A0A077Z4C1_TRITR Loading...

Major sperm protein

Central component in molecular interactions underlying sperm crawling. Forms an extensive filament system that extends from sperm villipoda, along the leading edge of the pseudopod.

AlphaFold DB , UniProt , Accession A0A077Z4C1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 235 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.1	Low	87.9	Confident	251 Å²	251	76 Å²	76	100%	1.236	40%	0.398	S	S	*	.				0	122.6	0	-109.3	161.9	175.5	0	0	106.8
2	G	73.6	Confident	88.4	Confident	57 Å²	57	81.8 Å²	81.8	59%	0.588	42%	0.422	S	S	*	.			trans	-80.2	149.4	172.7	0	0	0	0	0	110.5
3	E	84	Confident	88.9	Confident	96 Å²	96	80.5 Å²	80.5	45%	0.449	42%	0.42	S	S	.	.			trans	-65.5	147	178	-55.1	-158.4	107.1	0	0	111.6	H6 K111	E3-H6 HydrophobicContact CB-CB 4.29Å; E3-H6 IonicContact OE2-CE1 3.64Å; E3-H6 IonicContact OE2-CG 2.85Å; E3-H6 IonicContact OE2-ND1 3.21Å; E3-H6 PolarHBondContact OE2-ND1 2.63Å; E3-K111 IonicContact OE1-NZ 2.76Å; E3-K111 PolarHBondContact OE1-NZ 2.63Å; E3-K111 IonicContact OE2-NZ 2.92Å; E3-K111 PolarHBondContact OE2-NZ 2.66Å
4	L	90.7	Very high	89.3	Confident	97 Å²	97	74.8 Å²	74.8	51%	0.508	39%	0.39	S	S	.	.	S	Bend	trans	-67.6	-44.1	174.4	-77.3	160.3	0	0	0	111.3	G34 K35 K36	L4-G34 CarbonylContact O-C 3.58Å; L4-K35 PolarHBondContact O-N 3.24Å; L4-K36 HydrophobicContact CD2-CD 4.23Å; L4-K36 HydrophobicContact CD2-CG 4.44Å; L4-K36 PolarHBondContact O-N 3.38Å; L4-K36 VanDerWaalsContact O-N 3.09Å
5	I	93	Very high	89.6	Confident	13 Å²	13	72.3 Å²	72.3	7%	0.067	38%	0.379	C	S	.	.	S	Bend	trans	-121.6	125.1	176	60.2	171	0	0	0	109.7	K36 V38 Y90 E92 K111	I5-K36 HydrophobicContact CG2-CB 4.3Å; I5-V38 HydrophobicContact CB-CG1 3.69Å; I5-V38 HydrophobicContact CG2-CG1 3.52Å; I5-Y90 HydrophobicContact CB-CE2 4.34Å; I5-Y90 HydrophobicContact CD1-CD2 4.42Å; I5-Y90 HydrophobicContact CD1-CE2 4.46Å; I5-Y90 HydrophobicContact CG1-CE2 4.36Å; I5-E92 HydrophobicContact CD1-CB 4.34Å; I5-E92 HydrophobicContact CG2-CB 3.9Å; I5-E92 HydrophobicContact CG2-CG 3.79Å; I5-K111 HydrophobicContact CD1-CD 4.34Å; I5-K111 HydrophobicContact CG1-CD 4.19Å; I5-K111 PolarHBondContact O-NZ 2.85Å
6	H	94.9	Very high	89.8	Confident	71 Å²	71	67.9 Å²	67.9	33%	0.329	36%	0.356	S	S	.	.			trans	-151.3	119.3	175.2	-169.9	84.6	0	0	0	109.9	E3 N32 D33 G34	E3-H6 HydrophobicContact CB-CB 4.29Å; E3-H6 IonicContact OE2-CE1 3.64Å; E3-H6 IonicContact OE2-CG 2.85Å; E3-H6 IonicContact OE2-ND1 3.21Å; E3-H6 PolarHBondContact OE2-ND1 2.63Å; H6-N32 CarbonylContact O-C 3.53Å; H6-N32 WeakPolarHBondContact O-CA 3.42Å; H6-N32 PolarHBondContact O-OD1 3.09Å; H6-N32 VanDerWaalsContact O-OD1 3.09Å; H6-D33 PolarHBondContact O-N 2.85Å; H6-G34 PolarHBondContact O-N 3.43Å
7	V	95.6	Very high	89.9	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.012	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.4	174	179	0	0	0	0	108.4	I31 V38 V88 Y90 V113	V7-I31 WeakPolarHBondContact CA-O 3.08Å; V7-V38 HydrophobicContact CG2-CG2 3.74Å; V7-V88 HydrophobicContact CG1-CG1 4.32Å; V7-Y90 HydrophobicContact CB-CD1 3.99Å; V7-Y90 HydrophobicContact CB-CD2 4.23Å; V7-Y90 HydrophobicContact CB-CE1 3.99Å; V7-Y90 HydrophobicContact CB-CE2 4.2Å; V7-Y90 HydrophobicContact CB-CG 4.1Å; V7-Y90 HydrophobicContact CG2-CD1 4.12Å; V7-Y90 HydrophobicContact CG2-CD2 3.62Å; V7-Y90 HydrophobicContact CG2-CE1 4.43Å; V7-Y90 HydrophobicContact CG2-CE2 3.94Å; V7-Y90 HydrophobicContact CG2-CG 3.69Å; V7-Y90 PolarHBondContact N-OH 3.21Å; V7-V113 WeakPolarHBondContact O-CG2 3.41Å
8	R	95.1	Very high	89.9	Confident	94 Å²	94	68.7 Å²	68.7	36%	0.355	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	153.2	168	61.1	178	158	136.1	-14.1	110.6	E10 I31 D33	R8-E10 IonicContact CZ-OE1 2.63Å; R8-E10 IonicContact NH1-OE1 2.66Å; R8-E10 PolarHBondContact NH1-OE1 2.94Å; R8-I31 HydrophobicContact CG-CB 3.78Å; R8-I31 HydrophobicContact CG-CD1 4.31Å; R8-I31 HydrophobicContact CG-CG1 4.43Å; R8-I31 PolarHBondContact N-O 3Å; R8-I31 PolarHBondContact O-N 2.79Å; R8-D33 IonicContact CZ-OD2 3.58Å; R8-D33 IonicContact NE-OD2 3.97Å; R8-D33 PolarHBondContact NE-OD2 2.97Å; R8-D33 VanDerWaalsContact NE-OD2 3.11Å; R8-D33 IonicContact NH2-OD2 2.71Å; R8-D33 PolarHBondContact NH2-OD2 2.91Å
9	C	95.6	Very high	89.9	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.034	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.2	-177.1	-57.7	0	0	0	0	109.3	P11 E12 V28 L30 V113 M115	C9-P11 CarbonylContact O-C 3.56Å; C9-E12 PolarHBondContact O-N 2.87Å; C9-V28 HydrophobicContact CB-CG1 4.09Å; C9-L30 HydrophobicContact CB-CD2 4.2Å; C9-L30 VanDerWaalsContact SG-CD2 3.5Å; C9-V113 HydrophobicContact CB-CG1 4.16Å; C9-M115 HydrophobicContact CB-CE 4.43Å; C9-M115 HydrophobicContact CB-CG 3.95Å; C9-M115 HydrophobicContact CB-SD 3.61Å
10	E	95.5	Very high	90	Very high	93 Å²	93	67.2 Å²	67.2	44%	0.435	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116	-179.5	-70.4	173.7	-158.5	0	0	109.1	R8 V28 T29	R8-E10 IonicContact CZ-OE1 2.63Å; R8-E10 IonicContact NH1-OE1 2.66Å; R8-E10 PolarHBondContact NH1-OE1 2.94Å; E10-V28 CarbonylContact O-C 3.6Å; E10-V28 WeakPolarHBondContact O-CA 3.08Å; E10-T29 PolarHBondContact N-O 2.89Å; E10-T29 PolarHBondContact O-N 2.77Å
11	P	96	Very high	90.1	Very high	57 Å²	57	69.2 Å²	69.2	37%	0.37	36%	0.363	S	S	.	.	S	Bend	cis	-81.1	154.6	1.4	34.1	-36.2	0	0	0	114.1	C9 V13	C9-P11 CarbonylContact O-C 3.56Å; P11-V13 VanDerWaalsContact C-N 3.25Å; P11-V13 PolarHBondContact O-N 2.86Å
12	E	93.2	Very high	92	Very high	145 Å²	145	63.1 Å²	63.1	68%	0.678	33%	0.331	S	S	*	.	S	Bend	trans	-70.7	-19.4	170.7	-64	-171.1	99.5	0	0	113.6	C9 M115 K116	C9-E12 PolarHBondContact O-N 2.87Å; E12-M115 VanDerWaalsContact O-CA 3.23Å; E12-M115 WeakPolarHBondContact O-CA 3.37Å; E12-M115 WeakPolarHBondContact O-CB 3.49Å; E12-K116 PolarHBondContact O-N 3.24Å; E12-K116 VanDerWaalsContact O-N 3.1Å
13	V	94.9	Very high	93	Very high	66 Å²	66	68.2 Å²	68.2	40%	0.4	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	115	-179.9	-175	0	0	0	0	110.2	P11 T15 K116 R118	P11-V13 VanDerWaalsContact C-N 3.25Å; P11-V13 PolarHBondContact O-N 2.86Å; V13-T15 PolarHBondContact O-N 3.09Å; V13-K116 CarbonylContact C-O 3.55Å; V13-K116 WeakPolarHBondContact CA-O 3.45Å; V13-R118 HydrophobicContact CG1-CB 4.12Å
14	L	94.7	Very high	93.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	110.3	176.6	-72.6	72.1	0	0	0	108.4	F16 T26 V28 V69 V86 M115 K116 V117 R118	L14-F16 HydrophobicContact CB-CE2 4.19Å; L14-T26 HydrophobicContact CB-CG2 4.12Å; L14-T26 HydrophobicContact CD2-CG2 3.68Å; L14-T26 HydrophobicContact CG-CG2 3.86Å; L14-V28 HydrophobicContact CD1-CG2 3.99Å; L14-V28 HydrophobicContact CD2-CG2 4.06Å; L14-V28 HydrophobicContact CG-CG2 3.96Å; L14-V69 HydrophobicContact CD2-CB 3.8Å; L14-V69 HydrophobicContact CD2-CG1 3.83Å; L14-V69 HydrophobicContact CD2-CG2 3.78Å; L14-V86 HydrophobicContact CD2-CG2 4.1Å; L14-M115 HydrophobicContact CD1-CB 3.52Å; L14-M115 HydrophobicContact CD1-CG 4.14Å; L14-M115 HydrophobicContact CD1-SD 3.87Å; L14-K116 PolarHBondContact N-O 2.69Å; L14-V117 HydrophobicContact CB-CG2 4.41Å; L14-V117 CarbonylContact O-C 3.6Å; L14-V117 WeakPolarHBondContact O-CA 3.29Å; L14-R118 PolarHBondContact O-N 3.42Å
15	T	93.5	Very high	93.7	Very high	38 Å²	38	64.3 Å²	64.3	23%	0.233	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.4	176.5	-54.9	0	0	0	0	110.9	V13 Y17 R118 T120	V13-T15 PolarHBondContact O-N 3.09Å; T15-Y17 HydrophobicContact CG2-CD1 4.43Å; T15-Y17 HydrophobicContact CG2-CD2 4.45Å; T15-Y17 HydrophobicContact CG2-CE1 3.85Å; T15-Y17 HydrophobicContact CG2-CE2 3.87Å; T15-R118 CarbonylContact C-O 3.48Å; T15-R118 WeakPolarHBondContact CA-O 3.2Å; T15-T120 WeakPolarHBondContact CG2-OG1 3.27Å
16	F	93.2	Very high	93.9	Very high	2 Å²	2	65.1 Å²	65.1	1%	0.009	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	141.5	170.9	-64	-78.1	0	0	0	109.4	L14 Q24 T26 F50 V69 C71 V117 R118 F119 T120	L14-F16 HydrophobicContact CB-CE2 4.19Å; F16-Q24 HydrophobicContact CD1-CB 3.71Å; F16-Q24 HydrophobicContact CE1-CB 4.19Å; F16-T26 HydrophobicContact CE1-CG2 3.94Å; F16-T26 HydrophobicContact CE2-CG2 4.44Å; F16-T26 HydrophobicContact CZ-CG2 3.63Å; F16-F50 HydrophobicContact CD2-CE1 4.34Å; F16-F50 HydrophobicContact CE2-CD1 4.37Å; F16-F50 AromaticContact CE2-CE1 3.73Å; F16-F50 HydrophobicContact CE2-CE1 3.73Å; F16-F50 HydrophobicContact CZ-CE1 4.26Å; F16-V69 HydrophobicContact CZ-CG1 4.4Å; F16-C71 HydrophobicContact CD1-CB 3.79Å; F16-C71 HydrophobicContact CD2-CB 4.43Å; F16-C71 HydrophobicContact CE1-CB 3.64Å; F16-C71 HydrophobicContact CE2-CB 4.31Å; F16-C71 HydrophobicContact CG-CB 4.18Å; F16-C71 HydrophobicContact CZ-CB 3.91Å; F16-V117 HydrophobicContact CD2-CG1 3.58Å; F16-V117 HydrophobicContact CE2-CG1 3.67Å; F16-R118 PolarHBondContact N-O 3Å; F16-F119 HydrophobicContact CB-CD1 4.06Å; F16-F119 HydrophobicContact CB-CE1 4.26Å; F16-F119 HydrophobicContact CD2-CE1 4.34Å; F16-T120 PolarHBondContact O-N 2.81Å
17	Y	91.9	Very high	93.9	Very high	127 Å²	127	65.3 Å²	65.3	50%	0.498	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.8	-170.6	-66.1	-82.3	0	0	0	111.7	T15 Q24 T120	T15-Y17 HydrophobicContact CG2-CD1 4.43Å; T15-Y17 HydrophobicContact CG2-CD2 4.45Å; T15-Y17 HydrophobicContact CG2-CE1 3.85Å; T15-Y17 HydrophobicContact CG2-CE2 3.87Å; Y17-Q24 VanDerWaalsContact O-CD 3.28Å; Y17-Q24 PolarHBondContact O-NE2 2.9Å; Y17-Q24 PolarHBondContact O-OE1 2.84Å; Y17-T120 CarbonylContact C-O 3.58Å; Y17-T120 WeakPolarHBondContact CA-O 3.39Å; Y17-T120 HydrophobicContact CD1-CG2 4.28Å; Y17-T120 HydrophobicContact CE1-CG2 4.13Å
18	A	89.1	Confident	94	Very high	22 Å²	22	65.2 Å²	65.2	18%	0.182	33%	0.325	C	S	.	.	S	Bend	trans	-62.6	149.3	173.8	0	0	0	0	0	111	Y20 T120 M121 P122	A18-Y20 HydrophobicContact CB-CD2 4.02Å; A18-Y20 HydrophobicContact CB-CE1 4.21Å; A18-Y20 HydrophobicContact CB-CE2 3.58Å; A18-T120 PolarHBondContact N-O 3.02Å; A18-M121 HydrophobicContact CB-CB 4.22Å; A18-M121 HydrophobicContact CB-CG 3.86Å; A18-P122 WeakPolarHBondContact O-CD 3.38Å; A18-P122 VanDerWaalsContact O-CG 3.27Å; A18-P122 WeakPolarHBondContact O-CG 3.39Å
19	P	91.2	Very high	94	Very high	93 Å²	93	62.7 Å²	62.7	60%	0.604	32%	0.32	S	S	*	.			cis	-74.6	141.8	5.2	30.4	-35.6	0	0	0	114.1	D21 Q24	P19-D21 VanDerWaalsContact C-N 3.33Å; P19-Q24 PolarHBondContact O-NE2 3.1Å; P19-Q24 VanDerWaalsContact O-NE2 3.09Å
