A0A3Q0KCS4_SCHMA Loading...

Methylosome subunit pICln

AlphaFold DB , UniProt , Accession A0A3Q0KCS4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 210 aa.

Structure Viewer

Loading PAE data...

(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	38.8	Very low	58.1	Low	242 Å²	242	117.7 Å²	117.7	100%	1.192	66%	0.657	S	S	*	*				0	116.8	0	-87.3	160.4	164.8	0	0	105.7	A3	M1-A3 PolarHBondContact O-N 3.48Å
2	V	42.9	Very low	60.8	Low	141 Å²	141	109.1 Å²	109.1	86%	0.855	61%	0.607	S	S	*	*			trans	-59.6	119.6	172	-101.1	0	0	0	0	106.7	D4	V2-D4 PolarHBondContact O-N 3.21Å
3	A	47	Very low	63.3	Low	101 Å²	101	108.8 Å²	108.8	84%	0.835	60%	0.603	S	S	*	*			trans	-68.6	89.4	165.9	0	0	0	0	0	105.4	M1 A5	M1-A3 PolarHBondContact O-N 3.48Å; A3-A5 PolarHBondContact O-N 3.16Å
4	D	45.7	Very low	65.5	Low	114 Å²	114	103.5 Å²	103.5	61%	0.61	57%	0.572	S	S	*	*			trans	-62.9	92.6	168.8	-159.8	-118.2	0	0	0	105.2	V2 E6	V2-D4 PolarHBondContact O-N 3.21Å; D4-E6 PolarHBondContact O-N 3.39Å; D4-E6 WeakPolarHBondContact OD1-CB 3.44Å; D4-E6 WeakPolarHBondContact OD1-CG 3.02Å
5	A	50.8	Low	67.5	Low	99 Å²	99	100.2 Å²	100.2	82%	0.818	56%	0.559	S	S	*	*			trans	-72	41.4	173.5	0	0	0	0	0	110	A3	A3-A5 PolarHBondContact O-N 3.16Å
6	E	50.7	Low	69.1	Low	118 Å²	118	100.4 Å²	100.4	55%	0.551	56%	0.558	S	S	*	*			trans	-88.3	123.6	173.6	-61.9	-146.5	135.8	0	0	107.8	D4	D4-E6 PolarHBondContact O-N 3.39Å; D4-E6 WeakPolarHBondContact OD1-CB 3.44Å; D4-E6 WeakPolarHBondContact OD1-CG 3.02Å
7	Y	52.8	Low	70.7	Confident	198 Å²	198	94.5 Å²	94.5	78%	0.776	53%	0.525	S	S	*	.			trans	76.7	61.4	172.5	-39.9	-78.2	0	0	0	116.5	D9	Y7-D9 PolarHBondContact O-N 2.94Å
8	S	61.5	Low	72.1	Confident	55 Å²	55	91 Å²	91	39%	0.385	51%	0.509	S	S	.	.			trans	-58.5	119.2	134.8	-45.5	0	0	0	0	105.9	V10	S8-V10 VanDerWaalsContact O-CG2 3.28Å; S8-V10 WeakPolarHBondContact O-CG2 3.27Å; S8-V10 PolarHBondContact O-N 3.02Å
9	D	79.3	Confident	73.4	Confident	87 Å²	87	86.2 Å²	86.2	47%	0.465	48%	0.482	S	S	.	.			trans	-57	117.9	-177.5	-164.3	-97.8	0	0	0	108.2	Y7 H11 S34 E35	Y7-D9 PolarHBondContact O-N 2.94Å; D9-H11 PolarHBondContact O-CD2 3.15Å; D9-H11 PolarHBondContact O-N 2.87Å; D9-H11 IonicContact OD1-CD2 3.15Å; D9-H11 PolarHBondContact OD1-CD2 2.91Å; D9-H11 IonicContact OD1-NE2 3.97Å; D9-H11 PolarHBondContact OD1-NE2 3.46Å; D9-S34 VanDerWaalsContact O-CA 3.23Å; D9-S34 WeakPolarHBondContact O-CA 3.34Å; D9-S34 WeakPolarHBondContact O-CB 3.29Å; D9-E35 HydrophobicContact CB-CG 4.01Å; D9-E35 PolarHBondContact O-N 2.7Å
10	V	84.1	Confident	74.5	Confident	64 Å²	64	83.8 Å²	83.8	39%	0.388	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	99.6	-174.9	-173.5	0	0	0	0	106.6	S8 F12 L13 K32	S8-V10 VanDerWaalsContact O-CG2 3.28Å; S8-V10 WeakPolarHBondContact O-CG2 3.27Å; S8-V10 PolarHBondContact O-N 3.02Å; V10-F12 VanDerWaalsContact C-N 3.34Å; V10-L13 HydrophobicContact CG1-CB 4.3Å; V10-K32 HydrophobicContact CG1-CD 4.38Å; V10-K32 HydrophobicContact CG1-CG 3.77Å; V10-K32 HydrophobicContact CG2-CD 4.47Å
11	H	85.6	Confident	75.4	Confident	76 Å²	76	81.5 Å²	81.5	35%	0.352	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-32.8	-179.3	-80.5	-123.9	0	0	0	111.5	D9 I33 E35	D9-H11 PolarHBondContact O-CD2 3.15Å; D9-H11 PolarHBondContact O-N 2.87Å; D9-H11 IonicContact OD1-CD2 3.15Å; D9-H11 PolarHBondContact OD1-CD2 2.91Å; D9-H11 IonicContact OD1-NE2 3.97Å; D9-H11 PolarHBondContact OD1-NE2 3.46Å; H11-I33 PolarHBondContact N-O 2.89Å; H11-E35 IonicContact CE1-OE1 2.68Å; H11-E35 VanDerWaalsContact NE2-CG 3.3Å; H11-E35 WeakPolarHBondContact NE2-CG 3.23Å; H11-E35 IonicContact NE2-OE1 3.14Å; H11-E35 PolarHBondContact NE2-OE1 2.84Å; H11-E35 VanDerWaalsContact NE2-OE1 3.15Å
12	F	90.8	Very high	77.7	Confident	14 Å²	14	74.2 Å²	74.2	6%	0.061	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	141	-178.4	179.4	-92.9	0	0	0	112.2	V10 Q14 I33 D151 M152 A155	V10-F12 VanDerWaalsContact C-N 3.34Å; F12-Q14 HydrophobicContact CD1-CB 4.31Å; F12-Q14 HydrophobicContact CE1-CB 3.3Å; F12-Q14 HydrophobicContact CE1-CG 4.3Å; F12-Q14 HydrophobicContact CE2-CB 4.45Å; F12-Q14 HydrophobicContact CZ-CB 3.4Å; F12-Q14 VanDerWaalsContact CZ-CB 3.4Å; F12-Q14 HydrophobicContact CZ-CG 4.06Å; F12-I33 HydrophobicContact CB-CB 4.12Å; F12-I33 HydrophobicContact CB-CD1 4.32Å; F12-I33 HydrophobicContact CB-CG1 4.5Å; F12-I33 HydrophobicContact CD1-CD1 3.83Å; F12-I33 HydrophobicContact CD1-CG1 4.19Å; F12-I33 HydrophobicContact CG-CD1 4.39Å; F12-I33 PolarHBondContact N-O 2.87Å; F12-I33 PolarHBondContact O-N 3Å; F12-D151 HydrophobicContact CD2-CB 4.3Å; F12-D151 WeakPolarHBondContact CD2-OD1 3.49Å; F12-D151 HydrophobicContact CE2-CB 3.78Å; F12-D151 WeakPolarHBondContact CE2-OD1 3.5Å; F12-M152 HydrophobicContact CD1-CG 4.31Å; F12-M152 HydrophobicContact CE1-CB 4.21Å; F12-M152 HydrophobicContact CE1-CG 3.3Å; F12-M152 HydrophobicContact CE2-CG 4.34Å; F12-M152 HydrophobicContact CZ-CB 4.27Å; F12-M152 HydrophobicContact CZ-CG 3.3Å; F12-A155 HydrophobicContact CB-CB 3.38Å; F12-A155 HydrophobicContact CD2-CB 4.47Å; F12-A155 HydrophobicContact CG-CB 3.98Å
13	L	93.7	Very high	79.8	Confident	105 Å²	105	70.2 Å²	70.2	55%	0.55	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	120.3	178.4	-177	74.3	0	0	0	109.1	V10 T30 L31 K32	V10-L13 HydrophobicContact CG1-CB 4.3Å; L13-T30 HydrophobicContact CD1-CG2 3.62Å; L13-T30 HydrophobicContact CG-CG2 4.2Å; L13-L31 WeakPolarHBondContact CA-O 3.4Å; L13-K32 HydrophobicContact CD1-CB 3.78Å; L13-K32 HydrophobicContact CD1-CG 4.06Å
14	Q	93.7	Very high	81.9	Confident	35 Å²	35	69.1 Å²	69.1	16%	0.164	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127.2	-178.9	-177.3	58.2	56.7	0	0	111.6	F12 I17 T30 L31 Q148	F12-Q14 HydrophobicContact CD1-CB 4.31Å; F12-Q14 HydrophobicContact CE1-CB 3.3Å; F12-Q14 HydrophobicContact CE1-CG 4.3Å; F12-Q14 HydrophobicContact CE2-CB 4.45Å; F12-Q14 HydrophobicContact CZ-CB 3.4Å; F12-Q14 VanDerWaalsContact CZ-CB 3.4Å; F12-Q14 HydrophobicContact CZ-CG 4.06Å; Q14-I17 HydrophobicContact CB-CD1 3.72Å; Q14-I17 HydrophobicContact CG-CD1 3.62Å; Q14-I17 HydrophobicContact CG-CG1 3.95Å; Q14-T30 CarbonylContact O-C 3.36Å; Q14-T30 VanDerWaalsContact O-CA 3.26Å; Q14-T30 WeakPolarHBondContact O-CA 3.42Å; Q14-T30 WeakPolarHBondContact O-CG2 3.49Å; Q14-L31 PolarHBondContact N-O 2.99Å; Q14-L31 PolarHBondContact O-N 2.57Å; Q14-Q148 VanDerWaalsContact NE2-OE1 3.11Å
15	S	94.6	Very high	84.1	Confident	54 Å²	54	68.2 Å²	68.2	38%	0.378	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	168.1	176.3	58.5	0	0	0	0	111.5	I17	S15-I17 VanDerWaalsContact C-N 3.32Å; S15-I17 PolarHBondContact O-N 3.14Å
16	N	94.5	Very high	86.2	Confident	103 Å²	103	65.4 Å²	65.4	55%	0.551	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	62.7	37.2	178.4	-52.5	-82.3	0	0	0	113	G29 Q144	N16-G29 PolarHBondContact N-O 2.9Å; N16-Q144 HydrophobicContact CB-CB 4.49Å
17	I	96.1	Very high	88.3	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	141	170.6	-67.3	167.3	0	0	0	108.3	Q14 S15 T28 G29 L31 W40 L141 V142 P143 M152	Q14-I17 HydrophobicContact CB-CD1 3.72Å; Q14-I17 HydrophobicContact CG-CD1 3.62Å; Q14-I17 HydrophobicContact CG-CG1 3.95Å; S15-I17 VanDerWaalsContact C-N 3.32Å; S15-I17 PolarHBondContact O-N 3.14Å; I17-T28 CarbonylContact O-C 3.58Å; I17-T28 VanDerWaalsContact O-CA 3.32Å; I17-T28 WeakPolarHBondContact O-CA 3.17Å; I17-G29 PolarHBondContact N-O 3.19Å; I17-G29 PolarHBondContact O-N 3.22Å; I17-L31 HydrophobicContact CD1-CB 3.4Å; I17-L31 HydrophobicContact CD1-CD2 4.2Å; I17-L31 HydrophobicContact CD1-CG 4.43Å; I17-W40 HydrophobicContact CB-CH2 3.97Å; I17-W40 HydrophobicContact CB-CZ3 3.92Å; I17-W40 HydrophobicContact CG2-CH2 3.85Å; I17-W40 HydrophobicContact CG2-CZ3 3.7Å; I17-W40 WeakPolarHBondContact O-CH2 3.1Å; I17-L141 HydrophobicContact CG2-CB 3.94Å; I17-L141 HydrophobicContact CG2-CD2 3.81Å; I17-L141 HydrophobicContact CG2-CG 4.5Å; I17-V142 WeakPolarHBondContact CA-O 3.5Å; I17-P143 HydrophobicContact CG1-CB 4.32Å; I17-M152 HydrophobicContact CD1-CE 4.05Å; I17-M152 HydrophobicContact CD1-SD 4.12Å
18	S	96	Very high	90.4	Very high	32 Å²	32	53.2 Å²	53.2	22%	0.224	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.5	168.7	-57.3	0	0	0	0	109.3	Y20 V142	S18-Y20 VanDerWaalsContact CB-CE2 3.48Å; S18-V142 PolarHBondContact N-O 3.46Å; S18-V142 PolarHBondContact O-N 2.88Å
19	L	96.1	Very high	92	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120	179.3	-178.4	68.3	0	0	0	109.4	I26 D27 W40 F47 L139 L141	L19-I26 HydrophobicContact CB-CG1 4.26Å; L19-I26 HydrophobicContact CD2-CD1 3.59Å; L19-I26 HydrophobicContact CD2-CG1 3.91Å; L19-I26 HydrophobicContact CG-CD1 3.8Å; L19-I26 HydrophobicContact CG-CG1 3.78Å; L19-I26 WeakPolarHBondContact O-CG1 3.22Å; L19-I26 PolarHBondContact O-N 3.16Å; L19-D27 PolarHBondContact N-O 2.9Å; L19-D27 PolarHBondContact O-N 2.76Å; L19-W40 HydrophobicContact CB-CD2 4.49Å; L19-W40 HydrophobicContact CB-CH2 3.63Å; L19-W40 HydrophobicContact CB-CZ2 3.48Å; L19-W40 VanDerWaalsContact CB-CZ2 3.48Å; L19-W40 HydrophobicContact CB-CZ3 4.22Å; L19-W40 HydrophobicContact CD2-CD2 4.01Å; L19-W40 HydrophobicContact CD2-CG 4.23Å; L19-W40 HydrophobicContact CD2-CZ2 4.26Å; L19-W40 HydrophobicContact CG-CZ2 4.47Å; L19-F47 HydrophobicContact CD2-CE1 3.9Å; L19-F47 HydrophobicContact CD2-CZ 3.65Å; L19-L139 HydrophobicContact CD1-CB 4.16Å; L19-L139 HydrophobicContact CD1-CD1 4.14Å; L19-L139 HydrophobicContact CD1-CD2 4.33Å; L19-L139 HydrophobicContact CD1-CG 4.44Å; L19-L141 HydrophobicContact CD1-CD2 4.1Å; L19-L141 HydrophobicContact CD1-CG 4.1Å
20	Y	94.6	Very high	92.8	Very high	37 Å²	37	48.9 Å²	48.9	15%	0.145	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145	174.9	-64.5	-108.2	0	0	0	109.8	S18 S24 L25 F75 L139 R140 V142	S18-Y20 VanDerWaalsContact CB-CE2 3.48Å; Y20-S24 CarbonylContact C-O 3.6Å; Y20-S24 WeakPolarHBondContact CA-O 3.34Å; Y20-S24 WeakPolarHBondContact CB-O 3.32Å; Y20-S24 VanDerWaalsContact CD1-C 3.5Å; Y20-L25 VanDerWaalsContact CD1-CA 3.47Å; Y20-L25 HydrophobicContact CD1-CB 3.88Å; Y20-L25 HydrophobicContact CD1-CD1 4.41Å; Y20-L25 VanDerWaalsContact CD1-N 3.31Å; Y20-L25 HydrophobicContact CD2-CD1 4.07Å; Y20-L25 HydrophobicContact CE1-CB 3.56Å; Y20-L25 HydrophobicContact CE1-CD1 4.06Å; Y20-L25 HydrophobicContact CE1-CG 4.36Å; Y20-L25 HydrophobicContact CE2-CD1 3.69Å; Y20-L25 HydrophobicContact CG-CD1 4.4Å; Y20-F75 AromaticContact CD1-CE2 3.49Å; Y20-F75 HydrophobicContact CD1-CE2 3.49Å; Y20-F75 VanDerWaalsContact CD1-CE2 3.49Å; Y20-F75 AromaticContact CD1-CZ 3.58Å; Y20-F75 HydrophobicContact CD1-CZ 3.58Å; Y20-F75 HydrophobicContact CD2-CE2 4.25Å; Y20-F75 AromaticContact CD2-CZ 3.6Å; Y20-F75 HydrophobicContact CD2-CZ 3.6Å; Y20-F75 AromaticContact CE1-CE2 3.87Å; Y20-F75 HydrophobicContact CE1-CE2 3.87Å; Y20-F75 AromaticContact CE1-CZ 3.68Å; Y20-F75 HydrophobicContact CE1-CZ 3.68Å; Y20-F75 AromaticContact CE2-CZ 3.69Å; Y20-F75 HydrophobicContact CE2-CZ 3.69Å; Y20-F75 AromaticContact CG-CE2 3.72Å; Y20-F75 HydrophobicContact CG-CE2 3.72Å; Y20-F75 AromaticContact CG-CZ 3.55Å; Y20-F75 HydrophobicContact CG-CZ 3.55Å; Y20-F75 AromaticContact CZ-CZ 3.75Å; Y20-L139 CarbonylContact O-C 3.53Å; Y20-L139 WeakPolarHBondContact O-CA 3.49Å; Y20-R140 PolarHBondContact N-O 3.31Å; Y20-R140 PolarHBondContact O-N 2.85Å; Y20-V142 HydrophobicContact CD2-CB 4.45Å; Y20-V142 HydrophobicContact CD2-CG2 3.52Å; Y20-V142 HydrophobicContact CE2-CB 4.14Å; Y20-V142 HydrophobicContact CE2-CG2 3.51Å
