A0A077ZM19_TRITR Loading...

PDZ domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZM19, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 270 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	77.7	Confident	246 Å²	246	85.7 Å²	85.7	100%	1.212	47%	0.474	S	S	*	.				0	98.5	0	-87	-177.7	-100.4	0	0	105.8
2	T	48.6	Very low	79	Confident	68 Å²	68	78.7 Å²	78.7	42%	0.417	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-55.5	139.5	165.4	31.7	0	0	0	0	108.1	A4	T2-A4 PolarHBondContact O-N 2.99Å
3	A	58.7	Low	79.9	Confident	84 Å²	84	77.2 Å²	77.2	69%	0.694	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-62.8	134.2	176.5	0	0	0	0	0	108.7	M5	A3-M5 PolarHBondContact O-N 3.12Å
4	A	65.9	Low	80.2	Confident	63 Å²	63	72.7 Å²	72.7	52%	0.521	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-63.7	127.1	175.6	0	0	0	0	0	109.2	T2 T24	T2-A4 PolarHBondContact O-N 2.99Å; A4-T24 HydrophobicContact CB-CG2 3.7Å
5	M	82.5	Confident	80.1	Confident	105 Å²	105	76.7 Å²	76.7	52%	0.517	41%	0.405	S	S	.	.	S	Bend	trans	-78.9	-34.1	176.4	-66.3	-177.9	69.7	0	0	111.1	A3 L25 E27 C236	A3-M5 PolarHBondContact O-N 3.12Å; M5-L25 PolarHBondContact N-O 3.01Å; M5-E27 HydrophobicContact SD-CG 3.94Å; M5-C236 PolarHBondContact SD-SG 3.49Å
6	R	91.5	Very high	80.1	Confident	81 Å²	81	80.9 Å²	80.9	31%	0.306	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	143	178.8	-174.9	171.8	-127.5	93.7	20.3	110.7	T24 L25 W229 S232	R6-T24 CarbonylContact O-C 3.45Å; R6-T24 WeakPolarHBondContact O-CA 3.35Å; R6-L25 HydrophobicContact CB-CB 4.31Å; R6-L25 PolarHBondContact N-O 3.4Å; R6-L25 PolarHBondContact O-N 3.5Å; R6-W229 HydrophobicContact CB-CH2 4.29Å; R6-W229 HydrophobicContact CB-CZ3 4.48Å; R6-W229 HydrophobicContact CG-CH2 3.83Å; R6-W229 HydrophobicContact CG-CZ2 3.76Å; R6-W229 HydrophobicContact CG-CZ3 4.24Å; R6-S232 PolarHBondContact NH1-OG 3.47Å
7	S	93.4	Very high	80.4	Confident	75 Å²	75	83.5 Å²	83.5	52%	0.524	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	132.6	169.2	-169.2	0	0	0	0	110	V23 T24	S7-V23 VanDerWaalsContact CA-O 3.27Å; S7-V23 WeakPolarHBondContact CA-O 3.48Å; S7-V23 PolarHBondContact OG-O 2.81Å; S7-T24 PolarHBondContact OG-OG1 2.8Å
8	S	93.4	Very high	80.9	Confident	34 Å²	34	82.2 Å²	82.2	24%	0.238	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	172.5	171.9	80.7	0	0	0	0	110.5	V23 W229	S8-V23 PolarHBondContact N-O 2.83Å; S8-V23 PolarHBondContact O-N 2.99Å; S8-W229 WeakPolarHBondContact OG-CZ2 3.25Å; S8-W229 PolarHBondContact OG-NE1 3.36Å
9	Y	93.7	Very high	81.2	Confident	123 Å²	123	79.6 Å²	79.6	48%	0.482	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.2	170.3	-67.6	-82.4	0	0	0	110.6	R20 V21 D35	Y9-R20 HydrophobicContact CD1-CG 4.29Å; Y9-V21 WeakPolarHBondContact CA-O 3.36Å; Y9-D35 HydrophobicContact CD1-CB 4.05Å; Y9-D35 HydrophobicContact CE1-CB 3.75Å; Y9-D35 WeakPolarHBondContact CE1-OD2 3.48Å
10	L	94.9	Very high	81.7	Confident	7 Å²	7	80.9 Å²	80.9	4%	0.037	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	172	170.5	-60.3	-175.7	0	0	0	108.8	R20 V21 V23 F218 C220 W229	L10-R20 WeakPolarHBondContact O-CA 3.41Å; L10-V21 PolarHBondContact N-O 3.46Å; L10-V21 WeakPolarHBondContact O-CG2 3.31Å; L10-V21 PolarHBondContact O-N 2.69Å; L10-V21 VanDerWaalsContact O-O 3.05Å; L10-V23 HydrophobicContact CB-CG2 3.89Å; L10-V23 HydrophobicContact CD1-CB 4.07Å; L10-V23 HydrophobicContact CD1-CG1 4.27Å; L10-V23 HydrophobicContact CD1-CG2 3.93Å; L10-V23 HydrophobicContact CG-CB 4.26Å; L10-V23 HydrophobicContact CG-CG2 4.02Å; L10-F218 HydrophobicContact CB-CD1 4.36Å; L10-F218 HydrophobicContact CD1-CB 4.31Å; L10-F218 HydrophobicContact CD1-CD1 4.15Å; L10-F218 HydrophobicContact CD1-CG 4.39Å; L10-C220 HydrophobicContact CD2-CB 3.9Å; L10-C220 VanDerWaalsContact CD2-SG 3.52Å; L10-W229 HydrophobicContact CD1-CD2 4.11Å; L10-W229 HydrophobicContact CD1-CG 4.4Å; L10-W229 HydrophobicContact CD1-CZ2 4.39Å
11	E	93.7	Very high	82.1	Confident	57 Å²	57	77 Å²	77	27%	0.266	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.2	165.9	-61.9	173.4	100.5	0	0	109.6	W18 H19 F218 R219	E11-W18 HydrophobicContact CB-CB 4.38Å; E11-W18 HydrophobicContact CB-CE3 3.83Å; E11-H19 CarbonylContact C-O 3.56Å; E11-H19 VanDerWaalsContact CA-O 3.25Å; E11-H19 WeakPolarHBondContact CA-O 3.37Å; E11-F218 CarbonylContact O-C 3.56Å; E11-F218 WeakPolarHBondContact O-CA 2.87Å; E11-R219 HydrophobicContact CB-CB 4.33Å; E11-R219 PolarHBondContact N-O 3.09Å; E11-R219 PolarHBondContact O-N 3.1Å; E11-R219 IonicContact OE1-CZ 3.24Å; E11-R219 IonicContact OE1-NH2 3.17Å; E11-R219 PolarHBondContact OE1-NH2 2.96Å; E11-R219 IonicContact OE2-CZ 3.61Å; E11-R219 IonicContact OE2-NE 2.99Å; E11-R219 PolarHBondContact OE2-NE 3.3Å; E11-R219 IonicContact OE2-NH2 3.67Å; E11-R219 PolarHBondContact OE2-NH2 3.19Å
12	V	93.1	Very high	84.6	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.1	173.2	68.4	0	0	0	0	109.5	H19 V21 L32 I155 I159 I216 F218	V12-H19 HydrophobicContact CG1-CB 4.33Å; V12-H19 PolarHBondContact N-O 2.91Å; V12-H19 PolarHBondContact O-N 3.15Å; V12-V21 HydrophobicContact CB-CG2 4.03Å; V12-V21 HydrophobicContact CG1-CB 4.49Å; V12-V21 HydrophobicContact CG1-CG1 3.63Å; V12-V21 HydrophobicContact CG1-CG2 3.96Å; V12-L32 HydrophobicContact CG2-CD2 4.46Å; V12-I155 HydrophobicContact CG1-CD1 4.1Å; V12-I159 HydrophobicContact CG1-CD1 4.33Å; V12-I159 HydrophobicContact CG2-CD1 3.85Å; V12-I216 HydrophobicContact CG2-CG2 3.61Å; V12-F218 HydrophobicContact CB-CD1 4.28Å; V12-F218 HydrophobicContact CB-CE1 4.37Å; V12-F218 HydrophobicContact CG2-CD1 4.4Å; V12-F218 HydrophobicContact CG2-CE1 4.28Å
13	F	90.6	Very high	86.8	Confident	59 Å²	59	63.5 Å²	63.5	26%	0.259	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.9	176.2	-168.9	-105.3	0	0	0	110.6	D16 Q17 W18 H197 T217	F13-D16 VanDerWaalsContact CZ-CA 3.48Å; F13-D16 HydrophobicContact CZ-CB 4.5Å; F13-Q17 WeakPolarHBondContact CA-O 3.27Å; F13-W18 HydrophobicContact CB-CD2 4.3Å; F13-W18 HydrophobicContact CB-CE3 4.02Å; F13-W18 HydrophobicContact CB-CH2 3.95Å; F13-W18 HydrophobicContact CB-CZ2 4.21Å; F13-W18 HydrophobicContact CB-CZ3 3.83Å; F13-W18 AromaticContact CD2-CD2 3.97Å; F13-W18 HydrophobicContact CD2-CD2 3.97Å; F13-W18 AromaticContact CD2-CE2 3.69Å; F13-W18 HydrophobicContact CD2-CG 4.23Å; F13-W18 HydrophobicContact CD2-CZ2 4.07Å; F13-W18 AromaticContact CD2-NE1 3.72Å; F13-W18 HydrophobicContact CG-CZ2 4.43Å; F13-H197 AromaticContact CD1-CE1 3.63Å; F13-H197 AromaticContact CD1-NE2 3.39Å; F13-H197 WeakPolarHBondContact CD1-NE2 3.46Å; F13-H197 AromaticContact CE1-CE1 3.36Å; F13-H197 WeakPolarHBondContact CE1-CE1 3.28Å; F13-H197 AromaticContact CE1-NE2 3.59Å; F13-H197 AromaticContact CE2-CE1 3.88Å; F13-H197 AromaticContact CG-CE1 3.99Å; F13-H197 AromaticContact CG-NE2 3.76Å; F13-H197 AromaticContact CZ-CE1 3.46Å; F13-H197 VanDerWaalsContact CZ-CE1 3.46Å; F13-H197 WeakPolarHBondContact CZ-CE1 3.43Å; F13-T217 PolarHBondContact N-O 3.46Å; F13-T217 VanDerWaalsContact N-O 3.09Å
14	C	84.9	Confident	88.5	Confident	15 Å²	15	61 Å²	61	10%	0.101	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	142.6	177.8	-170.8	0	0	0	0	109.2	D16 Q17 H19	C14-D16 VanDerWaalsContact C-N 3.3Å; C14-D16 PolarHBondContact O-N 2.91Å; C14-Q17 PolarHBondContact N-O 2.98Å; C14-Q17 PolarHBondContact O-N 3.03Å; C14-H19 PolarHBondContact O-NE2 2.71Å
15	R	78.7	Confident	90	Very high	133 Å²	133	58 Å²	58	50%	0.502	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	45.6	-178.8	-66.3	-175.4	157.4	162.4	4.5	114.2	Q17 E158	R15-Q17 PolarHBondContact O-N 3.42Å; R15-Q17 VanDerWaalsContact O-N 3.08Å; R15-E158 WeakPolarHBondContact CD-OE2 3.43Å; R15-E158 VanDerWaalsContact CG-OE2 3.28Å; R15-E158 WeakPolarHBondContact CG-OE2 3.45Å; R15-E158 IonicContact CZ-OE1 2.78Å; R15-E158 IonicContact CZ-OE2 2.73Å; R15-E158 IonicContact NE-OE1 3.18Å; R15-E158 PolarHBondContact NE-OE1 3.32Å; R15-E158 IonicContact NE-OE2 2.66Å; R15-E158 PolarHBondContact NE-OE2 3.26Å; R15-E158 IonicContact NH1-OE1 2.69Å; R15-E158 PolarHBondContact NH1-OE1 3.03Å; R15-E158 IonicContact NH2-OE1 3.39Å; R15-E158 PolarHBondContact NH2-OE1 2.85Å; R15-E158 IonicContact NH2-OE2 2.63Å; R15-E158 PolarHBondContact NH2-OE2 3.19Å
16	D	80.1	Confident	90.4	Very high	144 Å²	144	54.4 Å²	54.4	77%	0.77	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	16.7	-179.4	-55.1	-47.6	0	0	0	115	F13 C14	F13-D16 VanDerWaalsContact CZ-CA 3.48Å; F13-D16 HydrophobicContact CZ-CB 4.5Å; C14-D16 VanDerWaalsContact C-N 3.3Å; C14-D16 PolarHBondContact O-N 2.91Å
17	Q	84.7	Confident	90.4	Very high	125 Å²	125	56 Å²	56	58%	0.584	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	153.8	-179.2	-65.5	-171	-7.8	0	0	111.8	F13 C14 R15	F13-Q17 WeakPolarHBondContact CA-O 3.27Å; C14-Q17 PolarHBondContact N-O 2.98Å; C14-Q17 PolarHBondContact O-N 3.03Å; R15-Q17 PolarHBondContact O-N 3.42Å; R15-Q17 VanDerWaalsContact O-N 3.08Å
