PolarHBondContact SG-OG1 3.05Å; F392-T394 WeakPolarHBondContact CE2-OG1 3.48Å; T394-K398 WeakPolarHBondContact CA-O 3.33Å
395	R	85	Confident	88.6	Confident	110 Å²	110	73.2 Å²	73.2	42%	0.415	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.4	172.3	-169.6	178.5	73	136.4	-1	109.1	Q397 K398 F400	R395-Q397 PolarHBondContact O-N 2.86Å; R395-Q397 VanDerWaalsContact O-N 3.14Å; R395-K398 PolarHBondContact N-O 2.81Å; R395-K398 WeakPolarHBondContact O-CA 3.38Å; R395-K398 WeakPolarHBondContact O-CB 3.48Å; R395-K398 PolarHBondContact O-N 3.42Å; R395-K398 VanDerWaalsContact O-O 3.12Å; R395-F400 HydrophobicContact CB-CD2 4.01Å; R395-F400 HydrophobicContact CB-CE2 3.8Å
396	D	84.8	Confident	88.2	Confident	124 Å²	124	71.4 Å²	71.4	66%	0.663	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	38.6	-175.4	-51.2	-42.3	0	0	0	113.2	K398	D396-K398 PolarHBondContact O-N 2.94Å; D396-K398 VanDerWaalsContact O-N 3.15Å
397	Q	84.8	Confident	87.5	Confident	114 Å²	114	69.6 Å²	69.6	53%	0.533	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	23.5	-175.2	-48.8	175.6	35.5	0	0	114.3	R395	R395-Q397 PolarHBondContact O-N 2.86Å; R395-Q397 VanDerWaalsContact O-N 3.14Å
398	K	88.7	Confident	86.2	Confident	124 Å²	124	71.7 Å²	71.7	54%	0.539	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.3	175.3	-66.2	176.5	-176.3	174.7	0	110.2	A381 T394 R395 D396 F400	A381-K398 HydrophobicContact CB-CB 4.11Å; A381-K398 HydrophobicContact CB-CD 4.47Å; T394-K398 WeakPolarHBondContact CA-O 3.33Å; R395-K398 PolarHBondContact N-O 2.81Å; R395-K398 WeakPolarHBondContact O-CA 3.38Å; R395-K398 WeakPolarHBondContact O-CB 3.48Å; R395-K398 PolarHBondContact O-N 3.42Å; R395-K398 VanDerWaalsContact O-O 3.12Å; D396-K398 PolarHBondContact O-N 2.94Å; D396-K398 VanDerWaalsContact O-N 3.15Å; K398-F400 HydrophobicContact CB-CE2 3.91Å; K398-F400 HydrophobicContact CB-CZ 4.42Å; K398-F400 VanDerWaalsContact O-CD2 3.28Å; K398-F400 WeakPolarHBondContact O-CD2 3.45Å; K398-F400 WeakPolarHBondContact O-CE2 3.46Å
399	P	91.5	Very high	85	Confident	6 Å²	6	73 Å²	73	4%	0.039	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	138.6	-178.8	34.9	-36.2	0	0	0	112.1	F378 C380 A381 L387 F392 H393	F378-P399 HydrophobicContact CD2-CB 4.45Å; F378-P399 HydrophobicContact CD2-CG 4.14Å; F378-P399 HydrophobicContact CE2-CB 3.59Å; F378-P399 HydrophobicContact CE2-CG 3.73Å; F378-P399 HydrophobicContact CZ-CB 3.91Å; F378-P399 HydrophobicContact CZ-CG 4.46Å; C380-P399 CarbonylContact C-O 3.55Å; C380-P399 WeakPolarHBondContact CA-O 3.49Å; A381-P399 PolarHBondContact N-O 2.98Å; L387-P399 HydrophobicContact CD1-CB 3.69Å; L387-P399 HydrophobicContact CD1-CG 4.26Å; F392-P399 HydrophobicContact CD2-CB 3.82Å; F392-P399 HydrophobicContact CE2-CB 4.2Å; H393-P399 CarbonylContact O-C 3.58Å