21	E	93.2	Very high	93.4	Very high	37 Å²	37	45.8 Å²	45.8	17%	0.173	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.6	161.2	-176.5	-177.7	-118.8	0	0	107.4	S23 S24 I26 W90 L139	E21-S23 PolarHBondContact O-N 2.79Å; E21-S24 PolarHBondContact N-O 2.75Å; E21-S24 PolarHBondContact O-N 3.07Å; E21-I26 HydrophobicContact CB-CD1 4.27Å; E21-I26 HydrophobicContact CB-CG2 3.94Å; E21-W90 PolarHBondContact OE1-NE1 2.71Å; E21-L139 HydrophobicContact CB-CD2 4.11Å; E21-L139 HydrophobicContact CG-CD2 4.4Å
22	N	87.5	Confident	93.8	Very high	88 Å²	88	45.1 Å²	45.1	47%	0.471	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	-101	-170.5	-61.3	-54.9	0	0	0	112.1	V138 R140	N22-V138 PolarHBondContact N-O 3.27Å; N22-V138 VanDerWaalsContact N-O 3.1Å; N22-R140 WeakPolarHBondContact O-CD 3.34Å; N22-R140 PolarHBondContact O-NE 3.23Å
23	S	86.7	Confident	93.9	Very high	58 Å²	58	44.4 Å²	44.4	41%	0.406	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	3.3	176.8	-64.9	0	0	0	0	113.2	E21	E21-S23 PolarHBondContact O-N 2.79Å
24	S	91.1	Very high	93.8	Very high	78 Å²	78	39.5 Å²	39.5	55%	0.545	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.9	-175	-62.9	0	0	0	0	110.4	Y20 E21 I26	Y20-S24 CarbonylContact C-O 3.6Å; Y20-S24 WeakPolarHBondContact CA-O 3.34Å; Y20-S24 WeakPolarHBondContact CB-O 3.32Å; Y20-S24 VanDerWaalsContact CD1-C 3.5Å; E21-S24 PolarHBondContact N-O 2.75Å; E21-S24 PolarHBondContact O-N 3.07Å; S24-I26 PolarHBondContact O-N 3.01Å
25	L	93.5	Very high	93.7	Very high	95 Å²	95	41.4 Å²	41.4	50%	0.497	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	118.1	173.8	179	65.8	0	0	0	108.8	Y20 D27 T28	Y20-L25 VanDerWaalsContact CD1-CA 3.47Å; Y20-L25 HydrophobicContact CD1-CB 3.88Å; Y20-L25 HydrophobicContact CD1-CD1 4.41Å; Y20-L25 VanDerWaalsContact CD1-N 3.31Å; Y20-L25 HydrophobicContact CD2-CD1 4.07Å; Y20-L25 HydrophobicContact CE1-CB 3.56Å; Y20-L25 HydrophobicContact CE1-CD1 4.06Å; Y20-L25 HydrophobicContact CE1-CG 4.36Å; Y20-L25 HydrophobicContact CE2-CD1 3.69Å; Y20-L25 HydrophobicContact CG-CD1 4.4Å; L25-D27 WeakPolarHBondContact CD1-O 3.21Å; L25-T28 HydrophobicContact CD1-CG2 4.13Å; L25-T28 HydrophobicContact CD2-CG2 4.47Å
26	I	94.5	Very high	93.3	Very high	39 Å²	39	44.8 Å²	44.8	20%	0.2	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-29.2	-179	59.7	164.1	0	0	0	113	L19 E21 S24 W90 L139	L19-I26 HydrophobicContact CB-CG1 4.26Å; L19-I26 HydrophobicContact CD2-CD1 3.59Å; L19-I26 HydrophobicContact CD2-CG1 3.91Å; L19-I26 HydrophobicContact CG-CD1 3.8Å; L19-I26 HydrophobicContact CG-CG1 3.78Å; L19-I26 WeakPolarHBondContact O-CG1 3.22Å; L19-I26 PolarHBondContact O-N 3.16Å; E21-I26 HydrophobicContact CB-CD1 4.27Å; E21-I26 HydrophobicContact CB-CG2 3.94Å; S24-I26 PolarHBondContact O-N 3.01Å; I26-W90 HydrophobicContact CD1-CB 4.42Å; I26-W90 HydrophobicContact CD1-CG 4.04Å; I26-L139 HydrophobicContact CD1-CD2 4.1Å
27	D	95.3	Very high	93	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.032	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	168.3	175.7	-155.3	-1.3	0	0	0	112	L19 L25 W40 G42 T43 S44 K45	L19-D27 PolarHBondContact N-O 2.9Å; L19-D27 PolarHBondContact O-N 2.76Å; L25-D27 WeakPolarHBondContact CD1-O 3.21Å; D27-W40 HydrophobicContact CB-CZ2 4.22Å; D27-W40 PolarHBondContact OD2-NE1 3.09Å; D27-G42 VanDerWaalsContact OD2-CA 3.26Å; D27-G42 WeakPolarHBondContact OD2-CA 3.46Å; D27-T43 PolarHBondContact OD1-N 2.74Å; D27-T43 VanDerWaalsContact OD1-N 3.13Å; D27-T43 PolarHBondContact OD1-OG1 3.06Å; D27-T43 PolarHBondContact OD2-N 2.6Å; D27-S44 PolarHBondContact OD1-N 3.5Å; D27-S44 PolarHBondContact OD2-N 2.87Å; D27-K45 HydrophobicContact CB-CD 4.33Å; D27-K45 HydrophobicContact CB-CG 4.49Å; D27-K45 WeakPolarHBondContact OD2-CA 3.15Å; D27-K45 WeakPolarHBondContact OD2-CB 3.17Å; D27-K45 PolarHBondContact OD2-N 2.85Å
28	T	96.3	Very high	92.8	Very high	55 Å²	55	41 Å²	41	34%	0.337	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142	169.2	59.2	0	0	0	0	109	I17 L25 G42 T43	I17-T28 CarbonylContact O-C 3.58Å; I17-T28 VanDerWaalsContact O-CA 3.32Å; I17-T28 WeakPolarHBondContact O-CA 3.17Å; L25-T28 HydrophobicContact CD1-CG2 4.13Å; L25-T28 HydrophobicContact CD2-CG2 4.47Å; T28-G42 CarbonylContact O-C 3.51Å; T28-G42 WeakPolarHBondContact O-CA 3.4Å; T28-T43 WeakPolarHBondContact O-CG2 3.46Å; T28-T43 PolarHBondContact O-N 2.82Å
29	G	95.7	Very high	92.7	Very high	12 Å²	12	40.6 Å²	40.6	12%	0.124	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	-160.4	-164.8	0	0	0	0	0	116.5	N16 I17 E41	N16-G29 PolarHBondContact N-O 2.9Å; I17-G29 PolarHBondContact N-O 3.19Å; I17-G29 PolarHBondContact O-N 3.22Å; G29-E41 CarbonylContact C-O 3.54Å; G29-E41 WeakPolarHBondContact CA-O 3.39Å
30	T	95.7	Very high	92.7	Very high	38 Å²	38	40.6 Å²	40.6	23%	0.233	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127	176.3	-55.7	0	0	0	0	109.2	L13 Q14 E41	L13-T30 HydrophobicContact CD1-CG2 3.62Å; L13-T30 HydrophobicContact CG-CG2 4.2Å; Q14-T30 CarbonylContact O-C 3.36Å; Q14-T30 VanDerWaalsContact O-CA 3.26Å; Q14-T30 WeakPolarHBondContact O-CA 3.42Å; Q14-T30 WeakPolarHBondContact O-CG2 3.49Å; T30-E41 PolarHBondContact N-O 2.61Å; T30-E41 PolarHBondContact O-N 3.4Å
31	L	95.2	Very high	92.6	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	133.2	167.5	175.6	61.8	0	0	0	109.2	L13 Q14 I17 I33 F38 W40 L141 M152	L13-L31 WeakPolarHBondContact CA-O 3.4Å; Q14-L31 PolarHBondContact N-O 2.99Å; Q14-L31 PolarHBondContact O-N 2.57Å; I17-L31 HydrophobicContact CD1-CB 3.4Å; I17-L31 HydrophobicContact CD1-CD2 4.2Å; I17-L31 HydrophobicContact CD1-CG 4.43Å; L31-I33 HydrophobicContact CD1-CG1 4.33Å; L31-I33 HydrophobicContact CD2-CD1 4.03Å; L31-I33 HydrophobicContact CD2-CG1 4.07Å; L31-I33 HydrophobicContact CG-CG1 4.06Å; L31-F38 HydrophobicContact CD1-CD1 4.22Å; L31-F38 HydrophobicContact CD1-CD2 3.46Å; L31-F38 VanDerWaalsContact CD1-CD2 3.46Å; L31-F38 HydrophobicContact CD1-CE1 3.93Å; L31-F38 HydrophobicContact CD1-CE2 3.13Å; L31-F38 HydrophobicContact CD1-CG 4.01Å; L31-F38 HydrophobicContact CD1-CZ 3.4Å; L31-F38 VanDerWaalsContact CD1-CZ 3.4Å; L31-F38 HydrophobicContact CD2-CE2 4.08Å; L31-F38 HydrophobicContact CG-CE2 4.24Å; L31-W40 HydrophobicContact CB-CE3 4.38Å; L31-W40 HydrophobicContact CB-CZ3 4.34Å; L31-L141 HydrophobicContact CB-CD2 4.48Å; L31-L141 HydrophobicContact CD1-CD2 4.34Å; L31-L141 HydrophobicContact CD2-CD2 4.03Å; L31-M152 HydrophobicContact CD2-CE 3.82Å
32	K	94.2	Very high	92.6	Very high	61 Å²	61	42.4 Å²	42.4	27%	0.265	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.8	170.6	179.4	-175.5	175.3	-178	0	109	V10 L13 T39	V10-K32 HydrophobicContact CG1-CD 4.38Å; V10-K32 HydrophobicContact CG1-CG 3.77Å; V10-K32 HydrophobicContact CG2-CD 4.47Å; L13-K32 HydrophobicContact CD1-CB 3.78Å; L13-K32 HydrophobicContact CD1-CG 4.06Å; K32-T39 PolarHBondContact N-O 3.32Å; K32-T39 PolarHBondContact O-N 3.44Å
33	I	93.8	Very high	92.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121	174.8	-56.5	175.6	0	0	0	106.7	H11 F12 L31 Y51 A155 L156 C159	H11-I33 PolarHBondContact N-O 2.89Å; F12-I33 HydrophobicContact CB-CB 4.12Å; F12-I33 HydrophobicContact CB-CD1 4.32Å; F12-I33 HydrophobicContact CB-CG1 4.5Å; F12-I33 HydrophobicContact CD1-CD1 3.83Å; F12-I33 HydrophobicContact CD1-CG1 4.19Å; F12-I33 HydrophobicContact CG-CD1 4.39Å; F12-I33 PolarHBondContact N-O 2.87Å; F12-I33 PolarHBondContact O-N 3Å; L31-I33 HydrophobicContact CD1-CG1 4.33Å; L31-I33 HydrophobicContact CD2-CD1 4.03Å; L31-I33 HydrophobicContact CD2-CG1 4.07Å; L31-I33 HydrophobicContact CG-CG1 4.06Å; I33-Y51 WeakPolarHBondContact CG2-OH 3.18Å; I33-A155 HydrophobicContact CB-CB 4.49Å; I33-A155 HydrophobicContact CD1-CB 3.91Å; I33-A155 HydrophobicContact CG2-CB 4.28Å; I33-L156 HydrophobicContact CD1-CB 4.15Å; I33-L156 HydrophobicContact CD1-CD1 4.34Å; I33-C159 HydrophobicContact CG2-CB 4.27Å
34	S	92.2	Very high	93	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	168.4	178.4	65.5	0	0	0	0	110.5	D9 E36 C37 Y51	D9-S34 VanDerWaalsContact O-CA 3.23Å; D9-S34 WeakPolarHBondContact O-CA 3.34Å; D9-S34 WeakPolarHBondContact O-CB 3.29Å; S34-E36 PolarHBondContact O-N 3.31Å; S34-E36 VanDerWaalsContact O-N 3.08Å; S34-C37 PolarHBondContact N-O 3.41Å; S34-C37 PolarHBondContact O-N 2.86Å; S34-C37 PolarHBondContact OG-N 2.76Å; S34-C37 PolarHBondContact OG-O 2.94Å; S34-Y51 WeakPolarHBondContact O-CE2 3.32Å; S34-Y51 VanDerWaalsContact O-CZ 3.28Å; S34-Y51 PolarHBondContact O-OH 2.84Å
35	E	90.9	Very high	93.1	Very high	74 Å²	74	44 Å²	44	35%	0.346	25%	0.247	S	C	.	.	S	Bend	trans	-56.8	-27.3	179.8	-69.6	-175.9	156.7	0	0	114.4	D9 H11 Y51 L162 N163	D9-E35 HydrophobicContact CB-CG 4.01Å; D9-E35 PolarHBondContact O-N 2.7Å; H11-E35 IonicContact CE1-OE1 2.68Å; H11-E35 VanDerWaalsContact NE2-CG 3.3Å; H11-E35 WeakPolarHBondContact NE2-CG 3.23Å; H11-E35 IonicContact NE2-OE1 3.14Å; H11-E35 PolarHBondContact NE2-OE1 2.84Å; H11-E35 VanDerWaalsContact NE2-OE1 3.15Å; E35-Y51 VanDerWaalsContact O-CE2 3.31Å; E35-Y51 WeakPolarHBondContact O-CE2 3.1Å; E35-L162 HydrophobicContact CG-CD1 4.13Å; E35-N163 PolarHBondContact O-ND2 3.47Å
36	E	86.3	Confident	93	Very high	125 Å²	125	46 Å²	46	58%	0.584	25%	0.254	S	S	*	.	S	Bend	trans	-100.3	-31.1	-174.1	-62.7	-71.6	134	0	0	113.1	S34 Y51	S34-E36 PolarHBondContact O-N 3.31Å; S34-E36 VanDerWaalsContact O-N 3.08Å; E36-Y51 VanDerWaalsContact C-CE2 3.42Å; E36-Y51 WeakPolarHBondContact O-CD2 3.36Å
37	C	88.9	Confident	93	Very high	21 Å²	21	44.8 Å²	44.8	14%	0.142	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	160.1	-176.1	64.1	0	0	0	0	114.5	S34 T39 F48 I49 Y51	S34-C37 PolarHBondContact N-O 3.41Å; S34-C37 PolarHBondContact O-N 2.86Å; S34-C37 PolarHBondContact OG-N 2.76Å; S34-C37 PolarHBondContact OG-O 2.94Å; C37-T39 PolarHBondContact SG-OG1 3.33Å; C37-F48 HydrophobicContact CB-CB 4.5Å; C37-I49 WeakPolarHBondContact CB-O 3.49Å; C37-Y51 VanDerWaalsContact N-CE2 3.34Å; C37-Y51 PolarHBondContact O-OH 2.86Å
38	F	91.1	Very high	92.9	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.7	161.2	170.7	-75.5	0	0	0	108.6	L31 W40 F47 F48 I49 I54 L141 L156	L31-F38 HydrophobicContact CD1-CD1 4.22Å; L31-F38 HydrophobicContact CD1-CD2 3.46Å; L31-F38 VanDerWaalsContact CD1-CD2 3.46Å; L31-F38 HydrophobicContact CD1-CE1 3.93Å; L31-F38 HydrophobicContact CD1-CE2 3.13Å; L31-F38 HydrophobicContact CD1-CG 4.01Å; L31-F38 HydrophobicContact CD1-CZ 3.4Å; L31-F38 VanDerWaalsContact CD1-CZ 3.4Å; L31-F38 HydrophobicContact CD2-CE2 4.08Å; L31-F38 HydrophobicContact CG-CE2 4.24Å; F38-W40 HydrophobicContact CE1-CB 4.31Å; F38-F47 HydrophobicContact CE1-CE2 4.07Å; F38-F48 CarbonylContact O-C 3.43Å; F38-F48 WeakPolarHBondContact O-CA 3.44Å; F38-I49 HydrophobicContact CB-CB 4.29Å; F38-I49 WeakPolarHBondContact CB-O 3.42Å; F38-I49 HydrophobicContact CD1-CB 4.1Å; F38-I49 HydrophobicContact CD1-CD1 3.85Å; F38-I49 HydrophobicContact CD1-CG1 4.23Å; F38-I49 HydrophobicContact CE1-CD1 3.92Å; F38-I49 PolarHBondContact N-O 3.3Å; F38-I49 PolarHBondContact O-N 2.92Å; F38-I54 HydrophobicContact CB-CD1 4.31Å; F38-L141 HydrophobicContact CE2-CD1 3.72Å; F38-L141 HydrophobicContact CE2-CD2 4.13Å; F38-L141 HydrophobicContact CZ-CD1 3.97Å; F38-L141 HydrophobicContact CZ-CD2 3.86Å; F38-L141 HydrophobicContact CZ-CG 4.42Å; F38-L156 HydrophobicContact CD2-CD1 4.05Å
39	T	93.6	Very high	92.7	Very high	24 Å²	24	48 Å²	48	15%	0.147	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131	178.4	-61.5	0	0	0	0	110.6	K32 C37 E41	K32-T39 PolarHBondContact N-O 3.32Å; K32-T39 PolarHBondContact O-N 3.44Å; C37-T39 PolarHBondContact SG-OG1 3.33Å; T39-E41 HydrophobicContact CG2-CG 4.26Å