20	Y	91.6	Very high	94.1	Very high	15 Å²	15	62.5 Å²	62.5	6%	0.059	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	7.7	177.9	-49.3	-66	0	0	0	113.5	A18 H22 P73 F74 F76 F119 T120	A18-Y20 HydrophobicContact CB-CD2 4.02Å; A18-Y20 HydrophobicContact CB-CE1 4.21Å; A18-Y20 HydrophobicContact CB-CE2 3.58Å; Y20-H22 PolarHBondContact O-N 3.07Å; Y20-P73 WeakPolarHBondContact O-CA 3.44Å; Y20-F74 HydrophobicContact CD1-CE1 4.07Å; Y20-F74 HydrophobicContact CD1-CZ 4.41Å; Y20-F74 HydrophobicContact CD2-CZ 4.46Å; Y20-F74 AromaticContact CG-CE1 3.87Å; Y20-F74 HydrophobicContact CG-CE1 3.87Å; Y20-F74 HydrophobicContact CG-CZ 4.1Å; Y20-F74 PolarHBondContact O-N 2.84Å; Y20-F76 HydrophobicContact CD2-CB 3.44Å; Y20-F76 VanDerWaalsContact CD2-CB 3.44Å; Y20-F76 HydrophobicContact CD2-CD2 4.03Å; Y20-F76 AromaticContact CD2-CG 3.83Å; Y20-F76 HydrophobicContact CD2-CG 3.83Å; Y20-F76 HydrophobicContact CE2-CB 3.89Å; Y20-F76 HydrophobicContact CE2-CD1 4.36Å; Y20-F76 AromaticContact CE2-CD2 3.72Å; Y20-F76 HydrophobicContact CE2-CD2 3.72Å; Y20-F76 HydrophobicContact CE2-CE2 4.35Å; Y20-F76 AromaticContact CE2-CG 3.72Å; Y20-F76 HydrophobicContact CE2-CG 3.72Å; Y20-F76 HydrophobicContact CG-CB 4.38Å; Y20-F119 HydrophobicContact CD1-CD1 4.12Å; Y20-F119 HydrophobicContact CE1-CB 4.19Å; Y20-F119 AromaticContact CE1-CD1 3.75Å; Y20-F119 HydrophobicContact CE1-CD1 3.75Å; Y20-F119 HydrophobicContact CE1-CG 4.45Å; Y20-F119 WeakPolarHBondContact OH-CB 3.18Å; Y20-T120 PolarHBondContact OH-N 2.75Å; Y20-T120 VanDerWaalsContact OH-N 3.14Å; Y20-T120 PolarHBondContact OH-O 2.89Å
21	D	91.9	Very high	94.2	Very high	110 Å²	110	59.2 Å²	59.2	59%	0.588	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.3	176.9	-164.6	-108.7	0	0	0	112.9	P19 P73	P19-D21 VanDerWaalsContact C-N 3.33Å; D21-P73 VanDerWaalsContact C-CB 3.44Å; D21-P73 WeakPolarHBondContact O-CB 3.44Å
22	H	92.4	Very high	94.2	Very high	122 Å²	122	56.5 Å²	56.5	57%	0.565	29%	0.286	S	S	*	.	S	Bend	trans	-123.6	148.8	-179.2	-60.4	-16.3	0	0	0	111.6	Y20 Q24	Y20-H22 PolarHBondContact O-N 3.07Å; H22-Q24 PolarHBondContact O-N 3.24Å
23	R	94.8	Very high	94.2	Very high	164 Å²	164	54.2 Å²	54.2	62%	0.619	28%	0.279	S	S	*	.			trans	-65.5	116.3	176.8	177.6	-175.2	63	-151.3	-4.9	110.4	R70 C71 L72	R23-R70 HydrophobicContact CG-CB 4.47Å; R23-C71 VanDerWaalsContact CA-O 3.29Å; R23-C71 WeakPolarHBondContact CA-O 3.13Å; R23-C71 WeakPolarHBondContact CG-O 3.44Å; R23-L72 HydrophobicContact CG-CD2 4.42Å
24	Q	95.2	Very high	94.2	Very high	38 Å²	38	51.3 Å²	51.3	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	149.6	174.8	-66.7	173.6	45.9	0	0	110.7	F16 Y17 P19 H22 R70 C71	F16-Q24 HydrophobicContact CD1-CB 3.71Å; F16-Q24 HydrophobicContact CE1-CB 4.19Å; Y17-Q24 VanDerWaalsContact O-CD 3.28Å; Y17-Q24 PolarHBondContact O-NE2 2.9Å; Y17-Q24 PolarHBondContact O-OE1 2.84Å; P19-Q24 PolarHBondContact O-NE2 3.1Å; P19-Q24 VanDerWaalsContact O-NE2 3.09Å; H22-Q24 PolarHBondContact O-N 3.24Å; Q24-R70 CarbonylContact O-C 3.47Å; Q24-R70 VanDerWaalsContact O-CA 3.23Å; Q24-R70 WeakPolarHBondContact O-CA 3.3Å; Q24-C71 PolarHBondContact N-O 3.32Å; Q24-C71 PolarHBondContact O-N 3.04Å
25	T	95.4	Very high	94.1	Very high	73 Å²	73	58.8 Å²	58.8	45%	0.448	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.7	175.9	-57.4	0	0	0	0	109.3	H68 V69 R70	T25-H68 HydrophobicContact CG2-CB 4.21Å; T25-V69 WeakPolarHBondContact CA-O 3.37Å; T25-R70 HydrophobicContact CG2-CG 4.04Å
26	T	95.4	Very high	94	Very high	30 Å²	30	60 Å²	60	18%	0.184	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148.4	168	-170.3	0	0	0	0	109.6	L14 F16 V69	L14-T26 HydrophobicContact CB-CG2 4.12Å; L14-T26 HydrophobicContact CD2-CG2 3.68Å; L14-T26 HydrophobicContact CG-CG2 3.86Å; F16-T26 HydrophobicContact CE1-CG2 3.94Å; F16-T26 HydrophobicContact CE2-CG2 4.44Å; F16-T26 HydrophobicContact CZ-CG2 3.63Å; T26-V69 HydrophobicContact CG2-CB 4.04Å; T26-V69 PolarHBondContact N-O 2.93Å; T26-V69 PolarHBondContact O-N 3.48Å
27	I	96.1	Very high	94.1	Very high	76 Å²	76	63.1 Å²	63.1	39%	0.39	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.5	-179.4	-57.9	175.9	0	0	0	107.3	Q66	I27-Q66 HydrophobicContact CG2-CB 3.93Å; I27-Q66 HydrophobicContact CG2-CG 3.96Å
28	V	96.4	Very high	94.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.9	172.4	-179.4	0	0	0	0	108	C9 E10 L14 L30 L67 V69 M115	C9-V28 HydrophobicContact CB-CG1 4.09Å; E10-V28 CarbonylContact O-C 3.6Å; E10-V28 WeakPolarHBondContact O-CA 3.08Å; L14-V28 HydrophobicContact CD1-CG2 3.99Å; L14-V28 HydrophobicContact CD2-CG2 4.06Å; L14-V28 HydrophobicContact CG-CG2 3.96Å; V28-L30 HydrophobicContact CG1-CD2 3.98Å; V28-L67 HydrophobicContact CB-CB 4.31Å; V28-L67 PolarHBondContact N-O 2.94Å; V28-L67 PolarHBondContact O-N 3.1Å; V28-V69 HydrophobicContact CG2-CG2 4.35Å; V28-M115 HydrophobicContact CB-SD 4.44Å; V28-M115 HydrophobicContact CG1-SD 3.59Å; V28-M115 VanDerWaalsContact CG1-SD 3.59Å; V28-M115 HydrophobicContact CG2-SD 4.15Å
29	T	97	Very high	94.5	Very high	41 Å²	41	56 Å²	56	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	115.7	170.4	-52.6	0	0	0	0	108.9	E10 I31	E10-T29 PolarHBondContact N-O 2.89Å; E10-T29 PolarHBondContact O-N 2.77Å; T29-I31 HydrophobicContact CG2-CD1 4.2Å; T29-I31 HydrophobicContact CG2-CG1 3.74Å
30	L	96.7	Very high	94.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	127.1	169.6	-51.9	-178.8	0	0	0	107.7	C9 V28 I40 I42 L59 S64 K65 L67 V88	C9-L30 HydrophobicContact CB-CD2 4.2Å; C9-L30 VanDerWaalsContact SG-CD2 3.5Å; V28-L30 HydrophobicContact CG1-CD2 3.98Å; L30-I40 HydrophobicContact CD1-CD1 3.4Å; L30-I42 HydrophobicContact CD1-CD1 4.17Å; L30-L59 HydrophobicContact CB-CD2 4.19Å; L30-S64 CarbonylContact O-C 3.58Å; L30-S64 WeakPolarHBondContact O-CA 3.48Å; L30-S64 WeakPolarHBondContact O-CB 3.34Å; L30-K65 PolarHBondContact N-O 2.71Å; L30-K65 PolarHBondContact O-N 2.81Å; L30-L67 HydrophobicContact CD1-CB 4.05Å; L30-L67 HydrophobicContact CD1-CD2 4.38Å; L30-L67 HydrophobicContact CD2-CD2 4.37Å; L30-L67 HydrophobicContact CG-CB 4.11Å; L30-V88 HydrophobicContact CD1-CG2 4.45Å; L30-V88 HydrophobicContact CD2-CG2 3.74Å
31	I	96.8	Very high	94.9	Very high	25 Å²	25	53.2 Å²	53.2	13%	0.128	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.6	-176.6	-48.5	168.8	0	0	0	108.6	V7 R8 T29	V7-I31 WeakPolarHBondContact CA-O 3.08Å; R8-I31 HydrophobicContact CG-CB 3.78Å; R8-I31 HydrophobicContact CG-CD1 4.31Å; R8-I31 HydrophobicContact CG-CG1 4.43Å; R8-I31 PolarHBondContact N-O 3Å; R8-I31 PolarHBondContact O-N 2.79Å; T29-I31 HydrophobicContact CG2-CD1 4.2Å; T29-I31 HydrophobicContact CG2-CG1 3.74Å
32	N	96	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	102.3	172.7	-176.8	12.5	0	0	0	109.6	H6 G34 K36 L59 D60 G62 S63	H6-N32 CarbonylContact O-C 3.53Å; H6-N32 WeakPolarHBondContact O-CA 3.42Å; H6-N32 PolarHBondContact O-OD1 3.09Å; H6-N32 VanDerWaalsContact O-OD1 3.09Å; N32-G34 VanDerWaalsContact C-N 3.27Å; N32-G34 WeakPolarHBondContact OD1-CA 3.33Å; N32-G34 PolarHBondContact OD1-N 2.92Å; N32-K36 PolarHBondContact ND2-O 3.09Å; N32-L59 HydrophobicContact CB-CB 4.33Å; N32-L59 HydrophobicContact CB-CD2 3.78Å; N32-L59 HydrophobicContact CB-CG 3.74Å; N32-L59 PolarHBondContact ND2-O 2.77Å; N32-L59 VanDerWaalsContact ND2-O 3.08Å; N32-D60 WeakPolarHBondContact CB-O 3.49Å; N32-D60 PolarHBondContact ND2-O 3.25Å; N32-G62 VanDerWaalsContact O-CA 3.3Å; N32-G62 WeakPolarHBondContact O-CA 3.42Å; N32-G62 PolarHBondContact O-N 2.92Å; N32-S63 PolarHBondContact N-O 2.98Å
33	D	94.8	Very high	95.2	Very high	97 Å²	97	48.6 Å²	48.6	52%	0.519	22%	0.224	S	C	.	.			trans	-84.3	-7	173.7	-134	-102	0	0	0	111.6	H6 R8	H6-D33 PolarHBondContact O-N 2.85Å; R8-D33 IonicContact CZ-OD2 3.58Å; R8-D33 IonicContact NE-OD2 3.97Å; R8-D33 PolarHBondContact NE-OD2 2.97Å; R8-D33 VanDerWaalsContact NE-OD2 3.11Å; R8-D33 IonicContact NH2-OD2 2.71Å; R8-D33 PolarHBondContact NH2-OD2 2.91Å
34	G	93.9	Very high	95.2	Very high	5 Å²	5	41.5 Å²	41.5	5%	0.052	20%	0.199	C	C	.	.	S	Bend	trans	-71	169.2	175.7	0	0	0	0	0	113.9	L4 H6 N32 A61	L4-G34 CarbonylContact O-C 3.58Å; H6-G34 PolarHBondContact O-N 3.43Å; N32-G34 VanDerWaalsContact C-N 3.27Å; N32-G34 WeakPolarHBondContact OD1-CA 3.33Å; N32-G34 PolarHBondContact OD1-N 2.92Å; G34-A61 WeakPolarHBondContact O-CB 3.42Å
35	K	92	Very high	95.1	Very high	156 Å²	156	43.3 Å²	43.3	68%	0.678	21%	0.213	S	C	*	.	S	Bend	trans	-90.9	-17	-178.9	-62.8	-175.3	177.8	-173.4	0	114	L4	L4-K35 PolarHBondContact O-N 3.24Å
36	K	92.8	Very high	95	Very high	65 Å²	65	42.1 Å²	42.1	28%	0.283	20%	0.204	S	C	.	.	S	Bend	trans	-112.6	157.5	179.4	-73.7	-174	165.3	-175.7	0	111.3	L4 I5 N32 E92 E94	L4-K36 HydrophobicContact CD2-CD 4.23Å; L4-K36 HydrophobicContact CD2-CG 4.44Å; L4-K36 PolarHBondContact O-N 3.38Å; L4-K36 VanDerWaalsContact O-N 3.09Å; I5-K36 HydrophobicContact CG2-CB 4.3Å; N32-K36 PolarHBondContact ND2-O 3.09Å; K36-E92 HydrophobicContact CB-CG 4.3Å; K36-E92 HydrophobicContact CD-CG 3.9Å; K36-E92 WeakPolarHBondContact CD-OE1 3.34Å; K36-E92 WeakPolarHBondContact CD-OE2 3.4Å; K36-E92 WeakPolarHBondContact CE-OE1 3.34Å; K36-E92 IonicContact NZ-OE1 3.95Å; K36-E92 PolarHBondContact NZ-OE1 3.17Å; K36-E92 IonicContact NZ-OE2 2.63Å; K36-E94 IonicContact NZ-OE1 3.77Å; K36-E94 PolarHBondContact NZ-OE1 2.95Å
37	R	94	Very high	94.8	Very high	67 Å²	67	46 Å²	46	25%	0.253	22%	0.224	S	C	.	.			trans	-64.1	142.6	168.9	176	-177.1	-93.8	-162	-7.3	109.2	F58 D60 A93	R37-F58 HydrophobicContact CG-CD1 4.4Å; R37-D60 IonicContact CZ-OD1 2.79Å; R37-D60 IonicContact CZ-OD2 3.85Å; R37-D60 IonicContact NE-OD1 2.77Å; R37-D60 PolarHBondContact NE-OD1 3.06Å; R37-D60 IonicContact NE-OD2 3.38Å; R37-D60 VanDerWaalsContact NH2-CG 3.28Å; R37-D60 IonicContact NH2-OD1 2.94Å; R37-D60 PolarHBondContact NH2-OD1 3.42Å; R37-D60 IonicContact NH2-OD2 3.63Å; R37-D60 PolarHBondContact NH2-OD2 3.08Å; R37-A93 HydrophobicContact CG-CB 4.12Å; R37-A93 PolarHBondContact O-N 3.19Å
38	V	94.9	Very high	94.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145	175.6	-63.2	0	0	0	0	111.8	I5 V7 I40 F58 L59 Y90 T91	I5-V38 HydrophobicContact CB-CG1 3.69Å; I5-V38 HydrophobicContact CG2-CG1 3.52Å; V7-V38 HydrophobicContact CG2-CG2 3.74Å; V38-I40 HydrophobicContact CG2-CG2 4.08Å; V38-F58 WeakPolarHBondContact O-CA 3.27Å; V38-L59 HydrophobicContact CG2-CB 3.82Å; V38-L59 PolarHBondContact N-O 2.86Å; V38-L59 PolarHBondContact O-N 2.97Å; V38-Y90 HydrophobicContact CG1-CD2 4.28Å; V38-T91 CarbonylContact C-O 3.6Å; V38-T91 VanDerWaalsContact CA-O 3.23Å; V38-T91 WeakPolarHBondContact CA-O 3.43Å; V38-T91 VanDerWaalsContact CB-O 3.32Å; V38-T91 WeakPolarHBondContact CB-O 3.38Å
39	A	95	Very high	94.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.3	162.9	0	0	0	0	0	108.5	F58 Y90 T91 A93 I103 W104	A39-F58 HydrophobicContact CB-CD1 4.1Å; A39-F58 HydrophobicContact CB-CE1 3.85Å; A39-Y90 VanDerWaalsContact O-CA 3.3Å; A39-Y90 WeakPolarHBondContact O-CA 3.39Å; A39-T91 HydrophobicContact CB-CG2 3.98Å; A39-T91 PolarHBondContact N-O 3.01Å; A39-T91 PolarHBondContact O-N 3.09Å; A39-A93 HydrophobicContact CB-CB 4.2Å; A39-I103 HydrophobicContact CB-CD1 4.32Å; A39-I103 HydrophobicContact CB-CG2 4.16Å; A39-W104 WeakPolarHBondContact O-CZ2 3.2Å