18	W	89.1	Confident	90.4	Very high	59 Å²	59	55.3 Å²	55.3	22%	0.223	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127	172.6	-70.3	94.4	0	0	0	109.4	E11 F13 M204 T217 R219	E11-W18 HydrophobicContact CB-CB 4.38Å; E11-W18 HydrophobicContact CB-CE3 3.83Å; F13-W18 HydrophobicContact CB-CD2 4.3Å; F13-W18 HydrophobicContact CB-CE3 4.02Å; F13-W18 HydrophobicContact CB-CH2 3.95Å; F13-W18 HydrophobicContact CB-CZ2 4.21Å; F13-W18 HydrophobicContact CB-CZ3 3.83Å; F13-W18 AromaticContact CD2-CD2 3.97Å; F13-W18 HydrophobicContact CD2-CD2 3.97Å; F13-W18 AromaticContact CD2-CE2 3.69Å; F13-W18 HydrophobicContact CD2-CG 4.23Å; F13-W18 HydrophobicContact CD2-CZ2 4.07Å; F13-W18 AromaticContact CD2-NE1 3.72Å; F13-W18 HydrophobicContact CG-CZ2 4.43Å; W18-M204 HydrophobicContact CH2-CG 4.45Å; W18-M204 HydrophobicContact CH2-SD 3.75Å; W18-M204 HydrophobicContact CZ2-SD 3.9Å; W18-T217 HydrophobicContact CH2-CG2 3.91Å; W18-R219 VanDerWaalsContact CD1-NH1 3.35Å; W18-R219 HydrophobicContact CE3-CB 3.85Å; W18-R219 HydrophobicContact CH2-CB 3.73Å; W18-R219 HydrophobicContact CZ2-CB 4.45Å; W18-R219 HydrophobicContact CZ3-CB 3.4Å
19	H	87.7	Confident	90.4	Very high	34 Å²	34	54.9 Å²	54.9	16%	0.157	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.2	-179.6	-65	-79.7	0	0	0	110.9	E11 V12 C14 V21 I155	E11-H19 CarbonylContact C-O 3.56Å; E11-H19 VanDerWaalsContact CA-O 3.25Å; E11-H19 WeakPolarHBondContact CA-O 3.37Å; V12-H19 HydrophobicContact CG1-CB 4.33Å; V12-H19 PolarHBondContact N-O 2.91Å; V12-H19 PolarHBondContact O-N 3.15Å; C14-H19 PolarHBondContact O-NE2 2.71Å; H19-V21 PolarHBondContact O-N 3.37Å; H19-I155 HydrophobicContact CB-CD1 3.36Å
20	R	90.1	Very high	90.4	Very high	104 Å²	104	49 Å²	49	39%	0.392	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.8	176.1	-169.2	176.7	174.7	-166.7	-7.5	110.5	Y9 L10 D35 C38	Y9-R20 HydrophobicContact CD1-CG 4.29Å; L10-R20 WeakPolarHBondContact O-CA 3.41Å; R20-D35 HydrophobicContact CB-CB 4.37Å; R20-D35 WeakPolarHBondContact CD-OD2 3.31Å; R20-D35 HydrophobicContact CG-CB 4.08Å; R20-D35 IonicContact CZ-OD2 2.7Å; R20-D35 VanDerWaalsContact CZ-OD2 3.24Å; R20-D35 IonicContact NE-OD2 3.74Å; R20-D35 PolarHBondContact NE-OD2 3.41Å; R20-D35 VanDerWaalsContact NE-OD2 3.17Å; R20-D35 IonicContact NH1-OD2 3.9Å; R20-D35 IonicContact NH2-OD2 2.78Å; R20-D35 PolarHBondContact O-N 3.32Å; R20-D35 VanDerWaalsContact O-N 3.16Å; R20-C38 HydrophobicContact CB-CB 4.07Å
21	V	90.6	Very high	90.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.6	-178.6	-68.3	0	0	0	0	109.5	Y9 L10 V12 H19 V23 L32 A33 I155 L156	Y9-V21 WeakPolarHBondContact CA-O 3.36Å; L10-V21 PolarHBondContact N-O 3.46Å; L10-V21 WeakPolarHBondContact O-CG2 3.31Å; L10-V21 PolarHBondContact O-N 2.69Å; L10-V21 VanDerWaalsContact O-O 3.05Å; V12-V21 HydrophobicContact CB-CG2 4.03Å; V12-V21 HydrophobicContact CG1-CB 4.49Å; V12-V21 HydrophobicContact CG1-CG1 3.63Å; V12-V21 HydrophobicContact CG1-CG2 3.96Å; H19-V21 PolarHBondContact O-N 3.37Å; V21-V23 HydrophobicContact CG2-CG2 3.76Å; V21-L32 HydrophobicContact CG2-CD2 4.4Å; V21-A33 CarbonylContact C-O 3.51Å; V21-A33 WeakPolarHBondContact CA-O 3.36Å; V21-A33 WeakPolarHBondContact CB-O 3.5Å; V21-I155 HydrophobicContact CG1-CD1 4.45Å; V21-L156 HydrophobicContact CG1-CD2 4.1Å
22	S	91.6	Very high	90.1	Very high	30 Å²	30	48.4 Å²	48.4	21%	0.21	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	130.8	162.5	66.6	0	0	0	0	108.5	L32 A33	S22-L32 CarbonylContact O-C 3.47Å; S22-L32 WeakPolarHBondContact O-CA 3.33Å; S22-A33 PolarHBondContact N-O 2.93Å; S22-A33 PolarHBondContact O-N 3.33Å; S22-A33 WeakPolarHBondContact OG-CB 3.31Å; S22-A33 PolarHBondContact OG-O 2.99Å
23	V	94.6	Very high	89.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.8	-179.4	-177.1	0	0	0	0	107.6	S7 S8 L10 V21 L30 L31 F218 W229	S7-V23 VanDerWaalsContact CA-O 3.27Å; S7-V23 WeakPolarHBondContact CA-O 3.48Å; S7-V23 PolarHBondContact OG-O 2.81Å; S8-V23 PolarHBondContact N-O 2.83Å; S8-V23 PolarHBondContact O-N 2.99Å; L10-V23 HydrophobicContact CB-CG2 3.89Å; L10-V23 HydrophobicContact CD1-CB 4.07Å; L10-V23 HydrophobicContact CD1-CG1 4.27Å; L10-V23 HydrophobicContact CD1-CG2 3.93Å; L10-V23 HydrophobicContact CG-CB 4.26Å; L10-V23 HydrophobicContact CG-CG2 4.02Å; V21-V23 HydrophobicContact CG2-CG2 3.76Å; V23-L30 HydrophobicContact CG1-CD1 3.43Å; V23-L30 VanDerWaalsContact CG1-CD1 3.43Å; V23-L30 HydrophobicContact CG1-CD2 3.85Å; V23-L30 HydrophobicContact CG1-CG 3.61Å; V23-L31 CarbonylContact C-O 3.59Å; V23-L31 WeakPolarHBondContact CA-O 3.4Å; V23-F218 HydrophobicContact CG2-CD1 4.36Å; V23-F218 HydrophobicContact CG2-CE1 3.99Å; V23-W229 HydrophobicContact CB-CH2 4.09Å; V23-W229 HydrophobicContact CB-CZ2 4.42Å; V23-W229 HydrophobicContact CG1-CH2 3.81Å; V23-W229 HydrophobicContact CG1-CZ3 3.99Å; V23-W229 WeakPolarHBondContact O-CH2 3.12Å
24	T	94.8	Very high	89.2	Confident	33 Å²	33	47.9 Å²	47.9	20%	0.202	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122	179.3	-57	0	0	0	0	109.3	A4 R6 S7 L31	A4-T24 HydrophobicContact CB-CG2 3.7Å; R6-T24 CarbonylContact O-C 3.45Å; R6-T24 WeakPolarHBondContact O-CA 3.35Å; S7-T24 PolarHBondContact OG-OG1 2.8Å; T24-L31 PolarHBondContact N-O 2.83Å; T24-L31 PolarHBondContact O-N 2.83Å
25	L	95.9	Very high	88.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.1	176	177	65.9	0	0	0	109.6	M5 R6 L30 L185 W229 I233	M5-L25 PolarHBondContact N-O 3.01Å; R6-L25 HydrophobicContact CB-CB 4.31Å; R6-L25 PolarHBondContact N-O 3.4Å; R6-L25 PolarHBondContact O-N 3.5Å; L25-L30 HydrophobicContact CB-CD1 3.96Å; L25-L30 HydrophobicContact CD1-CD1 4.02Å; L25-L185 HydrophobicContact CD1-CD1 3.47Å; L25-L185 VanDerWaalsContact CD1-CD1 3.47Å; L25-W229 HydrophobicContact CB-CH2 4.49Å; L25-W229 HydrophobicContact CB-CZ3 3.94Å; L25-I233 HydrophobicContact CD1-CG1 4.24Å; L25-I233 HydrophobicContact CD2-CG1 4.04Å
26	D	91.6	Very high	87.5	Confident	29 Å²	29	46.3 Å²	46.3	16%	0.155	23%	0.232	C	C	.	.			trans	-111.2	-175	160.4	73	35.7	0	0	0	110.7	T28 T29	D26-T28 PolarHBondContact O-N 2.81Å; D26-T28 WeakPolarHBondContact OD1-CA 3.25Å; D26-T28 PolarHBondContact OD1-N 3.41Å; D26-T28 PolarHBondContact OD1-OG1 2.95Å; D26-T28 VanDerWaalsContact OD1-OG1 3.14Å; D26-T29 VanDerWaalsContact CG-OG1 3.27Å; D26-T29 PolarHBondContact N-O 2.97Å; D26-T29 PolarHBondContact OD1-N 3.01Å; D26-T29 PolarHBondContact OD1-OG1 2.95Å; D26-T29 VanDerWaalsContact OD1-OG1 3.14Å; D26-T29 PolarHBondContact OD2-OG1 3.24Å
27	E	91.7	Very high	86.1	Confident	113 Å²	113	43.4 Å²	43.4	53%	0.528	22%	0.223	S	C	.	.	S	Bend	trans	-62	-21.3	-177	-64.1	176.3	177.5	0	0	114.1	M5	M5-E27 HydrophobicContact SD-CG 3.94Å
28	T	92.6	Very high	83.8	Confident	61 Å²	61	41.1 Å²	41.1	37%	0.374	22%	0.22	S	C	.	.	S	Bend	trans	-129.1	-21.8	-167.6	63.8	0	0	0	0	114.3	D26 L185 L240	D26-T28 PolarHBondContact O-N 2.81Å; D26-T28 WeakPolarHBondContact OD1-CA 3.25Å; D26-T28 PolarHBondContact OD1-N 3.41Å; D26-T28 PolarHBondContact OD1-OG1 2.95Å; D26-T28 VanDerWaalsContact OD1-OG1 3.14Å; T28-L185 PolarHBondContact O-N 3.25Å; T28-L240 HydrophobicContact CG2-CD2 4.19Å
29	T	93.6	Very high	81.3	Confident	25 Å²	25	41.5 Å²	41.5	15%	0.153	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.1	-170.8	71.1	0	0	0	0	112.5	D26 I182 I183	D26-T29 VanDerWaalsContact CG-OG1 3.27Å; D26-T29 PolarHBondContact N-O 2.97Å; D26-T29 PolarHBondContact OD1-N 3.01Å; D26-T29 PolarHBondContact OD1-OG1 2.95Å; D26-T29 VanDerWaalsContact OD1-OG1 3.14Å; D26-T29 PolarHBondContact OD2-OG1 3.24Å; T29-I182 HydrophobicContact CG2-CG2 3.88Å; T29-I183 CarbonylContact C-O 3.59Å; T29-I183 VanDerWaalsContact CA-O 3.27Å; T29-I183 WeakPolarHBondContact CA-O 3.26Å
30	L	93.7	Very high	78.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	119.4	164.9	-165	75.1	0	0	0	108.8	V23 L25 I183 L185 I207 F218 W229	V23-L30 HydrophobicContact CG1-CD1 3.43Å; V23-L30 VanDerWaalsContact CG1-CD1 3.43Å; V23-L30 HydrophobicContact CG1-CD2 3.85Å; V23-L30 HydrophobicContact CG1-CG 3.61Å; L25-L30 HydrophobicContact CB-CD1 3.96Å; L25-L30 HydrophobicContact CD1-CD1 4.02Å; L30-I183 HydrophobicContact CB-CB 4.23Å; L30-I183 PolarHBondContact N-O 2.97Å; L30-I183 PolarHBondContact O-N 2.76Å; L30-L185 HydrophobicContact CB-CD2 4.16Å; L30-I207 HydrophobicContact CD2-CD1 3.55Å; L30-F218 HydrophobicContact CD2-CE1 4.49Å; L30-F218 HydrophobicContact CD2-CE2 3.94Å; L30-F218 HydrophobicContact CD2-CZ 3.65Å; L30-W229 HydrophobicContact CD1-CZ3 4Å
31	L	91.7	Very high	76	Confident	51 Å²	51	47.5 Å²	47.5	27%	0.267	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.8	178.4	-179.3	139.7	0	0	0	109.5	V23 T24 L180 K181 I182	V23-L31 CarbonylContact C-O 3.59Å; V23-L31 WeakPolarHBondContact CA-O 3.4Å; T24-L31 PolarHBondContact N-O 2.83Å; T24-L31 PolarHBondContact O-N 2.83Å; L31-L180 HydrophobicContact CD2-CD2 3.96Å; L31-L180 HydrophobicContact CG-CD2 4.37Å; L31-K181 CarbonylContact C-O 3.59Å; L31-K181 WeakPolarHBondContact CA-O 3.17Å; L31-I182 HydrophobicContact CD1-CG1 4.34Å