40	W	95.5	Very high	92.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.9	175.2	-178.8	-100.6	0	0	0	110.4	I17 L19 D27 L31 F38 Q46 F47 L141	I17-W40 HydrophobicContact CB-CH2 3.97Å; I17-W40 HydrophobicContact CB-CZ3 3.92Å; I17-W40 HydrophobicContact CG2-CH2 3.85Å; I17-W40 HydrophobicContact CG2-CZ3 3.7Å; I17-W40 WeakPolarHBondContact O-CH2 3.1Å; L19-W40 HydrophobicContact CB-CD2 4.49Å; L19-W40 HydrophobicContact CB-CH2 3.63Å; L19-W40 HydrophobicContact CB-CZ2 3.48Å; L19-W40 VanDerWaalsContact CB-CZ2 3.48Å; L19-W40 HydrophobicContact CB-CZ3 4.22Å; L19-W40 HydrophobicContact CD2-CD2 4.01Å; L19-W40 HydrophobicContact CD2-CG 4.23Å; L19-W40 HydrophobicContact CD2-CZ2 4.26Å; L19-W40 HydrophobicContact CG-CZ2 4.47Å; D27-W40 HydrophobicContact CB-CZ2 4.22Å; D27-W40 PolarHBondContact OD2-NE1 3.09Å; L31-W40 HydrophobicContact CB-CE3 4.38Å; L31-W40 HydrophobicContact CB-CZ3 4.34Å; F38-W40 HydrophobicContact CE1-CB 4.31Å; W40-Q46 VanDerWaalsContact O-CA 3.28Å; W40-Q46 WeakPolarHBondContact O-CA 3.43Å; W40-Q46 WeakPolarHBondContact O-CG 3.43Å; W40-F47 HydrophobicContact CB-CD1 4.05Å; W40-F47 HydrophobicContact CB-CD2 4.2Å; W40-F47 HydrophobicContact CB-CE1 3.64Å; W40-F47 HydrophobicContact CB-CE2 3.81Å; W40-F47 HydrophobicContact CB-CG 4.32Å; W40-F47 HydrophobicContact CB-CZ 3.51Å; W40-F47 AromaticContact CD1-CD1 3.93Å; W40-F47 AromaticContact CD1-CE1 3.34Å; W40-F47 AromaticContact CD1-CZ 3.94Å; W40-F47 HydrophobicContact CG-CD1 4.31Å; W40-F47 AromaticContact CG-CE1 3.61Å; W40-F47 HydrophobicContact CG-CE1 3.61Å; W40-F47 AromaticContact CG-CZ 3.74Å; W40-F47 HydrophobicContact CG-CZ 3.74Å; W40-F47 PolarHBondContact N-O 2.88Å; W40-F47 PolarHBondContact O-N 3.1Å; W40-F47 VanDerWaalsContact O-N 3.12Å; W40-L141 HydrophobicContact CE3-CD2 4.14Å; W40-L141 HydrophobicContact CZ3-CD2 3.82Å
41	E	94.2	Very high	92.3	Very high	87 Å²	87	48 Å²	48	41%	0.407	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	90.5	172.7	-62	-170.3	118.1	0	0	109.2	G29 T30 T39 Q46	G29-E41 CarbonylContact C-O 3.54Å; G29-E41 WeakPolarHBondContact CA-O 3.39Å; T30-E41 PolarHBondContact N-O 2.61Å; T30-E41 PolarHBondContact O-N 3.4Å; T39-E41 HydrophobicContact CG2-CG 4.26Å; E41-Q46 HydrophobicContact CG-CG 4.29Å; E41-Q46 PolarHBondContact OE1-NE2 3.28Å; E41-Q46 VanDerWaalsContact OE1-NE2 3.08Å
42	G	92.7	Very high	92.1	Very high	26 Å²	26	52.2 Å²	52.2	27%	0.268	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-177.9	-177.8	0	0	0	0	0	114.9	D27 T28 S44 K45	D27-G42 VanDerWaalsContact OD2-CA 3.26Å; D27-G42 WeakPolarHBondContact OD2-CA 3.46Å; T28-G42 CarbonylContact O-C 3.51Å; T28-G42 WeakPolarHBondContact O-CA 3.4Å; G42-S44 VanDerWaalsContact C-N 3.33Å; G42-K45 WeakPolarHBondContact CA-O 3.47Å; G42-K45 PolarHBondContact N-O 2.95Å
43	T	92.2	Very high	91.9	Very high	108 Å²	108	51.6 Å²	51.6	66%	0.663	28%	0.281	S	S	*	.	S	Bend	trans	-70.4	-33.7	177.1	57.7	0	0	0	0	112.4	D27 T28	D27-T43 PolarHBondContact OD1-N 2.74Å; D27-T43 VanDerWaalsContact OD1-N 3.13Å; D27-T43 PolarHBondContact OD1-OG1 3.06Å; D27-T43 PolarHBondContact OD2-N 2.6Å; T28-T43 WeakPolarHBondContact O-CG2 3.46Å; T28-T43 PolarHBondContact O-N 2.82Å
44	S	90.7	Very high	91.8	Very high	101 Å²	101	52.1 Å²	52.1	71%	0.706	28%	0.283	S	S	*	.	S	Bend	trans	-119.2	-24.1	-174	-56.1	0	0	0	0	112.7	D27 G42	D27-S44 PolarHBondContact OD1-N 3.5Å; D27-S44 PolarHBondContact OD2-N 2.87Å; G42-S44 VanDerWaalsContact C-N 3.33Å
45	K	91.7	Very high	91.7	Very high	47 Å²	47	55.5 Å²	55.5	20%	0.204	30%	0.304	C	S	.	.			trans	-130.3	142.3	-172.4	-55.2	178.9	-179.7	-69.8	0	110.4	D27 G42 F47 W90	D27-K45 HydrophobicContact CB-CD 4.33Å; D27-K45 HydrophobicContact CB-CG 4.49Å; D27-K45 WeakPolarHBondContact OD2-CA 3.15Å; D27-K45 WeakPolarHBondContact OD2-CB 3.17Å; D27-K45 PolarHBondContact OD2-N 2.85Å; G42-K45 WeakPolarHBondContact CA-O 3.47Å; G42-K45 PolarHBondContact N-O 2.95Å; K45-F47 HydrophobicContact CB-CD1 4.3Å; K45-F47 HydrophobicContact CB-CE1 4.4Å; K45-W90 HydrophobicContact CD-CB 4.13Å; K45-W90 WeakPolarHBondContact CD-O 3.32Å; K45-W90 WeakPolarHBondContact CE-O 3.49Å; K45-W90 PolarHBondContact NZ-O 3.49Å
46	Q	93.1	Very high	91.8	Very high	138 Å²	138	55.5 Å²	55.5	65%	0.645	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.9	170.1	-175.5	176.5	18.6	0	0	108.6	W40 E41	W40-Q46 VanDerWaalsContact O-CA 3.28Å; W40-Q46 WeakPolarHBondContact O-CA 3.43Å; W40-Q46 WeakPolarHBondContact O-CG 3.43Å; E41-Q46 HydrophobicContact CG-CG 4.29Å; E41-Q46 PolarHBondContact OE1-NE2 3.28Å; E41-Q46 VanDerWaalsContact OE1-NE2 3.08Å
47	F	94.2	Very high	92.1	Very high	13 Å²	13	50.9 Å²	50.9	6%	0.057	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	165.2	-178	60.7	-91.4	0	0	0	110.5	L19 F38 W40 K45 I49 V89 W90	L19-F47 HydrophobicContact CD2-CE1 3.9Å; L19-F47 HydrophobicContact CD2-CZ 3.65Å; F38-F47 HydrophobicContact CE1-CE2 4.07Å; W40-F47 HydrophobicContact CB-CD1 4.05Å; W40-F47 HydrophobicContact CB-CD2 4.2Å; W40-F47 HydrophobicContact CB-CE1 3.64Å; W40-F47 HydrophobicContact CB-CE2 3.81Å; W40-F47 HydrophobicContact CB-CG 4.32Å; W40-F47 HydrophobicContact CB-CZ 3.51Å; W40-F47 AromaticContact CD1-CD1 3.93Å; W40-F47 AromaticContact CD1-CE1 3.34Å; W40-F47 AromaticContact CD1-CZ 3.94Å; W40-F47 HydrophobicContact CG-CD1 4.31Å; W40-F47 AromaticContact CG-CE1 3.61Å; W40-F47 HydrophobicContact CG-CE1 3.61Å; W40-F47 AromaticContact CG-CZ 3.74Å; W40-F47 HydrophobicContact CG-CZ 3.74Å; W40-F47 PolarHBondContact N-O 2.88Å; W40-F47 PolarHBondContact O-N 3.1Å; W40-F47 VanDerWaalsContact O-N 3.12Å; K45-F47 HydrophobicContact CB-CD1 4.3Å; K45-F47 HydrophobicContact CB-CE1 4.4Å; F47-I49 HydrophobicContact CD2-CD1 4.07Å; F47-I49 HydrophobicContact CD2-CG1 3.95Å; F47-I49 HydrophobicContact CE2-CD1 3.58Å; F47-I49 HydrophobicContact CE2-CG1 4Å; F47-V89 HydrophobicContact CB-CB 4.29Å; F47-V89 HydrophobicContact CB-CG2 3.82Å; F47-V89 HydrophobicContact CD2-CG2 3.67Å; F47-V89 HydrophobicContact CG-CG2 3.93Å; F47-W90 HydrophobicContact CD1-CB 3.81Å; F47-W90 HydrophobicContact CE1-CB 3.58Å; F47-W90 HydrophobicContact CE2-CE3 4.15Å; F47-W90 HydrophobicContact CG-CB 4.47Å; F47-W90 HydrophobicContact CZ-CB 4.07Å; F47-W90 HydrophobicContact CZ-CE3 4.35Å
48	F	92.3	Very high	92.3	Very high	130 Å²	130	51.6 Å²	51.6	57%	0.57	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.6	172.1	64.6	-87.1	0	0	0	109.9	C37 F38	C37-F48 HydrophobicContact CB-CB 4.5Å; F38-F48 CarbonylContact O-C 3.43Å; F38-F48 WeakPolarHBondContact O-CA 3.44Å
49	I	92.8	Very high	92.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	112.4	179.9	-61.7	165.7	0	0	0	106.8	C37 F38 F47 Q53 I54 I84 V89 W90 L139	C37-I49 WeakPolarHBondContact CB-O 3.49Å; F38-I49 HydrophobicContact CB-CB 4.29Å; F38-I49 WeakPolarHBondContact CB-O 3.42Å; F38-I49 HydrophobicContact CD1-CB 4.1Å; F38-I49 HydrophobicContact CD1-CD1 3.85Å; F38-I49 HydrophobicContact CD1-CG1 4.23Å; F38-I49 HydrophobicContact CE1-CD1 3.92Å; F38-I49 PolarHBondContact N-O 3.3Å; F38-I49 PolarHBondContact O-N 2.92Å; F47-I49 HydrophobicContact CD2-CD1 4.07Å; F47-I49 HydrophobicContact CD2-CG1 3.95Å; F47-I49 HydrophobicContact CE2-CD1 3.58Å; F47-I49 HydrophobicContact CE2-CG1 4Å; I49-Q53 HydrophobicContact CG2-CB 3.94Å; I49-I54 HydrophobicContact CG2-CD1 4.31Å; I49-I54 HydrophobicContact CG2-CG1 3.82Å; I49-I84 HydrophobicContact CD1-CD1 3.44Å; I49-I84 VanDerWaalsContact CD1-CD1 3.44Å; I49-I84 HydrophobicContact CD1-CG1 4.18Å; I49-I84 HydrophobicContact CG2-CG1 4.33Å; I49-I84 HydrophobicContact CG2-CG2 4.24Å; I49-V89 HydrophobicContact CG1-CG2 4.3Å; I49-W90 HydrophobicContact CD1-CZ3 4.12Å; I49-L139 HydrophobicContact CD1-CD1 4.13Å
50	P	92.1	Very high	92.3	Very high	40 Å²	40	53.9 Å²	53.9	26%	0.26	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	150.8	169.9	-22.4	34.5	0	0	0	111.9	S52 Q53	P50-S52 PolarHBondContact O-N 2.78Å; P50-Q53 VanDerWaalsContact CD-OE1 3.3Å; P50-Q53 WeakPolarHBondContact O-CB 3.35Å; P50-Q53 PolarHBondContact O-N 2.85Å
51	Y	91.7	Very high	91.8	Very high	10 Å²	10	61.5 Å²	61.5	4%	0.039	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-62.3	-30.8	-179.7	-67.8	-61.7	0	0	0	114	I33 S34 E35 E36 C37 Q53 I54 L156 C159 Q160 N163	I33-Y51 WeakPolarHBondContact CG2-OH 3.18Å; S34-Y51 WeakPolarHBondContact O-CE2 3.32Å; S34-Y51 VanDerWaalsContact O-CZ 3.28Å; S34-Y51 PolarHBondContact O-OH 2.84Å; E35-Y51 VanDerWaalsContact O-CE2 3.31Å; E35-Y51 WeakPolarHBondContact O-CE2 3.1Å; E36-Y51 VanDerWaalsContact C-CE2 3.42Å; E36-Y51 WeakPolarHBondContact O-CD2 3.36Å; C37-Y51 VanDerWaalsContact N-CE2 3.34Å; C37-Y51 PolarHBondContact O-OH 2.86Å; Y51-Q53 PolarHBondContact O-N 2.86Å; Y51-Q53 VanDerWaalsContact O-N 3.16Å; Y51-I54 HydrophobicContact CD1-CD1 4.15Å; Y51-I54 PolarHBondContact O-N 2.94Å; Y51-L156 HydrophobicContact CE1-CD1 3.82Å; Y51-C159 HydrophobicContact CD2-CB 4.5Å; Y51-C159 HydrophobicContact CE1-CB 3.94Å; Y51-C159 HydrophobicContact CE2-CB 3.62Å; Y51-C159 WeakPolarHBondContact OH-CB 3.47Å; Y51-Q160 HydrophobicContact CD1-CB 4.49Å; Y51-Q160 HydrophobicContact CD1-CG 3.46Å; Y51-Q160 VanDerWaalsContact CD1-CG 3.46Å; Y51-Q160 HydrophobicContact CE1-CG 4.2Å; Y51-Q160 HydrophobicContact CG-CG 4.05Å; Y51-N163 HydrophobicContact CD2-CB 4.25Å; Y51-N163 VanDerWaalsContact CD2-ND2 3.34Å; Y51-N163 WeakPolarHBondContact CD2-ND2 3.5Å
52	S	89.6	Confident	90.7	Very high	87 Å²	87	62.2 Å²	62.2	61%	0.608	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-60.1	-22	174.4	55.7	0	0	0	0	113.8	P50	P50-S52 PolarHBondContact O-N 2.78Å
53	Q	90.1	Very high	89.4	Confident	48 Å²	48	63.5 Å²	63.5	22%	0.224	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-85.9	-17.1	175.4	-65.2	-168.9	-48.5	0	0	112.7	I49 P50 Y51 T55 I84 D85	I49-Q53 HydrophobicContact CG2-CB 3.94Å; P50-Q53 VanDerWaalsContact CD-OE1 3.3Å; P50-Q53 WeakPolarHBondContact O-CB 3.35Å; P50-Q53 PolarHBondContact O-N 2.85Å; Y51-Q53 PolarHBondContact O-N 2.86Å; Y51-Q53 VanDerWaalsContact O-N 3.16Å; Q53-T55 PolarHBondContact O-N 2.79Å; Q53-I84 HydrophobicContact CB-CG2 4.12Å; Q53-I84 CarbonylContact O-C 3.57Å; Q53-I84 VanDerWaalsContact O-CA 3.27Å; Q53-I84 WeakPolarHBondContact O-CA 3.27Å; Q53-D85 WeakPolarHBondContact CB-O 3.45Å; Q53-D85 PolarHBondContact O-N 2.9Å
54	I	92.1	Very high	88	Confident	11 Å²	11	62.5 Å²	62.5	6%	0.056	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	105.6	-177.2	-57.4	176.5	0	0	0	109	F38 I49 Y51 V82 M83 L156 Q160	F38-I54 HydrophobicContact CB-CD1 4.31Å; I49-I54 HydrophobicContact CG2-CD1 4.31Å; I49-I54 HydrophobicContact CG2-CG1 3.82Å; Y51-I54 HydrophobicContact CD1-CD1 4.15Å; Y51-I54 PolarHBondContact O-N 2.94Å; I54-V82 HydrophobicContact CB-CG1 4.48Å; I54-V82 HydrophobicContact CD1-CG1 4.14Å; I54-V82 HydrophobicContact CG1-CG1 4.12Å; I54-V82 HydrophobicContact CG2-CG1 3.61Å; I54-M83 WeakPolarHBondContact CA-O 3.46Å; I54-L156 HydrophobicContact CD1-CD1 4.07Å; I54-Q160 VanDerWaalsContact CB-NE2 3.28Å
55	T	91	Very high	86.5	Confident	74 Å²	74	61.6 Å²	61.6	45%	0.454	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-26.1	-179.7	49.2	0	0	0	0	113.2	Q53 M83 D85	Q53-T55 PolarHBondContact O-N 2.79Å; T55-M83 PolarHBondContact N-O 2.83Å; T55-M83 WeakPolarHBondContact OG1-CE 3.36Å; T55-M83 WeakPolarHBondContact OG1-CG 3.4Å; T55-M83 PolarHBondContact OG1-O 2.91Å; T55-D85 HydrophobicContact CG2-CB 3.69Å