40	I	95.4	Very high	94.5	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	148.8	178.1	69.7	167.5	0	0	0	111.5	L30 V38 I42 Y56 A57 V88 V89	L30-I40 HydrophobicContact CD1-CD1 3.4Å; V38-I40 HydrophobicContact CG2-CG2 4.08Å; I40-I42 HydrophobicContact CD1-CD1 4.24Å; I40-Y56 WeakPolarHBondContact O-CA 3.3Å; I40-A57 HydrophobicContact CD1-CB 4.02Å; I40-A57 HydrophobicContact CG1-CB 3.8Å; I40-A57 WeakPolarHBondContact CG1-O 3.48Å; I40-A57 PolarHBondContact N-O 2.99Å; I40-A57 PolarHBondContact O-N 2.91Å; I40-V88 HydrophobicContact CB-CG1 4.43Å; I40-V88 HydrophobicContact CG2-CG1 4.49Å; I40-V89 CarbonylContact C-O 3.55Å; I40-V89 WeakPolarHBondContact CA-O 3.41Å
41	K	95.7	Very high	94.4	Very high	47 Å²	47	52.3 Å²	52.3	20%	0.204	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	115.8	173.8	178.1	176.5	-171.5	155.6	0	109.6	V55 Y56 V89 W104	K41-V55 CarbonylContact C-O 3.6Å; K41-V55 VanDerWaalsContact CA-O 3.29Å; K41-V55 WeakPolarHBondContact CA-O 3.33Å; K41-Y56 HydrophobicContact CB-CD1 4.14Å; K41-Y56 HydrophobicContact CB-CE1 4.07Å; K41-Y56 HydrophobicContact CD-CE1 3.65Å; K41-Y56 VanDerWaalsContact CE-OH 3.27Å; K41-Y56 WeakPolarHBondContact CE-OH 3.36Å; K41-Y56 HydrophobicContact CG-CD1 4.16Å; K41-Y56 HydrophobicContact CG-CE1 3.68Å; K41-Y56 PolarHBondContact NZ-OH 2.96Å; K41-V89 PolarHBondContact N-O 3.1Å; K41-V89 PolarHBondContact O-N 3.12Å; K41-W104 HydrophobicContact CB-CD2 4.14Å; K41-W104 VanDerWaalsContact CB-CE2 3.46Å; K41-W104 HydrophobicContact CB-CH2 3.99Å; K41-W104 HydrophobicContact CB-CZ2 3.39Å; K41-W104 HydrophobicContact CD-CD2 4.22Å; K41-W104 HydrophobicContact CD-CE3 4.41Å
42	I	95.8	Very high	94.4	Very high	9 Å²	9	52.9 Å²	52.9	5%	0.046	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	134.5	176	-46.4	-57.2	0	0	0	109.4	L30 I40 V52 M54 V55 L67 V86 V87 V88	L30-I42 HydrophobicContact CD1-CD1 4.17Å; I40-I42 HydrophobicContact CD1-CD1 4.24Å; I42-V52 HydrophobicContact CG2-CG1 4.06Å; I42-V52 HydrophobicContact CG2-CG2 4.34Å; I42-M54 WeakPolarHBondContact CG1-O 3.48Å; I42-V55 PolarHBondContact N-O 2.87Å; I42-L67 HydrophobicContact CD1-CD1 4.29Å; I42-L67 HydrophobicContact CD1-CD2 3.93Å; I42-L67 HydrophobicContact CG1-CD1 4.02Å; I42-L67 HydrophobicContact CG1-CD2 4.4Å; I42-L67 HydrophobicContact CG2-CD2 4.34Å; I42-V86 HydrophobicContact CG2-CG1 3.92Å; I42-V87 WeakPolarHBondContact CA-O 3.12Å; I42-V88 HydrophobicContact CD1-CB 4.38Å; I42-V88 HydrophobicContact CD1-CG1 4.34Å; I42-V88 HydrophobicContact CD1-CG2 3.67Å
43	R	95.1	Very high	94.4	Very high	125 Å²	125	56.3 Å²	56.3	47%	0.472	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.2	169.2	-52.3	-176.4	-173.5	-165.6	4	109	V86 V87 V89	R43-V86 CarbonylContact O-C 3.56Å; R43-V87 HydrophobicContact CB-CB 4.15Å; R43-V87 HydrophobicContact CB-CG2 4.24Å; R43-V87 PolarHBondContact N-O 2.84Å; R43-V87 PolarHBondContact O-N 2.87Å; R43-V89 HydrophobicContact CG-CG2 4.28Å
44	T	94.5	Very high	94.4	Very high	15 Å²	15	53 Å²	53	9%	0.092	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	151	173.1	62.2	0	0	0	0	109.4	D46 N47 F50 V52 V86	T44-D46 PolarHBondContact O-N 3.16Å; T44-D46 PolarHBondContact OG1-O 3.01Å; T44-D46 VanDerWaalsContact OG1-O 3.1Å; T44-N47 PolarHBondContact O-ND2 2.77Å; T44-N47 PolarHBondContact OG1-OD1 2.82Å; T44-F50 HydrophobicContact CG2-CB 4.03Å; T44-V52 HydrophobicContact CG2-CG1 4.34Å; T44-V86 HydrophobicContact CG2-CG1 4.37Å; T44-V86 HydrophobicContact CG2-CG2 4.26Å
45	T	93.7	Very high	94.4	Very high	77 Å²	77	56.1 Å²	56.1	47%	0.472	27%	0.273	S	S	.	.	S	Bend	trans	-65.2	-26	171.8	50	0	0	0	0	112.6	H84 R85	T45-H84 VanDerWaalsContact OG1-CA 3.29Å; T45-H84 WeakPolarHBondContact OG1-CA 3.49Å; T45-H84 WeakPolarHBondContact OG1-CB 3.43Å; T45-H84 PolarHBondContact OG1-ND1 2.76Å; T45-R85 HydrophobicContact CG2-CB 3.84Å; T45-R85 HydrophobicContact CG2-CG 4.14Å; T45-R85 PolarHBondContact N-O 3.11Å; T45-R85 PolarHBondContact OG1-N 2.85Å; T45-R85 PolarHBondContact OG1-O 3.48Å
46	D	92.3	Very high	94.6	Very high	48 Å²	48	52.3 Å²	52.3	26%	0.257	26%	0.255	S	S	.	.			trans	-137.6	108	179.1	-168.1	-36.3	0	0	0	109.4	T44 I48 L49 F50 H84	T44-D46 PolarHBondContact O-N 3.16Å; T44-D46 PolarHBondContact OG1-O 3.01Å; T44-D46 VanDerWaalsContact OG1-O 3.1Å; D46-I48 VanDerWaalsContact C-N 3.32Å; D46-I48 WeakPolarHBondContact OD1-CA 3.3Å; D46-I48 WeakPolarHBondContact OD1-CB 3.32Å; D46-I48 PolarHBondContact OD1-N 3.26Å; D46-L49 HydrophobicContact CB-CB 4.07Å; D46-L49 PolarHBondContact OD1-N 3.34Å; D46-F50 HydrophobicContact CB-CD2 4.15Å; D46-F50 HydrophobicContact CB-CE2 4.37Å; D46-F50 WeakPolarHBondContact O-CD2 3.35Å; D46-F50 PolarHBondContact O-N 3.38Å; D46-F50 VanDerWaalsContact O-N 3.12Å; D46-H84 IonicContact OD2-CE1 3.75Å
47	N	92.6	Very high	94.6	Very high	111 Å²	111	50 Å²	50	59%	0.594	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.2	-179.4	-69	-91.3	0	0	0	112.4	T44 K51	T44-N47 PolarHBondContact O-ND2 2.77Å; T44-N47 PolarHBondContact OG1-OD1 2.82Å; N47-K51 PolarHBondContact O-NZ 2.79Å
48	I	92.3	Very high	94.6	Very high	137 Å²	137	49.3 Å²	49.3	70%	0.703	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-54.9	171.5	-57.8	177.1	0	0	0	107.6	D46 K51 L72	D46-I48 VanDerWaalsContact C-N 3.32Å; D46-I48 WeakPolarHBondContact OD1-CA 3.3Å; D46-I48 WeakPolarHBondContact OD1-CB 3.32Å; D46-I48 PolarHBondContact OD1-N 3.26Å; I48-K51 WeakPolarHBondContact O-CE 3.38Å; I48-L72 WeakPolarHBondContact O-CD1 3.23Å
49	L	94.1	Very high	94.6	Very high	15 Å²	15	49.4 Å²	49.4	8%	0.079	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-42	-176.4	-174.1	59.3	0	0	0	113.5	D46 L72 F74 F119	D46-L49 HydrophobicContact CB-CB 4.07Å; D46-L49 PolarHBondContact OD1-N 3.34Å; L49-L72 WeakPolarHBondContact CD1-O 3.44Å; L49-L72 WeakPolarHBondContact O-CB 3.17Å; L49-L72 PolarHBondContact O-N 3.4Å; L49-F74 HydrophobicContact CD1-CB 3.81Å; L49-F74 HydrophobicContact CD1-CD1 3.64Å; L49-F74 HydrophobicContact CD1-CE1 4.39Å; L49-F74 HydrophobicContact CD1-CG 3.82Å; L49-F119 HydrophobicContact CD2-CZ 4.35Å
50	F	95.9	Very high	94.6	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.4	-178	-58	-77.7	0	0	0	112.2	F16 T44 D46 V69 R70 C71 H84 V117 F119	F16-F50 HydrophobicContact CD2-CE1 4.34Å; F16-F50 HydrophobicContact CE2-CD1 4.37Å; F16-F50 AromaticContact CE2-CE1 3.73Å; F16-F50 HydrophobicContact CE2-CE1 3.73Å; F16-F50 HydrophobicContact CZ-CE1 4.26Å; T44-F50 HydrophobicContact CG2-CB 4.03Å; D46-F50 HydrophobicContact CB-CD2 4.15Å; D46-F50 HydrophobicContact CB-CE2 4.37Å; D46-F50 WeakPolarHBondContact O-CD2 3.35Å; D46-F50 PolarHBondContact O-N 3.38Å; D46-F50 VanDerWaalsContact O-N 3.12Å; F50-V69 HydrophobicContact CD1-CG1 4.19Å; F50-R70 WeakPolarHBondContact CA-O 3.35Å; F50-C71 HydrophobicContact CD1-CB 4.32Å; F50-C71 HydrophobicContact CE1-CB 4.16Å; F50-H84 HydrophobicContact CE2-CB 3.5Å; F50-H84 AromaticContact CE2-CD2 3.69Å; F50-H84 AromaticContact CE2-CG 3.55Å; F50-H84 HydrophobicContact CZ-CB 3.8Å; F50-H84 AromaticContact CZ-CD2 3.91Å; F50-V117 HydrophobicContact CE1-CG1 4.02Å; F50-V117 HydrophobicContact CE1-CG2 4.33Å; F50-V117 HydrophobicContact CZ-CB 4.4Å; F50-V117 HydrophobicContact CZ-CG1 3.86Å; F50-V117 HydrophobicContact CZ-CG2 4.17Å; F50-F119 AromaticContact CZ-CZ 3.89Å; F50-F119 HydrophobicContact CZ-CZ 3.89Å
51	K	95.5	Very high	94.6	Very high	94 Å²	94	54.8 Å²	54.8	41%	0.409	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.5	172.1	-56.5	-57.8	-179	-173.5	0	110	N47 I48 R70 L72	N47-K51 PolarHBondContact O-NZ 2.79Å; I48-K51 WeakPolarHBondContact O-CE 3.38Å; K51-R70 HydrophobicContact CB-CB 4.43Å; K51-R70 PolarHBondContact N-O 2.84Å; K51-R70 WeakPolarHBondContact O-CB 3.44Å; K51-R70 PolarHBondContact O-N 3.1Å; K51-L72 HydrophobicContact CG-CD1 4.13Å; K51-L72 HydrophobicContact CG-CD2 4.08Å; K51-L72 HydrophobicContact CG-CG 4.03Å
52	V	96.2	Very high	94.5	Very high	36 Å²	36	55.8 Å²	55.8	22%	0.218	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.6	177.6	-65.9	0	0	0	0	110.5	I42 T44 M54 V55 L67 H68 V69	I42-V52 HydrophobicContact CG2-CG1 4.06Å; I42-V52 HydrophobicContact CG2-CG2 4.34Å; T44-V52 HydrophobicContact CG2-CG1 4.34Å; V52-M54 VanDerWaalsContact C-N 3.27Å; V52-M54 WeakPolarHBondContact CG2-O 3.34Å; V52-M54 PolarHBondContact O-N 2.93Å; V52-V55 HydrophobicContact CG2-CG2 4.01Å; V52-L67 HydrophobicContact CB-CD1 3.99Å; V52-L67 HydrophobicContact CG1-CD1 4.2Å; V52-H68 WeakPolarHBondContact CA-O 3.34Å; V52-V69 HydrophobicContact CG1-CG1 4.42Å; V52-V69 HydrophobicContact CG1-CG2 4.19Å
53	N	95.6	Very high	94.5	Very high	73 Å²	73	57.6 Å²	57.6	39%	0.39	32%	0.32	S	S	.	.	S	Bend	trans	-74.8	-17	176.8	74	-52.7	0	0	0	113.7	H68	N53-H68 HydrophobicContact CB-CB 4.17Å; N53-H68 PolarHBondContact N-O 2.91Å; N53-H68 PolarHBondContact OD1-N 3.42Å
54	M	94.5	Very high	94.5	Very high	28 Å²	28	55.1 Å²	55.1	14%	0.138	32%	0.322	C	S	.	.			trans	-140	137.2	175.6	65.6	-171.1	76.2	0	0	109.9	I42 V52 A57 K65 Q66 L67	I42-M54 WeakPolarHBondContact CG1-O 3.48Å; V52-M54 VanDerWaalsContact C-N 3.27Å; V52-M54 WeakPolarHBondContact CG2-O 3.34Å; V52-M54 PolarHBondContact O-N 2.93Å; M54-A57 HydrophobicContact SD-CB 4.04Å; M54-K65 HydrophobicContact CE-CD 4.43Å; M54-K65 HydrophobicContact CE-CG 3.82Å; M54-K65 HydrophobicContact SD-CD 4.45Å; M54-K65 HydrophobicContact SD-CG 3.98Å; M54-Q66 WeakPolarHBondContact CE-O 3.29Å; M54-L67 HydrophobicContact CG-CD1 3.69Å; M54-L67 HydrophobicContact SD-CD1 4.5Å
55	V	94.9	Very high	94.6	Very high	70 Å²	70	59 Å²	59	42%	0.424	34%	0.337	S	S	.	.	S	Bend	trans	-104	-40.8	172.2	-179.9	0	0	0	0	110.3	K41 I42 V52	K41-V55 CarbonylContact C-O 3.6Å; K41-V55 VanDerWaalsContact CA-O 3.29Å; K41-V55 WeakPolarHBondContact CA-O 3.33Å; I42-V55 PolarHBondContact N-O 2.87Å; V52-V55 HydrophobicContact CG2-CG2 4.01Å
56	Y	94.7	Very high	94.7	Very high	75 Å²	75	60.6 Å²	60.6	29%	0.294	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.5	175	-60.9	-82.6	0	0	0	109.2	I40 K41 Q101 W104	I40-Y56 WeakPolarHBondContact O-CA 3.3Å; K41-Y56 HydrophobicContact CB-CD1 4.14Å; K41-Y56 HydrophobicContact CB-CE1 4.07Å; K41-Y56 HydrophobicContact CD-CE1 3.65Å; K41-Y56 VanDerWaalsContact CE-OH 3.27Å; K41-Y56 WeakPolarHBondContact CE-OH 3.36Å; K41-Y56 HydrophobicContact CG-CD1 4.16Å; K41-Y56 HydrophobicContact CG-CE1 3.68Å; K41-Y56 PolarHBondContact NZ-OH 2.96Å; Y56-Q101 HydrophobicContact CD2-CG 4.31Å; Y56-Q101 HydrophobicContact CE2-CG 4.39Å; Y56-Q101 HydrophobicContact CG-CG 4.46Å; Y56-W104 AromaticContact CD1-CD1 3.44Å; Y56-W104 VanDerWaalsContact CD1-CD1 3.44Å; Y56-W104 HydrophobicContact CD1-CG 4.43Å; Y56-W104 AromaticContact CD1-NE1 3.65Å; Y56-W104 AromaticContact CE1-CD1 3.51Å; Y56-W104 HydrophobicContact CE1-CG 4.11Å; Y56-W104 AromaticContact CE1-NE1 3.99Å
57	A	94.1	Very high	94.9	Very high	17 Å²	17	58.3 Å²	58.3	14%	0.14	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	171.8	172.4	0	0	0	0	0	111	I40 M54	I40-A57 HydrophobicContact CD1-CB 4.02Å; I40-A57 HydrophobicContact CG1-CB 3.8Å; I40-A57 WeakPolarHBondContact CG1-O 3.48Å; I40-A57 PolarHBondContact N-O 2.99Å; I40-A57 PolarHBondContact O-N 2.91Å; M54-A57 HydrophobicContact SD-CB 4.04Å