400	F	91.4	Very high	83.9	Confident	22 Å²	22	75.9 Å²	75.9	10%	0.096	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139.6	178.1	-66.3	-93.7	0	0	0	110.6	A381 A382 F392 H393 R395 K398 H404	A381-F400 HydrophobicContact CB-CD1 4.42Å; A381-F400 HydrophobicContact CB-CE1 3.93Å; A381-F400 HydrophobicContact CB-CE2 4.41Å; A381-F400 HydrophobicContact CB-CZ 3.92Å; A382-F400 HydrophobicContact CB-CD1 4.22Å; A382-F400 HydrophobicContact CB-CE1 4.27Å; F392-F400 CarbonylContact C-O 3.5Å; F392-F400 VanDerWaalsContact CA-O 3.28Å; F392-F400 WeakPolarHBondContact CA-O 3.34Å; F392-F400 WeakPolarHBondContact CB-O 3.34Å; H393-F400 PolarHBondContact N-O 3.2Å; H393-F400 PolarHBondContact O-N 2.93Å; R395-F400 HydrophobicContact CB-CD2 4.01Å; R395-F400 HydrophobicContact CB-CE2 3.8Å; K398-F400 HydrophobicContact CB-CE2 3.91Å; K398-F400 HydrophobicContact CB-CZ 4.42Å; K398-F400 VanDerWaalsContact O-CD2 3.28Å; K398-F400 WeakPolarHBondContact O-CD2 3.45Å; K398-F400 WeakPolarHBondContact O-CE2 3.46Å; F400-H404 HydrophobicContact CB-CB 4.45Å; F400-H404 HydrophobicContact CD1-CB 4.16Å
401	C	92.4	Very high	82.4	Confident	16 Å²	16	79.5 Å²	79.5	11%	0.108	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	160.4	170.4	67.4	0	0	0	0	110.4	C380 L387 I403 H404 A405	C380-C401 HydrophobicContact CB-CB 4.17Å; C380-C401 PolarHBondContact SG-N 2.72Å; L387-C401 HydrophobicContact CD2-CB 3.7Å; C401-I403 PolarHBondContact O-N 3.47Å; C401-I403 VanDerWaalsContact O-N 3.14Å; C401-H404 PolarHBondContact O-N 3.04Å; C401-H404 PolarHBondContact SG-ND1 3.46Å; C401-A405 WeakPolarHBondContact O-CB 3.43Å; C401-A405 PolarHBondContact O-N 3.19Å
402	L	89.4	Confident	80.6	Confident	97 Å²	97	80.8 Å²	80.8	51%	0.508	45%	0.449	S	S	.	.	H	α-helix	trans	-53.5	-37.1	-179.3	-171	60.6	0	0	0	113.4	A405 N406	L402-A405 PolarHBondContact O-N 2.88Å; L402-N406 WeakPolarHBondContact O-CB 3.23Å; L402-N406 PolarHBondContact O-N 3.42Å; L402-N406 PolarHBondContact O-OD1 2.9Å
403	I	89.6	Confident	80.1	Confident	121 Å²	121	83.8 Å²	83.8	62%	0.621	47%	0.466	S	S	*	.	H	α-helix	trans	-61	-48.9	177	-60.4	171.4	0	0	0	111.1	C401 A407	C401-I403 PolarHBondContact O-N 3.47Å; C401-I403 VanDerWaalsContact O-N 3.14Å; I403-A407 WeakPolarHBondContact O-CB 3.49Å; I403-A407 PolarHBondContact O-N 2.87Å
404	H	90.4	Very high	79.6	Confident	57 Å²	57	82.5 Å²	82.5	26%	0.264	47%	0.465	S	S	.	.	H	α-helix	trans	-77.8	-26.5	-179.5	-71.8	106.7	0	0	0	113	A382 C383 F400 C401 V408	A382-H404 HydrophobicContact CB-CB 4.03Å; A382-H404 VanDerWaalsContact CB-CG 3.5Å; C383-H404 WeakPolarHBondContact CB-CE1 3.29Å; C383-H404 PolarHBondContact SG-CE1 3.47Å; C383-H404 PolarHBondContact SG-ND1 3.47Å; F400-H404 HydrophobicContact CB-CB 4.45Å; F400-H404 HydrophobicContact CD1-CB 4.16Å; C401-H404 PolarHBondContact O-N 3.04Å; C401-H404 PolarHBondContact SG-ND1 3.46Å; H404-V408 WeakPolarHBondContact O-CG2 3.25Å; H404-V408 PolarHBondContact O-N 3.07Å