56	L	92.2	Very high	84.8	Confident	73 Å²	73	68.8 Å²	68.8	38%	0.382	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	143.4	178.8	-180	144.2	0	0	0	111.1	A58 L81 V82 M83	L56-A58 HydrophobicContact CD2-CB 4.24Å; L56-L81 HydrophobicContact CD2-CD2 4.07Å; L56-V82 CarbonylContact O-C 3.6Å; L56-V82 WeakPolarHBondContact O-CA 3.32Å; L56-M83 HydrophobicContact CB-CB 3.93Å; L56-M83 HydrophobicContact CB-CE 3.9Å; L56-M83 PolarHBondContact O-N 2.85Å
57	H	92.3	Very high	83.3	Confident	29 Å²	29	66.3 Å²	66.3	13%	0.134	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.5	165.6	61.8	-84	0	0	0	111	L81 Y153 L156 Q160	H57-L81 CarbonylContact C-O 3.55Å; H57-L81 WeakPolarHBondContact CA-O 3.37Å; H57-Y153 AromaticContact CD2-CD2 3.63Å; H57-Y153 AromaticContact CD2-CE2 3.39Å; H57-Y153 WeakPolarHBondContact CD2-CE2 3.47Å; H57-Y153 AromaticContact NE2-CE2 3.81Å; H57-L156 HydrophobicContact CB-CD2 3.48Å; H57-L156 VanDerWaalsContact CB-CD2 3.48Å; H57-Q160 PolarHBondContact CE1-OE1 3.43Å; H57-Q160 PolarHBondContact ND1-NE2 3.34Å; H57-Q160 PolarHBondContact ND1-OE1 3.39Å
58	A	94.2	Very high	81.5	Confident	36 Å²	36	69.6 Å²	69.6	30%	0.298	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	148.2	-177.5	0	0	0	0	0	112.4	L56 L81	L56-A58 HydrophobicContact CD2-CB 4.24Å; A58-L81 PolarHBondContact N-O 3.49Å; A58-L81 WeakPolarHBondContact O-CB 3.27Å; A58-L81 PolarHBondContact O-N 2.94Å
59	I	93.5	Very high	80	Confident	42 Å²	42	69.5 Å²	69.5	22%	0.215	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.6	172.3	-61.5	161.2	0	0	0	109.6	R61 L80 L149 E150 Y153	I59-R61 HydrophobicContact CG2-CG 3.69Å; I59-L80 HydrophobicContact CG1-CD1 4.19Å; I59-L149 HydrophobicContact CG2-CB 4.29Å; I59-L149 HydrophobicContact CG2-CD1 4.3Å; I59-E150 WeakPolarHBondContact CD1-OE1 3.39Å; I59-Y153 VanDerWaalsContact CD1-CB 3.47Å; I59-Y153 HydrophobicContact CD1-CD1 4.18Å; I59-Y153 HydrophobicContact CD1-CD2 4.02Å; I59-Y153 HydrophobicContact CD1-CG 3.62Å; I59-Y153 HydrophobicContact CG1-CD2 3.81Å; I59-Y153 HydrophobicContact CG1-CG 3.88Å
60	A	90.8	Very high	78.2	Confident	32 Å²	32	75.9 Å²	75.9	26%	0.264	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	110.7	171.7	0	0	0	0	0	109.8	P78 H79	A60-P78 CarbonylContact O-C 3.53Å; A60-P78 VanDerWaalsContact O-CA 3.23Å; A60-P78 WeakPolarHBondContact O-CA 3.3Å; A60-H79 VanDerWaalsContact CB-CE1 3.4Å; A60-H79 WeakPolarHBondContact CB-CE1 3.48Å; A60-H79 WeakPolarHBondContact CB-NE2 3.46Å; A60-H79 PolarHBondContact N-O 3.16Å; A60-H79 PolarHBondContact O-N 3.46Å
61	R	85	Confident	76.4	Confident	159 Å²	159	80 Å²	80	60%	0.6	45%	0.454	S	S	*	.			trans	-102.6	-16.5	178.8	-53.4	-168	-166.6	123.6	0.7	114.2	I59 T63 E150	I59-R61 HydrophobicContact CG2-CG 3.69Å; R61-T63 PolarHBondContact O-N 3.41Å; R61-E150 IonicContact CZ-OE1 3.39Å; R61-E150 IonicContact NE-OE1 3.4Å; R61-E150 PolarHBondContact NE-OE1 3.43Å; R61-E150 VanDerWaalsContact NH2-CD 3.26Å; R61-E150 IonicContact NH2-OE1 2.61Å; R61-E150 PolarHBondContact NH2-OE1 3.27Å; R61-E150 IonicContact NH2-OE2 3.33Å; R61-E150 PolarHBondContact NH2-OE2 3.29Å
62	N	70.6	Confident	74.7	Confident	102 Å²	102	85.4 Å²	85.4	55%	0.545	48%	0.484	S	S	.	.			trans	-80	105.7	-175.6	-167.4	9.8	0	0	0	110.4
63	T	64.5	Low	73.3	Confident	53 Å²	53	88 Å²	88	33%	0.325	49%	0.491	S	S	.	.			trans	-111.7	108.3	179.9	57.5	0	0	0	0	108.4	R61 P76	R61-T63 PolarHBondContact O-N 3.41Å; T63-P76 WeakPolarHBondContact CB-O 3.37Å; T63-P76 WeakPolarHBondContact CG2-O 3.32Å
64	V	64.4	Low	72.5	Confident	87 Å²	87	88.4 Å²	88.4	53%	0.527	49%	0.494	S	S	.	.			trans	45.3	103.3	176.2	-167.2	0	0	0	0	114	Q66	V64-Q66 PolarHBondContact O-N 2.85Å; V64-Q66 VanDerWaalsContact O-N 3.16Å
65	D	58.5	Low	72	Confident	82 Å²	82	88.3 Å²	88.3	44%	0.439	49%	0.493	S	S	.	.			trans	-59.1	122.6	166.9	-161.7	-31.1	0	0	0	108.9	T67	D65-T67 PolarHBondContact O-N 2.9Å; D65-T67 WeakPolarHBondContact OD1-CA 3.42Å; D65-T67 VanDerWaalsContact OD1-CB 3.27Å; D65-T67 WeakPolarHBondContact OD1-CB 3.49Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.44Å; D65-T67 PolarHBondContact OD1-N 3.14Å; D65-T67 PolarHBondContact OD1-OG1 3.34Å; D65-T67 PolarHBondContact OD2-OG1 3.43Å; D65-T67 VanDerWaalsContact OD2-OG1 3.07Å
66	Q	56.8	Low	71.6	Confident	198 Å²	198	88.1 Å²	88.1	93%	0.925	49%	0.494	S	S	*	.	S	Bend	trans	-67	-12.7	174.3	-69.4	176.6	51.7	0	0	111.5	V64 G68	V64-Q66 PolarHBondContact O-N 2.85Å; V64-Q66 VanDerWaalsContact O-N 3.16Å; Q66-G68 PolarHBondContact O-N 2.84Å
67	T	59.9	Low	71.4	Confident	86 Å²	86	88.7 Å²	88.7	53%	0.528	49%	0.494	S	S	.	.	S	Bend	trans	-77.8	103.7	167.6	71.4	0	0	0	0	108.1	D65 D69	D65-T67 PolarHBondContact O-N 2.9Å; D65-T67 WeakPolarHBondContact OD1-CA 3.42Å; D65-T67 VanDerWaalsContact OD1-CB 3.27Å; D65-T67 WeakPolarHBondContact OD1-CB 3.49Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.44Å; D65-T67 PolarHBondContact OD1-N 3.14Å; D65-T67 PolarHBondContact OD1-OG1 3.34Å; D65-T67 PolarHBondContact OD2-OG1 3.43Å; D65-T67 VanDerWaalsContact OD2-OG1 3.07Å; T67-D69 PolarHBondContact O-N 3.39Å
68	G	58.1	Low	71.4	Confident	82 Å²	82	89.1 Å²	89.1	85%	0.845	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	32	-177.8	0	0	0	0	0	115.3	Q66	Q66-G68 PolarHBondContact O-N 2.84Å
69	D	60.7	Low	71.3	Confident	128 Å²	128	87.6 Å²	87.6	68%	0.684	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-27.2	-177	-151.4	-120.3	0	0	0	112.4	T67	T67-D69 PolarHBondContact O-N 3.39Å
70	H	54.3	Low	71.4	Confident	134 Å²	134	85.6 Å²	85.6	62%	0.62	48%	0.476	S	S	*	.			trans	-142.5	103.1	173.3	-69.3	-57.4	0	0	0	111.5	N72	H70-N72 PolarHBondContact O-N 3.39Å
71	P	53.7	Low	71.6	Confident	126 Å²	126	86 Å²	86	82%	0.818	47%	0.474	S	S	*	.			trans	-75.4	60.7	164.6	35.7	-34.9	0	0	0	108.2	N73	P71-N73 PolarHBondContact O-N 3.45Å; P71-N73 VanDerWaalsContact O-N 3.09Å
72	N	57.5	Low	72	Confident	124 Å²	124	78.5 Å²	78.5	66%	0.663	45%	0.445	S	S	*	.			trans	-57.3	123.7	155.7	-88.9	-8	0	0	0	104.3	H70 L74	H70-N72 PolarHBondContact O-N 3.39Å; N72-L74 HydrophobicContact CB-CD1 4.48Å; N72-L74 HydrophobicContact CB-CG 4.38Å; N72-L74 WeakPolarHBondContact O-CG 3.21Å; N72-L74 PolarHBondContact O-N 3.02Å
73	N	59.1	Low	73.2	Confident	141 Å²	141	76.6 Å²	76.6	75%	0.754	43%	0.434	S	S	*	.			trans	-59.6	66.5	-176.2	-171.7	19.8	0	0	0	110.6	P71	P71-N73 PolarHBondContact O-N 3.45Å; P71-N73 VanDerWaalsContact O-N 3.09Å
74	L	73.5	Confident	74.6	Confident	58 Å²	58	74.2 Å²	74.2	30%	0.304	42%	0.419	S	S	.	.			trans	-78.3	122.5	-176.3	-75	153.2	0	0	0	105.9	N72	N72-L74 HydrophobicContact CB-CD1 4.48Å; N72-L74 HydrophobicContact CB-CG 4.38Å; N72-L74 WeakPolarHBondContact O-CG 3.21Å; N72-L74 PolarHBondContact O-N 3.02Å
75	F	81.9	Confident	75.8	Confident	8 Å²	8	73.2 Å²	73.2	4%	0.035	41%	0.411	C	S	.	.			trans	-58.9	133.3	175.7	-172.4	-90.3	0	0	0	109.5	Y20 H77 H79 V142	Y20-F75 AromaticContact CD1-CE2 3.49Å; Y20-F75 HydrophobicContact CD1-CE2 3.49Å; Y20-F75 VanDerWaalsContact CD1-CE2 3.49Å; Y20-F75 AromaticContact CD1-CZ 3.58Å; Y20-F75 HydrophobicContact CD1-CZ 3.58Å; Y20-F75 HydrophobicContact CD2-CE2 4.25Å; Y20-F75 AromaticContact CD2-CZ 3.6Å; Y20-F75 HydrophobicContact CD2-CZ 3.6Å; Y20-F75 AromaticContact CE1-CE2 3.87Å; Y20-F75 HydrophobicContact CE1-CE2 3.87Å; Y20-F75 AromaticContact CE1-CZ 3.68Å; Y20-F75 HydrophobicContact CE1-CZ 3.68Å; Y20-F75 AromaticContact CE2-CZ 3.69Å; Y20-F75 HydrophobicContact CE2-CZ 3.69Å; Y20-F75 AromaticContact CG-CE2 3.72Å; Y20-F75 HydrophobicContact CG-CE2 3.72Å; Y20-F75 AromaticContact CG-CZ 3.55Å; Y20-F75 HydrophobicContact CG-CZ 3.55Å; Y20-F75 AromaticContact CZ-CZ 3.75Å; F75-H77 VanDerWaalsContact C-N 3.26Å; F75-H77 HydrophobicContact CD1-CB 4.33Å; F75-H77 WeakPolarHBondContact CD1-O 3.16Å; F75-H77 HydrophobicContact CE1-CB 3.92Å; F75-H77 PolarHBondContact O-N 2.95Å; F75-H79 AromaticContact CD1-CE1 3.76Å; F75-H79 AromaticContact CD1-ND1 3.39Å; F75-H79 WeakPolarHBondContact CD1-ND1 3.49Å; F75-H79 AromaticContact CG-CE1 3.98Å; F75-V142 HydrophobicContact CE1-CG2 3.44Å; F75-V142 VanDerWaalsContact CE1-CG2 3.44Å; F75-V142 HydrophobicContact CZ-CG2 3.77Å
76	P	82.3	Confident	77.2	Confident	71 Å²	71	70.3 Å²	70.3	46%	0.461	40%	0.4	S	S	.	.	S	Bend	trans	-75.7	-7.8	-162.7	28.6	-36.6	0	0	0	114.9	T63	T63-P76 WeakPolarHBondContact CB-O 3.37Å; T63-P76 WeakPolarHBondContact CG2-O 3.32Å
77	H	87.5	Confident	78.6	Confident	85 Å²	85	65.9 Å²	65.9	39%	0.394	38%	0.383	S	S	.	.	S	Bend	trans	-121.2	147.7	-179	-56	-61.7	0	0	0	111.5	F75 H79 V142	F75-H77 VanDerWaalsContact C-N 3.26Å; F75-H77 HydrophobicContact CD1-CB 4.33Å; F75-H77 WeakPolarHBondContact CD1-O 3.16Å; F75-H77 HydrophobicContact CE1-CB 3.92Å; F75-H77 PolarHBondContact O-N 2.95Å; H77-H79 PolarHBondContact O-N 3.02Å; H77-H79 PolarHBondContact O-ND1 2.94Å; H77-V142 HydrophobicContact CB-CG1 3.49Å; H77-V142 VanDerWaalsContact CB-CG1 3.49Å
78	P	91.9	Very high	79.9	Confident	37 Å²	37	66.6 Å²	66.6	24%	0.24	38%	0.376	C	S	.	.			trans	-65.1	132.4	171.7	31.6	-35.8	0	0	0	108.6	A60 L149	A60-P78 CarbonylContact O-C 3.53Å; A60-P78 VanDerWaalsContact O-CA 3.23Å; A60-P78 WeakPolarHBondContact O-CA 3.3Å; P78-L149 HydrophobicContact CB-CD1 3.65Å; P78-L149 HydrophobicContact CG-CD1 4.31Å
79	H	93.5	Very high	81.2	Confident	5 Å²	5	66 Å²	66	2%	0.023	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	156.9	-169.7	60.7	-80.9	0	0	0	112.5	A60 F75 H77 R140 L141 V142	A60-H79 VanDerWaalsContact CB-CE1 3.4Å; A60-H79 WeakPolarHBondContact CB-CE1 3.48Å; A60-H79 WeakPolarHBondContact CB-NE2 3.46Å; A60-H79 PolarHBondContact N-O 3.16Å; A60-H79 PolarHBondContact O-N 3.46Å; F75-H79 AromaticContact CD1-CE1 3.76Å; F75-H79 AromaticContact CD1-ND1 3.39Å; F75-H79 WeakPolarHBondContact CD1-ND1 3.49Å; F75-H79 AromaticContact CG-CE1 3.98Å; H77-H79 PolarHBondContact O-N 3.02Å; H77-H79 PolarHBondContact O-ND1 2.94Å; H79-R140 HydrophobicContact CB-CB 4.33Å; H79-R140 VanDerWaalsContact CD2-CG 3.49Å; H79-R140 WeakPolarHBondContact CD2-CG 3.33Å; H79-R140 PolarHBondContact CE1-NH1 3.19Å; H79-R140 VanDerWaalsContact CE1-NH1 3.31Å; H79-R140 WeakPolarHBondContact NE2-CD 3.38Å; H79-R140 PolarHBondContact NE2-NH1 3.23Å; H79-L141 CarbonylContact C-O 3.57Å; H79-L141 VanDerWaalsContact CA-O 3.29Å; H79-L141 WeakPolarHBondContact CA-O 3.33Å; H79-L141 WeakPolarHBondContact CB-O 3.21Å; H79-V142 HydrophobicContact CB-CG2 3.9Å
80	L	95.1	Very high	82.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116.5	167.3	-178	68.9	0	0	0	108.1	I59 V82 R140 L141 L149 M152 Y153 L156	I59-L80 HydrophobicContact CG1-CD1 4.19Å; L80-V82 HydrophobicContact CD2-CG2 4.27Å; L80-V82 HydrophobicContact CG-CG2 4.11Å; L80-R140 CarbonylContact O-C 3.49Å; L80-R140 WeakPolarHBondContact O-CA 3.34Å; L80-L141 HydrophobicContact CB-CB 4.29Å; L80-L141 HydrophobicContact CB-CD1 4.44Å; L80-L141 HydrophobicContact CD2-CD1 4.11Å; L80-L141 HydrophobicContact CG-CD1 4.43Å; L80-L141 PolarHBondContact N-O 3.48Å; L80-L141 PolarHBondContact O-N 3.47Å; L80-L149 HydrophobicContact CB-CD2 4.15Å; L80-M152 HydrophobicContact CB-CE 4.11Å; L80-M152 HydrophobicContact CD2-CB 4.12Å; L80-M152 HydrophobicContact CD2-CE 4.03Å; L80-Y153 HydrophobicContact CD1-CD2 3.92Å; L80-L156 HydrophobicContact CD2-CD2 4.24Å
81	L	94	Very high	83.9	Confident	41 Å²	41	56.8 Å²	56.8	22%	0.215	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	133.2	172	-169.7	78.5	0	0	0	108.6	L56 H57 A58 V138 L139 R140	L56-L81 HydrophobicContact CD2-CD2 4.07Å; H57-L81 CarbonylContact C-O 3.55Å; H57-L81 WeakPolarHBondContact CA-O 3.37Å; A58-L81 PolarHBondContact N-O 3.49Å; A58-L81 WeakPolarHBondContact O-CB 3.27Å; A58-L81 PolarHBondContact O-N 2.94Å; L81-V138 HydrophobicContact CD1-CG1 3.32Å; L81-V138 HydrophobicContact CG-CG1 4.06Å; L81-L139 WeakPolarHBondContact CA-O 3.43Å; L81-R140 HydrophobicContact CD1-CG 3.86Å