58	F	94.7	Very high	95.1	Very high	52 Å²	52	55.6 Å²	55.6	23%	0.228	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	147	168	-72.5	-73	0	0	0	110.5	R37 V38 A39 A93 L98 S100 I103	R37-F58 HydrophobicContact CG-CD1 4.4Å; V38-F58 WeakPolarHBondContact O-CA 3.27Å; A39-F58 HydrophobicContact CB-CD1 4.1Å; A39-F58 HydrophobicContact CB-CE1 3.85Å; F58-A93 HydrophobicContact CD1-CB 4.13Å; F58-A93 HydrophobicContact CE1-CB 3.85Å; F58-L98 WeakPolarHBondContact CZ-O 3.42Å; F58-S100 VanDerWaalsContact CZ-N 3.3Å; F58-I103 HydrophobicContact CE1-CD1 3.52Å; F58-I103 HydrophobicContact CZ-CD1 3.74Å
59	L	94.7	Very high	95.3	Very high	3 Å²	3	49 Å²	49	2%	0.016	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	109	175.2	-159.3	59.9	0	0	0	109.2	L30 N32 V38 K65	L30-L59 HydrophobicContact CB-CD2 4.19Å; N32-L59 HydrophobicContact CB-CB 4.33Å; N32-L59 HydrophobicContact CB-CD2 3.78Å; N32-L59 HydrophobicContact CB-CG 3.74Å; N32-L59 PolarHBondContact ND2-O 2.77Å; N32-L59 VanDerWaalsContact ND2-O 3.08Å; V38-L59 HydrophobicContact CG2-CB 3.82Å; V38-L59 PolarHBondContact N-O 2.86Å; V38-L59 PolarHBondContact O-N 2.97Å; L59-K65 HydrophobicContact CD1-CB 3.7Å
60	D	94.4	Very high	95.4	Very high	66 Å²	66	53 Å²	53	35%	0.353	29%	0.291	S	S	.	.			trans	-64.7	157.9	175.8	-73	-72.7	0	0	0	111.9	N32 R37 G62 S63	N32-D60 WeakPolarHBondContact CB-O 3.49Å; N32-D60 PolarHBondContact ND2-O 3.25Å; R37-D60 IonicContact CZ-OD1 2.79Å; R37-D60 IonicContact CZ-OD2 3.85Å; R37-D60 IonicContact NE-OD1 2.77Å; R37-D60 PolarHBondContact NE-OD1 3.06Å; R37-D60 IonicContact NE-OD2 3.38Å; R37-D60 VanDerWaalsContact NH2-CG 3.28Å; R37-D60 IonicContact NH2-OD1 2.94Å; R37-D60 PolarHBondContact NH2-OD1 3.42Å; R37-D60 IonicContact NH2-OD2 3.63Å; R37-D60 PolarHBondContact NH2-OD2 3.08Å; D60-G62 PolarHBondContact O-N 2.88Å; D60-S63 WeakPolarHBondContact O-CB 3.39Å; D60-S63 PolarHBondContact O-N 2.95Å
61	A	94.1	Very high	95.3	Very high	48 Å²	48	53 Å²	53	40%	0.397	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	133.4	176.7	0	0	0	0	0	110.6	G34 S63	G34-A61 WeakPolarHBondContact O-CB 3.42Å; A61-S63 PolarHBondContact O-N 2.85Å; A61-S63 VanDerWaalsContact O-N 3.16Å
62	G	93.6	Very high	95.3	Very high	68 Å²	68	51.1 Å²	51.1	70%	0.701	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	2.9	-175.8	0	0	0	0	0	115.5	N32 D60	N32-G62 VanDerWaalsContact O-CA 3.3Å; N32-G62 WeakPolarHBondContact O-CA 3.42Å; N32-G62 PolarHBondContact O-N 2.92Å; D60-G62 PolarHBondContact O-N 2.88Å
63	S	95.8	Very high	95.3	Very high	48 Å²	48	52.7 Å²	52.7	34%	0.336	30%	0.297	S	S	.	.			trans	-93.9	156	179.6	-65.4	0	0	0	0	112.8	N32 D60 A61	N32-S63 PolarHBondContact N-O 2.98Å; D60-S63 WeakPolarHBondContact O-CB 3.39Å; D60-S63 PolarHBondContact O-N 2.95Å; A61-S63 PolarHBondContact O-N 2.85Å; A61-S63 VanDerWaalsContact O-N 3.16Å
64	S	95.9	Very high	95.1	Very high	72 Å²	72	51 Å²	51	50%	0.503	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	160	174.2	68.3	0	0	0	0	112.8	L30	L30-S64 CarbonylContact O-C 3.58Å; L30-S64 WeakPolarHBondContact O-CA 3.48Å; L30-S64 WeakPolarHBondContact O-CB 3.34Å
65	K	96.1	Very high	94.9	Very high	96 Å²	96	57.7 Å²	57.7	42%	0.417	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	136.7	179.5	-168.7	128.8	-69.4	172.2	0	111.1	L30 M54 L59	L30-K65 PolarHBondContact N-O 2.71Å; L30-K65 PolarHBondContact O-N 2.81Å; M54-K65 HydrophobicContact CE-CD 4.43Å; M54-K65 HydrophobicContact CE-CG 3.82Å; M54-K65 HydrophobicContact SD-CD 4.45Å; M54-K65 HydrophobicContact SD-CG 3.98Å; L59-K65 HydrophobicContact CD1-CB 3.7Å
66	Q	96.9	Very high	94.6	Very high	111 Å²	111	57.1 Å²	57.1	52%	0.519	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	112.6	-179.1	-71.6	-179.3	-24.4	0	0	111.5	I27 M54	I27-Q66 HydrophobicContact CG2-CB 3.93Å; I27-Q66 HydrophobicContact CG2-CG 3.96Å; M54-Q66 WeakPolarHBondContact CE-O 3.29Å
67	L	96.7	Very high	94.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113	170.8	174.9	67.4	0	0	0	109.3	V28 L30 I42 V52 M54 V69	V28-L67 HydrophobicContact CB-CB 4.31Å; V28-L67 PolarHBondContact N-O 2.94Å; V28-L67 PolarHBondContact O-N 3.1Å; L30-L67 HydrophobicContact CD1-CB 4.05Å; L30-L67 HydrophobicContact CD1-CD2 4.38Å; L30-L67 HydrophobicContact CD2-CD2 4.37Å; L30-L67 HydrophobicContact CG-CB 4.11Å; I42-L67 HydrophobicContact CD1-CD1 4.29Å; I42-L67 HydrophobicContact CD1-CD2 3.93Å; I42-L67 HydrophobicContact CG1-CD1 4.02Å; I42-L67 HydrophobicContact CG1-CD2 4.4Å; I42-L67 HydrophobicContact CG2-CD2 4.34Å; V52-L67 HydrophobicContact CB-CD1 3.99Å; V52-L67 HydrophobicContact CG1-CD1 4.2Å; M54-L67 HydrophobicContact CG-CD1 3.69Å; M54-L67 HydrophobicContact SD-CD1 4.5Å; L67-V69 HydrophobicContact CD2-CG2 3.94Å; L67-V69 HydrophobicContact CG-CG2 3.85Å; L67-V69 PolarHBondContact O-N 2.94Å
68	H	96.6	Very high	93.7	Very high	54 Å²	54	60.5 Å²	60.5	25%	0.25	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	105	175.7	-67.6	-124.6	0	0	0	108.9	T25 V52 N53	T25-H68 HydrophobicContact CG2-CB 4.21Å; V52-H68 WeakPolarHBondContact CA-O 3.34Å; N53-H68 HydrophobicContact CB-CB 4.17Å; N53-H68 PolarHBondContact N-O 2.91Å; N53-H68 PolarHBondContact OD1-N 3.42Å
69	V	96	Very high	93.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114	175.8	-172.7	0	0	0	0	108.8	L14 F16 T25 T26 V28 F50 V52 L67 V86	L14-V69 HydrophobicContact CD2-CB 3.8Å; L14-V69 HydrophobicContact CD2-CG1 3.83Å; L14-V69 HydrophobicContact CD2-CG2 3.78Å; F16-V69 HydrophobicContact CZ-CG1 4.4Å; T25-V69 WeakPolarHBondContact CA-O 3.37Å; T26-V69 HydrophobicContact CG2-CB 4.04Å; T26-V69 PolarHBondContact N-O 2.93Å; T26-V69 PolarHBondContact O-N 3.48Å; V28-V69 HydrophobicContact CG2-CG2 4.35Å; F50-V69 HydrophobicContact CD1-CG1 4.19Å; V52-V69 HydrophobicContact CG1-CG1 4.42Å; V52-V69 HydrophobicContact CG1-CG2 4.19Å; L67-V69 HydrophobicContact CD2-CG2 3.94Å; L67-V69 HydrophobicContact CG-CG2 3.85Å; L67-V69 PolarHBondContact O-N 2.94Å; V69-V86 HydrophobicContact CG1-CG2 4.32Å
70	R	96	Very high	92.8	Very high	98 Å²	98	68.5 Å²	68.5	37%	0.37	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.5	-178.9	-45.8	-178.9	-163.9	179.2	3.1	109.1	R23 Q24 T25 F50 K51	R23-R70 HydrophobicContact CG-CB 4.47Å; Q24-R70 CarbonylContact O-C 3.47Å; Q24-R70 VanDerWaalsContact O-CA 3.23Å; Q24-R70 WeakPolarHBondContact O-CA 3.3Å; T25-R70 HydrophobicContact CG2-CG 4.04Å; F50-R70 WeakPolarHBondContact CA-O 3.35Å; K51-R70 HydrophobicContact CB-CB 4.43Å; K51-R70 PolarHBondContact N-O 2.84Å; K51-R70 WeakPolarHBondContact O-CB 3.44Å; K51-R70 PolarHBondContact O-N 3.1Å
71	C	95.2	Very high	92.2	Very high	3 Å²	3	70.5 Å²	70.5	2%	0.02	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	123.8	166.7	-168.4	0	0	0	0	107.8	F16 R23 Q24 F50	F16-C71 HydrophobicContact CD1-CB 3.79Å; F16-C71 HydrophobicContact CD2-CB 4.43Å; F16-C71 HydrophobicContact CE1-CB 3.64Å; F16-C71 HydrophobicContact CE2-CB 4.31Å; F16-C71 HydrophobicContact CG-CB 4.18Å; F16-C71 HydrophobicContact CZ-CB 3.91Å; R23-C71 VanDerWaalsContact CA-O 3.29Å; R23-C71 WeakPolarHBondContact CA-O 3.13Å; R23-C71 WeakPolarHBondContact CG-O 3.44Å; Q24-C71 PolarHBondContact N-O 3.32Å; Q24-C71 PolarHBondContact O-N 3.04Å; F50-C71 HydrophobicContact CD1-CB 4.32Å; F50-C71 HydrophobicContact CE1-CB 4.16Å
72	L	95.6	Very high	91.8	Very high	55 Å²	55	70 Å²	70	29%	0.288	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-70.9	157.7	169	-66.1	-164.2	0	0	0	110.3	R23 I48 L49 K51	R23-L72 HydrophobicContact CG-CD2 4.42Å; I48-L72 WeakPolarHBondContact O-CD1 3.23Å; L49-L72 WeakPolarHBondContact CD1-O 3.44Å; L49-L72 WeakPolarHBondContact O-CB 3.17Å; L49-L72 PolarHBondContact O-N 3.4Å; K51-L72 HydrophobicContact CG-CD1 4.13Å; K51-L72 HydrophobicContact CG-CD2 4.08Å; K51-L72 HydrophobicContact CG-CG 4.03Å
73	P	94.2	Very high	91.5	Very high	70 Å²	70	72.7 Å²	72.7	46%	0.455	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-64.5	142.7	175.5	29.3	-37.6	0	0	0	111.4	Y20 D21	Y20-P73 WeakPolarHBondContact O-CA 3.44Å; D21-P73 VanDerWaalsContact C-CB 3.44Å; D21-P73 WeakPolarHBondContact O-CB 3.44Å
74	F	92.3	Very high	91.4	Very high	37 Å²	37	71.9 Å²	71.9	16%	0.162	38%	0.379	C	S	.	.			trans	-154.4	154	-180	74.9	-73.8	0	0	0	112.2	Y20 L49 F76 M82 F119	Y20-F74 HydrophobicContact CD1-CE1 4.07Å; Y20-F74 HydrophobicContact CD1-CZ 4.41Å; Y20-F74 HydrophobicContact CD2-CZ 4.46Å; Y20-F74 AromaticContact CG-CE1 3.87Å; Y20-F74 HydrophobicContact CG-CE1 3.87Å; Y20-F74 HydrophobicContact CG-CZ 4.1Å; Y20-F74 PolarHBondContact O-N 2.84Å; L49-F74 HydrophobicContact CD1-CB 3.81Å; L49-F74 HydrophobicContact CD1-CD1 3.64Å; L49-F74 HydrophobicContact CD1-CE1 4.39Å; L49-F74 HydrophobicContact CD1-CG 3.82Å; F74-F76 HydrophobicContact CE2-CB 3.97Å; F74-F76 AromaticContact CE2-CD2 3.93Å; F74-F76 HydrophobicContact CE2-CD2 3.93Å; F74-F76 HydrophobicContact CE2-CG 4.44Å; F74-F76 HydrophobicContact CZ-CB 4.31Å; F74-F76 AromaticContact CZ-CD2 3.96Å; F74-F76 HydrophobicContact CZ-CD2 3.96Å; F74-F76 PolarHBondContact O-N 2.83Å; F74-M82 HydrophobicContact CD2-CE 4.31Å; F74-M82 HydrophobicContact CE2-CE 3.81Å; F74-M82 HydrophobicContact CE2-SD 3.89Å; F74-F119 HydrophobicContact CE1-CD1 4.11Å; F74-F119 AromaticContact CE1-CE1 3.61Å; F74-F119 HydrophobicContact CE1-CE1 3.61Å; F74-F119 HydrophobicContact CE1-CZ 4.3Å; F74-F119 AromaticContact CZ-CD1 3.79Å; F74-F119 HydrophobicContact CZ-CD1 3.79Å; F74-F119 AromaticContact CZ-CE1 3.52Å; F74-F119 HydrophobicContact CZ-CE1 3.52Å; F74-F119 HydrophobicContact CZ-CG 4.46Å; F74-F119 AromaticContact CZ-CZ 3.98Å; F74-F119 HydrophobicContact CZ-CZ 3.98Å
75	Q	90.7	Very high	91.4	Very high	168 Å²	168	74.3 Å²	74.3	79%	0.785	38%	0.377	S	S	*	.			trans	-74	107	170.6	-165.9	66.4	20.3	0	0	109.4	D77	Q75-D77 PolarHBondContact O-N 3.04Å
76	F	87.5	Confident	91.3	Very high	58 Å²	58	69.7 Å²	69.7	25%	0.254	36%	0.357	S	S	.	.			trans	-70.3	118.6	175.4	179.9	-90.9	0	0	0	110.4	Y20 F74 P78 M82 F119 M121	Y20-F76 HydrophobicContact CD2-CB 3.44Å; Y20-F76 VanDerWaalsContact CD2-CB 3.44Å; Y20-F76 HydrophobicContact CD2-CD2 4.03Å; Y20-F76 AromaticContact CD2-CG 3.83Å; Y20-F76 HydrophobicContact CD2-CG 3.83Å; Y20-F76 HydrophobicContact CE2-CB 3.89Å; Y20-F76 HydrophobicContact CE2-CD1 4.36Å; Y20-F76 AromaticContact CE2-CD2 3.72Å; Y20-F76 HydrophobicContact CE2-CD2 3.72Å; Y20-F76 HydrophobicContact CE2-CE2 4.35Å; Y20-F76 AromaticContact CE2-CG 3.72Å; Y20-F76 HydrophobicContact CE2-CG 3.72Å; Y20-F76 HydrophobicContact CG-CB 4.38Å; F74-F76 HydrophobicContact CE2-CB 3.97Å; F74-F76 AromaticContact CE2-CD2 3.93Å; F74-F76 HydrophobicContact CE2-CD2 3.93Å; F74-F76 HydrophobicContact CE2-CG 4.44Å; F74-F76 HydrophobicContact CZ-CB 4.31Å; F74-F76 AromaticContact CZ-CD2 3.96Å; F74-F76 HydrophobicContact CZ-CD2 3.96Å; F74-F76 PolarHBondContact O-N 2.83Å; F76-P78 HydrophobicContact CE1-CB 4.1Å; F76-M82 HydrophobicContact CD2-CG 4.41Å; F76-M82 HydrophobicContact CE2-CG 4.05Å; F76-F119 HydrophobicContact CD2-CB 4.5Å; F76-F119 HydrophobicContact CE2-CB 3.98Å; F76-F119 HydrophobicContact CE2-CG 4.45Å; F76-M121 HydrophobicContact CD1-CE 3.64Å; F76-M121 HydrophobicContact CE1-CE 3.59Å; F76-M121 HydrophobicContact CZ-CE 4.49Å