405	A	86.7	Confident	79.2	Confident	15 Å²	15	84.4 Å²	84.4	12%	0.124	47%	0.474	C	S	.	.	H	α-helix	trans	-62.6	-48	171.1	0	0	0	0	0	110.6	H393 C401 L402 A409	H393-A405 HydrophobicContact CB-CB 3.4Å; H393-A405 VanDerWaalsContact CB-CB 3.4Å; C401-A405 WeakPolarHBondContact O-CB 3.43Å; C401-A405 PolarHBondContact O-N 3.19Å; L402-A405 PolarHBondContact O-N 2.88Å; A405-A409 PolarHBondContact O-N 3.43Å
406	N	84.2	Confident	78.8	Confident	88 Å²	88	82.9 Å²	82.9	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-71.5	-37.1	179.7	-66.5	-4	0	0	0	112.4	L402 V408 A409 L410	L402-N406 WeakPolarHBondContact O-CB 3.23Å; L402-N406 PolarHBondContact O-N 3.42Å; L402-N406 PolarHBondContact O-OD1 2.9Å; N406-V408 VanDerWaalsContact C-N 3.27Å; N406-V408 PolarHBondContact O-N 3.32Å; N406-A409 PolarHBondContact O-N 2.77Å; N406-L410 WeakPolarHBondContact O-CG 3.5Å; N406-L410 PolarHBondContact O-N 3.37Å
407	A	77.7	Confident	78.4	Confident	38 Å²	38	80.3 Å²	80.3	31%	0.314	47%	0.466	S	S	.	.	H	α-helix	trans	-59.4	-40.2	177.7	0	0	0	0	0	111.6	I403 L410 F411	I403-A407 WeakPolarHBondContact O-CB 3.49Å; I403-A407 PolarHBondContact O-N 2.87Å; A407-L410 PolarHBondContact O-N 3.26Å; A407-F411 VanDerWaalsContact O-CD2 3.24Å; A407-F411 WeakPolarHBondContact O-CD2 3.48Å
408	V	63	Low	78	Confident	48 Å²	48	78.1 Å²	78.1	29%	0.291	46%	0.462	S	S	.	.	H	α-helix	trans	-77.2	-29.8	179.6	-175.7	0	0	0	0	112.2	H404 N406 L410 F411 G412	H404-V408 WeakPolarHBondContact O-CG2 3.25Å; H404-V408 PolarHBondContact O-N 3.07Å; N406-V408 VanDerWaalsContact C-N 3.27Å; N406-V408 PolarHBondContact O-N 3.32Å; V408-L410 PolarHBondContact O-N 3.26Å; V408-F411 PolarHBondContact O-N 2.96Å; V408-G412 PolarHBondContact O-N 3.2Å
409	A	61.7	Low	77.2	Confident	83 Å²	83	74.8 Å²	74.8	69%	0.686	46%	0.456	S	S	*	.	H	α-helix	trans	-66.7	-18.5	173.7	0	0	0	0	0	113.7	A405 N406	A405-A409 PolarHBondContact O-N 3.43Å; N406-A409 PolarHBondContact O-N 2.77Å
410	L	60.2	Low	76.2	Confident	137 Å²	137	80.1 Å²	80.1	72%	0.717	49%	0.488	S	S	*	.	H	α-helix	trans	-97.1	-13.2	179.8	-68.5	171.4	0	0	0	114	N406 A407 V408	N406-L410 WeakPolarHBondContact O-CG 3.5Å; N406-L410 PolarHBondContact O-N 3.37Å; A407-L410 PolarHBondContact O-N 3.26Å; V408-L410 PolarHBondContact O-N 3.26Å
411	F	55.3	Low	74.9	Confident	193 Å²	193	84.9 Å²	84.9	85%	0.846	52%	0.521	S	S	*	.	H	α-helix	trans	-133.5	11.7	-174.4	-63.1	-68.3	0	0	0	114.1	A407 V408	A407-F411 VanDerWaalsContact O-CD2 3.24Å; A407-F411 WeakPolarHBondContact O-CD2 3.48Å; V408-F411 PolarHBondContact O-N 2.96Å
412	G	48.2	Very low	73.3	Confident	126 Å²	126	91.2 Å²	91.2	100%	1.299	56%	0.558	S	S	*	*			trans	-120.6	0	-174.5	0	0	0	0	0	114.3	V408	V408-G412 PolarHBondContact O-N 3.2Å

Retrieved 412 of 412 residues in 581.8 ms (Link to these results)

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