82	V	95	Very high	84.7	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120.8	175.1	-173.3	0	0	0	0	108.2	I54 L56 L80 I84 L139 L141 L156	I54-V82 HydrophobicContact CB-CG1 4.48Å; I54-V82 HydrophobicContact CD1-CG1 4.14Å; I54-V82 HydrophobicContact CG1-CG1 4.12Å; I54-V82 HydrophobicContact CG2-CG1 3.61Å; L56-V82 CarbonylContact O-C 3.6Å; L56-V82 WeakPolarHBondContact O-CA 3.32Å; L80-V82 HydrophobicContact CD2-CG2 4.27Å; L80-V82 HydrophobicContact CG-CG2 4.11Å; V82-I84 HydrophobicContact CG1-CD1 4.36Å; V82-I84 HydrophobicContact CG1-CG1 4.06Å; V82-L139 PolarHBondContact N-O 3.12Å; V82-L139 PolarHBondContact O-N 3.37Å; V82-L141 HydrophobicContact CG2-CD1 3.63Å; V82-L156 HydrophobicContact CG2-CD2 4.24Å
83	M	94.4	Very high	85.1	Confident	62 Å²	62	54.5 Å²	54.5	31%	0.305	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.1	173.9	-168.7	168.2	71.3	0	0	108.8	I54 T55 L56 S137 V138	I54-M83 WeakPolarHBondContact CA-O 3.46Å; T55-M83 PolarHBondContact N-O 2.83Å; T55-M83 WeakPolarHBondContact OG1-CE 3.36Å; T55-M83 WeakPolarHBondContact OG1-CG 3.4Å; T55-M83 PolarHBondContact OG1-O 2.91Å; L56-M83 HydrophobicContact CB-CB 3.93Å; L56-M83 HydrophobicContact CB-CE 3.9Å; L56-M83 PolarHBondContact O-N 2.85Å; M83-S137 WeakPolarHBondContact CA-O 3.49Å; M83-V138 HydrophobicContact CG-CG2 4.29Å
84	I	93.7	Very high	84.8	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.4	-173	-62.8	148.5	0	0	0	108.2	I49 Q53 V82 W90 T136 S137 L139	I49-I84 HydrophobicContact CD1-CD1 3.44Å; I49-I84 VanDerWaalsContact CD1-CD1 3.44Å; I49-I84 HydrophobicContact CD1-CG1 4.18Å; I49-I84 HydrophobicContact CG2-CG1 4.33Å; I49-I84 HydrophobicContact CG2-CG2 4.24Å; Q53-I84 HydrophobicContact CB-CG2 4.12Å; Q53-I84 CarbonylContact O-C 3.57Å; Q53-I84 VanDerWaalsContact O-CA 3.27Å; Q53-I84 WeakPolarHBondContact O-CA 3.27Å; V82-I84 HydrophobicContact CG1-CD1 4.36Å; V82-I84 HydrophobicContact CG1-CG1 4.06Å; I84-W90 HydrophobicContact CB-CH2 4.35Å; I84-W90 HydrophobicContact CD1-CH2 3.69Å; I84-W90 HydrophobicContact CD1-CZ3 3.74Å; I84-W90 HydrophobicContact CG2-CH2 4.42Å; I84-W90 HydrophobicContact CG2-CZ3 4.48Å; I84-T136 CarbonylContact O-C 3.54Å; I84-T136 VanDerWaalsContact O-CA 3.3Å; I84-T136 WeakPolarHBondContact O-CA 3.39Å; I84-S137 PolarHBondContact N-O 2.82Å; I84-S137 PolarHBondContact O-N 2.9Å; I84-L139 HydrophobicContact CD1-CB 4.34Å; I84-L139 HydrophobicContact CD1-CD1 3.33Å; I84-L139 HydrophobicContact CD1-CG 3.69Å
85	D	91.5	Very high	83.7	Confident	67 Å²	67	53.2 Å²	53.2	36%	0.358	30%	0.298	S	S	.	.			trans	-97.3	133.7	169.6	-170	-113.9	0	0	0	110.4	Q53 T55 T136	Q53-D85 WeakPolarHBondContact CB-O 3.45Å; Q53-D85 PolarHBondContact O-N 2.9Å; T55-D85 HydrophobicContact CG2-CB 3.69Å; D85-T136 WeakPolarHBondContact OD2-CG2 3.32Å
86	G	87.3	Confident	82.1	Confident	21 Å²	21	58.4 Å²	58.4	22%	0.216	33%	0.327	C	S	.	.	S	Bend	trans	113.2	-157.2	-178.3	0	0	0	0	0	114.7	S135	G86-S135 PolarHBondContact O-OG 2.68Å
87	D	84.9	Confident	80.3	Confident	104 Å²	104	61.4 Å²	61.4	56%	0.556	34%	0.339	S	S	*	.			trans	-75.3	142.4	-171.3	-65.6	-31.7	0	0	0	112.8	V89	D87-V89 VanDerWaalsContact C-N 3.3Å; D87-V89 PolarHBondContact O-N 2.91Å
88	R	87.2	Confident	78.5	Confident	101 Å²	101	65 Å²	65	38%	0.381	36%	0.36	S	S	.	.			trans	-74.6	80.6	174.1	-69.9	-173.4	-108.6	-105.2	6.3	110.8	W90 D91 T94 S137	R88-W90 HydrophobicContact CB-CD2 4.5Å; R88-W90 HydrophobicContact CB-CZ2 4.21Å; R88-W90 HydrophobicContact CG-CH2 4.35Å; R88-W90 HydrophobicContact CG-CZ2 3.77Å; R88-W90 PolarHBondContact O-N 3.26Å; R88-W90 VanDerWaalsContact O-N 3.12Å; R88-D91 HydrophobicContact CB-CB 3.83Å; R88-D91 PolarHBondContact O-N 2.85Å; R88-T94 PolarHBondContact O-OG1 2.96Å; R88-S137 WeakPolarHBondContact CG-OG 3.26Å; R88-S137 PolarHBondContact NH1-OG 2.9Å
89	V	86	Confident	76.2	Confident	69 Å²	69	67.1 Å²	67.1	42%	0.418	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-14.9	179.6	-63.7	0	0	0	0	114.2	F47 I49 D87	F47-V89 HydrophobicContact CB-CB 4.29Å; F47-V89 HydrophobicContact CB-CG2 3.82Å; F47-V89 HydrophobicContact CD2-CG2 3.67Å; F47-V89 HydrophobicContact CG-CG2 3.93Å; I49-V89 HydrophobicContact CG1-CG2 4.3Å; D87-V89 VanDerWaalsContact C-N 3.3Å; D87-V89 PolarHBondContact O-N 2.91Å
90	W	87.2	Confident	73.8	Confident	9 Å²	9	73.8 Å²	73.8	3%	0.034	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-12.9	172.9	56.7	87.7	0	0	0	113.3	E21 I26 K45 F47 I49 I84 R88 L139	E21-W90 PolarHBondContact OE1-NE1 2.71Å; I26-W90 HydrophobicContact CD1-CB 4.42Å; I26-W90 HydrophobicContact CD1-CG 4.04Å; K45-W90 HydrophobicContact CD-CB 4.13Å; K45-W90 WeakPolarHBondContact CD-O 3.32Å; K45-W90 WeakPolarHBondContact CE-O 3.49Å; K45-W90 PolarHBondContact NZ-O 3.49Å; F47-W90 HydrophobicContact CD1-CB 3.81Å; F47-W90 HydrophobicContact CE1-CB 3.58Å; F47-W90 HydrophobicContact CE2-CE3 4.15Å; F47-W90 HydrophobicContact CG-CB 4.47Å; F47-W90 HydrophobicContact CZ-CB 4.07Å; F47-W90 HydrophobicContact CZ-CE3 4.35Å; I49-W90 HydrophobicContact CD1-CZ3 4.12Å; I84-W90 HydrophobicContact CB-CH2 4.35Å; I84-W90 HydrophobicContact CD1-CH2 3.69Å; I84-W90 HydrophobicContact CD1-CZ3 3.74Å; I84-W90 HydrophobicContact CG2-CH2 4.42Å; I84-W90 HydrophobicContact CG2-CZ3 4.48Å; R88-W90 HydrophobicContact CB-CD2 4.5Å; R88-W90 HydrophobicContact CB-CZ2 4.21Å; R88-W90 HydrophobicContact CG-CH2 4.35Å; R88-W90 HydrophobicContact CG-CZ2 3.77Å; R88-W90 PolarHBondContact O-N 3.26Å; R88-W90 VanDerWaalsContact O-N 3.12Å; W90-L139 HydrophobicContact CD2-CD1 4.37Å; W90-L139 HydrophobicContact CD2-CD2 4.26Å; W90-L139 HydrophobicContact CE3-CD1 4.02Å; W90-L139 HydrophobicContact CH2-CD1 4.03Å; W90-L139 HydrophobicContact CH2-CD2 4.29Å; W90-L139 HydrophobicContact CH2-CG 4.12Å; W90-L139 HydrophobicContact CZ2-CD1 4.36Å; W90-L139 HydrophobicContact CZ2-CD2 3.81Å; W90-L139 HydrophobicContact CZ2-CG 4.13Å; W90-L139 HydrophobicContact CZ3-CD1 3.86Å; W90-L139 HydrophobicContact CZ3-CG 4.46Å
91	D	83.7	Confident	71.2	Confident	61 Å²	61	80.3 Å²	80.3	33%	0.326	45%	0.451	S	S	.	.			trans	-94.7	119.8	-179.8	-170.3	-88.7	0	0	0	110.7	R88 N93 T94	R88-D91 HydrophobicContact CB-CB 3.83Å; R88-D91 PolarHBondContact O-N 2.85Å; D91-N93 PolarHBondContact O-N 2.86Å; D91-N93 WeakPolarHBondContact OD1-CA 3.3Å; D91-N93 WeakPolarHBondContact OD1-CB 3.27Å; D91-N93 PolarHBondContact OD1-N 2.82Å; D91-T94 PolarHBondContact O-OG1 2.8Å
92	S	72.4	Confident	68.6	Low	93 Å²	93	89.1 Å²	89.1	65%	0.65	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-69.6	-20.2	-176.4	-57.1	0	0	0	0	113	T94	S92-T94 VanDerWaalsContact C-N 3.32Å; S92-T94 PolarHBondContact O-N 3.34Å
93	N	64	Low	66.2	Low	109 Å²	109	94.9 Å²	94.9	58%	0.583	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-75.5	-20.2	-176.5	-165.6	37.7	0	0	0	112.7	D91 T95 D96	D91-N93 PolarHBondContact O-N 2.86Å; D91-N93 WeakPolarHBondContact OD1-CA 3.3Å; D91-N93 WeakPolarHBondContact OD1-CB 3.27Å; D91-N93 PolarHBondContact OD1-N 2.82Å; N93-T95 PolarHBondContact O-N 2.81Å; N93-D96 PolarHBondContact O-N 3.23Å
94	T	53.4	Low	63.6	Low	61 Å²	61	100.9 Å²	100.9	37%	0.374	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-61.7	-27.1	-179.9	-50.4	0	0	0	0	112.5	R88 D91 S92 D96	R88-T94 PolarHBondContact O-OG1 2.96Å; D91-T94 PolarHBondContact O-OG1 2.8Å; S92-T94 VanDerWaalsContact C-N 3.32Å; S92-T94 PolarHBondContact O-N 3.34Å; T94-D96 PolarHBondContact O-N 2.97Å
95	T	50.5	Low	61.1	Low	110 Å²	110	107.8 Å²	107.8	68%	0.675	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-74	-26	-178.1	-37.5	0	0	0	0	112.9	N93	N93-T95 PolarHBondContact O-N 2.81Å
96	D	48.5	Very low	58.8	Low	118 Å²	118	112.1 Å²	112.1	63%	0.631	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-18.6	-173.2	-83.5	-47.2	0	0	0	113.8	N93 T94	N93-D96 PolarHBondContact O-N 3.23Å; T94-D96 PolarHBondContact O-N 2.97Å
97	N	45.5	Very low	56.8	Low	134 Å²	134	120.4 Å²	120.4	72%	0.717	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-86.5	-7.2	179.8	-123.6	-90.3	0	0	0	115	S99	N97-S99 PolarHBondContact O-N 3.07Å
98	L	49.1	Very low	54.7	Low	159 Å²	159	123.2 Å²	123.2	83%	0.832	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-80.2	1.1	170.8	-147.3	76	0	0	0	112.9
99	S	42.6	Very low	52.5	Low	82 Å²	82	121.4 Å²	121.4	57%	0.573	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-102.2	27.8	-176.5	-54.5	0	0	0	0	114.3	N97	N97-S99 PolarHBondContact O-N 3.07Å
100	D	44.4	Very low	50.5	Low	146 Å²	146	126.6 Å²	126.6	78%	0.781	68%	0.684	S	S	*	*			trans	-127.3	40.8	171.6	-126	-35.7	0	0	0	114.9
101	T	39.7	Very low	48.4	Very low	136 Å²	136	135.2 Å²	135.2	83%	0.834	73%	0.725	S	S	*	*			trans	-125.3	60.9	151.3	10.4	0	0	0	0	110.1	P103	T101-P103 WeakPolarHBondContact O-CD 2.98Å
102	R	39.7	Very low	47	Very low	226 Å²	226	139.1 Å²	139.1	85%	0.853	75%	0.751	S	S	*	*			trans	-82.5	116	157.4	-89.7	177.8	129.6	-155.8	-1.8	108.1	Q104	R102-Q104 PolarHBondContact O-N 3.48Å; R102-Q104 VanDerWaalsContact O-N 3.15Å
103	P	45	Very low	45.5	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	76%	0.762	S	S	*	*			trans	-62.3	123.5	178	24.2	-31	0	0	0	109.3	T101 N105	T101-P103 WeakPolarHBondContact O-CD 2.98Å; P103-N105 PolarHBondContact O-N 2.98Å
104	Q	39.5	Very low	44.4	Very low	188 Å²	188	141 Å²	141	88%	0.879	77%	0.771	S	S	*	*			trans	-49.2	92.6	172.3	-168.2	171.3	-13.1	0	0	110.1	R102	R102-Q104 PolarHBondContact O-N 3.48Å; R102-Q104 VanDerWaalsContact O-N 3.15Å
105	N	42	Very low	43.8	Very low	147 Å²	147	141.7 Å²	141.7	79%	0.786	79%	0.79	S	S	*	*			trans	-113.4	97.4	162.9	-152.8	30.5	0	0	0	108.3	P103 Q107	P103-N105 PolarHBondContact O-N 2.98Å; N105-Q107 PolarHBondContact O-N 3.06Å
106	E	42.4	Very low	43.2	Very low	158 Å²	158	140.2 Å²	140.2	74%	0.738	80%	0.797	S	S	*	*			trans	-20.1	113.6	162	-59.5	156.8	88.7	0	0	114.6
107	Q	45.2	Very low	43.3	Very low	195 Å²	195	140.3 Å²	140.3	91%	0.911	81%	0.807	S	S	*	*			trans	-166.6	120.6	135.4	-110.7	165.3	64.6	0	0	113.6	N105	N105-Q107 PolarHBondContact O-N 3.06Å
108	D	41.3	Very low	43.3	Very low	164 Å²	164	142.3 Å²	142.3	88%	0.877	81%	0.812	S	S	*	*			trans	69.2	116	143.4	-143.5	-121.8	0	0	0	119.5
109	G	40.3	Very low	43.6	Very low	63 Å²	63	142.6 Å²	142.6	65%	0.649	81%	0.809	S	S	*	*			trans	-77.2	154.8	-173.7	0	0	0	0	0	114.9
110	M	45.3	Very low	43.8	Very low	178 Å²	178	145.8 Å²	145.8	88%	0.877	82%	0.815	S	S	*	*			trans	-149.4	117.9	142.2	-151	74.5	-156.6	0	0	108	V112	M110-V112 PolarHBondContact O-N 3.41Å
111	Q	41.5	Very low	43.7	Very low	190 Å²	190	147.1 Å²	147.1	89%	0.888	82%	0.822	S	S	*	*			trans	-61.3	126.3	167.6	-80.3	162.6	32.6	0	0	109.3
112	V	55.2	Low	44	Very low	142 Å²	142	148 Å²	148	86%	0.861	82%	0.816	S	S	*	*			trans	-123.5	118.1	148.9	-72.9	0	0	0	0	108.1	M110	M110-V112 PolarHBondContact O-N 3.41Å
113	D	40.5	Very low	44.2	Very low	168 Å²	168	144 Å²	144	90%	0.898	81%	0.812	S	S	*	*			trans	-80.9	136.8	176.2	-160.6	-41.3	0	0	0	108.2
114	G	41.4	Very low	44.6	Very low	75 Å²	75	143.6 Å²	143.6	77%	0.773	81%	0.812	S	S	*	*			trans	132.5	111.2	160.3	0	0	0	0	0	116.7
115	G	39.9	Very low	45	Very low	75 Å²	75	141.5 Å²	141.5	77%	0.773	81%	0.807	S	S	*	*			trans	130.2	86.2	150.3	0	0	0	0	0	113.5	S117	G115-S117 PolarHBondContact O-N 3Å
116	G	38.8	Very low	45.5	Very low	78 Å²	78	138.1 Å²	138.1	80%	0.804	80%	0.795	S	S	*	*			trans	-59.8	128.9	170.7	0	0	0	0	0	111.7
117	S	49.4	Very low	45.8	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	80%	0.801	S	S	*	*			trans	-118.1	84.2	156.2	-58.6	0	0	0	0	105.7	G115 E119	G115-S117 PolarHBondContact O-N 3Å; S117-E119 PolarHBondContact O-N 3.36Å