32	L	91.2	Very high	73.6	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.4	172.8	-55.8	94.2	0	0	0	109.9	V12 V21 S22 L156 I159 L180 K181 I183 F218	V12-L32 HydrophobicContact CG2-CD2 4.46Å; V21-L32 HydrophobicContact CG2-CD2 4.4Å; S22-L32 CarbonylContact O-C 3.47Å; S22-L32 WeakPolarHBondContact O-CA 3.33Å; L32-L156 HydrophobicContact CB-CD1 4.2Å; L32-L156 HydrophobicContact CB-CD2 3.95Å; L32-L156 HydrophobicContact CD2-CD2 4.18Å; L32-L156 WeakPolarHBondContact O-CD1 3.25Å; L32-I159 HydrophobicContact CD2-CD1 4.36Å; L32-L180 CarbonylContact O-C 3.48Å; L32-L180 VanDerWaalsContact O-CA 3.27Å; L32-L180 WeakPolarHBondContact O-CA 3.27Å; L32-K181 HydrophobicContact CB-CB 4.26Å; L32-K181 HydrophobicContact CD1-CB 4Å; L32-K181 HydrophobicContact CD1-CG 4.08Å; L32-K181 PolarHBondContact N-O 2.88Å; L32-K181 PolarHBondContact O-N 2.99Å; L32-I183 HydrophobicContact CD1-CD1 4.41Å; L32-I183 HydrophobicContact CD1-CG1 3.52Å; L32-F218 HydrophobicContact CD2-CE1 3.45Å; L32-F218 VanDerWaalsContact CD2-CE1 3.45Å; L32-F218 HydrophobicContact CD2-CZ 3.71Å; L32-F218 HydrophobicContact CG-CE1 4.25Å; L32-F218 HydrophobicContact CG-CZ 4.32Å
33	A	85.3	Confident	70.7	Confident	16 Å²	16	57.3 Å²	57.3	13%	0.132	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.8	165.7	0	0	0	0	0	110.9	V21 S22 D35 D179 L180	V21-A33 CarbonylContact C-O 3.51Å; V21-A33 WeakPolarHBondContact CA-O 3.36Å; V21-A33 WeakPolarHBondContact CB-O 3.5Å; S22-A33 PolarHBondContact N-O 2.93Å; S22-A33 PolarHBondContact O-N 3.33Å; S22-A33 WeakPolarHBondContact OG-CB 3.31Å; S22-A33 PolarHBondContact OG-O 2.99Å; A33-D35 PolarHBondContact O-N 2.9Å; A33-D179 VanDerWaalsContact CA-O 3.27Å; A33-D179 WeakPolarHBondContact CA-O 2.99Å; A33-L180 HydrophobicContact CB-CD2 3.47Å; A33-L180 VanDerWaalsContact CB-CD2 3.47Å
34	I	79.8	Confident	67.7	Low	32 Å²	32	64.9 Å²	64.9	16%	0.164	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.7	178.1	-60.3	176.4	0	0	0	109.6	Q36 S154 I155 L156	I34-Q36 HydrophobicContact CG2-CG 4.39Å; I34-Q36 PolarHBondContact O-N 2.6Å; I34-Q36 VanDerWaalsContact O-N 3.17Å; I34-S154 WeakPolarHBondContact CD1-OG 3.38Å; I34-I155 HydrophobicContact CD1-CD1 4.38Å; I34-I155 HydrophobicContact CD1-CG1 3.41Å; I34-I155 VanDerWaalsContact CD1-CG1 3.41Å; I34-I155 HydrophobicContact CG1-CD1 4.37Å; I34-I155 HydrophobicContact CG1-CG1 3.9Å; I34-L156 HydrophobicContact CD1-CD1 4.42Å; I34-L156 HydrophobicContact CD1-CG 4.04Å; I34-L156 HydrophobicContact CG1-CD1 3.61Å; I34-L156 HydrophobicContact CG1-CD2 4.41Å; I34-L156 HydrophobicContact CG1-CG 3.55Å
35	D	70.6	Confident	64.9	Low	23 Å²	23	68.8 Å²	68.8	12%	0.123	40%	0.395	C	S	.	.			trans	-78.1	96.3	164.3	-170.1	-2.9	0	0	0	108.4	Y9 R20 A33 S37 C38	Y9-D35 HydrophobicContact CD1-CB 4.05Å; Y9-D35 HydrophobicContact CE1-CB 3.75Å; Y9-D35 WeakPolarHBondContact CE1-OD2 3.48Å; R20-D35 HydrophobicContact CB-CB 4.37Å; R20-D35 WeakPolarHBondContact CD-OD2 3.31Å; R20-D35 HydrophobicContact CG-CB 4.08Å; R20-D35 IonicContact CZ-OD2 2.7Å; R20-D35 VanDerWaalsContact CZ-OD2 3.24Å; R20-D35 IonicContact NE-OD2 3.74Å; R20-D35 PolarHBondContact NE-OD2 3.41Å; R20-D35 VanDerWaalsContact NE-OD2 3.17Å; R20-D35 IonicContact NH1-OD2 3.9Å; R20-D35 IonicContact NH2-OD2 2.78Å; R20-D35 PolarHBondContact O-N 3.32Å; R20-D35 VanDerWaalsContact O-N 3.16Å; A33-D35 PolarHBondContact O-N 2.9Å; D35-S37 PolarHBondContact O-N 2.98Å; D35-S37 WeakPolarHBondContact OD1-CB 3.15Å; D35-S37 PolarHBondContact OD1-N 3.03Å; D35-S37 PolarHBondContact OD1-OG 3.45Å; D35-S37 PolarHBondContact OD2-OG 2.83Å; D35-C38 PolarHBondContact O-N 3.19Å; D35-C38 VanDerWaalsContact O-N 3.13Å
36	Q	57.3	Low	62.2	Low	93 Å²	93	71.1 Å²	71.1	44%	0.435	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-1.1	-176.3	-63.9	179.2	21	0	0	113.4	I34 C38 D179	I34-Q36 HydrophobicContact CG2-CG 4.39Å; I34-Q36 PolarHBondContact O-N 2.6Å; I34-Q36 VanDerWaalsContact O-N 3.17Å; Q36-C38 VanDerWaalsContact C-N 3.28Å; Q36-D179 PolarHBondContact NE2-OD2 2.65Å; Q36-D179 VanDerWaalsContact NE2-OD2 3.13Å
37	S	49.7	Very low	59.7	Low	82 Å²	82	73.6 Å²	73.6	57%	0.573	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-14	170.4	64	0	0	0	0	113.9	D35	D35-S37 PolarHBondContact O-N 2.98Å; D35-S37 WeakPolarHBondContact OD1-CB 3.15Å; D35-S37 PolarHBondContact OD1-N 3.03Å; D35-S37 PolarHBondContact OD1-OG 3.45Å; D35-S37 PolarHBondContact OD2-OG 2.83Å
38	C	37.4	Very low	57.8	Low	77 Å²	77	73.6 Å²	73.6	52%	0.52	42%	0.424	S	S	.	.	S	Bend	trans	-114.5	85.1	-175.1	-159.8	0	0	0	0	111.3	R20 D35 Q36	R20-C38 HydrophobicContact CB-CB 4.07Å; D35-C38 PolarHBondContact O-N 3.19Å; D35-C38 VanDerWaalsContact O-N 3.13Å; Q36-C38 VanDerWaalsContact C-N 3.28Å
39	G	36.9	Very low	55.8	Low	68 Å²	68	74.3 Å²	74.3	70%	0.701	43%	0.429	S	S	*	.			trans	171	-6.1	177.1	0	0	0	0	0	115.6	T41	G39-T41 VanDerWaalsContact C-N 3.3Å; G39-T41 PolarHBondContact O-N 3.1Å
40	E	35.8	Very low	54.3	Low	120 Å²	120	76.8 Å²	76.8	56%	0.561	45%	0.447	S	S	*	.			trans	-77.8	80.2	169.8	-59.3	-169.7	158.5	0	0	110.2	L42 F48	E40-L42 VanDerWaalsContact CA-N 3.34Å; E40-L42 HydrophobicContact CB-CB 4.07Å; E40-L42 HydrophobicContact CB-CD1 4.22Å; E40-L42 HydrophobicContact CB-CG 4.06Å; E40-L42 HydrophobicContact CG-CB 4.42Å; E40-L42 HydrophobicContact CG-CD1 3.64Å; E40-L42 HydrophobicContact CG-CG 3.98Å; E40-L42 PolarHBondContact O-N 3.22Å; E40-L42 WeakPolarHBondContact OE1-CD1 3.36Å; E40-F48 WeakPolarHBondContact OE1-CE2 3.22Å
41	T	30.3	Very low	52.8	Low	144 Å²	144	77 Å²	77	88%	0.883	45%	0.449	S	S	*	.				-83.3	58.3	129.6	58.6	0	0	0	0	106.5	G39	G39-T41 VanDerWaalsContact C-N 3.3Å; G39-T41 PolarHBondContact O-N 3.1Å
42	L	38.9	Very low	51.6	Low	80 Å²	80	77.6 Å²	77.6	42%	0.419	46%	0.456	S	S	.	.	S	Bend	trans	-83.8	129	155.8	-68.3	175.8	0	0	0	103.7	E40 D44 F48	E40-L42 VanDerWaalsContact CA-N 3.34Å; E40-L42 HydrophobicContact CB-CB 4.07Å; E40-L42 HydrophobicContact CB-CD1 4.22Å; E40-L42 HydrophobicContact CB-CG 4.06Å; E40-L42 HydrophobicContact CG-CB 4.42Å; E40-L42 HydrophobicContact CG-CD1 3.64Å; E40-L42 HydrophobicContact CG-CG 3.98Å; E40-L42 PolarHBondContact O-N 3.22Å; E40-L42 WeakPolarHBondContact OE1-CD1 3.36Å; L42-D44 PolarHBondContact O-N 3.01Å; L42-F48 HydrophobicContact CD1-CE2 3.94Å; L42-F48 HydrophobicContact CD1-CZ 4.2Å
43	D	32.2	Very low	50.3	Low	156 Å²	156	84.3 Å²	84.3	83%	0.834	49%	0.487	S	S	*	.			trans	-41.4	120.5	166.2	-79.1	-40.2	0	0	0	109	N45	D43-N45 VanDerWaalsContact C-N 3.31Å; D43-N45 PolarHBondContact O-N 2.7Å
44	D	30.3	Very low	49.4	Very low	158 Å²	158	90.2 Å²	90.2	85%	0.845	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.4	88.5	172.2	-120.4	-23	0	0	0	109.9	L42	L42-D44 PolarHBondContact O-N 3.01Å
45	N	36.8	Very low	48.9	Very low	116 Å²	116	90.7 Å²	90.7	62%	0.62	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	170.3	-1.8	158	-100.9	-62.5	0	0	0	117.4	D43 C47 K93	D43-N45 VanDerWaalsContact C-N 3.31Å; D43-N45 PolarHBondContact O-N 2.7Å; N45-C47 PolarHBondContact O-N 3.26Å; N45-K93 WeakPolarHBondContact O-CE 3.34Å; N45-K93 PolarHBondContact O-NZ 2.7Å; N45-K93 PolarHBondContact OD1-NZ 3.35Å
46	D	39.8	Very low	48.7	Very low	48 Å²	48	91.1 Å²	91.1	26%	0.257	52%	0.523	S	S	.	.			trans	-77.5	92.8	-179.9	-85.9	-18.3	0	0	0	111.8	F48 K90	D46-F48 PolarHBondContact O-N 3.36Å; D46-K90 VanDerWaalsContact OD1-CE 3.31Å; D46-K90 WeakPolarHBondContact OD1-CE 3.32Å; D46-K90 IonicContact OD1-NZ 2.73Å; D46-K90 PolarHBondContact OD1-NZ 2.78Å; D46-K90 WeakPolarHBondContact OD2-CD 3.2Å; D46-K90 WeakPolarHBondContact OD2-CE 3.39Å; D46-K90 IonicContact OD2-NZ 2.7Å; D46-K90 PolarHBondContact OD2-NZ 3.49Å
47	C	39.1	Very low	49.2	Very low	82 Å²	82	91 Å²	91	55%	0.554	53%	0.525	S	S	*	.			trans	-66.3	98.7	171.3	-168.2	0	0	0	0	108.6	N45 T49	N45-C47 PolarHBondContact O-N 3.26Å; C47-T49 PolarHBondContact O-N 3.47Å
48	F	51.1	Low	50.7	Low	112 Å²	112	92.7 Å²	92.7	49%	0.491	52%	0.524	S	S	.	.			trans	-68.6	76.7	163.9	-69.5	-83	0	0	0	108.8	E40 L42 D46 S50 V105	E40-F48 WeakPolarHBondContact OE1-CE2 3.22Å; L42-F48 HydrophobicContact CD1-CE2 3.94Å; L42-F48 HydrophobicContact CD1-CZ 4.2Å; D46-F48 PolarHBondContact O-N 3.36Å; F48-S50 PolarHBondContact O-N 2.81Å; F48-V105 HydrophobicContact CD1-CB 4.3Å; F48-V105 HydrophobicContact CD1-CG1 4.14Å; F48-V105 HydrophobicContact CE1-CG1 4.08Å
49	T	51.3	Low	53.2	Low	76 Å²	76	94.4 Å²	94.4	47%	0.466	52%	0.523	S	S	.	.			trans	-63.9	106.3	162.8	37.6	0	0	0	0	107.2	C47 Y104	C47-T49 PolarHBondContact O-N 3.47Å; T49-Y104 WeakPolarHBondContact O-CD1 3.46Å
50	S	61	Low	55.8	Low	77 Å²	77	92.6 Å²	92.6	54%	0.538	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-67.4	138.4	164.2	55	0	0	0	0	108.7	F48	F48-S50 PolarHBondContact O-N 2.81Å
51	A	63	Low	58.5	Low	5 Å²	5	93.1 Å²	93.1	4%	0.041	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-59.6	142.3	174.4	0	0	0	0	0	110.5	L55 Y104 Y142	A51-L55 HydrophobicContact CB-CB 4.43Å; A51-Y104 HydrophobicContact CB-CD1 3.99Å; A51-Y104 HydrophobicContact CB-CD2 3.86Å; A51-Y104 HydrophobicContact CB-CE1 4.32Å; A51-Y104 HydrophobicContact CB-CE2 4.22Å; A51-Y104 HydrophobicContact CB-CG 3.73Å; A51-Y142 HydrophobicContact CB-CD1 3.83Å; A51-Y142 HydrophobicContact CB-CD2 3.59Å; A51-Y142 HydrophobicContact CB-CE1 3.94Å; A51-Y142 HydrophobicContact CB-CE2 3.71Å; A51-Y142 HydrophobicContact CB-CG 3.64Å