77	D	86.9	Confident	91.3	Very high	49 Å²	49	65.5 Å²	65.5	26%	0.262	34%	0.338	S	S	.	.			trans	-116.9	108.8	-178.5	-172.9	-27.6	0	0	0	108.7	Q75 S79 K80	Q75-D77 PolarHBondContact O-N 3.04Å; D77-S79 PolarHBondContact O-N 3.45Å; D77-S79 WeakPolarHBondContact OD1-CB 3.46Å; D77-S79 PolarHBondContact OD1-N 3.01Å; D77-S79 PolarHBondContact OD1-OG 3.35Å; D77-K80 HydrophobicContact CB-CB 4.47Å; D77-K80 HydrophobicContact CB-CD 4.06Å; D77-K80 HydrophobicContact CB-CG 4.21Å; D77-K80 PolarHBondContact O-N 2.97Å; D77-K80 VanDerWaalsContact O-N 3.09Å; D77-K80 WeakPolarHBondContact OD2-CE 3.47Å; D77-K80 IonicContact OD2-NZ 3.11Å
78	P	83.5	Confident	91.3	Very high	114 Å²	114	65.5 Å²	65.5	74%	0.74	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-11.5	-176.5	28.8	-35.1	0	0	0	113.4	F76 K80	F76-P78 HydrophobicContact CE1-CB 4.1Å; P78-K80 VanDerWaalsContact C-N 3.3Å
79	S	86.1	Confident	91.2	Very high	98 Å²	98	63.1 Å²	63.1	69%	0.685	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-18.8	172.7	74.7	0	0	0	0	112.8	D77	D77-S79 PolarHBondContact O-N 3.45Å; D77-S79 WeakPolarHBondContact OD1-CB 3.46Å; D77-S79 PolarHBondContact OD1-N 3.01Å; D77-S79 PolarHBondContact OD1-OG 3.35Å
80	K	85.4	Confident	91.2	Very high	125 Å²	125	63.6 Å²	63.6	54%	0.543	33%	0.33	S	S	.	.	S	Bend	trans	-95.1	136.6	-176.5	-67.5	-179.3	-173.4	167	0	111.4	D77 P78 M82	D77-K80 HydrophobicContact CB-CB 4.47Å; D77-K80 HydrophobicContact CB-CD 4.06Å; D77-K80 HydrophobicContact CB-CG 4.21Å; D77-K80 PolarHBondContact O-N 2.97Å; D77-K80 VanDerWaalsContact O-N 3.09Å; D77-K80 WeakPolarHBondContact OD2-CE 3.47Å; D77-K80 IonicContact OD2-NZ 3.11Å; P78-K80 VanDerWaalsContact C-N 3.3Å; K80-M82 HydrophobicContact CB-CE 4.06Å; K80-M82 PolarHBondContact O-N 2.8Å
81	P	82.2	Confident	91.2	Very high	108 Å²	108	59.2 Å²	59.2	70%	0.701	31%	0.314	S	S	*	.			trans	-73	92.9	179.1	29.3	-34.7	0	0	0	111.6	N83	P81-N83 PolarHBondContact O-N 2.95Å
82	M	84.3	Confident	91.1	Very high	39 Å²	39	61.2 Å²	61.2	19%	0.192	32%	0.323	C	S	.	.			trans	-74	44.5	179.2	-64.5	-70.9	171.2	0	0	113.6	F74 F76 K80 H84 F119	F74-M82 HydrophobicContact CD2-CE 4.31Å; F74-M82 HydrophobicContact CE2-CE 3.81Å; F74-M82 HydrophobicContact CE2-SD 3.89Å; F76-M82 HydrophobicContact CD2-CG 4.41Å; F76-M82 HydrophobicContact CE2-CG 4.05Å; K80-M82 HydrophobicContact CB-CE 4.06Å; K80-M82 PolarHBondContact O-N 2.8Å; M82-H84 PolarHBondContact O-N 2.81Å; M82-F119 HydrophobicContact CB-CD2 3.8Å; M82-F119 HydrophobicContact CB-CE2 3.95Å
83	N	88.3	Confident	90.9	Very high	124 Å²	124	58.9 Å²	58.9	66%	0.663	31%	0.312	S	S	*	.			trans	-84.7	47.4	-175.6	-73	-66.2	0	0	0	112.9	P81	P81-N83 PolarHBondContact O-N 2.95Å
84	H	93.7	Very high	90.4	Very high	30 Å²	30	62.6 Å²	62.6	14%	0.139	32%	0.323	C	S	.	.			trans	-71.8	152.5	-176.3	-63.9	-53.5	0	0	0	113	T45 D46 F50 M82 V117 F119	T45-H84 VanDerWaalsContact OG1-CA 3.29Å; T45-H84 WeakPolarHBondContact OG1-CA 3.49Å; T45-H84 WeakPolarHBondContact OG1-CB 3.43Å; T45-H84 PolarHBondContact OG1-ND1 2.76Å; D46-H84 IonicContact OD2-CE1 3.75Å; F50-H84 HydrophobicContact CE2-CB 3.5Å; F50-H84 AromaticContact CE2-CD2 3.69Å; F50-H84 AromaticContact CE2-CG 3.55Å; F50-H84 HydrophobicContact CZ-CB 3.8Å; F50-H84 AromaticContact CZ-CD2 3.91Å; M82-H84 PolarHBondContact O-N 2.81Å; H84-V117 HydrophobicContact CB-CB 4.01Å; H84-V117 HydrophobicContact CB-CG2 4.23Å; H84-V117 WeakPolarHBondContact O-CB 3.23Å; H84-V117 PolarHBondContact O-N 3.09Å; H84-F119 AromaticContact CD2-CE2 3.73Å; H84-F119 AromaticContact CD2-CZ 3.91Å
85	R	94.7	Very high	89.9	Confident	123 Å²	123	64 Å²	64	46%	0.464	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	152.2	-177.5	-42.8	-174.2	-175.4	176.8	-1.4	111.9	T45 M114 M115	T45-R85 HydrophobicContact CG2-CB 3.84Å; T45-R85 HydrophobicContact CG2-CG 4.14Å; T45-R85 PolarHBondContact N-O 3.11Å; T45-R85 PolarHBondContact OG1-N 2.85Å; T45-R85 PolarHBondContact OG1-O 3.48Å; R85-M114 HydrophobicContact CB-CE 3.35Å; R85-M114 HydrophobicContact CB-SD 3.71Å; R85-M114 WeakPolarHBondContact CD-SD 3.37Å; R85-M114 HydrophobicContact CG-CE 4.4Å; R85-M114 HydrophobicContact CG-SD 4.14Å; R85-M115 WeakPolarHBondContact CA-O 3.23Å
86	V	95.6	Very high	89.3	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.2	173.8	-176.4	0	0	0	0	108.3	L14 I42 R43 T44 V69 M114 M115 V117	L14-V86 HydrophobicContact CD2-CG2 4.1Å; I42-V86 HydrophobicContact CG2-CG1 3.92Å; R43-V86 CarbonylContact O-C 3.56Å; T44-V86 HydrophobicContact CG2-CG1 4.37Å; T44-V86 HydrophobicContact CG2-CG2 4.26Å; V69-V86 HydrophobicContact CG1-CG2 4.32Å; V86-M114 WeakPolarHBondContact O-CE 3.33Å; V86-M115 HydrophobicContact CB-CE 4.01Å; V86-M115 HydrophobicContact CG1-CE 3.74Å; V86-M115 PolarHBondContact N-O 2.79Å; V86-M115 WeakPolarHBondContact O-CE 3.4Å; V86-M115 PolarHBondContact O-N 3.06Å; V86-V117 HydrophobicContact CG2-CG2 4.11Å
87	V	96	Very high	89	Confident	22 Å²	22	67.2 Å²	67.2	13%	0.133	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	129	178.1	-158.4	0	0	0	0	108.9	I42 R43 V89 E112 V113 M114	I42-V87 WeakPolarHBondContact CA-O 3.12Å; R43-V87 HydrophobicContact CB-CB 4.15Å; R43-V87 HydrophobicContact CB-CG2 4.24Å; R43-V87 PolarHBondContact N-O 2.84Å; R43-V87 PolarHBondContact O-N 2.87Å; V87-V89 HydrophobicContact CB-CG2 4.38Å; V87-V89 HydrophobicContact CG1-CG2 3.77Å; V87-E112 HydrophobicContact CG1-CB 3.8Å; V87-V113 WeakPolarHBondContact CA-O 3.4Å; V87-M114 HydrophobicContact CB-CE 3.89Å; V87-M114 HydrophobicContact CG1-CE 4.34Å; V87-M114 HydrophobicContact CG2-CE 3.36Å; V87-M114 HydrophobicContact CG2-SD 4.2Å
88	V	96.2	Very high	89	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	99.8	162.5	175.2	0	0	0	0	106.4	V7 L30 I40 I42 E112 V113 M115	V7-V88 HydrophobicContact CG1-CG1 4.32Å; L30-V88 HydrophobicContact CD1-CG2 4.45Å; L30-V88 HydrophobicContact CD2-CG2 3.74Å; I40-V88 HydrophobicContact CB-CG1 4.43Å; I40-V88 HydrophobicContact CG2-CG1 4.49Å; I42-V88 HydrophobicContact CD1-CB 4.38Å; I42-V88 HydrophobicContact CD1-CG1 4.34Å; I42-V88 HydrophobicContact CD1-CG2 3.67Å; V88-E112 CarbonylContact O-C 3.54Å; V88-E112 WeakPolarHBondContact O-CA 3.35Å; V88-V113 HydrophobicContact CB-CB 4.45Å; V88-V113 PolarHBondContact N-O 2.84Å; V88-V113 PolarHBondContact O-N 3.16Å; V88-M115 HydrophobicContact CG2-CE 3.4Å
89	V	95.9	Very high	89.2	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.024	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	135	171	-164.8	0	0	0	0	107.3	I40 K41 R43 V87 W104 V110 K111 E112	I40-V89 CarbonylContact C-O 3.55Å; I40-V89 WeakPolarHBondContact CA-O 3.41Å; K41-V89 PolarHBondContact N-O 3.1Å; K41-V89 PolarHBondContact O-N 3.12Å; R43-V89 HydrophobicContact CG-CG2 4.28Å; V87-V89 HydrophobicContact CB-CG2 4.38Å; V87-V89 HydrophobicContact CG1-CG2 3.77Å; V89-W104 HydrophobicContact CB-CH2 4.01Å; V89-W104 HydrophobicContact CG1-CH2 3.72Å; V89-W104 HydrophobicContact CG1-CZ3 3.92Å; V89-V110 HydrophobicContact CG1-CB 4.02Å; V89-V110 HydrophobicContact CG1-CG2 4.38Å; V89-K111 CarbonylContact C-O 3.58Å; V89-K111 WeakPolarHBondContact CA-O 3.06Å; V89-K111 WeakPolarHBondContact CG1-O 3.29Å; V89-E112 HydrophobicContact CG2-CB 4.41Å
90	Y	95.8	Very high	89.1	Confident	10 Å²	10	62.4 Å²	62.4	4%	0.039	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.4	-179.8	65.2	-80.3	0	0	0	111.7	I5 V7 V38 A39 K111 V113	I5-Y90 HydrophobicContact CB-CE2 4.34Å; I5-Y90 HydrophobicContact CD1-CD2 4.42Å; I5-Y90 HydrophobicContact CD1-CE2 4.46Å; I5-Y90 HydrophobicContact CG1-CE2 4.36Å; V7-Y90 HydrophobicContact CB-CD1 3.99Å; V7-Y90 HydrophobicContact CB-CD2 4.23Å; V7-Y90 HydrophobicContact CB-CE1 3.99Å; V7-Y90 HydrophobicContact CB-CE2 4.2Å; V7-Y90 HydrophobicContact CB-CG 4.1Å; V7-Y90 HydrophobicContact CG2-CD1 4.12Å; V7-Y90 HydrophobicContact CG2-CD2 3.62Å; V7-Y90 HydrophobicContact CG2-CE1 4.43Å; V7-Y90 HydrophobicContact CG2-CE2 3.94Å; V7-Y90 HydrophobicContact CG2-CG 3.69Å; V7-Y90 PolarHBondContact N-OH 3.21Å; V38-Y90 HydrophobicContact CG1-CD2 4.28Å; A39-Y90 VanDerWaalsContact O-CA 3.3Å; A39-Y90 WeakPolarHBondContact O-CA 3.39Å; Y90-K111 HydrophobicContact CD1-CB 4.01Å; Y90-K111 WeakPolarHBondContact CD1-O 3.5Å; Y90-K111 HydrophobicContact CD2-CB 4.16Å; Y90-K111 HydrophobicContact CE1-CB 3.51Å; Y90-K111 HydrophobicContact CE2-CB 3.7Å; Y90-K111 HydrophobicContact CE2-CD 3.74Å; Y90-K111 HydrophobicContact CE2-CG 4.28Å; Y90-K111 HydrophobicContact CG-CB 4.32Å; Y90-K111 PolarHBondContact N-O 3.07Å; Y90-K111 PolarHBondContact O-N 2.8Å; Y90-K111 WeakPolarHBondContact OH-CD 3.34Å; Y90-V113 HydrophobicContact CD1-CG2 4.5Å; Y90-V113 HydrophobicContact CE1-CG2 3.84Å
91	T	94.8	Very high	89.2	Confident	7 Å²	7	62 Å²	62	4%	0.043	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	159.3	179.3	-177.6	0	0	0	0	108.7	V38 A39 I103 W104 A107	V38-T91 CarbonylContact C-O 3.6Å; V38-T91 VanDerWaalsContact CA-O 3.23Å; V38-T91 WeakPolarHBondContact CA-O 3.43Å; V38-T91 VanDerWaalsContact CB-O 3.32Å; V38-T91 WeakPolarHBondContact CB-O 3.38Å; A39-T91 HydrophobicContact CB-CG2 3.98Å; A39-T91 PolarHBondContact N-O 3.01Å; A39-T91 PolarHBondContact O-N 3.09Å; T91-I103 HydrophobicContact CG2-CG2 3.75Å; T91-W104 HydrophobicContact CG2-CD2 4.43Å; T91-W104 HydrophobicContact CG2-CE3 4.41Å; T91-W104 HydrophobicContact CG2-CH2 3.9Å; T91-W104 HydrophobicContact CG2-CZ2 3.92Å; T91-W104 HydrophobicContact CG2-CZ3 4.17Å; T91-A107 HydrophobicContact CG2-CB 3.93Å
92	E	93.6	Very high	89.5	Confident	44 Å²	44	59.9 Å²	59.9	21%	0.206	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	144.6	171.2	-158.6	165.1	119.3	0	0	111.4	I5 K36 E94	I5-E92 HydrophobicContact CD1-CB 4.34Å; I5-E92 HydrophobicContact CG2-CB 3.9Å; I5-E92 HydrophobicContact CG2-CG 3.79Å; K36-E92 HydrophobicContact CB-CG 4.3Å; K36-E92 HydrophobicContact CD-CG 3.9Å; K36-E92 WeakPolarHBondContact CD-OE1 3.34Å; K36-E92 WeakPolarHBondContact CD-OE2 3.4Å; K36-E92 WeakPolarHBondContact CE-OE1 3.34Å; K36-E92 IonicContact NZ-OE1 3.95Å; K36-E92 PolarHBondContact NZ-OE1 3.17Å; K36-E92 IonicContact NZ-OE2 2.63Å; E92-E94 HydrophobicContact CG-CG 3.95Å; E92-E94 VanDerWaalsContact OE1-CD 3.22Å; E92-E94 WeakPolarHBondContact OE1-CG 3.35Å
93	A	91.8	Very high	89.8	Confident	6 Å²	6	58.6 Å²	58.6	5%	0.05	29%	0.292	C	S	.	.			trans	-128.9	77.6	176	0	0	0	0	0	108.9	R37 A39 F58 I103	R37-A93 HydrophobicContact CG-CB 4.12Å; R37-A93 PolarHBondContact O-N 3.19Å; A39-A93 HydrophobicContact CB-CB 4.2Å; F58-A93 HydrophobicContact CD1-CB 4.13Å; F58-A93 HydrophobicContact CE1-CB 3.85Å; A93-I103 HydrophobicContact CB-CD1 3.8Å