118	E	47.2	Very low	46.1	Very low	177 Å²	177	135.5 Å²	135.5	83%	0.827	78%	0.782	S	S	*	*			trans	-82	91.2	162.9	-65.6	176.1	134.7	0	0	106.4
119	E	54.7	Low	46.9	Very low	165 Å²	165	130.7 Å²	130.7	77%	0.771	77%	0.765	S	S	*	*			trans	-142.1	75.2	159.4	-64.1	-77.7	155.8	0	0	106.7	S117 N121	S117-E119 PolarHBondContact O-N 3.36Å; E119-N121 PolarHBondContact O-N 3.5Å
120	E	46.6	Very low	47.6	Very low	149 Å²	149	133.9 Å²	133.9	70%	0.696	78%	0.775	S	S	*	*			trans	31.2	89.7	132.9	-15.9	-168.2	119.2	0	0	115.5	E122	E120-E122 HydrophobicContact CB-CG 3.53Å; E120-E122 PolarHBondContact O-N 2.94Å
121	N	43.1	Very low	48.1	Very low	173 Å²	173	132.5 Å²	132.5	93%	0.925	77%	0.77	S	S	*	*			trans	-73.7	81.8	159.6	-77.8	-77.2	0	0	0	108.2	E119	E119-N121 PolarHBondContact O-N 3.5Å
122	E	44.3	Very low	48.4	Very low	154 Å²	154	126.1 Å²	126.1	72%	0.72	75%	0.746	S	S	*	*			trans	-110.7	79.9	171.9	-0.2	-174.5	115.9	0	0	109.2	E120	E120-E122 HydrophobicContact CB-CG 3.53Å; E120-E122 PolarHBondContact O-N 2.94Å
123	D	44.7	Very low	48.2	Very low	144 Å²	144	124.5 Å²	124.5	77%	0.77	74%	0.739	S	S	*	*			trans	-166.4	72.7	130.9	-143.7	-18	0	0	0	109.6
124	S	53.1	Low	49.2	Very low	112 Å²	112	118.4 Å²	118.4	78%	0.783	72%	0.715	S	S	*	*			trans	-115.6	54.5	163.6	-140.4	0	0	0	0	108.5	S126	S124-S126 PolarHBondContact O-N 3.49Å
125	D	47.9	Very low	51.2	Low	145 Å²	145	117.1 Å²	117.1	78%	0.775	69%	0.694	S	S	*	*			trans	-73.3	57	165.6	-110.7	-11.3	0	0	0	110
126	S	52.5	Low	53.5	Low	76 Å²	76	116 Å²	116	53%	0.531	67%	0.673	S	S	.	*			trans	-102.4	69.2	168.6	-176.4	0	0	0	0	109.2	S124 R128	S124-S126 PolarHBondContact O-N 3.49Å; S126-R128 PolarHBondContact O-N 3.31Å; S126-R128 WeakPolarHBondContact OG-CB 3.03Å
127	D	49.4	Very low	56.1	Low	164 Å²	164	112.5 Å²	112.5	88%	0.877	64%	0.636	S	S	*	*			trans	-63.5	34	153.3	-93.1	-33.8	0	0	0	111.3	A129	D127-A129 PolarHBondContact O-N 2.81Å
128	R	50.5	Low	58.1	Low	133 Å²	133	108.5 Å²	108.5	50%	0.502	61%	0.606	S	S	.	*			trans	-76.9	125.8	171	-88.2	-176.9	126.3	145.8	-7.9	108.4	S126 C132	S126-R128 PolarHBondContact O-N 3.31Å; S126-R128 WeakPolarHBondContact OG-CB 3.03Å; R128-C132 HydrophobicContact CB-CB 4.42Å; R128-C132 HydrophobicContact CG-CB 4.37Å; R128-C132 PolarHBondContact NE-SG 2.87Å; R128-C132 PolarHBondContact NH2-SG 2.94Å
129	A	58.6	Low	60.4	Low	64 Å²	64	100 Å²	100	53%	0.529	57%	0.567	S	S	.	*			trans	-51.6	137.4	162.5	0	0	0	0	0	109.2	D127 D131 C132	D127-A129 PolarHBondContact O-N 2.81Å; A129-D131 PolarHBondContact O-N 3.45Å; A129-C132 WeakPolarHBondContact O-CB 3.05Å; A129-C132 PolarHBondContact O-N 3.31Å
130	P	55.2	Low	62.3	Low	130 Å²	130	94.4 Å²	94.4	84%	0.844	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-16.9	178	23.7	-33.6	0	0	0	113.2	C132	P130-C132 VanDerWaalsContact C-N 3.27Å; P130-C132 PolarHBondContact O-N 3.02Å
131	D	54.9	Low	64.7	Low	148 Å²	148	87.3 Å²	87.3	79%	0.791	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	8.7	174.4	-58.9	-66.5	0	0	0	113.9	A129 P133	A129-D131 PolarHBondContact O-N 3.45Å; D131-P133 VanDerWaalsContact O-CD 3.32Å; D131-P133 WeakPolarHBondContact O-CD 3.41Å
132	C	48.5	Very low	67.1	Low	56 Å²	56	79.7 Å²	79.7	38%	0.378	47%	0.465	S	S	.	.			trans	-78.4	112	172.7	-149.2	0	0	0	0	109.1	R128 A129 P130 G134	R128-C132 HydrophobicContact CB-CB 4.42Å; R128-C132 HydrophobicContact CG-CB 4.37Å; R128-C132 PolarHBondContact NE-SG 2.87Å; R128-C132 PolarHBondContact NH2-SG 2.94Å; A129-C132 WeakPolarHBondContact O-CB 3.05Å; A129-C132 PolarHBondContact O-N 3.31Å; P130-C132 VanDerWaalsContact C-N 3.27Å; P130-C132 PolarHBondContact O-N 3.02Å; C132-G134 PolarHBondContact O-N 2.86Å
133	P	50.2	Low	69.5	Low	109 Å²	109	72.8 Å²	72.8	71%	0.708	43%	0.434	S	S	*	.			trans	-72.9	129.2	-172.6	31.2	-33.2	0	0	0	109.6	D131	D131-P133 VanDerWaalsContact O-CD 3.32Å; D131-P133 WeakPolarHBondContact O-CD 3.41Å
134	G	62.1	Low	71.8	Confident	39 Å²	39	73.7 Å²	73.7	40%	0.402	43%	0.433	S	S	.	.	S	Bend	trans	70.3	138.7	167.4	0	0	0	0	0	116.4	C132 T136	C132-G134 PolarHBondContact O-N 2.86Å; G134-T136 PolarHBondContact O-N 3.32Å
135	S	82.5	Confident	73.6	Confident	48 Å²	48	72 Å²	72	34%	0.336	42%	0.416	S	S	.	.			trans	-75	70.4	166.9	47.5	0	0	0	0	110.8	G86 S137	G86-S135 PolarHBondContact O-OG 2.68Å; S135-S137 PolarHBondContact O-N 2.73Å; S135-S137 PolarHBondContact O-OG 2.94Å
136	T	89.3	Confident	75.6	Confident	52 Å²	52	68.3 Å²	68.3	32%	0.319	40%	0.401	S	S	.	.			trans	-64.1	130.1	176.9	58.1	0	0	0	0	111.1	I84 D85 G134	I84-T136 CarbonylContact O-C 3.54Å; I84-T136 VanDerWaalsContact O-CA 3.3Å; I84-T136 WeakPolarHBondContact O-CA 3.39Å; D85-T136 WeakPolarHBondContact OD2-CG2 3.32Å; G134-T136 PolarHBondContact O-N 3.32Å
137	S	92.3	Very high	77.4	Confident	5 Å²	5	68 Å²	68	4%	0.035	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	151.6	179.4	-57.8	0	0	0	0	111.7	M83 I84 R88 S135	M83-S137 WeakPolarHBondContact CA-O 3.49Å; I84-S137 PolarHBondContact N-O 2.82Å; I84-S137 PolarHBondContact O-N 2.9Å; R88-S137 WeakPolarHBondContact CG-OG 3.26Å; R88-S137 PolarHBondContact NH1-OG 2.9Å; S135-S137 PolarHBondContact O-N 2.73Å; S135-S137 PolarHBondContact O-OG 2.94Å
138	V	93.2	Very high	79.4	Confident	35 Å²	35	62.4 Å²	62.4	21%	0.212	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.3	-174.9	179.2	0	0	0	0	110.3	N22 L81 M83	N22-V138 PolarHBondContact N-O 3.27Å; N22-V138 VanDerWaalsContact N-O 3.1Å; L81-V138 HydrophobicContact CD1-CG1 3.32Å; L81-V138 HydrophobicContact CG-CG1 4.06Å; M83-V138 HydrophobicContact CG-CG2 4.29Å
139	L	95	Very high	81.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	146.9	173.1	-63.2	-177.5	0	0	0	110.9	L19 Y20 E21 I26 I49 L81 V82 I84 W90	L19-L139 HydrophobicContact CD1-CB 4.16Å; L19-L139 HydrophobicContact CD1-CD1 4.14Å; L19-L139 HydrophobicContact CD1-CD2 4.33Å; L19-L139 HydrophobicContact CD1-CG 4.44Å; Y20-L139 CarbonylContact O-C 3.53Å; Y20-L139 WeakPolarHBondContact O-CA 3.49Å; E21-L139 HydrophobicContact CB-CD2 4.11Å; E21-L139 HydrophobicContact CG-CD2 4.4Å; I26-L139 HydrophobicContact CD1-CD2 4.1Å; I49-L139 HydrophobicContact CD1-CD1 4.13Å; L81-L139 WeakPolarHBondContact CA-O 3.43Å; V82-L139 PolarHBondContact N-O 3.12Å; V82-L139 PolarHBondContact O-N 3.37Å; I84-L139 HydrophobicContact CD1-CB 4.34Å; I84-L139 HydrophobicContact CD1-CD1 3.33Å; I84-L139 HydrophobicContact CD1-CG 3.69Å; W90-L139 HydrophobicContact CD2-CD1 4.37Å; W90-L139 HydrophobicContact CD2-CD2 4.26Å; W90-L139 HydrophobicContact CE3-CD1 4.02Å; W90-L139 HydrophobicContact CH2-CD1 4.03Å; W90-L139 HydrophobicContact CH2-CD2 4.29Å; W90-L139 HydrophobicContact CH2-CG 4.12Å; W90-L139 HydrophobicContact CZ2-CD1 4.36Å; W90-L139 HydrophobicContact CZ2-CD2 3.81Å; W90-L139 HydrophobicContact CZ2-CG 4.13Å; W90-L139 HydrophobicContact CZ3-CD1 3.86Å; W90-L139 HydrophobicContact CZ3-CG 4.46Å
140	R	94.7	Very high	83.1	Confident	46 Å²	46	57.1 Å²	57.1	17%	0.174	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.5	170.8	-55.1	177.9	-167.9	-108.5	3.8	108.8	Y20 N22 H79 L80 L81	Y20-R140 PolarHBondContact N-O 3.31Å; Y20-R140 PolarHBondContact O-N 2.85Å; N22-R140 WeakPolarHBondContact O-CD 3.34Å; N22-R140 PolarHBondContact O-NE 3.23Å; H79-R140 HydrophobicContact CB-CB 4.33Å; H79-R140 VanDerWaalsContact CD2-CG 3.49Å; H79-R140 WeakPolarHBondContact CD2-CG 3.33Å; H79-R140 PolarHBondContact CE1-NH1 3.19Å; H79-R140 VanDerWaalsContact CE1-NH1 3.31Å; H79-R140 WeakPolarHBondContact NE2-CD 3.38Å; H79-R140 PolarHBondContact NE2-NH1 3.23Å; L80-R140 CarbonylContact O-C 3.49Å; L80-R140 WeakPolarHBondContact O-CA 3.34Å; L81-R140 HydrophobicContact CD1-CG 3.86Å
141	L	95.9	Very high	85	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.2	174.5	-63.4	124.3	0	0	0	109.4	I17 L19 L31 F38 W40 H79 L80 V82 P143 M152	I17-L141 HydrophobicContact CG2-CB 3.94Å; I17-L141 HydrophobicContact CG2-CD2 3.81Å; I17-L141 HydrophobicContact CG2-CG 4.5Å; L19-L141 HydrophobicContact CD1-CD2 4.1Å; L19-L141 HydrophobicContact CD1-CG 4.1Å; L31-L141 HydrophobicContact CB-CD2 4.48Å; L31-L141 HydrophobicContact CD1-CD2 4.34Å; L31-L141 HydrophobicContact CD2-CD2 4.03Å; F38-L141 HydrophobicContact CE2-CD1 3.72Å; F38-L141 HydrophobicContact CE2-CD2 4.13Å; F38-L141 HydrophobicContact CZ-CD1 3.97Å; F38-L141 HydrophobicContact CZ-CD2 3.86Å; F38-L141 HydrophobicContact CZ-CG 4.42Å; W40-L141 HydrophobicContact CE3-CD2 4.14Å; W40-L141 HydrophobicContact CZ3-CD2 3.82Å; H79-L141 CarbonylContact C-O 3.57Å; H79-L141 VanDerWaalsContact CA-O 3.29Å; H79-L141 WeakPolarHBondContact CA-O 3.33Å; H79-L141 WeakPolarHBondContact CB-O 3.21Å; L80-L141 HydrophobicContact CB-CB 4.29Å; L80-L141 HydrophobicContact CB-CD1 4.44Å; L80-L141 HydrophobicContact CD2-CD1 4.11Å; L80-L141 HydrophobicContact CG-CD1 4.43Å; L80-L141 PolarHBondContact N-O 3.48Å; L80-L141 PolarHBondContact O-N 3.47Å; V82-L141 HydrophobicContact CG2-CD1 3.63Å; L141-P143 WeakPolarHBondContact O-CD 3.48Å; L141-M152 HydrophobicContact CB-CE 3.65Å; L141-M152 HydrophobicContact CG-CE 4.49Å
142	V	95.2	Very high	86.9	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.079	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	100.6	-178.3	-170.8	0	0	0	0	108.4	I17 S18 Y20 F75 H77 H79	I17-V142 WeakPolarHBondContact CA-O 3.5Å; S18-V142 PolarHBondContact N-O 3.46Å; S18-V142 PolarHBondContact O-N 2.88Å; Y20-V142 HydrophobicContact CD2-CB 4.45Å; Y20-V142 HydrophobicContact CD2-CG2 3.52Å; Y20-V142 HydrophobicContact CE2-CB 4.14Å; Y20-V142 HydrophobicContact CE2-CG2 3.51Å; F75-V142 HydrophobicContact CE1-CG2 3.44Å; F75-V142 VanDerWaalsContact CE1-CG2 3.44Å; F75-V142 HydrophobicContact CZ-CG2 3.77Å; H77-V142 HydrophobicContact CB-CG1 3.49Å; H77-V142 VanDerWaalsContact CB-CG1 3.49Å; H79-V142 HydrophobicContact CB-CG2 3.9Å
143	P	94.1	Very high	89.1	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.065	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	154.8	171.9	30.4	-33.1	0	0	0	110.6	I17 L141 D145 Q148 L149 M152	I17-P143 HydrophobicContact CG1-CB 4.32Å; L141-P143 WeakPolarHBondContact O-CD 3.48Å; P143-D145 WeakPolarHBondContact CB-O 3.49Å; P143-D145 WeakPolarHBondContact CG-O 3.26Å; P143-D145 PolarHBondContact O-N 3.13Å; P143-Q148 HydrophobicContact CB-CB 4.3Å; P143-L149 VanDerWaalsContact CD-CD2 3.46Å; P143-L149 HydrophobicContact CG-CD2 3.52Å; P143-L149 HydrophobicContact CG-CG 3.65Å; P143-M152 HydrophobicContact CB-SD 3.96Å; P143-M152 HydrophobicContact CG-SD 3.9Å
144	Q	92.2	Very high	91.2	Very high	162 Å²	162	50 Å²	50	76%	0.757	28%	0.275	S	S	*	.	S	Bend	trans	-64.6	-32.4	173.6	-172.2	175.9	21.3	0	0	112.2	N16	N16-Q144 HydrophobicContact CB-CB 4.49Å
145	D	91.8	Very high	92.7	Very high	77 Å²	77	48.4 Å²	48.4	41%	0.412	26%	0.259	S	S	.	.	S	Bend	trans	-115.1	123.4	176.5	-180	-96.8	0	0	0	110.3	P143 A147 Q148	P143-D145 WeakPolarHBondContact CB-O 3.49Å; P143-D145 WeakPolarHBondContact CG-O 3.26Å; P143-D145 PolarHBondContact O-N 3.13Å; D145-A147 PolarHBondContact O-N 2.69Å; D145-A147 WeakPolarHBondContact OD1-CA 3.15Å; D145-A147 WeakPolarHBondContact OD1-CB 3.17Å; D145-A147 PolarHBondContact OD1-N 3.04Å; D145-Q148 HydrophobicContact CB-CG 4.3Å; D145-Q148 WeakPolarHBondContact O-CB 3.38Å; D145-Q148 PolarHBondContact O-N 2.77Å; D145-Q148 PolarHBondContact OD1-N 2.85Å
146	S	88.7	Confident	93.2	Very high	67 Å²	67	46.1 Å²	46.1	47%	0.469	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-14.7	-177	57	0	0	0	0	114	Q148 L149	S146-Q148 PolarHBondContact O-N 2.92Å; S146-L149 WeakPolarHBondContact O-CB 3.46Å; S146-L149 PolarHBondContact O-N 3.16Å