52	P	66.3	Low	61.6	Low	64 Å²	64	86.4 Å²	86.4	42%	0.416	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-47.5	143.5	169.6	-26.8	29.3	0	0	0	111.9	N54 L55	P52-N54 PolarHBondContact O-N 2.96Å; P52-L55 HydrophobicContact CB-CD1 4.11Å; P52-L55 HydrophobicContact CB-CG 4.37Å; P52-L55 HydrophobicContact CG-CD1 3.87Å; P52-L55 PolarHBondContact O-N 2.82Å
53	E	63.2	Low	64.2	Low	141 Å²	141	90 Å²	90	66%	0.659	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-55.9	-28.2	-173.7	-52.4	-149.8	109.2	0	0	113.9	L55 V56 R144	E53-L55 PolarHBondContact O-N 2.77Å; E53-V56 WeakPolarHBondContact O-CG2 3.19Å; E53-V56 PolarHBondContact O-N 3.19Å; E53-R144 VanDerWaalsContact CG-NH2 3.28Å; E53-R144 IonicContact OE1-CZ 3.21Å; E53-R144 IonicContact OE1-NH1 3.1Å; E53-R144 IonicContact OE1-NH2 3.41Å; E53-R144 PolarHBondContact OE1-NH2 3.39Å
54	N	67.2	Low	67.1	Low	140 Å²	140	82.5 Å²	82.5	75%	0.749	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-69.9	-12	179.3	-61.8	-27	0	0	0	114	P52	P52-N54 PolarHBondContact O-N 2.96Å
55	L	68.9	Low	70	Confident	43 Å²	43	80.2 Å²	80.2	23%	0.225	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-103.1	2.2	-174.9	-54.4	172.9	0	0	0	112.8	A51 P52 E53 N57 E58 Y104	A51-L55 HydrophobicContact CB-CB 4.43Å; P52-L55 HydrophobicContact CB-CD1 4.11Å; P52-L55 HydrophobicContact CB-CG 4.37Å; P52-L55 HydrophobicContact CG-CD1 3.87Å; P52-L55 PolarHBondContact O-N 2.82Å; E53-L55 PolarHBondContact O-N 2.77Å; L55-N57 PolarHBondContact O-N 3.16Å; L55-E58 PolarHBondContact O-N 3.43Å; L55-Y104 HydrophobicContact CD1-CE2 4.42Å
56	V	66	Low	72.5	Confident	31 Å²	31	76.1 Å²	76.1	19%	0.188	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-69.7	124.1	-177.7	179	0	0	0	0	109	E53 E58 Y142 R144	E53-V56 WeakPolarHBondContact O-CG2 3.19Å; E53-V56 PolarHBondContact O-N 3.19Å; V56-E58 PolarHBondContact O-N 2.74Å; V56-Y142 HydrophobicContact CG2-CD1 4.28Å; V56-R144 HydrophobicContact CB-CG 4.45Å; V56-R144 HydrophobicContact CG1-CB 4.21Å; V56-R144 HydrophobicContact CG1-CG 3.73Å; V56-R144 HydrophobicContact CG2-CG 3.86Å
57	N	68.6	Low	74.5	Confident	91 Å²	91	76.8 Å²	76.8	49%	0.487	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	3.8	-178.9	-63.1	-44.2	0	0	0	116.9	L55 K141 Y142	L55-N57 PolarHBondContact O-N 3.16Å; N57-K141 VanDerWaalsContact CA-CE 3.42Å; N57-K141 WeakPolarHBondContact O-CE 3.34Å; N57-Y142 PolarHBondContact N-O 3.05Å
58	E	80.8	Confident	76.1	Confident	118 Å²	118	80.7 Å²	80.7	55%	0.551	41%	0.414	S	S	*	.			trans	-85.2	144.5	169.7	-67.2	-151.7	148.7	0	0	111.6	L55 V56	L55-E58 PolarHBondContact O-N 3.43Å; V56-E58 PolarHBondContact O-N 2.74Å
59	K	88.8	Confident	77.1	Confident	112 Å²	112	83.9 Å²	83.9	49%	0.487	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.5	173.2	-69.8	175.5	163.2	-145.9	0	109.2	L110 E139 V140	K59-L110 HydrophobicContact CD-CD1 4.31Å; K59-L110 HydrophobicContact CG-CD1 4.04Å; K59-E139 WeakPolarHBondContact CD-OE1 3.13Å; K59-E139 WeakPolarHBondContact CE-OE1 3.16Å; K59-E139 IonicContact NZ-OE1 3.19Å; K59-E139 PolarHBondContact NZ-OE1 2.83Å; K59-V140 CarbonylContact C-O 3.54Å; K59-V140 WeakPolarHBondContact CA-O 3.47Å
60	R	92.1	Very high	78.5	Confident	31 Å²	31	82.1 Å²	82.1	12%	0.117	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.8	-178.1	-58.4	176.4	-65	-174.1	1.1	108.9	D107 V140	R60-D107 IonicContact CZ-OD1 2.65Å; R60-D107 VanDerWaalsContact NH2-CG 3.29Å; R60-D107 IonicContact NH2-OD1 2.93Å; R60-D107 PolarHBondContact NH2-OD1 2.98Å; R60-D107 IonicContact NH2-OD2 3.25Å; R60-D107 PolarHBondContact NH2-OD2 3.46Å; R60-D107 VanDerWaalsContact NH2-OD2 3.1Å; R60-V140 HydrophobicContact CB-CG2 4.1Å; R60-V140 PolarHBondContact N-O 2.73Å; R60-V140 PolarHBondContact O-N 2.79Å
61	N	93.2	Very high	79.5	Confident	131 Å²	131	80.5 Å²	80.5	70%	0.701	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	118.8	171.1	-69.3	-35.2	0	0	0	108.2	L138	N61-L138 CarbonylContact C-O 3.56Å; N61-L138 WeakPolarHBondContact CA-O 3.37Å
62	V	94	Very high	80.8	Confident	3 Å²	3	81 Å²	81	2%	0.018	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	118.7	-179.4	-176.2	0	0	0	0	108.8	V64 T100 Q102 L103 L138 V140	V62-V64 HydrophobicContact CG1-CG2 4.14Å; V62-T100 HydrophobicContact CG1-CG2 4.46Å; V62-Q102 HydrophobicContact CB-CB 4.41Å; V62-Q102 HydrophobicContact CG1-CB 3.66Å; V62-Q102 HydrophobicContact CG2-CB 3.85Å; V62-L103 HydrophobicContact CB-CD2 4.01Å; V62-L103 HydrophobicContact CG1-CD2 4.06Å; V62-L103 HydrophobicContact CG1-CG 4.04Å; V62-L103 HydrophobicContact CG2-CD2 4.01Å; V62-L138 PolarHBondContact N-O 3.02Å; V62-L138 PolarHBondContact O-N 2.76Å; V62-V140 HydrophobicContact CG2-CG2 3.94Å
63	R	93.8	Very high	81.9	Confident	154 Å²	154	78.3 Å²	78.3	58%	0.581	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	120	173	179.8	171.5	-69.2	171.6	-2	109.6	V135 V136 D137	R63-V135 HydrophobicContact CG-CG1 3.94Å; R63-V136 WeakPolarHBondContact CA-O 3.26Å; R63-D137 WeakPolarHBondContact CB-OD1 3.47Å; R63-D137 WeakPolarHBondContact CG-OD1 3.43Å; R63-D137 IonicContact CZ-OD1 3.59Å; R63-D137 IonicContact NE-OD1 2.8Å; R63-D137 PolarHBondContact NE-OD1 2.66Å; R63-D137 IonicContact NE-OD2 3.9Å; R63-D137 IonicContact NH2-OD1 3.47Å; R63-D137 PolarHBondContact NH2-OD1 2.86Å; R63-D137 IonicContact NH2-OD2 3.5Å; R63-D137 PolarHBondContact NH2-OD2 3.36Å
64	V	93.2	Very high	83.3	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.9	176.9	-169.4	0	0	0	0	110.1	V62 L72 A96 T100 L103 V136 L138	V62-V64 HydrophobicContact CG1-CG2 4.14Å; V64-L72 HydrophobicContact CB-CD1 3.64Å; V64-L72 HydrophobicContact CG1-CD1 3.33Å; V64-L72 HydrophobicContact CG2-CD1 4.01Å; V64-A96 HydrophobicContact CG1-CB 3.75Å; V64-A96 WeakPolarHBondContact CG1-O 3.34Å; V64-T100 HydrophobicContact CB-CG2 4.03Å; V64-T100 HydrophobicContact CG1-CG2 3.82Å; V64-T100 HydrophobicContact CG2-CG2 3.76Å; V64-L103 HydrophobicContact CG2-CD1 4.01Å; V64-V136 HydrophobicContact CB-CB 4.5Å; V64-V136 PolarHBondContact N-O 3.42Å; V64-V136 PolarHBondContact O-N 3.36Å; V64-L138 HydrophobicContact CG2-CD1 3.94Å
65	L	91.5	Very high	84.3	Confident	110 Å²	110	68 Å²	68	58%	0.576	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	107.9	176.2	-65.5	172	0	0	0	108.6	A96 V135	L65-A96 WeakPolarHBondContact O-CB 3.47Å; L65-V135 HydrophobicContact CD2-CB 4.37Å; L65-V135 HydrophobicContact CD2-CG1 4.27Å; L65-V135 HydrophobicContact CD2-CG2 3.79Å
66	K	89.1	Confident	85.3	Confident	29 Å²	29	67.1 Å²	67.1	13%	0.126	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-96.7	150.1	177.2	74	-168.5	-165.7	-158.1	0	111.2	A96 S132 G133 R134 V136	K66-A96 HydrophobicContact CB-CB 3.9Å; K66-S132 PolarHBondContact NZ-O 2.77Å; K66-S132 PolarHBondContact NZ-OG 3.17Å; K66-G133 WeakPolarHBondContact CE-O 3.4Å; K66-G133 PolarHBondContact NZ-O 3.28Å; K66-R134 PolarHBondContact N-O 2.96Å; K66-R134 VanDerWaalsContact O-CG 3.27Å; K66-R134 WeakPolarHBondContact O-CG 3.03Å; K66-V136 HydrophobicContact CD-CG2 4.26Å
67	A	82.8	Confident	86.3	Confident	63 Å²	63	69.5 Å²	69.5	52%	0.521	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-68.3	156.1	173.1	0	0	0	0	0	111.3	N69 S70	A67-N69 PolarHBondContact O-N 2.82Å; A67-S70 PolarHBondContact O-N 3.39Å
68	E	71.3	Confident	87.1	Confident	164 Å²	164	65.5 Å²	65.5	77%	0.766	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	126.3	171.4	-70.2	-179.8	-175.6	0	0	108.9	S70	E68-S70 VanDerWaalsContact C-N 3.27Å; E68-S70 PolarHBondContact O-N 2.96Å
69	N	72.1	Confident	87.3	Confident	178 Å²	178	59.9 Å²	59.9	95%	0.952	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	7.1	-173.7	-52.2	-30.6	0	0	0	117.1	A67	A67-N69 PolarHBondContact O-N 2.82Å
70	S	80.6	Confident	87.1	Confident	39 Å²	39	62.7 Å²	62.7	27%	0.273	33%	0.326	S	S	.	.			trans	-93.8	142.8	171.7	-174.4	0	0	0	0	112.1	A67 E68	A67-S70 PolarHBondContact O-N 3.39Å; E68-S70 VanDerWaalsContact C-N 3.27Å; E68-S70 PolarHBondContact O-N 2.96Å
71	G	83.5	Confident	86.6	Confident	44 Å²	44	65.7 Å²	65.7	45%	0.454	34%	0.341	S	S	.	.			trans	-67.7	165.5	168.2	0	0	0	0	0	112	G73	G71-G73 PolarHBondContact O-N 3.46Å
72	L	89.2	Confident	85.8	Confident	16 Å²	16	63.9 Å²	63.9	8%	0.084	33%	0.331	C	S	.	.			trans	-64.2	-26.3	176.3	-174.1	61.9	0	0	0	112.5	V64 I74 A97 L129 V136 L138	V64-L72 HydrophobicContact CB-CD1 3.64Å; V64-L72 HydrophobicContact CG1-CD1 3.33Å; V64-L72 HydrophobicContact CG2-CD1 4.01Å; L72-I74 HydrophobicContact CB-CG1 4.44Å; L72-I74 HydrophobicContact CD2-CD1 3.5Å; L72-I74 VanDerWaalsContact CD2-CD1 3.5Å; L72-I74 HydrophobicContact CD2-CG1 3.8Å; L72-I74 HydrophobicContact CG-CD1 4.3Å; L72-I74 HydrophobicContact CG-CG1 4.16Å; L72-A97 HydrophobicContact CG-CB 4.45Å; L72-A97 WeakPolarHBondContact O-CB 3.49Å; L72-A97 PolarHBondContact O-N 2.89Å; L72-L129 HydrophobicContact CD2-CD2 4Å; L72-V136 HydrophobicContact CD1-CG2 4.47Å; L72-L138 HydrophobicContact CD2-CD1 4.15Å
73	G	90.3	Very high	85	Confident	6 Å²	6	71.6 Å²	71.6	6%	0.062	37%	0.365	C	S	.	.	S	Bend	trans	84.4	29.7	-178.3	0	0	0	0	0	114.2	G71 F92	G71-G73 PolarHBondContact O-N 3.46Å; G73-F92 WeakPolarHBondContact O-CD2 3.32Å; G73-F92 PolarHBondContact O-N 3.17Å