94	E	83.9	Confident	89.8	Confident	149 Å²	149	54.7 Å²	54.7	70%	0.696	27%	0.268	S	S	*	.			trans	-68.6	-37	178.5	-62.8	-160.7	102.5	0	0	112.4	K36 E92	K36-E94 IonicContact NZ-OE1 3.77Å; K36-E94 PolarHBondContact NZ-OE1 2.95Å; E92-E94 HydrophobicContact CG-CG 3.95Å; E92-E94 VanDerWaalsContact OE1-CD 3.22Å; E92-E94 WeakPolarHBondContact OE1-CG 3.35Å
95	D	80.9	Confident	89.6	Confident	67 Å²	67	60.8 Å²	60.8	36%	0.358	29%	0.294	S	S	.	.			trans	-90.4	120.9	-178.8	-163.2	-31.3	0	0	0	111.5	F97 L98	D95-F97 VanDerWaalsContact C-N 3.34Å; D95-F97 WeakPolarHBondContact OD1-CA 3.5Å; D95-F97 WeakPolarHBondContact OD1-CB 3.36Å; D95-F97 WeakPolarHBondContact OD1-CD2 3.38Å; D95-F97 PolarHBondContact OD1-N 3.24Å; D95-L98 HydrophobicContact CB-CB 4.35Å; D95-L98 HydrophobicContact CB-CD1 3.86Å; D95-L98 HydrophobicContact CB-CG 3.78Å
96	V	78.4	Confident	89.3	Confident	103 Å²	103	60.7 Å²	60.7	62%	0.624	30%	0.298	S	S	*	.	S	Bend	trans	-77.7	-20.4	179.7	-179.3	0	0	0	0	112.1
97	F	81.3	Confident	88.8	Confident	189 Å²	189	62 Å²	62	83%	0.829	31%	0.31	S	S	*	.	S	Bend	trans	-87.4	-21.3	-178.8	-56.4	-75	0	0	0	113.1	D95	D95-F97 VanDerWaalsContact C-N 3.34Å; D95-F97 WeakPolarHBondContact OD1-CA 3.5Å; D95-F97 WeakPolarHBondContact OD1-CB 3.36Å; D95-F97 WeakPolarHBondContact OD1-CD2 3.38Å; D95-F97 PolarHBondContact OD1-N 3.24Å
98	L	86.6	Confident	88.2	Confident	53 Å²	53	67.4 Å²	67.4	28%	0.277	34%	0.342	S	S	.	.	S	Bend	trans	-75.3	132.9	177.9	-62.1	-176.2	0	0	0	111.5	F58 D95 Q102 I103	F58-L98 WeakPolarHBondContact CZ-O 3.42Å; D95-L98 HydrophobicContact CB-CB 4.35Å; D95-L98 HydrophobicContact CB-CD1 3.86Å; D95-L98 HydrophobicContact CB-CG 3.78Å; L98-Q102 HydrophobicContact CD2-CG 4Å; L98-I103 HydrophobicContact CB-CD1 4.09Å; L98-I103 HydrophobicContact CB-CG1 3.7Å; L98-I103 HydrophobicContact CD1-CG1 4.08Å
99	T	88.2	Confident	87.8	Confident	93 Å²	93	75.4 Å²	75.4	57%	0.571	38%	0.38	S	S	*	.			trans	-67.5	147.3	168.5	-61.3	0	0	0	0	109.6	Q101 Q102 I103	T99-Q101 PolarHBondContact O-N 3.49Å; T99-Q101 VanDerWaalsContact O-N 3.1Å; T99-Q102 WeakPolarHBondContact O-CA 3.32Å; T99-Q102 WeakPolarHBondContact O-CB 3.43Å; T99-Q102 PolarHBondContact O-N 2.91Å; T99-I103 PolarHBondContact O-N 2.89Å
100	S	84.5	Confident	87.7	Confident	15 Å²	15	78.8 Å²	78.8	11%	0.105	40%	0.4	C	S	.	.	H	α-helix	trans	-49.8	-41.5	-179.6	54.4	0	0	0	0	112.9	F58 Q102 I103 W104	F58-S100 VanDerWaalsContact CZ-N 3.3Å; S100-Q102 VanDerWaalsContact C-N 3.29Å; S100-Q102 PolarHBondContact O-N 3.48Å; S100-I103 PolarHBondContact O-N 2.84Å; S100-W104 PolarHBondContact O-N 2.88Å; S100-W104 VanDerWaalsContact O-N 3.1Å
101	Q	86.8	Confident	87.7	Confident	117 Å²	117	81.2 Å²	81.2	55%	0.547	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-27.9	176.2	-65.7	-158.5	-57.3	0	0	115	Y56 T99	Y56-Q101 HydrophobicContact CD2-CG 4.31Å; Y56-Q101 HydrophobicContact CE2-CG 4.39Å; Y56-Q101 HydrophobicContact CG-CG 4.46Å; T99-Q101 PolarHBondContact O-N 3.49Å; T99-Q101 VanDerWaalsContact O-N 3.1Å
102	Q	89.4	Confident	87.7	Confident	62 Å²	62	87.3 Å²	87.3	29%	0.29	44%	0.439	S	S	.	.	H	α-helix	trans	-76.7	-44.5	177.3	-177.8	58.5	29.9	0	0	110.3	L98 T99 S100 W104 K105 E106	L98-Q102 HydrophobicContact CD2-CG 4Å; T99-Q102 WeakPolarHBondContact O-CA 3.32Å; T99-Q102 WeakPolarHBondContact O-CB 3.43Å; T99-Q102 PolarHBondContact O-N 2.91Å; S100-Q102 VanDerWaalsContact C-N 3.29Å; S100-Q102 PolarHBondContact O-N 3.48Å; Q102-W104 PolarHBondContact O-N 2.93Å; Q102-K105 WeakPolarHBondContact O-CB 3.47Å; Q102-K105 PolarHBondContact O-N 3.14Å; Q102-E106 PolarHBondContact NE2-OE2 2.59Å
103	I	90.5	Very high	87.8	Confident	13 Å²	13	86.5 Å²	86.5	7%	0.067	44%	0.437	C	S	.	.	H	α-helix	trans	-54.9	-40.2	172.4	-61.7	167.4	0	0	0	110.4	A39 F58 T91 A93 L98 T99 S100 K105 E106 A107	A39-I103 HydrophobicContact CB-CD1 4.32Å; A39-I103 HydrophobicContact CB-CG2 4.16Å; F58-I103 HydrophobicContact CE1-CD1 3.52Å; F58-I103 HydrophobicContact CZ-CD1 3.74Å; T91-I103 HydrophobicContact CG2-CG2 3.75Å; A93-I103 HydrophobicContact CB-CD1 3.8Å; L98-I103 HydrophobicContact CB-CD1 4.09Å; L98-I103 HydrophobicContact CB-CG1 3.7Å; L98-I103 HydrophobicContact CD1-CG1 4.08Å; T99-I103 PolarHBondContact O-N 2.89Å; S100-I103 PolarHBondContact O-N 2.84Å; I103-K105 PolarHBondContact O-N 2.89Å; I103-K105 VanDerWaalsContact O-N 3.07Å; I103-E106 CarbonylContact O-C 3.44Å; I103-E106 PolarHBondContact O-N 2.73Å; I103-A107 WeakPolarHBondContact O-CB 3.48Å; I103-A107 PolarHBondContact O-N 3.29Å
104	W	88.5	Confident	87.9	Confident	42 Å²	42	89.3 Å²	89.3	16%	0.159	45%	0.45	C	S	.	.	H	α-helix	trans	-65.8	-4.8	175.6	-75.6	114.6	0	0	0	116	A39 K41 Y56 V89 T91 S100 Q102 A107 V110	A39-W104 WeakPolarHBondContact O-CZ2 3.2Å; K41-W104 HydrophobicContact CB-CD2 4.14Å; K41-W104 VanDerWaalsContact CB-CE2 3.46Å; K41-W104 HydrophobicContact CB-CH2 3.99Å; K41-W104 HydrophobicContact CB-CZ2 3.39Å; K41-W104 HydrophobicContact CD-CD2 4.22Å; K41-W104 HydrophobicContact CD-CE3 4.41Å; Y56-W104 AromaticContact CD1-CD1 3.44Å; Y56-W104 VanDerWaalsContact CD1-CD1 3.44Å; Y56-W104 HydrophobicContact CD1-CG 4.43Å; Y56-W104 AromaticContact CD1-NE1 3.65Å; Y56-W104 AromaticContact CE1-CD1 3.51Å; Y56-W104 HydrophobicContact CE1-CG 4.11Å; Y56-W104 AromaticContact CE1-NE1 3.99Å; V89-W104 HydrophobicContact CB-CH2 4.01Å; V89-W104 HydrophobicContact CG1-CH2 3.72Å; V89-W104 HydrophobicContact CG1-CZ3 3.92Å; T91-W104 HydrophobicContact CG2-CD2 4.43Å; T91-W104 HydrophobicContact CG2-CE3 4.41Å; T91-W104 HydrophobicContact CG2-CH2 3.9Å; T91-W104 HydrophobicContact CG2-CZ2 3.92Å; T91-W104 HydrophobicContact CG2-CZ3 4.17Å; S100-W104 PolarHBondContact O-N 2.88Å; S100-W104 VanDerWaalsContact O-N 3.1Å; Q102-W104 PolarHBondContact O-N 2.93Å; W104-A107 HydrophobicContact CE3-CB 4.24Å; W104-V110 HydrophobicContact CH2-CG1 4.46Å; W104-V110 HydrophobicContact CZ3-CB 4.46Å; W104-V110 HydrophobicContact CZ3-CG1 3.71Å
105	K	89.1	Confident	88.5	Confident	158 Å²	158	82.2 Å²	82.2	69%	0.687	42%	0.416	S	S	*	.	H	α-helix	trans	-91.8	-28.9	168.3	-58	177.3	-169.6	163.4	0	112.7	Q102 I103	Q102-K105 WeakPolarHBondContact O-CB 3.47Å; Q102-K105 PolarHBondContact O-N 3.14Å; I103-K105 PolarHBondContact O-N 2.89Å; I103-K105 VanDerWaalsContact O-N 3.07Å
106	E	88	Confident	89.1	Confident	120 Å²	120	85.4 Å²	85.4	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-104	-8.3	-174.3	-64.5	172.3	84.6	0	0	112.1	Q102 I103 V108	Q102-E106 PolarHBondContact NE2-OE2 2.59Å; I103-E106 CarbonylContact O-C 3.44Å; I103-E106 PolarHBondContact O-N 2.73Å; E106-V108 PolarHBondContact O-N 2.82Å; E106-V108 VanDerWaalsContact O-N 3.09Å
107	A	85.8	Confident	89.9	Confident	29 Å²	29	81 Å²	81	24%	0.24	40%	0.401	C	S	.	.			trans	-64.6	105.2	179.7	0	0	0	0	0	112.7	T91 I103 W104 V110	T91-A107 HydrophobicContact CG2-CB 3.93Å; I103-A107 WeakPolarHBondContact O-CB 3.48Å; I103-A107 PolarHBondContact O-N 3.29Å; W104-A107 HydrophobicContact CE3-CB 4.24Å; A107-V110 HydrophobicContact CB-CG1 3.98Å
108	V	82.6	Confident	90.5	Very high	134 Å²	134	79.4 Å²	79.4	81%	0.812	39%	0.389	S	S	*	.			trans	-88.2	-50.8	173.5	-175.4	0	0	0	0	111.2	E106 V110	E106-V108 PolarHBondContact O-N 2.82Å; E106-V108 VanDerWaalsContact O-N 3.09Å; V108-V110 PolarHBondContact O-N 2.85Å
109	E	88.6	Confident	90.7	Very high	169 Å²	169	78.2 Å²	78.2	79%	0.79	38%	0.382	S	S	*	.	S	Bend	trans	-97.5	84.4	-175.3	-68	-170.9	86.1	0	0	111.7
110	V	93.4	Very high	90.7	Very high	75 Å²	75	75.5 Å²	75.5	46%	0.455	37%	0.365	S	S	.	.			trans	-93.3	138.2	176.3	-56	0	0	0	0	111.2	V89 W104 A107 V108	V89-V110 HydrophobicContact CG1-CB 4.02Å; V89-V110 HydrophobicContact CG1-CG2 4.38Å; W104-V110 HydrophobicContact CH2-CG1 4.46Å; W104-V110 HydrophobicContact CZ3-CB 4.46Å; W104-V110 HydrophobicContact CZ3-CG1 3.71Å; A107-V110 HydrophobicContact CB-CG1 3.98Å; V108-V110 PolarHBondContact O-N 2.85Å
111	K	94.6	Very high	90.7	Very high	60 Å²	60	80.3 Å²	80.3	26%	0.261	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	160	168.1	-67.9	-174	178.3	-176.4	0	109.9	E3 I5 V89 Y90	E3-K111 IonicContact OE1-NZ 2.76Å; E3-K111 PolarHBondContact OE1-NZ 2.63Å; E3-K111 IonicContact OE2-NZ 2.92Å; E3-K111 PolarHBondContact OE2-NZ 2.66Å; I5-K111 HydrophobicContact CD1-CD 4.34Å; I5-K111 HydrophobicContact CG1-CD 4.19Å; I5-K111 PolarHBondContact O-NZ 2.85Å; V89-K111 CarbonylContact C-O 3.58Å; V89-K111 WeakPolarHBondContact CA-O 3.06Å; V89-K111 WeakPolarHBondContact CG1-O 3.29Å; Y90-K111 HydrophobicContact CD1-CB 4.01Å; Y90-K111 WeakPolarHBondContact CD1-O 3.5Å; Y90-K111 HydrophobicContact CD2-CB 4.16Å; Y90-K111 HydrophobicContact CE1-CB 3.51Å; Y90-K111 HydrophobicContact CE2-CB 3.7Å; Y90-K111 HydrophobicContact CE2-CD 3.74Å; Y90-K111 HydrophobicContact CE2-CG 4.28Å; Y90-K111 HydrophobicContact CG-CB 4.32Å; Y90-K111 PolarHBondContact N-O 3.07Å; Y90-K111 PolarHBondContact O-N 2.8Å; Y90-K111 WeakPolarHBondContact OH-CD 3.34Å
112	E	95.4	Very high	90.3	Very high	135 Å²	135	78.1 Å²	78.1	63%	0.631	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	141.4	176.8	57.3	176.1	-155.7	0	0	113.2	V87 V88 V89	V87-E112 HydrophobicContact CG1-CB 3.8Å; V88-E112 CarbonylContact O-C 3.54Å; V88-E112 WeakPolarHBondContact O-CA 3.35Å; V89-E112 HydrophobicContact CG2-CB 4.41Å
113	V	95.2	Very high	88.9	Confident	27 Å²	27	79.6 Å²	79.6	16%	0.164	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.4	167	-172.9	0	0	0	0	108.7	V7 C9 V87 V88 Y90	V7-V113 WeakPolarHBondContact O-CG2 3.41Å; C9-V113 HydrophobicContact CB-CG1 4.16Å; V87-V113 WeakPolarHBondContact CA-O 3.4Å; V88-V113 HydrophobicContact CB-CB 4.45Å; V88-V113 PolarHBondContact N-O 2.84Å; V88-V113 PolarHBondContact O-N 3.16Å; Y90-V113 HydrophobicContact CD1-CG2 4.5Å; Y90-V113 HydrophobicContact CE1-CG2 3.84Å
114	M	95	Very high	87.3	Confident	65 Å²	65	87.2 Å²	87.2	32%	0.32	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	101.3	-175.2	179.5	82.3	-67.6	0	0	111.5	R85 V86 V87	R85-M114 HydrophobicContact CB-CE 3.35Å; R85-M114 HydrophobicContact CB-SD 3.71Å; R85-M114 WeakPolarHBondContact CD-SD 3.37Å; R85-M114 HydrophobicContact CG-CE 4.4Å; R85-M114 HydrophobicContact CG-SD 4.14Å; V86-M114 WeakPolarHBondContact O-CE 3.33Å; V87-M114 HydrophobicContact CB-CE 3.89Å; V87-M114 HydrophobicContact CG1-CE 4.34Å; V87-M114 HydrophobicContact CG2-CE 3.36Å; V87-M114 HydrophobicContact CG2-SD 4.2Å