147	A	90.1	Very high	93.4	Very high	71 Å²	71	45 Å²	45	59%	0.587	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-21.3	176	0	0	0	0	0	111.7	D145 L149	D145-A147 PolarHBondContact O-N 2.69Å; D145-A147 WeakPolarHBondContact OD1-CA 3.15Å; D145-A147 WeakPolarHBondContact OD1-CB 3.17Å; D145-A147 PolarHBondContact OD1-N 3.04Å; A147-L149 VanDerWaalsContact C-N 3.25Å; A147-L149 PolarHBondContact O-N 3.26Å
148	Q	92.3	Very high	93.4	Very high	45 Å²	45	48 Å²	48	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-72.2	-17.6	174.9	-63.4	167	7	0	0	112.9	Q14 P143 D145 S146 E150 D151 M152	Q14-Q148 VanDerWaalsContact NE2-OE1 3.11Å; P143-Q148 HydrophobicContact CB-CB 4.3Å; D145-Q148 HydrophobicContact CB-CG 4.3Å; D145-Q148 WeakPolarHBondContact O-CB 3.38Å; D145-Q148 PolarHBondContact O-N 2.77Å; D145-Q148 PolarHBondContact OD1-N 2.85Å; S146-Q148 PolarHBondContact O-N 2.92Å; Q148-E150 VanDerWaalsContact C-N 3.28Å; Q148-E150 PolarHBondContact O-N 2.84Å; Q148-D151 PolarHBondContact O-N 2.8Å; Q148-D151 VanDerWaalsContact O-N 3.14Å; Q148-M152 WeakPolarHBondContact O-CB 3.47Å; Q148-M152 VanDerWaalsContact O-CG 3.27Å; Q148-M152 WeakPolarHBondContact O-CG 3.4Å; Q148-M152 PolarHBondContact O-N 2.97Å
149	L	93.2	Very high	93.3	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-38.5	-179.9	-73.4	171	0	0	0	112.5	I59 P78 L80 P143 S146 A147 D151 M152 Y153	I59-L149 HydrophobicContact CG2-CB 4.29Å; I59-L149 HydrophobicContact CG2-CD1 4.3Å; P78-L149 HydrophobicContact CB-CD1 3.65Å; P78-L149 HydrophobicContact CG-CD1 4.31Å; L80-L149 HydrophobicContact CB-CD2 4.15Å; P143-L149 VanDerWaalsContact CD-CD2 3.46Å; P143-L149 HydrophobicContact CG-CD2 3.52Å; P143-L149 HydrophobicContact CG-CG 3.65Å; S146-L149 WeakPolarHBondContact O-CB 3.46Å; S146-L149 PolarHBondContact O-N 3.16Å; A147-L149 VanDerWaalsContact C-N 3.25Å; A147-L149 PolarHBondContact O-N 3.26Å; L149-D151 VanDerWaalsContact C-N 3.33Å; L149-M152 HydrophobicContact CD2-SD 4.4Å; L149-Y153 WeakPolarHBondContact O-CB 3.28Å; L149-Y153 PolarHBondContact O-N 2.82Å
150	E	94.3	Very high	93	Very high	85 Å²	85	48.3 Å²	48.3	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-64.7	-41.2	176.8	-57.3	-53.3	126.7	0	0	111.2	I59 R61 Q148 K154	I59-E150 WeakPolarHBondContact CD1-OE1 3.39Å; R61-E150 IonicContact CZ-OE1 3.39Å; R61-E150 IonicContact NE-OE1 3.4Å; R61-E150 PolarHBondContact NE-OE1 3.43Å; R61-E150 VanDerWaalsContact NH2-CD 3.26Å; R61-E150 IonicContact NH2-OE1 2.61Å; R61-E150 PolarHBondContact NH2-OE1 3.27Å; R61-E150 IonicContact NH2-OE2 3.33Å; R61-E150 PolarHBondContact NH2-OE2 3.29Å; Q148-E150 VanDerWaalsContact C-N 3.28Å; Q148-E150 PolarHBondContact O-N 2.84Å; E150-K154 WeakPolarHBondContact O-CB 3.37Å; E150-K154 PolarHBondContact O-N 2.89Å
151	D	94.1	Very high	92.7	Very high	90 Å²	90	49.9 Å²	49.9	48%	0.481	28%	0.277	S	S	.	.	H	α-helix	trans	-71.6	-41.6	-179	-154	-131.1	0	0	0	111	F12 Q148 L149 K154 A155	F12-D151 HydrophobicContact CD2-CB 4.3Å; F12-D151 WeakPolarHBondContact CD2-OD1 3.49Å; F12-D151 HydrophobicContact CE2-CB 3.78Å; F12-D151 WeakPolarHBondContact CE2-OD1 3.5Å; Q148-D151 PolarHBondContact O-N 2.8Å; Q148-D151 VanDerWaalsContact O-N 3.14Å; L149-D151 VanDerWaalsContact C-N 3.33Å; D151-K154 PolarHBondContact O-N 3.03Å; D151-A155 VanDerWaalsContact O-CB 3.27Å; D151-A155 WeakPolarHBondContact O-CB 3.42Å; D151-A155 PolarHBondContact O-N 2.93Å
152	M	94.1	Very high	92.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.8	-49.8	171.6	-72.6	172	61.1	0	0	111.8	F12 I17 L31 L80 L141 P143 Q148 L149 L156	F12-M152 HydrophobicContact CD1-CG 4.31Å; F12-M152 HydrophobicContact CE1-CB 4.21Å; F12-M152 HydrophobicContact CE1-CG 3.3Å; F12-M152 HydrophobicContact CE2-CG 4.34Å; F12-M152 HydrophobicContact CZ-CB 4.27Å; F12-M152 HydrophobicContact CZ-CG 3.3Å; I17-M152 HydrophobicContact CD1-CE 4.05Å; I17-M152 HydrophobicContact CD1-SD 4.12Å; L31-M152 HydrophobicContact CD2-CE 3.82Å; L80-M152 HydrophobicContact CB-CE 4.11Å; L80-M152 HydrophobicContact CD2-CB 4.12Å; L80-M152 HydrophobicContact CD2-CE 4.03Å; L141-M152 HydrophobicContact CB-CE 3.65Å; L141-M152 HydrophobicContact CG-CE 4.49Å; P143-M152 HydrophobicContact CB-SD 3.96Å; P143-M152 HydrophobicContact CG-SD 3.9Å; Q148-M152 WeakPolarHBondContact O-CB 3.47Å; Q148-M152 VanDerWaalsContact O-CG 3.27Å; Q148-M152 WeakPolarHBondContact O-CG 3.4Å; Q148-M152 PolarHBondContact O-N 2.97Å; L149-M152 HydrophobicContact CD2-SD 4.4Å; M152-L156 WeakPolarHBondContact O-CB 3.17Å; M152-L156 PolarHBondContact O-N 3.45Å
153	Y	94.9	Very high	91.8	Very high	89 Å²	89	56.4 Å²	56.4	35%	0.349	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-47.8	179	174.5	-90.5	0	0	0	110.9	H57 I59 L80 L149 L156 A157	H57-Y153 AromaticContact CD2-CD2 3.63Å; H57-Y153 AromaticContact CD2-CE2 3.39Å; H57-Y153 WeakPolarHBondContact CD2-CE2 3.47Å; H57-Y153 AromaticContact NE2-CE2 3.81Å; I59-Y153 VanDerWaalsContact CD1-CB 3.47Å; I59-Y153 HydrophobicContact CD1-CD1 4.18Å; I59-Y153 HydrophobicContact CD1-CD2 4.02Å; I59-Y153 HydrophobicContact CD1-CG 3.62Å; I59-Y153 HydrophobicContact CG1-CD2 3.81Å; I59-Y153 HydrophobicContact CG1-CG 3.88Å; L80-Y153 HydrophobicContact CD1-CD2 3.92Å; L149-Y153 WeakPolarHBondContact O-CB 3.28Å; L149-Y153 PolarHBondContact O-N 2.82Å; Y153-L156 PolarHBondContact O-N 2.54Å; Y153-A157 WeakPolarHBondContact O-CB 3.21Å; Y153-A157 PolarHBondContact O-N 2.8Å
154	K	94.5	Very high	91.2	Very high	113 Å²	113	60.5 Å²	60.5	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-47.1	-179.8	-178.2	-178.1	176	-62.7	0	111.2	E150 D151 L156 A157 D158	E150-K154 WeakPolarHBondContact O-CB 3.37Å; E150-K154 PolarHBondContact O-N 2.89Å; D151-K154 PolarHBondContact O-N 3.03Å; K154-L156 VanDerWaalsContact C-N 3.32Å; K154-L156 PolarHBondContact O-N 2.85Å; K154-A157 PolarHBondContact O-N 3.05Å; K154-D158 IonicContact NZ-OD2 3.22Å; K154-D158 PolarHBondContact NZ-OD2 2.81Å; K154-D158 VanDerWaalsContact O-CB 3.3Å; K154-D158 WeakPolarHBondContact O-CB 3.48Å; K154-D158 PolarHBondContact O-N 3.37Å
155	A	93.8	Very high	90.5	Very high	7 Å²	7	56.3 Å²	56.3	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-41.6	178.1	0	0	0	0	0	111.8	F12 I33 D151 C159	F12-A155 HydrophobicContact CB-CB 3.38Å; F12-A155 HydrophobicContact CD2-CB 4.47Å; F12-A155 HydrophobicContact CG-CB 3.98Å; I33-A155 HydrophobicContact CB-CB 4.49Å; I33-A155 HydrophobicContact CD1-CB 3.91Å; I33-A155 HydrophobicContact CG2-CB 4.28Å; D151-A155 VanDerWaalsContact O-CB 3.27Å; D151-A155 WeakPolarHBondContact O-CB 3.42Å; D151-A155 PolarHBondContact O-N 2.93Å; A155-C159 WeakPolarHBondContact O-CB 3.34Å; A155-C159 PolarHBondContact O-N 3.2Å; A155-C159 PolarHBondContact O-SG 3.2Å
156	L	93.4	Very high	89.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.3	-44.3	176.7	-165.7	74.8	0	0	0	111.7	I33 F38 Y51 I54 H57 L80 V82 M152 Y153 K154 C159 Q160	I33-L156 HydrophobicContact CD1-CB 4.15Å; I33-L156 HydrophobicContact CD1-CD1 4.34Å; F38-L156 HydrophobicContact CD2-CD1 4.05Å; Y51-L156 HydrophobicContact CE1-CD1 3.82Å; I54-L156 HydrophobicContact CD1-CD1 4.07Å; H57-L156 HydrophobicContact CB-CD2 3.48Å; H57-L156 VanDerWaalsContact CB-CD2 3.48Å; L80-L156 HydrophobicContact CD2-CD2 4.24Å; V82-L156 HydrophobicContact CG2-CD2 4.24Å; M152-L156 WeakPolarHBondContact O-CB 3.17Å; M152-L156 PolarHBondContact O-N 3.45Å; Y153-L156 PolarHBondContact O-N 2.54Å; K154-L156 VanDerWaalsContact C-N 3.32Å; K154-L156 PolarHBondContact O-N 2.85Å; L156-C159 PolarHBondContact O-N 2.89Å; L156-Q160 WeakPolarHBondContact O-CB 3.31Å; L156-Q160 WeakPolarHBondContact O-CG 3.39Å; L156-Q160 PolarHBondContact O-N 2.9Å
157	A	92.8	Very high	88.8	Confident	29 Å²	29	63.8 Å²	63.8	24%	0.24	36%	0.356	C	S	.	.	H	α-helix	trans	-64.8	-44.1	178	0	0	0	0	0	112	Y153 K154 C159 Q160 A161	Y153-A157 WeakPolarHBondContact O-CB 3.21Å; Y153-A157 PolarHBondContact O-N 2.8Å; K154-A157 PolarHBondContact O-N 3.05Å; A157-C159 PolarHBondContact O-N 2.97Å; A157-Q160 PolarHBondContact O-N 3.23Å; A157-A161 PolarHBondContact O-N 3.47Å
158	D	92.5	Very high	87.8	Confident	66 Å²	66	64.9 Å²	64.9	35%	0.353	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-44.7	178.1	-72.2	-9.4	0	0	0	110.3	K154 A161 L162	K154-D158 IonicContact NZ-OD2 3.22Å; K154-D158 PolarHBondContact NZ-OD2 2.81Å; K154-D158 VanDerWaalsContact O-CB 3.3Å; K154-D158 WeakPolarHBondContact O-CB 3.48Å; K154-D158 PolarHBondContact O-N 3.37Å; D158-A161 PolarHBondContact O-N 3.24Å; D158-L162 WeakPolarHBondContact O-CG 3.45Å; D158-L162 PolarHBondContact O-N 3.49Å
159	C	91.8	Very high	86.3	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-71.9	-34	177.9	-63.3	0	0	0	0	113.3	I33 Y51 A155 L156 A157 A161 L162 N163	I33-C159 HydrophobicContact CG2-CB 4.27Å; Y51-C159 HydrophobicContact CD2-CB 4.5Å; Y51-C159 HydrophobicContact CE1-CB 3.94Å; Y51-C159 HydrophobicContact CE2-CB 3.62Å; Y51-C159 WeakPolarHBondContact OH-CB 3.47Å; A155-C159 WeakPolarHBondContact O-CB 3.34Å; A155-C159 PolarHBondContact O-N 3.2Å; A155-C159 PolarHBondContact O-SG 3.2Å; L156-C159 PolarHBondContact O-N 2.89Å; A157-C159 PolarHBondContact O-N 2.97Å; C159-A161 VanDerWaalsContact C-N 3.31Å; C159-A161 PolarHBondContact O-N 3.19Å; C159-L162 PolarHBondContact O-N 3.47Å; C159-N163 PolarHBondContact O-N 3.3Å; C159-N163 PolarHBondContact O-ND2 3.02Å
160	Q	89.1	Confident	84.7	Confident	42 Å²	42	73.2 Å²	73.2	20%	0.196	40%	0.398	C	S	.	.	H	α-helix	trans	-62.6	-39	171.7	-79.4	-169.7	2.7	0	0	111.9	Y51 I54 H57 L156 A157 L162 N163	Y51-Q160 HydrophobicContact CD1-CB 4.49Å; Y51-Q160 HydrophobicContact CD1-CG 3.46Å; Y51-Q160 VanDerWaalsContact CD1-CG 3.46Å; Y51-Q160 HydrophobicContact CE1-CG 4.2Å; Y51-Q160 HydrophobicContact CG-CG 4.05Å; I54-Q160 VanDerWaalsContact CB-NE2 3.28Å; H57-Q160 PolarHBondContact CE1-OE1 3.43Å; H57-Q160 PolarHBondContact ND1-NE2 3.34Å; H57-Q160 PolarHBondContact ND1-OE1 3.39Å; L156-Q160 WeakPolarHBondContact O-CB 3.31Å; L156-Q160 WeakPolarHBondContact O-CG 3.39Å; L156-Q160 PolarHBondContact O-N 2.9Å; A157-Q160 PolarHBondContact O-N 3.23Å; Q160-L162 PolarHBondContact O-N 3.03Å; Q160-N163 CarbonylContact O-C 3.51Å; Q160-N163 PolarHBondContact O-N 3.24Å
161	A	88.3	Confident	83.1	Confident	80 Å²	80	73 Å²	73	66%	0.661	41%	0.405	S	S	*	.	H	α-helix	trans	-64	-23.3	177.1	0	0	0	0	0	113.2	A157 D158 C159 N163	A157-A161 PolarHBondContact O-N 3.47Å; D158-A161 PolarHBondContact O-N 3.24Å; C159-A161 VanDerWaalsContact C-N 3.31Å; C159-A161 PolarHBondContact O-N 3.19Å; A161-N163 VanDerWaalsContact C-N 3.33Å
162	L	88	Confident	81.5	Confident	97 Å²	97	75.6 Å²	75.6	51%	0.508	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-13	173.9	-62.6	175.5	0	0	0	113.2	E35 D158 C159 Q160 P164	E35-L162 HydrophobicContact CG-CD1 4.13Å; D158-L162 WeakPolarHBondContact O-CG 3.45Å; D158-L162 PolarHBondContact O-N 3.49Å; C159-L162 PolarHBondContact O-N 3.47Å; Q160-L162 PolarHBondContact O-N 3.03Å; L162-P164 VanDerWaalsContact C-CD 3.46Å; L162-P164 WeakPolarHBondContact O-CD 3.49Å
163	N	84.5	Confident	79.8	Confident	52 Å²	52	83.2 Å²	83.2	28%	0.278	45%	0.453	S	S	.	.	S	Bend	trans	-123.9	69.3	-177.8	-64.1	-90.9	0	0	0	110.4	E35 Y51 C159 Q160 A161	E35-N163 PolarHBondContact O-ND2 3.47Å; Y51-N163 HydrophobicContact CD2-CB 4.25Å; Y51-N163 VanDerWaalsContact CD2-ND2 3.34Å; Y51-N163 WeakPolarHBondContact CD2-ND2 3.5Å; C159-N163 PolarHBondContact O-N 3.3Å; C159-N163 PolarHBondContact O-ND2 3.02Å; Q160-N163 CarbonylContact O-C 3.51Å; Q160-N163 PolarHBondContact O-N 3.24Å; A161-N163 VanDerWaalsContact C-N 3.33Å
164	P	81.4	Confident	77.9	Confident	96 Å²	96	87.4 Å²	87.4	62%	0.623	48%	0.476	S	S	*	.			trans	-59.3	143.5	173.8	27	-34.1	0	0	0	110.2	L162	L162-P164 VanDerWaalsContact C-CD 3.46Å; L162-P164 WeakPolarHBondContact O-CD 3.49Å