74	I	91.2	Very high	84.3	Confident	26 Å²	26	66 Å²	66	13%	0.133	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152.1	173	63.9	175.2	0	0	0	111.5	L72 I76 I88 K90 I91 A97 I109	L72-I74 HydrophobicContact CB-CG1 4.44Å; L72-I74 HydrophobicContact CD2-CD1 3.5Å; L72-I74 VanDerWaalsContact CD2-CD1 3.5Å; L72-I74 HydrophobicContact CD2-CG1 3.8Å; L72-I74 HydrophobicContact CG-CD1 4.3Å; L72-I74 HydrophobicContact CG-CG1 4.16Å; I74-I76 HydrophobicContact CD1-CG2 4Å; I74-I76 HydrophobicContact CG1-CG2 4.39Å; I74-I88 HydrophobicContact CB-CG2 4.33Å; I74-I88 HydrophobicContact CD1-CD1 4.22Å; I74-I88 HydrophobicContact CD1-CG1 4.26Å; I74-I88 HydrophobicContact CG2-CG2 4.36Å; I74-K90 CarbonylContact C-O 3.51Å; I74-K90 VanDerWaalsContact CA-O 3.31Å; I74-K90 WeakPolarHBondContact CA-O 3.2Å; I74-I91 HydrophobicContact CG2-CG1 4.19Å; I74-A97 HydrophobicContact CG2-CB 3.34Å; I74-I109 HydrophobicContact CD1-CD1 3.91Å
75	S	89.8	Confident	84	Confident	40 Å²	40	68.4 Å²	68.4	28%	0.28	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.9	163.8	-60.6	0	0	0	0	109.5	S89 K90 F92	S75-S89 VanDerWaalsContact C-OG 3.28Å; S75-S89 WeakPolarHBondContact CB-OG 3.31Å; S75-S89 PolarHBondContact O-N 2.82Å; S75-S89 PolarHBondContact O-OG 3.43Å; S75-K90 PolarHBondContact N-O 3.39Å; S75-K90 PolarHBondContact O-N 3Å; S75-F92 VanDerWaalsContact OG-CE2 3.28Å; S75-F92 WeakPolarHBondContact OG-CE2 3.3Å
76	I	90.1	Very high	84	Confident	24 Å²	24	63.3 Å²	63.3	12%	0.123	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	153.7	177.4	59.1	162.4	0	0	0	112	I74 I86 L87 I109 H122 A125 V126 L129	I74-I76 HydrophobicContact CD1-CG2 4Å; I74-I76 HydrophobicContact CG1-CG2 4.39Å; I76-I86 HydrophobicContact CB-CG2 4.09Å; I76-I86 HydrophobicContact CD1-CG2 3.74Å; I76-I86 HydrophobicContact CG2-CG2 4.2Å; I76-L87 CarbonylContact C-O 3.55Å; I76-L87 WeakPolarHBondContact CA-O 3.26Å; I76-I109 HydrophobicContact CG2-CD1 3.86Å; I76-H122 PolarHBondContact O-CE1 3.15Å; I76-A125 HydrophobicContact CD1-CB 4.04Å; I76-V126 HydrophobicContact CD1-CG2 3.79Å; I76-V126 HydrophobicContact CG1-CG2 4.28Å; I76-L129 HydrophobicContact CD1-CD1 3.89Å; I76-L129 HydrophobicContact CG2-CD1 4.13Å
77	K	86.2	Confident	84.1	Confident	80 Å²	80	61.9 Å²	61.9	35%	0.348	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	169.2	169.5	-76.5	-176.1	178.9	-180	0	109.4	L87 F150	K77-L87 PolarHBondContact N-O 3.38Å; K77-L87 PolarHBondContact O-N 2.75Å; K77-F150 HydrophobicContact CD-CD1 4.43Å; K77-F150 PolarHBondContact NZ-O 2.86Å
78	G	86	Confident	84.4	Confident	7 Å²	7	58.9 Å²	58.9	7%	0.072	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86.5	-171	179.7	0	0	0	0	0	112.6	H122	G78-H122 VanDerWaalsContact O-CB 3.3Å; G78-H122 WeakPolarHBondContact O-CB 3.35Å; G78-H122 PolarHBondContact O-ND1 3.44Å
79	G	84.7	Confident	85	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140.5	154.4	-167.1	0	0	0	0	0	110.3	E81 N82 K83 M84	G79-E81 PolarHBondContact O-N 3.38Å; G79-N82 CarbonylContact O-C 3.48Å; G79-N82 WeakPolarHBondContact O-CA 3.31Å; G79-N82 PolarHBondContact O-N 3.45Å; G79-K83 PolarHBondContact O-N 2.85Å; G79-M84 CarbonylContact C-O 3.56Å; G79-M84 VanDerWaalsContact C-O 3.24Å; G79-M84 WeakPolarHBondContact CA-O 3.28Å; G79-M84 PolarHBondContact N-O 3.37Å; G79-M84 PolarHBondContact O-N 2.95Å
80	R	83.9	Confident	85.6	Confident	170 Å²	170	47.1 Å²	47.1	64%	0.642	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-53.3	-39.2	178.6	179.6	177.3	171.9	-167.7	-0.2	112.6	N82 K83 D119 A120	R80-N82 PolarHBondContact O-N 3.26Å; R80-K83 PolarHBondContact O-N 2.85Å; R80-D119 VanDerWaalsContact CD-O 3.3Å; R80-D119 WeakPolarHBondContact CD-O 3.48Å; R80-A120 PolarHBondContact N-O 3.39Å
81	E	82.5	Confident	85.9	Confident	95 Å²	95	46.2 Å²	46.2	44%	0.444	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-61.3	-30.4	177.2	70.4	-70.9	166.8	0	0	112.8	G79 T121 H122	G79-E81 PolarHBondContact O-N 3.38Å; E81-T121 WeakPolarHBondContact OE2-CA 3.34Å; E81-T121 VanDerWaalsContact OE2-CB 3.3Å; E81-T121 WeakPolarHBondContact OE2-CB 3.4Å; E81-H122 WeakPolarHBondContact OE1-CB 3.49Å; E81-H122 PolarHBondContact OE1-N 3.44Å; E81-H122 PolarHBondContact OE2-N 3.26Å
82	N	75	Confident	86	Confident	92 Å²	92	48.1 Å²	48.1	49%	0.492	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-91.2	3	177.1	-66.5	-55	0	0	0	112.9	G79 R80 M84	G79-N82 CarbonylContact O-C 3.48Å; G79-N82 WeakPolarHBondContact O-CA 3.31Å; G79-N82 PolarHBondContact O-N 3.45Å; R80-N82 PolarHBondContact O-N 3.26Å; N82-M84 HydrophobicContact CB-CB 4.32Å; N82-M84 PolarHBondContact O-N 3.02Å
83	K	78.1	Confident	85.8	Confident	166 Å²	166	52.4 Å²	52.4	72%	0.722	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	39.1	-172.7	-57.1	-178.5	-178.6	-179.8	0	112.1	G79 R80	G79-K83 PolarHBondContact O-N 2.85Å; R80-K83 PolarHBondContact O-N 2.85Å
84	M	79.4	Confident	85.6	Confident	35 Å²	35	54.9 Å²	54.9	17%	0.172	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.8	-174.1	-172.1	-175.3	-54.5	0	0	109.5	G79 N82 L87 Y149	G79-M84 CarbonylContact C-O 3.56Å; G79-M84 VanDerWaalsContact C-O 3.24Å; G79-M84 WeakPolarHBondContact CA-O 3.28Å; G79-M84 PolarHBondContact N-O 3.37Å; G79-M84 PolarHBondContact O-N 2.95Å; N82-M84 HydrophobicContact CB-CB 4.32Å; N82-M84 PolarHBondContact O-N 3.02Å; M84-L87 HydrophobicContact CG-CD1 3.78Å; M84-L87 HydrophobicContact SD-CD1 3.66Å; M84-Y149 HydrophobicContact CE-CD1 3.17Å; M84-Y149 HydrophobicContact CE-CE1 3.89Å; M84-Y149 HydrophobicContact CE-CG 3.65Å; M84-Y149 HydrophobicContact CG-CD1 4.43Å; M84-Y149 HydrophobicContact CG-CG 4.42Å; M84-Y149 HydrophobicContact SD-CD1 3.97Å; M84-Y149 HydrophobicContact SD-CG 3.82Å
85	P	86.8	Confident	85.5	Confident	51 Å²	51	56.7 Å²	56.7	33%	0.331	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	162.9	171.3	27.8	-34.9	0	0	0	110.9	L87 A108 I143	P85-L87 HydrophobicContact CG-CD1 4.47Å; P85-L87 HydrophobicContact CG-CD2 4.14Å; P85-L87 HydrophobicContact CG-CG 4.17Å; P85-L87 WeakPolarHBondContact O-CG 3.45Å; P85-L87 PolarHBondContact O-N 3.37Å; P85-A108 HydrophobicContact CB-CB 4.32Å; P85-I143 HydrophobicContact CG-CD1 4.39Å
86	I	91.5	Very high	85.6	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	116.9	172.7	-54.8	-59.2	0	0	0	108.7	I76 A108 I109 L117 A125	I76-I86 HydrophobicContact CB-CG2 4.09Å; I76-I86 HydrophobicContact CD1-CG2 3.74Å; I76-I86 HydrophobicContact CG2-CG2 4.2Å; I86-A108 CarbonylContact O-C 3.57Å; I86-A108 VanDerWaalsContact O-CA 3.28Å; I86-A108 WeakPolarHBondContact O-CA 3.16Å; I86-I109 HydrophobicContact CB-CB 4.47Å; I86-I109 HydrophobicContact CG2-CB 4.28Å; I86-I109 HydrophobicContact CG2-CD1 4.28Å; I86-I109 PolarHBondContact O-N 2.92Å; I86-L117 HydrophobicContact CG1-CB 4.37Å; I86-A125 HydrophobicContact CB-CB 4.4Å; I86-A125 HydrophobicContact CD1-CB 3.44Å; I86-A125 VanDerWaalsContact CD1-CB 3.44Å; I86-A125 HydrophobicContact CG1-CB 3.57Å; I86-A125 HydrophobicContact CG2-CB 3.99Å
87	L	90.2	Very high	85.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	140.5	-171.6	-70.2	170	0	0	0	112	I76 K77 M84 P85 S89 D107 A108 V146 Y149 F150	I76-L87 CarbonylContact C-O 3.55Å; I76-L87 WeakPolarHBondContact CA-O 3.26Å; K77-L87 PolarHBondContact N-O 3.38Å; K77-L87 PolarHBondContact O-N 2.75Å; M84-L87 HydrophobicContact CG-CD1 3.78Å; M84-L87 HydrophobicContact SD-CD1 3.66Å; P85-L87 HydrophobicContact CG-CD1 4.47Å; P85-L87 HydrophobicContact CG-CD2 4.14Å; P85-L87 HydrophobicContact CG-CG 4.17Å; P85-L87 WeakPolarHBondContact O-CG 3.45Å; P85-L87 PolarHBondContact O-N 3.37Å; L87-S89 PolarHBondContact O-N 2.9Å; L87-D107 CarbonylContact C-O 3.56Å; L87-D107 WeakPolarHBondContact CA-O 3.26Å; L87-A108 HydrophobicContact CD2-CB 3.74Å; L87-V146 HydrophobicContact CD1-CB 3.95Å; L87-V146 HydrophobicContact CD1-CG1 3.59Å; L87-V146 HydrophobicContact CD2-CB 4.15Å; L87-V146 HydrophobicContact CD2-CG1 3.59Å; L87-V146 HydrophobicContact CD2-CG2 4.18Å; L87-V146 HydrophobicContact CG-CG1 4.26Å; L87-Y149 HydrophobicContact CD1-CD2 4.06Å; L87-Y149 HydrophobicContact CD1-CG 4.39Å; L87-F150 HydrophobicContact CB-CE1 3.93Å; L87-F150 HydrophobicContact CB-CZ 3.78Å; L87-F150 HydrophobicContact CD1-CZ 4.15Å; L87-F150 HydrophobicContact CG-CZ 4.38Å
88	I	90.4	Very high	85.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	114.6	171.4	-57.4	-175.1	0	0	0	109.2	I74 I91 L103 G106 D107 I109 F150	I74-I88 HydrophobicContact CB-CG2 4.33Å; I74-I88 HydrophobicContact CD1-CD1 4.22Å; I74-I88 HydrophobicContact CD1-CG1 4.26Å; I74-I88 HydrophobicContact CG2-CG2 4.36Å; I88-I91 HydrophobicContact CG2-CD1 4.19Å; I88-I91 HydrophobicContact CG2-CG1 3.66Å; I88-L103 HydrophobicContact CD1-CB 4.26Å; I88-L103 HydrophobicContact CD1-CD1 4.42Å; I88-L103 HydrophobicContact CD1-CD2 4.08Å; I88-L103 HydrophobicContact CD1-CG 4.49Å; I88-G106 PolarHBondContact O-N 2.85Å; I88-D107 HydrophobicContact CD1-CB 3.98Å; I88-D107 HydrophobicContact CG1-CB 4.27Å; I88-D107 PolarHBondContact N-O 3.32Å; I88-I109 HydrophobicContact CD1-CD1 4.43Å; I88-I109 HydrophobicContact CD1-CG1 4.38Å; I88-I109 HydrophobicContact CG1-CD1 4.03Å; I88-I109 HydrophobicContact CG1-CG1 4.03Å; I88-F150 WeakPolarHBondContact O-CE1 3.33Å; I88-F150 VanDerWaalsContact O-CZ 3.26Å; I88-F150 WeakPolarHBondContact O-CZ 3.48Å