115	M	95.7	Very high	85.6	Confident	0 Å²	0	90.5 Å²	90.5	0%	0	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	134.1	173.7	-60.9	164.8	-79.4	0	0	111	C9 E12 L14 V28 R85 V86 V88	C9-M115 HydrophobicContact CB-CE 4.43Å; C9-M115 HydrophobicContact CB-CG 3.95Å; C9-M115 HydrophobicContact CB-SD 3.61Å; E12-M115 VanDerWaalsContact O-CA 3.23Å; E12-M115 WeakPolarHBondContact O-CA 3.37Å; E12-M115 WeakPolarHBondContact O-CB 3.49Å; L14-M115 HydrophobicContact CD1-CB 3.52Å; L14-M115 HydrophobicContact CD1-CG 4.14Å; L14-M115 HydrophobicContact CD1-SD 3.87Å; V28-M115 HydrophobicContact CB-SD 4.44Å; V28-M115 HydrophobicContact CG1-SD 3.59Å; V28-M115 VanDerWaalsContact CG1-SD 3.59Å; V28-M115 HydrophobicContact CG2-SD 4.15Å; R85-M115 WeakPolarHBondContact CA-O 3.23Å; V86-M115 HydrophobicContact CB-CE 4.01Å; V86-M115 HydrophobicContact CG1-CE 3.74Å; V86-M115 PolarHBondContact N-O 2.79Å; V86-M115 WeakPolarHBondContact O-CE 3.4Å; V86-M115 PolarHBondContact O-N 3.06Å; V88-M115 HydrophobicContact CG2-CE 3.4Å
116	K	94.8	Very high	83.5	Confident	134 Å²	134	90.1 Å²	90.1	58%	0.583	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	138.7	178.2	-65.5	176.3	-176.3	170	0	109.9	E12 V13 L14	E12-K116 PolarHBondContact O-N 3.24Å; E12-K116 VanDerWaalsContact O-N 3.1Å; V13-K116 CarbonylContact C-O 3.55Å; V13-K116 WeakPolarHBondContact CA-O 3.45Å; L14-K116 PolarHBondContact N-O 2.69Å
117	V	94.5	Very high	81.7	Confident	12 Å²	12	90.2 Å²	90.2	7%	0.073	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.7	168.8	-175.7	0	0	0	0	109.2	L14 F16 F50 H84 V86 F119	L14-V117 HydrophobicContact CB-CG2 4.41Å; L14-V117 CarbonylContact O-C 3.6Å; L14-V117 WeakPolarHBondContact O-CA 3.29Å; F16-V117 HydrophobicContact CD2-CG1 3.58Å; F16-V117 HydrophobicContact CE2-CG1 3.67Å; F50-V117 HydrophobicContact CE1-CG1 4.02Å; F50-V117 HydrophobicContact CE1-CG2 4.33Å; F50-V117 HydrophobicContact CZ-CB 4.4Å; F50-V117 HydrophobicContact CZ-CG1 3.86Å; F50-V117 HydrophobicContact CZ-CG2 4.17Å; H84-V117 HydrophobicContact CB-CB 4.01Å; H84-V117 HydrophobicContact CB-CG2 4.23Å; H84-V117 WeakPolarHBondContact O-CB 3.23Å; H84-V117 PolarHBondContact O-N 3.09Å; V86-V117 HydrophobicContact CG2-CG2 4.11Å; V117-F119 HydrophobicContact CG1-CE2 3.99Å; V117-F119 HydrophobicContact CG1-CZ 3.99Å
118	R	92.5	Very high	79.9	Confident	155 Å²	155	93.8 Å²	93.8	59%	0.585	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.1	176.1	-166.9	-179.6	-163.8	-142	3.8	110	V13 L14 T15 F16	V13-R118 HydrophobicContact CG1-CB 4.12Å; L14-R118 PolarHBondContact O-N 3.42Å; T15-R118 CarbonylContact C-O 3.48Å; T15-R118 WeakPolarHBondContact CA-O 3.2Å; F16-R118 PolarHBondContact N-O 3Å
119	F	91.1	Very high	78.9	Confident	28 Å²	28	91.7 Å²	91.7	12%	0.123	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	124.1	169.6	-60.4	-82.5	0	0	0	108.2	F16 Y20 L49 F50 F74 F76 M82 H84 V117	F16-F119 HydrophobicContact CB-CD1 4.06Å; F16-F119 HydrophobicContact CB-CE1 4.26Å; F16-F119 HydrophobicContact CD2-CE1 4.34Å; Y20-F119 HydrophobicContact CD1-CD1 4.12Å; Y20-F119 HydrophobicContact CE1-CB 4.19Å; Y20-F119 AromaticContact CE1-CD1 3.75Å; Y20-F119 HydrophobicContact CE1-CD1 3.75Å; Y20-F119 HydrophobicContact CE1-CG 4.45Å; Y20-F119 WeakPolarHBondContact OH-CB 3.18Å; L49-F119 HydrophobicContact CD2-CZ 4.35Å; F50-F119 AromaticContact CZ-CZ 3.89Å; F50-F119 HydrophobicContact CZ-CZ 3.89Å; F74-F119 HydrophobicContact CE1-CD1 4.11Å; F74-F119 AromaticContact CE1-CE1 3.61Å; F74-F119 HydrophobicContact CE1-CE1 3.61Å; F74-F119 HydrophobicContact CE1-CZ 4.3Å; F74-F119 AromaticContact CZ-CD1 3.79Å; F74-F119 HydrophobicContact CZ-CD1 3.79Å; F74-F119 AromaticContact CZ-CE1 3.52Å; F74-F119 HydrophobicContact CZ-CE1 3.52Å; F74-F119 HydrophobicContact CZ-CG 4.46Å; F74-F119 AromaticContact CZ-CZ 3.98Å; F74-F119 HydrophobicContact CZ-CZ 3.98Å; F76-F119 HydrophobicContact CD2-CB 4.5Å; F76-F119 HydrophobicContact CE2-CB 3.98Å; F76-F119 HydrophobicContact CE2-CG 4.45Å; M82-F119 HydrophobicContact CB-CD2 3.8Å; M82-F119 HydrophobicContact CB-CE2 3.95Å; H84-F119 AromaticContact CD2-CE2 3.73Å; H84-F119 AromaticContact CD2-CZ 3.91Å; V117-F119 HydrophobicContact CG1-CE2 3.99Å; V117-F119 HydrophobicContact CG1-CZ 3.99Å
120	T	89.6	Confident	77.4	Confident	35 Å²	35	89 Å²	89	22%	0.215	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.1	-179.7	-55.3	0	0	0	0	108	T15 F16 Y17 A18 Y20	T15-T120 WeakPolarHBondContact CG2-OG1 3.27Å; F16-T120 PolarHBondContact O-N 2.81Å; Y17-T120 CarbonylContact C-O 3.58Å; Y17-T120 WeakPolarHBondContact CA-O 3.39Å; Y17-T120 HydrophobicContact CD1-CG2 4.28Å; Y17-T120 HydrophobicContact CE1-CG2 4.13Å; A18-T120 PolarHBondContact N-O 3.02Å; Y20-T120 PolarHBondContact OH-N 2.75Å; Y20-T120 VanDerWaalsContact OH-N 3.14Å; Y20-T120 PolarHBondContact OH-O 2.89Å
121	M	83.8	Confident	75.3	Confident	116 Å²	116	89.9 Å²	89.9	57%	0.571	50%	0.501	S	S	*	.			trans	-72.6	128.6	164.1	-63.4	178.3	-179.6	0	0	107	A18 F76 A123	A18-M121 HydrophobicContact CB-CB 4.22Å; A18-M121 HydrophobicContact CB-CG 3.86Å; F76-M121 HydrophobicContact CD1-CE 3.64Å; F76-M121 HydrophobicContact CE1-CE 3.59Å; F76-M121 HydrophobicContact CZ-CE 4.49Å; M121-A123 PolarHBondContact O-N 3.03Å
122	P	78.1	Confident	73.6	Confident	71 Å²	71	93.5 Å²	93.5	46%	0.461	52%	0.522	S	S	.	.			trans	-60.9	113.6	166	27.3	-30.2	0	0	0	106.3	A18 E124	A18-P122 WeakPolarHBondContact O-CD 3.38Å; A18-P122 VanDerWaalsContact O-CG 3.27Å; A18-P122 WeakPolarHBondContact O-CG 3.39Å; P122-E124 PolarHBondContact O-N 3.19Å
123	A	59.4	Low	72.1	Confident	94 Å²	94	91.6 Å²	91.6	78%	0.777	52%	0.521	S	S	*	.			trans	-53.6	136.6	151.9	0	0	0	0	0	105.9	M121	M121-A123 PolarHBondContact O-N 3.03Å
124	E	57.8	Low	70.2	Confident	172 Å²	172	96.5 Å²	96.5	80%	0.804	55%	0.553	S	S	*	*			trans	-44.5	138.3	-173.9	-66.2	166.6	94	0	0	110.1	P122 I126	P122-E124 PolarHBondContact O-N 3.19Å; E124-I126 PolarHBondContact O-N 3.2Å
125	P	52.5	Low	68.5	Low	111 Å²	111	99.5 Å²	99.5	72%	0.721	57%	0.569	S	S	*	*			trans	-57.1	110.8	170.5	26	-31.8	0	0	0	105.7	V127	P125-V127 PolarHBondContact O-N 3.36Å
126	I	45.4	Very low	66.5	Low	151 Å²	151	106.5 Å²	106.5	77%	0.774	61%	0.607	S	S	*	*			trans	-63.3	96.6	168.6	-56.9	174.3	0	0	0	103.3	E124 T128	E124-I126 PolarHBondContact O-N 3.2Å; I126-T128 WeakPolarHBondContact CG2-OG1 3.19Å; I126-T128 PolarHBondContact O-N 2.72Å
127	V	49.4	Very low	64.9	Low	122 Å²	122	105.7 Å²	105.7	74%	0.739	61%	0.613	S	S	*	*			trans	-66.1	77.5	160.3	-176.1	0	0	0	0	103.7	P125 P129	P125-V127 PolarHBondContact O-N 3.36Å; V127-P129 VanDerWaalsContact C-N 3.34Å; V127-P129 WeakPolarHBondContact O-CD 3.19Å; V127-P129 VanDerWaalsContact O-N 3.14Å
128	T	49.2	Very low	63.3	Low	104 Å²	104	109.9 Å²	109.9	64%	0.638	64%	0.64	S	S	*	*			trans	-65.7	104.4	157.3	-42.8	0	0	0	0	102.2	I126	I126-T128 WeakPolarHBondContact CG2-OG1 3.19Å; I126-T128 PolarHBondContact O-N 2.72Å
129	P	60.1	Low	61.3	Low	89 Å²	89	109 Å²	109	58%	0.578	66%	0.655	S	S	*	*			trans	-53.7	145	167.6	27.4	-34.8	0	0	0	106.6	V127 A131	V127-P129 VanDerWaalsContact C-N 3.34Å; V127-P129 WeakPolarHBondContact O-CD 3.19Å; V127-P129 VanDerWaalsContact O-N 3.14Å; P129-A131 PolarHBondContact O-N 2.98Å
130	P	57.4	Low	59.8	Low	114 Å²	114	113.5 Å²	113.5	74%	0.74	69%	0.69	S	S	*	*			trans	-51	122.7	177	23.2	-33.3	0	0	0	107.3	I132	P130-I132 VanDerWaalsContact C-N 3.29Å; P130-I132 WeakPolarHBondContact O-CG1 3.49Å; P130-I132 PolarHBondContact O-N 2.74Å
131	A	49.1	Very low	58	Low	93 Å²	93	116.1 Å²	116.1	77%	0.769	72%	0.715	S	S	*	*			trans	-61.6	97.6	-175.8	0	0	0	0	0	107.7	P129 P133	P129-A131 PolarHBondContact O-N 2.98Å; A131-P133 WeakPolarHBondContact O-CD 3Å; A131-P133 VanDerWaalsContact O-N 3.1Å
132	I	60	Low	56.4	Low	136 Å²	136	115 Å²	115	70%	0.697	73%	0.725	S	S	*	*			trans	-60.6	117.4	176.2	-51.6	177.9	0	0	0	104.1	P130	P130-I132 VanDerWaalsContact C-N 3.29Å; P130-I132 WeakPolarHBondContact O-CG1 3.49Å; P130-I132 PolarHBondContact O-N 2.74Å
133	P	63.9	Low	55.7	Low	95 Å²	95	117.3 Å²	117.3	62%	0.617	74%	0.739	S	S	*	*			trans	-57.3	145.6	175.9	26.2	-33.9	0	0	0	107.7	A131 I135	A131-P133 WeakPolarHBondContact O-CD 3Å; A131-P133 VanDerWaalsContact O-N 3.1Å; P133-I135 PolarHBondContact O-N 2.83Å
134	P	54.5	Low	55.4	Low	129 Å²	129	118.1 Å²	118.1	84%	0.838	74%	0.737	S	S	*	*			trans	-57.7	108.3	-178.9	24.5	-33.3	0	0	0	108.5	D136	P134-D136 PolarHBondContact O-N 3.08Å; P134-D136 VanDerWaalsContact O-N 3.08Å
135	I	59	Low	54.9	Low	128 Å²	128	116.5 Å²	116.5	66%	0.656	74%	0.739	S	S	*	*			trans	-68.1	110.7	170.3	-65	178.7	0	0	0	104.9	P133 V137	P133-I135 PolarHBondContact O-N 2.83Å; I135-V137 VanDerWaalsContact C-N 3.28Å; I135-V137 HydrophobicContact CG2-CG1 4.14Å; I135-V137 PolarHBondContact O-N 2.86Å
136	D	54.4	Low	54.3	Low	148 Å²	148	114.8 Å²	114.8	79%	0.791	74%	0.741	S	S	*	*			trans	-61.6	93	170.5	-168.5	-108.1	0	0	0	108	P134 P138	P134-D136 PolarHBondContact O-N 3.08Å; P134-D136 VanDerWaalsContact O-N 3.08Å; D136-P138 VanDerWaalsContact O-CD 3.28Å; D136-P138 WeakPolarHBondContact O-CD 3.28Å
137	V	60.8	Low	54.2	Low	116 Å²	116	111.1 Å²	111.1	70%	0.703	74%	0.74	S	S	*	*			trans	-90.7	105.6	172	-86	0	0	0	0	107.9	I135	I135-V137 VanDerWaalsContact C-N 3.28Å; I135-V137 HydrophobicContact CG2-CG1 4.14Å; I135-V137 PolarHBondContact O-N 2.86Å
138	P	60.6	Low	54.4	Low	100 Å²	100	112.3 Å²	112.3	65%	0.649	75%	0.747	S	S	*	*			trans	-64.6	144.1	176.8	26.7	-34.3	0	0	0	110	D136 S140	D136-P138 VanDerWaalsContact O-CD 3.28Å; D136-P138 WeakPolarHBondContact O-CD 3.28Å; P138-S140 PolarHBondContact O-N 2.9Å
139	P	51.4	Low	54.3	Low	136 Å²	136	111.8 Å²	111.8	88%	0.883	75%	0.754	S	S	*	*			trans	-73.3	92.6	-173.6	29.6	-35.1	0	0	0	111.1
140	S	60.1	Low	53.6	Low	124 Å²	124	111.9 Å²	111.9	87%	0.867	76%	0.762	S	S	*	*			trans	-79	135.5	170.1	-163.6	0	0	0	0	110.7	P138	P138-S140 PolarHBondContact O-N 2.9Å
141	A	50.5	Low	53.2	Low	90 Å²	90	113.9 Å²	113.9	74%	0.744	77%	0.767	S	S	*	*			trans	-91.6	152.1	-158.9	0	0	0	0	0	115.3
142	A	51.7	Low	53.8	Low	93 Å²	93	114.4 Å²	114.4	77%	0.769	76%	0.762	S	S	*	*			trans	71.9	125.1	153.1	0	0	0	0	0	120.2
143	P	63.6	Low	53.5	Low	119 Å²	119	113.3 Å²	113.3	77%	0.773	76%	0.764	S	S	*	*			trans	-87.3	-168.9	157.6	43.1	-37.1	0	0	0	109.3
144	P	52.3	Low	52.5	Low	111 Å²	111	119.2 Å²	119.2	72%	0.721	78%	0.78	S	S	*	*			cis	-141.8	-165.5	8.1	35	-10.7	0	0	0	116.1
145	T	48	Very low	51.7	Low	138 Å²	138	117.2 Å²	117.2	85%	0.847	77%	0.774	S	S	*	*			trans	114.5	130.3	140.3	-32.2	0	0	0	0	118.1
146	G	39.9	Very low	51.4	Low	74 Å²	74	118.9 Å²	118.9	76%	0.763	78%	0.784	S	S	*	*			trans	90.9	120.1	175.4	0	0	0	0	0	112.2
147	G	42.2	Very low	51	Low	74 Å²	74	116.8 Å²	116.8	76%	0.763	78%	0.781	S	S	*	*			cis	88.7	125.1	39.2	0	0	0	0	0	108.1
148	V	53.9	Low	50.3	Low	147 Å²	147	115.5 Å²	115.5	89%	0.891	78%	0.782	S	S	*	*			cis	-150.4	168.7	24.8	175.7	0	0	0	0	110
149	A	48	Very low	49.8	Very low	93 Å²	93	119.5 Å²	119.5	77%	0.769	79%	0.792	S	S	*	*			trans	-34.2	169.1	172.8	0	0	0	0	0	118.5
150	A	44.3	Very low	49.8	Very low	92 Å²	92	121.1 Å²	121.1	76%	0.76	79%	0.788	S	S	*	*			cis	-159.7	156.7	20.2	0	0	0	0	0	114.4
151	D	49.6	Very low	49.1	Very low	156 Å²	156	121.4 Å²	121.4	83%	0.834	78%	0.779	S	S	*	*			trans	37.3	147	145.5	-137.1	-111.8	0	0	0	124.8