165	D	77.2	Confident	76.1	Confident	74 Å²	74	85 Å²	85	40%	0.396	48%	0.483	S	S	.	.			trans	-63.5	128.9	176.1	-167.6	-37	0	0	0	109.2	E167 D168	D165-E167 PolarHBondContact O-N 3.48Å; D165-E167 PolarHBondContact OD1-N 3.32Å; D165-D168 HydrophobicContact CB-CB 3.94Å; D165-D168 WeakPolarHBondContact O-CB 3.23Å; D165-D168 PolarHBondContact O-N 2.92Å
166	P	73.6	Confident	74.2	Confident	123 Å²	123	92.9 Å²	92.9	80%	0.799	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.5	175.4	26.1	-37	0	0	0	114.1
167	E	72.1	Confident	72.1	Confident	179 Å²	179	97 Å²	97	84%	0.836	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-14.2	174.7	-59.1	-159.7	107.5	0	0	112.9	D165 D169	D165-E167 PolarHBondContact O-N 3.48Å; D165-E167 PolarHBondContact OD1-N 3.32Å; E167-D169 PolarHBondContact O-N 3.12Å
168	D	68	Low	70.3	Confident	94 Å²	94	104.9 Å²	104.9	50%	0.503	58%	0.582	S	S	.	*			trans	-80.8	64	173.2	-167.6	22.7	0	0	0	110.1	D165 N170	D165-D168 HydrophobicContact CB-CB 3.94Å; D165-D168 WeakPolarHBondContact O-CB 3.23Å; D165-D168 PolarHBondContact O-N 2.92Å; D168-N170 VanDerWaalsContact C-N 3.27Å; D168-N170 PolarHBondContact O-N 3.49Å; D168-N170 PolarHBondContact O-ND2 2.75Å
169	D	60.8	Low	68.4	Low	119 Å²	119	108.3 Å²	108.3	64%	0.636	60%	0.6	S	S	*	*			trans	-67.9	92.9	167.3	-160	-24.5	0	0	0	107.4	E167 S171	E167-D169 PolarHBondContact O-N 3.12Å; D169-S171 PolarHBondContact O-N 2.83Å; D169-S171 WeakPolarHBondContact OD1-CB 3.28Å; D169-S171 PolarHBondContact OD1-N 2.77Å; D169-S171 PolarHBondContact OD1-OG 3.23Å
170	N	60.5	Low	66.5	Low	103 Å²	103	113.2 Å²	113.2	55%	0.551	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-58.7	2.6	177.5	-77	-91.7	0	0	0	113.3	D168 D172 F173	D168-N170 VanDerWaalsContact C-N 3.27Å; D168-N170 PolarHBondContact O-N 3.49Å; D168-N170 PolarHBondContact O-ND2 2.75Å; N170-D172 PolarHBondContact O-N 2.84Å; N170-F173 PolarHBondContact O-N 2.9Å
171	S	60	Low	64.6	Low	79 Å²	79	120.2 Å²	120.2	55%	0.552	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-63.3	-18.4	179.5	54.7	0	0	0	0	114.8	D169	D169-S171 PolarHBondContact O-N 2.83Å; D169-S171 WeakPolarHBondContact OD1-CB 3.28Å; D169-S171 PolarHBondContact OD1-N 2.77Å; D169-S171 PolarHBondContact OD1-OG 3.23Å
172	D	59.8	Low	63.3	Low	146 Å²	146	124.5 Å²	124.5	78%	0.781	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-88.4	-9.2	179.4	-131.2	12	0	0	0	113.8	N170	N170-D172 PolarHBondContact O-N 2.84Å
173	F	58.2	Low	61.6	Low	159 Å²	159	128.8 Å²	128.8	70%	0.697	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-86.2	-15.9	177.8	-172.6	-104.6	0	0	0	114	N170 G175	N170-F173 PolarHBondContact O-N 2.9Å; F173-G175 PolarHBondContact O-N 3.07Å
174	E	56.4	Low	60.6	Low	178 Å²	178	133.5 Å²	133.5	83%	0.832	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-69.8	14	173.2	-75.8	-87.4	155.1	0	0	113.2
175	G	55.7	Low	59.1	Low	63 Å²	63	134 Å²	134	65%	0.649	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-101.3	-8.4	179.6	0	0	0	0	0	116.6	F173	F173-G175 PolarHBondContact O-N 3.07Å
176	F	53.8	Low	58	Low	172 Å²	172	137.6 Å²	137.6	75%	0.754	72%	0.717	S	S	*	*	S	Bend	trans	-115.8	1.9	-174.7	-59	-74.7	0	0	0	115.1	E178	F176-E178 PolarHBondContact O-N 3.43Å
177	A	50.4	Low	56.9	Low	86 Å²	86	138.5 Å²	138.5	71%	0.711	71%	0.711	S	S	*	*	S	Bend	trans	-96.5	68.8	174	0	0	0	0	0	110.3
178	E	53.8	Low	55.7	Low	194 Å²	194	133 Å²	133	91%	0.907	70%	0.703	S	S	*	*	S	Bend	trans	168	89.7	153.7	-96.8	178	140.1	0	0	108.9	F176	F176-E178 PolarHBondContact O-N 3.43Å
179	N	53.2	Low	55	Low	138 Å²	138	135.8 Å²	135.8	74%	0.738	71%	0.714	S	S	*	*			trans	158.3	83.1	136.3	-175.4	57.3	0	0	0	109.3
180	D	51.7	Low	54.2	Low	104 Å²	104	138.8 Å²	138.8	56%	0.556	72%	0.724	S	S	*	*			trans	-153.8	57.5	157.3	-94.3	-27	0	0	0	108.7	Y182	D180-Y182 HydrophobicContact CB-CD2 3.81Å; D180-Y182 HydrophobicContact CB-CE1 4.41Å; D180-Y182 HydrophobicContact CB-CE2 3.31Å; D180-Y182 PolarHBondContact O-N 2.69Å; D180-Y182 WeakPolarHBondContact OD1-CE1 3.14Å; D180-Y182 PolarHBondContact OD1-OH 3.08Å; D180-Y182 WeakPolarHBondContact OD2-CE2 3.3Å; D180-Y182 PolarHBondContact OD2-OH 3.18Å
181	E	50.4	Low	53.6	Low	189 Å²	189	141.8 Å²	141.8	88%	0.883	73%	0.733	S	S	*	*			trans	-65.7	74	150.7	-65.5	-175.1	153.2	0	0	107.7	E183	E181-E183 PolarHBondContact O-N 3.49Å
182	Y	60.1	Low	52.8	Low	170 Å²	170	145 Å²	145	67%	0.667	74%	0.739	S	S	*	*			trans	-71.3	92.8	157.1	-47.3	-75.5	0	0	0	106.1	D180 I184	D180-Y182 HydrophobicContact CB-CD2 3.81Å; D180-Y182 HydrophobicContact CB-CE1 4.41Å; D180-Y182 HydrophobicContact CB-CE2 3.31Å; D180-Y182 PolarHBondContact O-N 2.69Å; D180-Y182 WeakPolarHBondContact OD1-CE1 3.14Å; D180-Y182 PolarHBondContact OD1-OH 3.08Å; D180-Y182 WeakPolarHBondContact OD2-CE2 3.3Å; D180-Y182 PolarHBondContact OD2-OH 3.18Å; Y182-I184 VanDerWaalsContact C-N 3.34Å; Y182-I184 PolarHBondContact O-N 3.33Å
183	E	51.7	Low	52	Low	186 Å²	186	145.4 Å²	145.4	87%	0.869	74%	0.742	S	S	*	*			trans	-53.5	102.8	161.7	-173.8	168.3	103.2	0	0	107.1	E181 D185	E181-E183 PolarHBondContact O-N 3.49Å; E183-D185 PolarHBondContact O-N 3.03Å
184	I	63.7	Low	51.2	Low	152 Å²	152	144.8 Å²	144.8	78%	0.779	74%	0.74	S	S	*	*			trans	-66.3	94.7	168.9	-63.5	171.3	0	0	0	105.1	Y182 D186	Y182-I184 VanDerWaalsContact C-N 3.34Å; Y182-I184 PolarHBondContact O-N 3.33Å; I184-D186 PolarHBondContact O-N 2.67Å
185	D	50	Low	50.5	Low	106 Å²	106	141.1 Å²	141.1	57%	0.567	73%	0.731	S	S	*	*			trans	-63	107.2	162.2	-174.1	-174.1	0	0	0	106.4	E183 Q187	E183-D185 PolarHBondContact O-N 3.03Å; D185-Q187 HydrophobicContact CB-CG 4.33Å; D185-Q187 VanDerWaalsContact CG-CG 3.49Å; D185-Q187 PolarHBondContact O-N 3.49Å; D185-Q187 WeakPolarHBondContact OD1-CG 3.46Å; D185-Q187 PolarHBondContact OD1-NE2 3.15Å
186	D	53.4	Low	50	Low	149 Å²	149	145.2 Å²	145.2	80%	0.797	74%	0.738	S	S	*	*			trans	-64.2	64.6	171.9	-168.6	71.4	0	0	0	109	I184 G188	I184-D186 PolarHBondContact O-N 2.67Å; D186-G188 PolarHBondContact O-N 3.22Å
187	Q	51.5	Low	49.3	Very low	142 Å²	142	143.3 Å²	143.3	66%	0.664	74%	0.735	S	S	*	*			trans	-78.4	87.4	166.2	-62.4	-166	-1.5	0	0	107	D185 M189	D185-Q187 HydrophobicContact CB-CG 4.33Å; D185-Q187 VanDerWaalsContact CG-CG 3.49Å; D185-Q187 PolarHBondContact O-N 3.49Å; D185-Q187 WeakPolarHBondContact OD1-CG 3.46Å; D185-Q187 PolarHBondContact OD1-NE2 3.15Å; Q187-M189 PolarHBondContact O-N 3.14Å
188	G	46.7	Very low	49	Very low	64 Å²	64	145.7 Å²	145.7	66%	0.66	74%	0.736	S	S	*	*			trans	-46.9	101.2	166.8	0	0	0	0	0	111	D186 E190	D186-G188 PolarHBondContact O-N 3.22Å; G188-E190 PolarHBondContact O-N 3.36Å
189	M	54	Low	48.4	Very low	153 Å²	153	143.4 Å²	143.4	75%	0.754	73%	0.725	S	S	*	*			trans	-95.4	80.5	164.9	-66.1	-72.7	-102.3	0	0	106.9	Q187 F191	Q187-M189 PolarHBondContact O-N 3.14Å; M189-F191 PolarHBondContact O-N 3.48Å; M189-F191 VanDerWaalsContact O-N 3.14Å
190	E	44.2	Very low	47.8	Very low	181 Å²	181	147.3 Å²	147.3	85%	0.846	73%	0.73	S	S	*	*			trans	-64.3	102.1	160.6	-69.4	-173.2	118.7	0	0	108.3	G188	G188-E190 PolarHBondContact O-N 3.36Å
191	F	47.9	Very low	47.3	Very low	166 Å²	166	151.2 Å²	151.2	73%	0.728	74%	0.742	S	S	*	*			trans	-135	89.8	160.4	-81.1	-76.7	0	0	0	110.4	M189	M189-F191 PolarHBondContact O-N 3.48Å; M189-F191 VanDerWaalsContact O-N 3.14Å
192	E	42.9	Very low	46.8	Very low	146 Å²	146	145 Å²	145	68%	0.682	73%	0.728	S	S	*	*			trans	31.8	108	141.5	-67.9	172.2	99.8	0	0	118.3	H194	E192-H194 PolarHBondContact O-N 3.28Å
193	N	42.8	Very low	46.1	Very low	156 Å²	156	145.7 Å²	145.7	83%	0.834	74%	0.737	S	S	*	*			trans	-52	95.9	155.4	-81	-67.4	0	0	0	110.8	T195	N193-T195 PolarHBondContact O-N 3.08Å
194	H	40.7	Very low	45.9	Very low	145 Å²	145	142.2 Å²	142.2	67%	0.671	73%	0.731	S	S	*	*			trans	-94.1	81.6	155.6	-71.3	-54	0	0	0	109.4	E192 N196	E192-H194 PolarHBondContact O-N 3.28Å; H194-N196 PolarHBondContact O-N 3.46Å
195	T	41.7	Very low	44.8	Very low	102 Å²	102	141.3 Å²	141.3	63%	0.626	73%	0.728	S	S	*	*			trans	-60.2	84.2	161.6	-27.3	0	0	0	0	108.8	N193 N197	N193-T195 PolarHBondContact O-N 3.08Å; T195-N197 PolarHBondContact O-N 2.85Å
196	N	44.9	Very low	44.8	Very low	149 Å²	149	145 Å²	145	80%	0.797	74%	0.742	S	S	*	*			trans	-82.2	70.7	166.1	-78.6	-19.6	0	0	0	109.1	H194 N198	H194-N196 PolarHBondContact O-N 3.46Å; N196-N198 VanDerWaalsContact C-N 3.29Å; N196-N198 PolarHBondContact O-N 3.42Å; N196-N198 VanDerWaalsContact O-N 3.15Å
197	N	39.9	Very low	44.2	Very low	132 Å²	132	146.5 Å²	146.5	71%	0.706	74%	0.741	S	S	*	*			trans	-65	97.2	146.2	-81	-37.6	0	0	0	106.7	T195	T195-N197 PolarHBondContact O-N 2.85Å
198	N	43.1	Very low	44.2	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	74%	0.744	S	S	*	*			trans	-127.5	85.8	153.1	-164.2	26.9	0	0	0	108.2	N196 R200	N196-N198 VanDerWaalsContact C-N 3.29Å; N196-N198 PolarHBondContact O-N 3.42Å; N196-N198 VanDerWaalsContact O-N 3.15Å; N198-R200 PolarHBondContact O-N 2.89Å
199	E	41.3	Very low	44	Very low	146 Å²	146	148.5 Å²	148.5	68%	0.682	75%	0.754	S	S	*	*			trans	-35.8	98.4	149.4	-66.5	163.1	80.4	0	0	110.2	F201	E199-F201 HydrophobicContact CB-CD2 4.33Å; E199-F201 HydrophobicContact CG-CD2 4.49Å; E199-F201 PolarHBondContact O-N 3.15Å
200	R	41.6	Very low	43.9	Very low	220 Å²	220	149.2 Å²	149.2	83%	0.83	78%	0.784	S	S	*	*			trans	-93.7	62.7	153.6	-125.6	-177.5	-167.6	-111.4	4.1	108.1	N198	N198-R200 PolarHBondContact O-N 2.89Å
201	F	41.5	Very low	43.9	Very low	187 Å²	187	147.7 Å²	147.7	82%	0.82	78%	0.781	S	S	*	*			trans	-64.4	123.9	153.1	-100	-93.6	0	0	0	107.7	E199	E199-F201 HydrophobicContact CB-CD2 4.33Å; E199-F201 HydrophobicContact CG-CD2 4.49Å; E199-F201 PolarHBondContact O-N 3.15Å
202	G	38.7	Very low	43.6	Very low	57 Å²	57	146.7 Å²	146.7	59%	0.588	78%	0.784	S	S	*	*			trans	116.3	101.9	163	0	0	0	0	0	114.1
203	E	46.2	Very low	43.7	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.864	79%	0.789	S	S	*	*				-143.7	135.5	102.9	-107.2	173.6	88.8	0	0	109.9
204	P	46.9	Very low	43.7	Very low	113 Å²	113	146.2 Å²	146.2	73%	0.734	79%	0.787	S	S	*	*			trans	-90.3	156.3	-168	36.4	-34	0	0	0	112.9	Q206	P204-Q206 PolarHBondContact O-N 2.92Å; P204-Q206 VanDerWaalsContact O-N 3.16Å
205	D	41.4	Very low	43.9	Very low	134 Å²	134	146.3 Å²	146.3	72%	0.717	79%	0.794	S	S	*	*			trans	-32.1	106.1	162.2	-147.6	-53.7	0	0	0	113.5	F207	D205-F207 WeakPolarHBondContact OD1-CD2 3.21Å; D205-F207 WeakPolarHBondContact OD1-CE2 3.33Å
206	Q	49.5	Very low	44.1	Very low	183 Å²	183	149.2 Å²	149.2	86%	0.855	81%	0.805	S	S	*	*			trans	-103.2	78	170.6	-157.9	171.1	56.1	0	0	108.8	P204 A208	P204-Q206 PolarHBondContact O-N 2.92Å; P204-Q206 VanDerWaalsContact O-N 3.16Å; Q206-A208 PolarHBondContact O-N 2.9Å
207	F	40.2	Very low	44	Very low	180 Å²	180	149.2 Å²	149.2	79%	0.789	81%	0.806	S	S	*	*			trans	-55.3	112.5	151	-92.1	-93.2	0	0	0	108.7	D205	D205-F207 WeakPolarHBondContact OD1-CD2 3.21Å; D205-F207 WeakPolarHBondContact OD1-CE2 3.33Å
208	A	52.2	Low	44.3	Very low	86 Å²	86	150.5 Å²	150.5	71%	0.711	81%	0.813	S	S	*	*			trans	-142.3	83.7	156.1	0	0	0	0	0	108.1	Q206 A210	Q206-A208 PolarHBondContact O-N 2.9Å; A208-A210 PolarHBondContact O-N 3.31Å
209	D	41.5	Very low	44.4	Very low	163 Å²	163	151.8 Å²	151.8	87%	0.872	82%	0.821	S	S	*	*			trans	-65.8	113.1	157.1	-166.9	-95	0	0	0	107.7
210	A	52.4	Low	44.7	Very low	168 Å²	168	152.4 Å²	152.4	100%	1.388	83%	0.833	S	S	*	*			trans	-162.6	0	160.6	0	0	0	0	0	110.4	A208	A208-A210 PolarHBondContact O-N 3.31Å

Retrieved 210 of 210 residues in 56.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).