89	S	83.7	Confident	86	Confident	24 Å²	24	58.1 Å²	58.1	17%	0.168	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-26.4	-179.1	63.8	0	0	0	0	114.4	S75 L87 F150	S75-S89 VanDerWaalsContact C-OG 3.28Å; S75-S89 WeakPolarHBondContact CB-OG 3.31Å; S75-S89 PolarHBondContact O-N 2.82Å; S75-S89 PolarHBondContact O-OG 3.43Å; L87-S89 PolarHBondContact O-N 2.9Å; S89-F150 VanDerWaalsContact CA-CE1 3.44Å
90	K	84.6	Confident	86.2	Confident	70 Å²	70	59.1 Å²	59.1	30%	0.304	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	145.5	176.3	-177.9	165	174.3	148.7	0	109.4	D46 I74 S75 F92	D46-K90 VanDerWaalsContact OD1-CE 3.31Å; D46-K90 WeakPolarHBondContact OD1-CE 3.32Å; D46-K90 IonicContact OD1-NZ 2.73Å; D46-K90 PolarHBondContact OD1-NZ 2.78Å; D46-K90 WeakPolarHBondContact OD2-CD 3.2Å; D46-K90 WeakPolarHBondContact OD2-CE 3.39Å; D46-K90 IonicContact OD2-NZ 2.7Å; D46-K90 PolarHBondContact OD2-NZ 3.49Å; I74-K90 CarbonylContact C-O 3.51Å; I74-K90 VanDerWaalsContact CA-O 3.31Å; I74-K90 WeakPolarHBondContact CA-O 3.2Å; S75-K90 PolarHBondContact N-O 3.39Å; S75-K90 PolarHBondContact O-N 3Å; K90-F92 HydrophobicContact CD-CE1 4.19Å; K90-F92 HydrophobicContact CD-CZ 4.29Å
91	I	86.9	Confident	86.3	Confident	20 Å²	20	60.9 Å²	60.9	10%	0.103	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.2	170.9	-58.2	177.7	0	0	0	106.2	I74 I88 A97 D98 L103 V105	I74-I91 HydrophobicContact CG2-CG1 4.19Å; I88-I91 HydrophobicContact CG2-CD1 4.19Å; I88-I91 HydrophobicContact CG2-CG1 3.66Å; I91-A97 HydrophobicContact CG2-CB 4.22Å; I91-D98 HydrophobicContact CG2-CB 3.95Å; I91-L103 VanDerWaalsContact CD1-C 3.5Å; I91-L103 HydrophobicContact CD1-CB 3.92Å; I91-L103 VanDerWaalsContact CD1-O 3.25Å; I91-L103 WeakPolarHBondContact CD1-O 3.1Å; I91-V105 HydrophobicContact CD1-CG2 4.46Å; I91-V105 HydrophobicContact CG1-CG2 4.2Å
92	F	86.4	Confident	86.7	Confident	85 Å²	85	61.2 Å²	61.2	37%	0.373	31%	0.306	S	S	.	.			trans	-82.7	123.1	-178.8	-67.9	-85.2	0	0	0	109.5	G73 S75 K90 M95 D98	G73-F92 WeakPolarHBondContact O-CD2 3.32Å; G73-F92 PolarHBondContact O-N 3.17Å; S75-F92 VanDerWaalsContact OG-CE2 3.28Å; S75-F92 WeakPolarHBondContact OG-CE2 3.3Å; K90-F92 HydrophobicContact CD-CE1 4.19Å; K90-F92 HydrophobicContact CD-CZ 4.29Å; F92-M95 HydrophobicContact CB-CB 4.39Å; F92-M95 HydrophobicContact CB-CG 3.77Å; F92-M95 WeakPolarHBondContact O-CB 3.47Å; F92-M95 PolarHBondContact O-N 2.94Å; F92-D98 WeakPolarHBondContact O-CB 3.12Å
93	K	84.2	Confident	87.4	Confident	105 Å²	105	57.1 Å²	57.1	46%	0.457	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	140	179	-71.7	-174.7	171.4	176	0	112.1	N45 M95 D98	N45-K93 WeakPolarHBondContact O-CE 3.34Å; N45-K93 PolarHBondContact O-NZ 2.7Å; N45-K93 PolarHBondContact OD1-NZ 3.35Å; K93-M95 VanDerWaalsContact C-N 3.28Å; K93-M95 PolarHBondContact O-N 3.15Å; K93-D98 VanDerWaalsContact CA-OD2 3.28Å; K93-D98 WeakPolarHBondContact CA-OD2 3.4Å
94	G	85.5	Confident	87.9	Confident	58 Å²	58	50.9 Å²	50.9	60%	0.598	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	19.3	178	0	0	0	0	0	114.8	D98	G94-D98 PolarHBondContact N-OD2 3.13Å
95	M	89.9	Confident	88.2	Confident	65 Å²	65	50.4 Å²	50.4	32%	0.32	26%	0.256	S	S	.	.	S	Bend	trans	-113.4	166.3	175.3	-60.1	-82.7	-80.6	0	0	110.1	F92 K93 A97 D98 D99	F92-M95 HydrophobicContact CB-CB 4.39Å; F92-M95 HydrophobicContact CB-CG 3.77Å; F92-M95 WeakPolarHBondContact O-CB 3.47Å; F92-M95 PolarHBondContact O-N 2.94Å; K93-M95 VanDerWaalsContact C-N 3.28Å; K93-M95 PolarHBondContact O-N 3.15Å; M95-A97 PolarHBondContact O-N 3.17Å; M95-D98 WeakPolarHBondContact O-CB 3.34Å; M95-D98 PolarHBondContact O-N 3.13Å; M95-D99 PolarHBondContact O-N 3.12Å
96	A	91.3	Very high	88.1	Confident	8 Å²	8	48.1 Å²	48.1	7%	0.066	24%	0.241	C	C	.	.	H	α-helix	trans	-49.9	-39.3	-173.1	0	0	0	0	0	114.9	V64 L65 K66 T100	V64-A96 HydrophobicContact CG1-CB 3.75Å; V64-A96 WeakPolarHBondContact CG1-O 3.34Å; L65-A96 WeakPolarHBondContact O-CB 3.47Å; K66-A96 HydrophobicContact CB-CB 3.9Å; A96-T100 VanDerWaalsContact O-CG2 3.31Å; A96-T100 WeakPolarHBondContact O-CG2 3.21Å; A96-T100 PolarHBondContact O-N 3.44Å
97	A	91	Very high	88.1	Confident	1 Å²	1	48 Å²	48	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-42.3	176.8	0	0	0	0	0	113.5	L72 I74 I91 M95 T100 L103	L72-A97 HydrophobicContact CG-CB 4.45Å; L72-A97 WeakPolarHBondContact O-CB 3.49Å; L72-A97 PolarHBondContact O-N 2.89Å; I74-A97 HydrophobicContact CG2-CB 3.34Å; I91-A97 HydrophobicContact CG2-CB 4.22Å; M95-A97 PolarHBondContact O-N 3.17Å; A97-T100 PolarHBondContact O-N 2.91Å; A97-T100 PolarHBondContact O-OG1 3.44Å; A97-L103 HydrophobicContact CB-CD1 3.81Å
98	D	90.6	Very high	88.2	Confident	61 Å²	61	48 Å²	48	33%	0.326	24%	0.241	S	C	.	.	H	α-helix	trans	-65.3	-41	177.4	-173.5	46.7	0	0	0	110.9	I91 F92 K93 G94 M95 T100 R101	I91-D98 HydrophobicContact CG2-CB 3.95Å; F92-D98 WeakPolarHBondContact O-CB 3.12Å; K93-D98 VanDerWaalsContact CA-OD2 3.28Å; K93-D98 WeakPolarHBondContact CA-OD2 3.4Å; G94-D98 PolarHBondContact N-OD2 3.13Å; M95-D98 WeakPolarHBondContact O-CB 3.34Å; M95-D98 PolarHBondContact O-N 3.13Å; D98-T100 PolarHBondContact O-N 3.25Å; D98-T100 VanDerWaalsContact O-N 3.15Å; D98-R101 WeakPolarHBondContact O-CG 3.36Å; D98-R101 PolarHBondContact O-N 2.89Å
99	D	89.2	Confident	88.4	Confident	110 Å²	110	48.1 Å²	48.1	59%	0.588	24%	0.242	S	C	*	.	H	α-helix	trans	-59.2	-29.7	178.5	-67.4	-25	0	0	0	112.9	M95 R101	M95-D99 PolarHBondContact O-N 3.12Å; D99-R101 VanDerWaalsContact C-N 3.27Å; D99-R101 PolarHBondContact O-N 2.84Å
100	T	89	Confident	88.8	Confident	22 Å²	22	48 Å²	48	14%	0.135	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-26.2	177.4	69.8	0	0	0	0	113.6	V62 V64 A96 A97 D98 Q102	V62-T100 HydrophobicContact CG1-CG2 4.46Å; V64-T100 HydrophobicContact CB-CG2 4.03Å; V64-T100 HydrophobicContact CG1-CG2 3.82Å; V64-T100 HydrophobicContact CG2-CG2 3.76Å; A96-T100 VanDerWaalsContact O-CG2 3.31Å; A96-T100 WeakPolarHBondContact O-CG2 3.21Å; A96-T100 PolarHBondContact O-N 3.44Å; A97-T100 PolarHBondContact O-N 2.91Å; A97-T100 PolarHBondContact O-OG1 3.44Å; D98-T100 PolarHBondContact O-N 3.25Å; D98-T100 VanDerWaalsContact O-N 3.15Å; T100-Q102 VanDerWaalsContact O-CG 3.31Å; T100-Q102 WeakPolarHBondContact O-CG 3.43Å; T100-Q102 PolarHBondContact O-N 2.96Å; T100-Q102 PolarHBondContact O-NE2 3.19Å; T100-Q102 VanDerWaalsContact O-NE2 3.12Å; T100-Q102 PolarHBondContact OG1-N 3.5Å
101	R	86.9	Confident	89.3	Confident	208 Å²	208	45.1 Å²	45.1	79%	0.785	23%	0.228	S	C	*	.	S	Bend	trans	49.1	23.2	-173	-57.3	-176	-178.4	179.1	0.7	114.8	D98 D99	D98-R101 WeakPolarHBondContact O-CG 3.36Å; D98-R101 PolarHBondContact O-N 2.89Å; D99-R101 VanDerWaalsContact C-N 3.27Å; D99-R101 PolarHBondContact O-N 2.84Å
102	Q	89.7	Confident	89.7	Confident	101 Å²	101	44.3 Å²	44.3	47%	0.472	22%	0.224	S	C	.	.			trans	-118.1	-9.7	-175.8	-77.2	169.3	81	0	0	112.6	V62 T100	V62-Q102 HydrophobicContact CB-CB 4.41Å; V62-Q102 HydrophobicContact CG1-CB 3.66Å; V62-Q102 HydrophobicContact CG2-CB 3.85Å; T100-Q102 VanDerWaalsContact O-CG 3.31Å; T100-Q102 WeakPolarHBondContact O-CG 3.43Å; T100-Q102 PolarHBondContact O-N 2.96Å; T100-Q102 PolarHBondContact O-NE2 3.19Å; T100-Q102 VanDerWaalsContact O-NE2 3.12Å; T100-Q102 PolarHBondContact OG1-N 3.5Å
103	L	90.9	Very high	90	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.037	23%	0.227	C	C	.	.			trans	-101.3	142.1	174.2	-63	174.7	0	0	0	110.2	V62 V64 I88 I91 A97 L138 V140	V62-L103 HydrophobicContact CB-CD2 4.01Å; V62-L103 HydrophobicContact CG1-CD2 4.06Å; V62-L103 HydrophobicContact CG1-CG 4.04Å; V62-L103 HydrophobicContact CG2-CD2 4.01Å; V64-L103 HydrophobicContact CG2-CD1 4.01Å; I88-L103 HydrophobicContact CD1-CB 4.26Å; I88-L103 HydrophobicContact CD1-CD1 4.42Å; I88-L103 HydrophobicContact CD1-CD2 4.08Å; I88-L103 HydrophobicContact CD1-CG 4.49Å; I91-L103 VanDerWaalsContact CD1-C 3.5Å; I91-L103 HydrophobicContact CD1-CB 3.92Å; I91-L103 VanDerWaalsContact CD1-O 3.25Å; I91-L103 WeakPolarHBondContact CD1-O 3.1Å; A97-L103 HydrophobicContact CB-CD1 3.81Å; L103-L138 HydrophobicContact CD1-CD1 4Å; L103-L138 HydrophobicContact CD2-CD1 4.21Å; L103-V140 HydrophobicContact CD2-CG1 3.89Å; L103-V140 HydrophobicContact CD2-CG2 4.22Å
104	Y	88.4	Confident	90.3	Very high	35 Å²	35	42.7 Å²	42.7	14%	0.137	24%	0.242	C	C	.	.			trans	-131.8	147.4	-179	-59.7	-92.1	0	0	0	110.4	T49 A51 L55 G106 D107	T49-Y104 WeakPolarHBondContact O-CD1 3.46Å; A51-Y104 HydrophobicContact CB-CD1 3.99Å; A51-Y104 HydrophobicContact CB-CD2 3.86Å; A51-Y104 HydrophobicContact CB-CE1 4.32Å; A51-Y104 HydrophobicContact CB-CE2 4.22Å; A51-Y104 HydrophobicContact CB-CG 3.73Å; L55-Y104 HydrophobicContact CD1-CE2 4.42Å; Y104-G106 PolarHBondContact O-N 3.31Å; Y104-D107 PolarHBondContact N-OD2 3.18Å; Y104-D107 WeakPolarHBondContact O-CB 3.15Å; Y104-D107 PolarHBondContact O-N 3.28Å
105	V	85.2	Confident	90.7	Very high	24 Å²	24	45.5 Å²	45.5	15%	0.145	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	125.5	170.4	178.6	0	0	0	0	108.5	F48 I91 Y142	F48-V105 HydrophobicContact CD1-CB 4.3Å; F48-V105 HydrophobicContact CD1-CG1 4.14Å; F48-V105 HydrophobicContact CE1-CG1 4.08Å; I91-V105 HydrophobicContact CD1-CG2 4.46Å; I91-V105 HydrophobicContact CG1-CG2 4.2Å; V105-Y142 WeakPolarHBondContact O-CE2 3.35Å