152	P	60.6	Low	49.4	Very low	104 Å²	104	123.9 Å²	123.9	68%	0.675	79%	0.785	S	S	*	*			trans	-110.7	-130.4	-176.9	27.8	-3.2	0	0	0	114.1
153	P	53.4	Low	49.1	Very low	113 Å²	113	124.2 Å²	124.2	73%	0.734	78%	0.78	S	S	*	*				-118	156.9	-100.1	37.4	-24.2	0	0	0	115.5
154	K	44.1	Very low	48.8	Very low	219 Å²	219	126.8 Å²	126.8	95%	0.952	79%	0.786	S	S	*	*			trans	-161.8	151.6	146.4	-122.7	171.4	-176.3	178.7	0	115.9
155	A	38.3	Very low	49.2	Very low	87 Å²	87	126.3 Å²	126.3	72%	0.719	78%	0.783	S	S	*	*			trans	-62.1	159.1	-178.4	0	0	0	0	0	115.9
156	L	52.2	Low	49.5	Very low	162 Å²	162	124.7 Å²	124.7	85%	0.848	78%	0.778	S	S	*	*			trans	-174	144.3	130.2	-98.5	151.7	0	0	0	111.6
157	S	45.9	Very low	50.4	Low	105 Å²	105	125.8 Å²	125.8	73%	0.734	77%	0.774	S	S	*	*			trans	39.5	119.7	150.2	-54.8	0	0	0	0	120.4
158	A	46.5	Very low	51.3	Low	89 Å²	89	127.8 Å²	127.8	74%	0.736	78%	0.776	S	S	*	*				104.1	152	59.9	0	0	0	0	0	112.5
159	E	48.6	Very low	51.5	Low	183 Å²	183	126.9 Å²	126.9	86%	0.855	77%	0.766	S	S	*	*			trans	86.9	156.5	165.8	-50.2	-151.9	91.2	0	0	121
160	H	53.1	Low	51.7	Low	171 Å²	171	131 Å²	131	79%	0.792	77%	0.769	S	S	*	*			trans	62.8	110.3	-174	-74.5	85.4	0	0	0	116.7
161	D	45.3	Very low	51.7	Low	129 Å²	129	130.9 Å²	130.9	69%	0.69	77%	0.768	S	S	*	*				71	97.5	51.6	-164.8	-90.9	0	0	0	113.7
162	T	56.2	Low	52	Low	142 Å²	142	130.1 Å²	130.1	87%	0.871	77%	0.769	S	S	*	*			trans	-169.7	121.4	150.1	-9.9	0	0	0	0	111.2
163	P	45	Very low	51.4	Low	101 Å²	101	131.4 Å²	131.4	66%	0.656	78%	0.775	S	S	*	*			trans	-119.6	143.7	159.7	35.9	-26.4	0	0	0	111.9
164	L	58.4	Low	51.3	Low	173 Å²	173	130.4 Å²	130.4	91%	0.906	78%	0.775	S	S	*	*			trans	151	166.6	164.5	-88.9	159.6	0	0	0	110.1
165	P	59.9	Low	51.7	Low	100 Å²	100	129 Å²	129	65%	0.649	77%	0.772	S	S	*	*			cis	-138.6	-179.2	-21.6	37.3	-19.1	0	0	0	116.2
166	S	55.2	Low	52.6	Low	105 Å²	105	130 Å²	130	73%	0.734	77%	0.771	S	S	*	*			trans	72.4	153.2	144.1	-70.1	0	0	0	0	121.7
167	S	57.3	Low	52.8	Low	97 Å²	97	129.6 Å²	129.6	68%	0.678	78%	0.775	S	S	*	*			cis	-173.8	155.8	-19.5	-95.5	0	0	0	0	111.8
168	S	61.6	Low	52.8	Low	115 Å²	115	134.3 Å²	134.3	80%	0.804	79%	0.786	S	S	*	*			trans	63.7	155	155.6	-60.2	0	0	0	0	118.4
169	D	57.7	Low	52.8	Low	128 Å²	128	133.4 Å²	133.4	68%	0.684	79%	0.785	S	S	*	*			cis	-152.2	156.9	-3.9	-148.3	-116.4	0	0	0	105.7
170	Q	53.2	Low	52.9	Low	181 Å²	181	132 Å²	132	85%	0.846	78%	0.784	S	S	*	*				174.5	171.7	64.8	-163.8	149.5	103.5	0	0	109
171	A	44.8	Very low	53	Low	89 Å²	89	130.6 Å²	130.6	74%	0.736	78%	0.78	S	S	*	*			trans	-116.6	-159.9	-157.8	0	0	0	0	0	117.7
172	V	54.8	Low	53.4	Low	140 Å²	140	130 Å²	130	85%	0.848	78%	0.784	S	S	*	*			trans	98	136.9	169.5	-172.5	0	0	0	0	116.2
173	V	49.1	Very low	53.6	Low	131 Å²	131	128.8 Å²	128.8	79%	0.794	78%	0.778	S	S	*	*			cis	-174.5	158.5	-40.5	130.2	0	0	0	0	109.8
174	A	49.6	Very low	54	Low	91 Å²	91	131.3 Å²	131.3	75%	0.752	79%	0.792	S	S	*	*			trans	76.2	153.4	163.3	0	0	0	0	0	120.6
175	Q	53.5	Low	53.6	Low	190 Å²	190	126.1 Å²	126.1	89%	0.888	78%	0.78	S	S	*	*			cis	-164.1	172.5	-41.9	-113.5	-147.9	-21.2	0	0	109.2
176	P	56.5	Low	53.3	Low	107 Å²	107	127 Å²	127	70%	0.695	79%	0.786	S	S	*	*			trans	-109.7	173.1	-153.7	42.4	-38.4	0	0	0	117.3
177	V	57.7	Low	53.1	Low	154 Å²	154	131.3 Å²	131.3	93%	0.933	80%	0.795	S	S	*	*			trans	-142.1	167.8	157.3	-69.1	0	0	0	0	111.9
178	Q	45.1	Very low	52.9	Low	204 Å²	204	131.1 Å²	131.1	95%	0.953	80%	0.799	S	S	*	*			trans	-139.9	154.3	-149.2	172.2	-178.6	-24.5	0	0	113.6
179	G	45.7	Very low	52.1	Low	70 Å²	70	134.8 Å²	134.8	72%	0.722	80%	0.803	S	S	*	*			trans	121.6	143.7	171.5	0	0	0	0	0	113.2
180	D	52.2	Low	51.8	Low	155 Å²	155	138.3 Å²	138.3	83%	0.829	82%	0.816	S	S	*	*			cis	-151.4	174	-6.7	-165.5	-120.6	0	0	0	110.2
181	I	54.5	Low	51.7	Low	140 Å²	140	138 Å²	138	72%	0.718	81%	0.812	S	S	*	*			trans	-97.9	-166.9	-169.8	2.2	178.1	0	0	0	110.5
182	P	54.3	Low	52	Low	117 Å²	117	141.6 Å²	141.6	76%	0.76	82%	0.818	S	S	*	*			cis	-131.8	-176.7	-11.9	23.7	2.4	0	0	0	114.9
183	P	59.8	Low	51.7	Low	117 Å²	117	139.2 Å²	139.2	76%	0.76	81%	0.813	S	S	*	*			trans	-103.2	149.3	179.8	37.8	-32.9	0	0	0	116.3
184	T	52.4	Low	51.9	Low	154 Å²	154	137.3 Å²	137.3	95%	0.945	81%	0.811	S	S	*	*			trans	-158.7	149.4	165.7	-40.1	0	0	0	0	108
185	G	50.8	Low	52.2	Low	63 Å²	63	138.5 Å²	138.5	65%	0.649	81%	0.811	S	S	*	*			cis	-175.6	171.8	-7.9	0	0	0	0	0	109.9
186	P	53.4	Low	52.4	Low	120 Å²	120	135.8 Å²	135.8	78%	0.779	81%	0.807	S	S	*	*			trans	-99.9	-178.2	-172.7	39.2	-35.7	0	0	0	115
187	Q	50.2	Low	51.7	Low	195 Å²	195	135.6 Å²	135.6	91%	0.911	82%	0.815	S	S	*	*			trans	96.6	144.2	-176.6	-60.1	175.9	23.7	0	0	113.9
188	A	53.8	Low	51.4	Low	93 Å²	93	132.5 Å²	132.5	77%	0.769	81%	0.805	S	S	*	*			cis	-145	152.2	-7	0	0	0	0	0	112.2
189	E	44.3	Very low	51.7	Low	192 Å²	192	126.8 Å²	126.8	90%	0.897	79%	0.793	S	S	*	*			trans	-41.4	123.4	147.1	178.1	175.1	116.5	0	0	114.1
190	E	51.7	Low	51.7	Low	202 Å²	202	132.7 Å²	132.7	94%	0.944	80%	0.802	S	S	*	*			trans	-147.4	153.2	145.4	-163.1	160.1	85.7	0	0	111.6
191	K	51.2	Low	51.6	Low	175 Å²	175	129 Å²	129	76%	0.761	79%	0.793	S	S	*	*			trans	-141.3	106.1	-157.9	160.9	-157.1	176.1	-176.3	0	107.7
192	N	51.3	Low	51.2	Low	164 Å²	164	128.6 Å²	128.6	88%	0.877	80%	0.797	S	S	*	*			trans	-177.1	169	150	-109	-41	0	0	0	116.8
193	A	48.2	Very low	51.1	Low	89 Å²	89	131.2 Å²	131.2	74%	0.736	80%	0.796	S	S	*	*			trans	79	105.3	156.5	0	0	0	0	0	119.1
194	A	54.2	Low	50.3	Low	92 Å²	92	132.5 Å²	132.5	76%	0.76	79%	0.792	S	S	*	*			trans	-67.7	171.1	148.7	0	0	0	0	0	110.8
195	P	56.3	Low	50.2	Low	115 Å²	115	130.6 Å²	130.6	75%	0.747	79%	0.785	S	S	*	*				-142.2	136.4	114.2	37.9	-23.9	0	0	0	113.3
196	V	56.5	Low	50.6	Low	134 Å²	134	133.4 Å²	133.4	81%	0.812	79%	0.792	S	S	*	*				85.2	129.1	100.4	173	0	0	0	0	114.7
197	A	41.5	Very low	50.4	Low	103 Å²	103	132.3 Å²	132.3	85%	0.851	79%	0.793	S	S	*	*			trans	-96.3	134.2	164.4	0	0	0	0	0	110.7
198	A	51.9	Low	50.6	Low	88 Å²	88	127.9 Å²	127.9	73%	0.727	78%	0.783	S	S	*	*			trans	-151.7	121.5	159.6	0	0	0	0	0	105.5
199	A	50.9	Low	50.4	Low	84 Å²	84	131 Å²	131	69%	0.694	79%	0.787	S	S	*	*				75.3	120.1	55.7	0	0	0	0	0	112.8
200	E	45.8	Very low	50.5	Low	195 Å²	195	125.6 Å²	125.6	91%	0.911	78%	0.783	S	S	*	*			trans	67.5	147.4	164.6	-70.2	178.9	80.6	0	0	117.9
201	A	50	Low	50.7	Low	77 Å²	77	123.8 Å²	123.8	64%	0.636	78%	0.78	S	S	*	*			cis	-158.6	152.9	-9.5	0	0	0	0	0	112.3
202	T	47	Very low	51	Low	132 Å²	132	121.5 Å²	121.5	81%	0.81	78%	0.78	S	S	*	*			trans	45.2	121.2	139.1	-52.8	0	0	0	0	121.5
203	K	51.3	Low	51.2	Low	171 Å²	171	118.9 Å²	118.9	74%	0.743	77%	0.772	S	S	*	*				-169.1	131.4	123.3	-105	171.1	171.6	-83.3	0	114.4
204	E	44.3	Very low	51.7	Low	145 Å²	145	120 Å²	120	68%	0.678	77%	0.772	S	S	*	*			trans	42	111.9	146.3	-61.9	164.6	78.2	0	0	119.3
205	S	50.7	Low	51.8	Low	114 Å²	114	121.7 Å²	121.7	80%	0.797	78%	0.778	S	S	*	*				68.4	151.4	57.5	-65.7	0	0	0	0	116.2
206	P	58.2	Low	51.8	Low	121 Å²	121	125.7 Å²	125.7	79%	0.786	78%	0.784	S	S	*	*			cis	-143.3	-166.8	-27.3	39.2	-19.3	0	0	0	115.3
207	A	48.5	Very low	51.7	Low	98 Å²	98	125.5 Å²	125.5	81%	0.81	78%	0.778	S	S	*	*			trans	78.3	149.8	165.6	0	0	0	0	0	117.6
208	S	55.9	Low	52.2	Low	101 Å²	101	128.5 Å²	128.5	71%	0.706	78%	0.775	S	S	*	*			cis	-153.5	164.5	12.7	-161	0	0	0	0	113.7
209	N	48.9	Very low	52.3	Low	159 Å²	159	131.5 Å²	131.5	85%	0.85	78%	0.778	S	S	*	*			trans	61	137.8	170.4	-61.1	-9.5	0	0	0	118.1
210	G	46.2	Very low	53.3	Low	78 Å²	78	132.7 Å²	132.7	80%	0.804	78%	0.779	S	S	*	*			cis	139.3	91.4	-4.8	0	0	0	0	0	113.6
211	N	55.5	Low	54.2	Low	165 Å²	165	128.8 Å²	128.8	88%	0.882	77%	0.77	S	S	*	*			trans	-157.2	153.7	151.1	-156.3	4.6	0	0	0	111.4
212	V	58.5	Low	54.5	Low	126 Å²	126	131.1 Å²	131.1	76%	0.764	77%	0.772	S	S	*	*			trans	-118.2	155.6	-161.2	165.3	0	0	0	0	111.4
213	P	55.9	Low	55.1	Low	110 Å²	110	132.1 Å²	132.1	71%	0.714	78%	0.779	S	S	*	*			trans	-108.3	-137.7	-164.2	44.6	-32.7	0	0	0	109.9
214	P	57.6	Low	55.2	Low	113 Å²	113	134.3 Å²	134.3	73%	0.734	78%	0.782	S	S	*	*			cis	-122.4	-174.3	-36.2	37.4	-22.1	0	0	0	112.1
215	S	57.4	Low	56	Low	126 Å²	126	132.2 Å²	132.2	88%	0.881	79%	0.79	S	S	*	*			trans	-149.2	149.6	156.8	-85.9	0	0	0	0	113.5
216	K	55.1	Low	56.4	Low	199 Å²	199	132.5 Å²	132.5	87%	0.865	79%	0.789	S	S	*	*			trans	-72.9	153.1	-170.7	-54	164.1	-178.6	175.5	0	111.8
217	N	55.3	Low	56.7	Low	130 Å²	130	136 Å²	136	70%	0.695	80%	0.795	S	S	*	*				-167.2	143.6	100.5	-129.9	16.5	0	0	0	116.4
218	E	50.9	Low	57.1	Low	167 Å²	167	139.5 Å²	139.5	78%	0.78	80%	0.8	S	S	*	*			trans	44.3	125.3	150.6	-70.7	174.8	78.6	0	0	123.6
219	N	54.7	Low	57.3	Low	150 Å²	150	137.9 Å²	137.9	80%	0.802	80%	0.8	S	S	*	*			trans	-146.8	136.5	158.2	-174	33.5	0	0	0	107.2
220	P	72	Confident	58	Low	109 Å²	109	139.4 Å²	139.4	71%	0.708	80%	0.799	S	S	*	*			trans	-130	163.3	157.4	20.2	1	0	0	0	114
221	P	63.9	Low	59.2	Low	113 Å²	113	141 Å²	141	73%	0.734	80%	0.795	S	S	*	*			trans	-126.9	-175.9	-144.6	43.9	-30.8	0	0	0	116
222	D	56.4	Low	59.6	Low	126 Å²	126	138.4 Å²	138.4	67%	0.674	79%	0.787	S	S	*	*			trans	68.5	114.4	146.5	-141.1	-81.3	0	0	0	119.7
223	T	60.2	Low	59.8	Low	154 Å²	154	140.4 Å²	140.4	95%	0.945	79%	0.793	S	S	*	*			trans	-145.2	144.3	138.6	-56	0	0	0	0	108.9
224	R	53.6	Low	60.3	Low	216 Å²	216	142.9 Å²	142.9	82%	0.815	80%	0.799	S	S	*	*			trans	-140	123.7	-151.2	163.9	-167.2	177.2	-162.7	1.1	110.2
225	A	60.8	Low	60.5	Low	102 Å²	102	149.9 Å²	149.9	84%	0.843	82%	0.822	S	S	*	*			trans	-169.9	132.2	160.8	0	0	0	0	0	112.9
226	P	58.9	Low	60.6	Low	120 Å²	120	151.1 Å²	151.1	78%	0.779	82%	0.819	S	S	*	*			trans	-123.4	140.5	165	37.3	-24.9	0	0	0	113.5
227	E	64	Low	60.9	Low	194 Å²	194	148.5 Å²	148.5	91%	0.907	82%	0.816	S	S	*	*			trans	-146.5	118.7	158.7	-66.5	-165.8	96.4	0	0	106.4
228	D	57.2	Low	61.2	Low	171 Å²	171	149.6 Å²	149.6	91%	0.914	82%	0.823	S	S	*	*				62.3	136.1	86.6	-145.6	-68.4	0	0	0	114.9
229	G	60.4	Low	61.9	Low	68 Å²	68	148.5 Å²	148.5	70%	0.701	83%	0.825	S	S	*	*			trans	148.4	72.1	-175.7	0	0	0	0	0	115.9
230	K	62.7	Low	62.3	Low	191 Å²	191	148.4 Å²	148.4	83%	0.83	83%	0.827	S	S	*	*			trans	-105	129.6	168.4	179.7	177.8	-177.2	178.4	0	111.3
231	P	71.4	Confident	61.7	Low	111 Å²	111	151.1 Å²	151.1	72%	0.721	84%	0.835	S	S	*	*			trans	-106.1	166.3	153.2	-5.7	26.6	0	0	0	112.6
232	P	64	Low	61.5	Low	111 Å²	111	153.8 Å²	153.8	72%	0.721	84%	0.842	S	S	*	*			trans	-100.7	170.6	-151.9	38.5	-37.5	0	0	0	116.1
233	L	62.6	Low	61.9	Low	168 Å²	168	155.9 Å²	155.9	88%	0.88	86%	0.855	S	S	*	*			trans	-61.3	139.2	161.1	-145.2	84.7	0	0	0	110.1
234	L	67	Low	62	Low	162 Å²	162	156.1 Å²	156.1	85%	0.848	85%	0.847	S	S	*	*			trans	-116.3	155	158.3	-106.5	157.2	0	0	0	108.5
235	Q	61.7	Low	62.8	Low	259 Å²	259	150.6 Å²	150.6	100%	1.21	85%	0.85	S	S	*	*			trans	-70.1	0	-164.2	-66	168.4	-10.9	0	0	113.8

Retrieved 235 of 235 residues in 105.7 ms (Link to these results)

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