106	G	85.4	Confident	90.8	Very high	3 Å²	3	45.8 Å²	45.8	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.1	-7.2	-169.4	0	0	0	0	0	115.4	I88 Y104 A108 I143 V146	I88-G106 PolarHBondContact O-N 2.85Å; Y104-G106 PolarHBondContact O-N 3.31Å; G106-A108 PolarHBondContact O-N 2.84Å; G106-I143 PolarHBondContact O-N 2.8Å; G106-V146 VanDerWaalsContact O-CG2 3.3Å; G106-V146 WeakPolarHBondContact O-CG2 3.34Å
107	D	90.9	Very high	90.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	130.3	171.2	-83.8	-32.2	0	0	0	111.5	R60 L87 I88 Y104 V140 Y142	R60-D107 IonicContact CZ-OD1 2.65Å; R60-D107 VanDerWaalsContact NH2-CG 3.29Å; R60-D107 IonicContact NH2-OD1 2.93Å; R60-D107 PolarHBondContact NH2-OD1 2.98Å; R60-D107 IonicContact NH2-OD2 3.25Å; R60-D107 PolarHBondContact NH2-OD2 3.46Å; R60-D107 VanDerWaalsContact NH2-OD2 3.1Å; L87-D107 CarbonylContact C-O 3.56Å; L87-D107 WeakPolarHBondContact CA-O 3.26Å; I88-D107 HydrophobicContact CD1-CB 3.98Å; I88-D107 HydrophobicContact CG1-CB 4.27Å; I88-D107 PolarHBondContact N-O 3.32Å; Y104-D107 PolarHBondContact N-OD2 3.18Å; Y104-D107 WeakPolarHBondContact O-CB 3.15Å; Y104-D107 PolarHBondContact O-N 3.28Å; D107-V140 HydrophobicContact CB-CB 4.17Å; D107-Y142 WeakPolarHBondContact OD1-CA 3.33Å; D107-Y142 WeakPolarHBondContact OD1-CB 3.34Å; D107-Y142 WeakPolarHBondContact OD1-CD2 3.3Å; D107-Y142 PolarHBondContact OD1-N 2.83Å
108	A	92	Very high	90.8	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.008	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121.7	167.6	0	0	0	0	0	110	P85 I86 L87 G106 L110 V140 K141 I143	P85-A108 HydrophobicContact CB-CB 4.32Å; I86-A108 CarbonylContact O-C 3.57Å; I86-A108 VanDerWaalsContact O-CA 3.28Å; I86-A108 WeakPolarHBondContact O-CA 3.16Å; L87-A108 HydrophobicContact CD2-CB 3.74Å; G106-A108 PolarHBondContact O-N 2.84Å; A108-L110 HydrophobicContact CB-CD2 4.42Å; A108-L110 PolarHBondContact O-N 3.23Å; A108-V140 CarbonylContact O-C 3.56Å; A108-V140 WeakPolarHBondContact O-CA 3.42Å; A108-K141 PolarHBondContact N-O 3.08Å; A108-K141 PolarHBondContact O-N 3.47Å; A108-I143 HydrophobicContact CB-CD1 3.55Å; A108-I143 HydrophobicContact CB-CG1 4.13Å
109	I	94	Very high	90.6	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	109.8	175	-49.9	178.1	0	0	0	107.9	I74 I76 I86 I88 V112 L117 L129 L138 V140	I74-I109 HydrophobicContact CD1-CD1 3.91Å; I76-I109 HydrophobicContact CG2-CD1 3.86Å; I86-I109 HydrophobicContact CB-CB 4.47Å; I86-I109 HydrophobicContact CG2-CB 4.28Å; I86-I109 HydrophobicContact CG2-CD1 4.28Å; I86-I109 PolarHBondContact O-N 2.92Å; I88-I109 HydrophobicContact CD1-CD1 4.43Å; I88-I109 HydrophobicContact CD1-CG1 4.38Å; I88-I109 HydrophobicContact CG1-CD1 4.03Å; I88-I109 HydrophobicContact CG1-CG1 4.03Å; I109-V112 HydrophobicContact CG2-CG2 3.92Å; I109-L117 HydrophobicContact CG2-CD1 4Å; I109-L129 HydrophobicContact CD1-CD1 4.18Å; I109-L129 HydrophobicContact CD1-CD2 4.48Å; I109-L138 HydrophobicContact CG2-CD2 4.31Å; I109-V140 HydrophobicContact CG1-CG1 4.36Å
110	L	93.5	Very high	90.6	Very high	23 Å²	23	50.6 Å²	50.6	12%	0.12	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-35.4	-178.2	-56.8	-177.3	0	0	0	112	K59 A108 L117 E139 K141	K59-L110 HydrophobicContact CD-CD1 4.31Å; K59-L110 HydrophobicContact CG-CD1 4.04Å; A108-L110 HydrophobicContact CB-CD2 4.42Å; A108-L110 PolarHBondContact O-N 3.23Å; L110-L117 PolarHBondContact O-N 3.2Å; L110-E139 HydrophobicContact CB-CB 4.34Å; L110-E139 HydrophobicContact CB-CG 4.2Å; L110-E139 WeakPolarHBondContact CB-O 3.3Å; L110-E139 HydrophobicContact CD1-CG 4.34Å; L110-E139 PolarHBondContact N-O 2.69Å; L110-K141 HydrophobicContact CD1-CB 3.98Å; L110-K141 HydrophobicContact CG-CB 4.42Å
111	A	94.7	Very high	90.8	Very high	8 Å²	8	51.6 Å²	51.6	7%	0.066	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	155.3	179	0	0	0	0	0	112.2	E115 E139	A111-E115 CarbonylContact C-O 3.24Å; A111-E115 WeakPolarHBondContact CA-O 2.98Å; A111-E115 WeakPolarHBondContact CB-O 3.45Å; A111-E139 HydrophobicContact CB-CB 3.94Å; A111-E139 PolarHBondContact N-O 2.66Å; A111-E139 PolarHBondContact O-N 3.38Å
112	V	95	Very high	90.9	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.024	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.4	175.2	-179.1	0	0	0	0	108.4	I109 G114 E115 L117 L129 V136 D137 L138	I109-V112 HydrophobicContact CG2-CG2 3.92Å; V112-G114 PolarHBondContact O-N 2.86Å; V112-G114 VanDerWaalsContact O-N 3.16Å; V112-E115 PolarHBondContact N-O 3.4Å; V112-E115 WeakPolarHBondContact O-CB 3.43Å; V112-E115 PolarHBondContact O-N 3.11Å; V112-L117 HydrophobicContact CG2-CD1 3.47Å; V112-L117 VanDerWaalsContact CG2-CD1 3.47Å; V112-L117 HydrophobicContact CG2-CG 4.12Å; V112-L129 HydrophobicContact CG1-CD2 4.28Å; V112-L129 HydrophobicContact CG2-CD2 3.62Å; V112-L129 HydrophobicContact CG2-CG 4.2Å; V112-V136 HydrophobicContact CG1-CG1 3.91Å; V112-D137 CarbonylContact C-O 3.56Å; V112-D137 WeakPolarHBondContact CA-O 3.49Å; V112-L138 HydrophobicContact CB-CD2 4.35Å; V112-L138 HydrophobicContact CG1-CD2 4.17Å; V112-L138 HydrophobicContact CG2-CD2 3.73Å
113	N	93.2	Very high	91	Very high	80 Å²	80	44.8 Å²	44.8	43%	0.428	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	35.8	-178.4	-62.9	-22.1	0	0	0	113.5	E115 D137	N113-E115 VanDerWaalsContact C-N 3.29Å; N113-E115 PolarHBondContact O-N 3.46Å; N113-D137 PolarHBondContact N-O 3.01Å; N113-D137 PolarHBondContact OD1-N 3.43Å
114	G	90.5	Very high	91.2	Very high	76 Å²	76	48.5 Å²	48.5	78%	0.784	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-9.1	-176.5	0	0	0	0	0	115.2	V112	V112-G114 PolarHBondContact O-N 2.86Å; V112-G114 VanDerWaalsContact O-N 3.16Å
115	E	93.1	Very high	91.4	Very high	116 Å²	116	46.8 Å²	46.8	54%	0.542	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	117.8	173.1	-171.3	179.7	173	0	0	110.1	A111 V112 N113	A111-E115 CarbonylContact C-O 3.24Å; A111-E115 WeakPolarHBondContact CA-O 2.98Å; A111-E115 WeakPolarHBondContact CB-O 3.45Å; V112-E115 PolarHBondContact N-O 3.4Å; V112-E115 WeakPolarHBondContact O-CB 3.43Å; V112-E115 PolarHBondContact O-N 3.11Å; N113-E115 VanDerWaalsContact C-N 3.29Å; N113-E115 PolarHBondContact O-N 3.46Å
116	S	93.3	Very high	91.7	Very high	72 Å²	72	47.3 Å²	47.3	50%	0.503	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	128.5	-179.4	171.7	0	0	0	0	111.8	R118	S116-R118 PolarHBondContact OG-N 2.92Å
117	L	93	Very high	92.1	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.021	29%	0.285	C	S	.	.			trans	-99.2	7.4	175.9	-64.4	-171.6	0	0	0	113.8	I86 I109 L110 V112 D119 A120 A125 A128	I86-L117 HydrophobicContact CG1-CB 4.37Å; I109-L117 HydrophobicContact CG2-CD1 4Å; L110-L117 PolarHBondContact O-N 3.2Å; V112-L117 HydrophobicContact CG2-CD1 3.47Å; V112-L117 VanDerWaalsContact CG2-CD1 3.47Å; V112-L117 HydrophobicContact CG2-CG 4.12Å; L117-D119 VanDerWaalsContact C-N 3.27Å; L117-D119 PolarHBondContact O-N 3.33Å; L117-A120 HydrophobicContact CB-CB 4.21Å; L117-A120 HydrophobicContact CD2-CB 3.94Å; L117-A120 WeakPolarHBondContact O-CB 3.44Å; L117-A120 PolarHBondContact O-N 2.93Å; L117-A125 HydrophobicContact CD1-CB 4Å; L117-A125 HydrophobicContact CD2-CB 4.48Å; L117-A128 HydrophobicContact CD2-CB 3.87Å
118	R	87.9	Confident	92.1	Very high	145 Å²	145	53.8 Å²	53.8	55%	0.547	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-36.7	-174.5	-66.2	-173.1	-172.7	174.4	12	114.3	S116	S116-R118 PolarHBondContact OG-N 2.92Å
119	D	87.6	Confident	92.1	Very high	120 Å²	120	54.5 Å²	54.5	64%	0.642	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	12.3	-179.8	-63.6	-57.7	0	0	0	112.7	R80 L117	R80-D119 VanDerWaalsContact CD-O 3.3Å; R80-D119 WeakPolarHBondContact CD-O 3.48Å; L117-D119 VanDerWaalsContact C-N 3.27Å; L117-D119 PolarHBondContact O-N 3.33Å
120	A	89	Confident	91.8	Very high	12 Å²	12	62.2 Å²	62.2	10%	0.099	33%	0.326	C	S	.	.			trans	-75	143.1	179.9	0	0	0	0	0	111.1	R80 L117 E124	R80-A120 PolarHBondContact N-O 3.39Å; L117-A120 HydrophobicContact CB-CB 4.21Å; L117-A120 HydrophobicContact CD2-CB 3.94Å; L117-A120 WeakPolarHBondContact O-CB 3.44Å; L117-A120 PolarHBondContact O-N 2.93Å; A120-E124 WeakPolarHBondContact CA-OE2 3.28Å; A120-E124 HydrophobicContact CB-CB 3.95Å
121	T	92.1	Very high	91.6	Very high	42 Å²	42	70.4 Å²	70.4	26%	0.258	36%	0.356	S	S	.	.			trans	-68.7	162.1	164.6	57.7	0	0	0	0	110.9	E81 D123 E124 A125	E81-T121 WeakPolarHBondContact OE2-CA 3.34Å; E81-T121 VanDerWaalsContact OE2-CB 3.3Å; E81-T121 WeakPolarHBondContact OE2-CB 3.4Å; T121-D123 PolarHBondContact O-N 2.86Å; T121-E124 PolarHBondContact N-OE2 2.84Å; T121-E124 PolarHBondContact O-N 3.16Å; T121-E124 VanDerWaalsContact O-N 3.16Å; T121-E124 WeakPolarHBondContact OG1-CB 3.49Å; T121-E124 VanDerWaalsContact OG1-CD 3.23Å; T121-E124 WeakPolarHBondContact OG1-CG 3.19Å; T121-E124 PolarHBondContact OG1-N 3.47Å; T121-E124 PolarHBondContact OG1-OE2 3.44Å; T121-A125 PolarHBondContact O-N 2.85Å
122	H	89.6	Confident	91.1	Very high	57 Å²	57	70.5 Å²	70.5	26%	0.264	36%	0.356	S	S	.	.	H	α-helix	trans	-51.3	-46.9	174.5	-174.3	80.6	0	0	0	111.9	I76 G78 E81 E124 A125 V126	I76-H122 PolarHBondContact O-CE1 3.15Å; G78-H122 VanDerWaalsContact O-CB 3.3Å; G78-H122 WeakPolarHBondContact O-CB 3.35Å; G78-H122 PolarHBondContact O-ND1 3.44Å; E81-H122 WeakPolarHBondContact OE1-CB 3.49Å; E81-H122 PolarHBondContact OE1-N 3.44Å; E81-H122 PolarHBondContact OE2-N 3.26Å; H122-E124 PolarHBondContact O-N 2.8Å; H122-A125 PolarHBondContact O-N 3.05Å; H122-V126 WeakPolarHBondContact O-CG2 3.22Å; H122-V126 PolarHBondContact O-N 3.41Å
123	D	92.7	Very high	90.6	Very high	109 Å²	109	72.4 Å²	72.4	58%	0.583	38%	0.376	S	S	*	.	H	α-helix	trans	-67.9	-34.1	-178.3	-69.9	-30.7	0	0	0	113.1	T121 R127	T121-D123 PolarHBondContact O-N 2.86Å; D123-R127 WeakPolarHBondContact O-CB 3.42Å; D123-R127 VanDerWaalsContact O-CG 3.26Å; D123-R127 WeakPolarHBondContact O-CG 3.27Å; D123-R127 PolarHBondContact O-N 3.28Å; D123-R127 PolarHBondContact O-NE 3.19Å
124	E	93.6	Very high	90.4	Very high	85 Å²	85	76.5 Å²	76.5	40%	0.397	39%	0.386	S	S	.	.	H	α-helix	trans	-65.2	-45	172.4	-75.8	167.1	159.6	0	0	111.2	A120 T121 H122 R127 A128	A120-E124 WeakPolarHBondContact CA-OE2 3.28Å; A120-E124 HydrophobicContact CB-CB 3.95Å; T121-E124 PolarHBondContact N-OE2 2.84Å; T121-E124 PolarHBondContact O-N 3.16Å; T121-E124 VanDerWaalsContact O-N 3.16Å; T121-E124 WeakPolarHBondContact OG1-CB 3.49Å; T121-E124 VanDerWaalsContact OG1-CD 3.23Å; T121-E124 WeakPolarHBondContact OG1-CG 3.19Å; T121-E124 PolarHBondContact OG1-N 3.47Å; T121-E124 PolarHBondContact OG1-OE2 3.44Å; H122-E124 PolarHBondContact O-N 2.8Å; E124-R127 PolarHBondContact O-N 3.25Å; E124-A128 WeakPolarHBondContact O-CB 3.4Å; E124-A128 PolarHBondContact O-N 3.38Å
125	A	93.3	Very high	90.5	Very high	0 Å²	0	76 Å²	76	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62.7	-44.1	177	0	0	0	0	0	112.2	I76 I86 L117 T121 H122 R127 A128 L129	I76-A125 HydrophobicContact CD1-CB 4.04Å; I86-A125 HydrophobicContact CB-CB 4.4Å; I86-A125 HydrophobicContact CD1-CB 3.44Å; I86-A125 VanDerWaalsContact CD1-CB 3.44Å; I86-A125 HydrophobicContact CG1-CB 3.57Å; I86-A125 HydrophobicContact CG2-CB 3.99Å; L117-A125 HydrophobicContact CD1-CB 4Å; L117-A125 HydrophobicContact CD2-CB 4.48Å; T121-A125 PolarHBondContact O-N 2.85Å; H122-A125 PolarHBondContact O-N 3.05Å; A125-R127 VanDerWaalsContact C-N 3.31Å; A125-R127 PolarHBondContact O-N 3.46Å; A125-A128 PolarHBondContact O-N 2.76Å; A125-L129 WeakPolarHBondContact O-CB 3.33Å; A125-L129 WeakPolarHBondContact O-CG 3.27Å; A125-L129 PolarHBondContact O-N 2.87Å
126	V	92.5	Very high	90.5	Very high	34 Å²	34	70.5 Å²	70.5	21%	0.206	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-44.2	173.4	172.2	0	0	0	0	110.4	I76 H122 L129 K130	I76-V126 HydrophobicContact CD1-CG2 3.79Å; I76-V126 HydrophobicContact CG1-CG2 4.28Å; H122-V126 WeakPolarHBondContact O-CG2 3.22Å; H122-V126 PolarHBondContact O-N 3.41Å; V126-L129 PolarHBondContact O-N 3Å; V126-K130 HydrophobicContact CG1-CD 3.91Å; V126-K130 HydrophobicContact CG1-CG 4.36Å; V126-K130 WeakPolarHBondContact O-CB 3.19Å; V126-K130 VanDerWaalsContact O-CG 3.31Å; V126-K130 WeakPolarHBondContact O-CG 3.06Å; V126-K130 PolarHBondContact O-N 2.8Å
127	R	92.2	Very high	90.6	Very high	129 Å²	129	70 Å²	70	49%	0.487	33%	0.333	S	S	.	.	H	α-helix	trans	-64.3	-42.5	177.7	-79.8	-178.6	-72.7	144	-11.1	112.4	D123 E124 A125 K130 R131	D123-R127 WeakPolarHBondContact O-CB 3.42Å; D123-R127 VanDerWaalsContact O-CG 3.26Å; D123-R127 WeakPolarHBondContact O-CG 3.27Å; D123-R127 PolarHBondContact O-N 3.28Å; D123-R127 PolarHBondContact O-NE 3.19Å; E124-R127 PolarHBondContact O-N 3.25Å; A125-R127 VanDerWaalsContact C-N 3.31Å; A125-R127 PolarHBondContact O-N 3.46Å; R127-K130 PolarHBondContact O-N 2.93Å; R127-R131 WeakPolarHBondContact O-CB 3.3Å; R127-R131 PolarHBondContact O-N 3.27Å
128	A	92.3	Very high	90.7	Very high	10 Å²	10	69.9 Å²	69.9	8%	0.083	33%	0.333	C	S	.	.	H	α-helix	trans	-62.8	-46.6	177.2	0	0	0	0	0	111.4	L117 E124 A125 K130 R131 S132	L117-A128 HydrophobicContact CD2-CB 3.87Å; E124-A128 WeakPolarHBondContact O-CB 3.4Å; E124-A128 PolarHBondContact O-N 3.38Å; A125-A128 PolarHBondContact O-N 2.76Å; A128-K130 PolarHBondContact O-N 3.22Å; A128-R131 PolarHBondContact O-N 3.27Å; A128-S132 PolarHBondContact O-N 2.9Å; A128-S132 VanDerWaalsContact O-N 3.15Å
129	L	91.4	Very high	91	Very high	17 Å²	17	65.2 Å²	65.2	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-38.2	176.3	-70.8	168.9	0	0	0	112.4	L72 I76 I109 V112 A125 V126 S132 L138	L72-L129 HydrophobicContact CD2-CD2 4Å; I76-L129 HydrophobicContact CD1-CD1 3.89Å; I76-L129 HydrophobicContact CG2-CD1 4.13Å; I109-L129 HydrophobicContact CD1-CD1 4.18Å; I109-L129 HydrophobicContact CD1-CD2 4.48Å; V112-L129 HydrophobicContact CG1-CD2 4.28Å; V112-L129 HydrophobicContact CG2-CD2 3.62Å; V112-L129 HydrophobicContact CG2-CG 4.2Å; A125-L129 WeakPolarHBondContact O-CB 3.33Å; A125-L129 WeakPolarHBondContact O-CG 3.27Å; A125-L129 PolarHBondContact O-N 2.87Å; V126-L129 PolarHBondContact O-N 3Å; L129-S132 WeakPolarHBondContact O-CB 3.37Å; L129-S132 PolarHBondContact O-OG 3.16Å; L129-L138 HydrophobicContact CD2-CD2 3.81Å
130	K	88.6	Confident	91.3	Very high	164 Å²	164	59.5 Å²	59.5	71%	0.713	29%	0.286	S	S	*	.	H	α-helix	trans	-71.4	-37.7	176.4	-77	-178.5	178	179.8	0	112.9	V126 R127 A128 S132	V126-K130 HydrophobicContact CG1-CD 3.91Å; V126-K130 HydrophobicContact CG1-CG 4.36Å; V126-K130 WeakPolarHBondContact O-CB 3.19Å; V126-K130 VanDerWaalsContact O-CG 3.31Å; V126-K130 WeakPolarHBondContact O-CG 3.06Å; V126-K130 PolarHBondContact O-N 2.8Å; R127-K130 PolarHBondContact O-N 2.93Å; A128-K130 PolarHBondContact O-N 3.22Å; K130-S132 VanDerWaalsContact C-N 3.26Å; K130-S132 PolarHBondContact O-N 3.19Å
131	R	87.4	Confident	91.4	Very high	195 Å²	195	62 Å²	62	74%	0.736	30%	0.295	S	S	*	.	H	α-helix	trans	-69.3	-24.1	179.2	-171.2	-175.4	-54.6	-154.2	2.7	112.7	R127 A128 G133	R127-R131 WeakPolarHBondContact O-CB 3.3Å; R127-R131 PolarHBondContact O-N 3.27Å; A128-R131 PolarHBondContact O-N 3.27Å; R131-G133 PolarHBondContact O-N 2.8Å
132	S	84.5	Confident	91.2	Very high	9 Å²	9	60.6 Å²	60.6	6%	0.063	29%	0.285	C	S	.	.			trans	-51.8	138.9	175.2	72	0	0	0	0	110.9	K66 A128 L129 K130 V136	K66-S132 PolarHBondContact NZ-O 2.77Å; K66-S132 PolarHBondContact NZ-OG 3.17Å; A128-S132 PolarHBondContact O-N 2.9Å; A128-S132 VanDerWaalsContact O-N 3.15Å; L129-S132 WeakPolarHBondContact O-CB 3.37Å; L129-S132 PolarHBondContact O-OG 3.16Å; K130-S132 VanDerWaalsContact C-N 3.26Å; K130-S132 PolarHBondContact O-N 3.19Å; S132-V136 WeakPolarHBondContact OG-CG2 3.46Å
133	G	85.3	Confident	90.8	Very high	44 Å²	44	59.8 Å²	59.8	45%	0.454	28%	0.282	S	S	.	.			trans	-76.5	-154.7	177.8	0	0	0	0	0	112.1	K66 R131 V135	K66-G133 WeakPolarHBondContact CE-O 3.4Å; K66-G133 PolarHBondContact NZ-O 3.28Å; R131-G133 PolarHBondContact O-N 2.8Å; G133-V135 PolarHBondContact O-N 3.31Å
134	R	89.5	Confident	89.6	Confident	166 Å²	166	60 Å²	60	63%	0.626	28%	0.275	S	S	*	.	S	Bend	trans	-57.8	-35.9	175.3	-171.1	-177.3	171.7	-175.4	-3.9	113	K66	K66-R134 PolarHBondContact N-O 2.96Å; K66-R134 VanDerWaalsContact O-CG 3.27Å; K66-R134 WeakPolarHBondContact O-CG 3.03Å
135	V	91	Very high	88.2	Confident	67 Å²	67	63.3 Å²	63.3	41%	0.406	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.4	178.3	-170.8	0	0	0	0	108.7	R63 L65 G133	R63-V135 HydrophobicContact CG-CG1 3.94Å; L65-V135 HydrophobicContact CD2-CB 4.37Å; L65-V135 HydrophobicContact CD2-CG1 4.27Å; L65-V135 HydrophobicContact CD2-CG2 3.79Å; G133-V135 PolarHBondContact O-N 3.31Å
136	V	93.5	Very high	86.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	112.4	178.7	-165.9	0	0	0	0	108.5	R63 V64 K66 L72 V112 S132 L138	R63-V136 WeakPolarHBondContact CA-O 3.26Å; V64-V136 HydrophobicContact CB-CB 4.5Å; V64-V136 PolarHBondContact N-O 3.42Å; V64-V136 PolarHBondContact O-N 3.36Å; K66-V136 HydrophobicContact CD-CG2 4.26Å; L72-V136 HydrophobicContact CD1-CG2 4.47Å; V112-V136 HydrophobicContact CG1-CG1 3.91Å; S132-V136 WeakPolarHBondContact OG-CG2 3.46Å; V136-L138 HydrophobicContact CG1-CD2 3.71Å; V136-L138 HydrophobicContact CG1-CG 4.12Å
137	D	94.9	Very high	84.7	Confident	61 Å²	61	69 Å²	69	33%	0.326	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	115.3	173.7	-70.7	-44.5	0	0	0	108.8	R63 V112 N113	R63-D137 WeakPolarHBondContact CB-OD1 3.47Å; R63-D137 WeakPolarHBondContact CG-OD1 3.43Å; R63-D137 IonicContact CZ-OD1 3.59Å; R63-D137 IonicContact NE-OD1 2.8Å; R63-D137 PolarHBondContact NE-OD1 2.66Å; R63-D137 IonicContact NE-OD2 3.9Å; R63-D137 IonicContact NH2-OD1 3.47Å; R63-D137 PolarHBondContact NH2-OD1 2.86Å; R63-D137 IonicContact NH2-OD2 3.5Å; R63-D137 PolarHBondContact NH2-OD2 3.36Å; V112-D137 CarbonylContact C-O 3.56Å; V112-D137 WeakPolarHBondContact CA-O 3.49Å; N113-D137 PolarHBondContact N-O 3.01Å; N113-D137 PolarHBondContact OD1-N 3.43Å
138	L	95.9	Very high	82.7	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.7	-178.8	-58.7	175.2	0	0	0	110.2	N61 V62 V64 L72 L103 I109 V112 L129 V136 V140	N61-L138 CarbonylContact C-O 3.56Å; N61-L138 WeakPolarHBondContact CA-O 3.37Å; V62-L138 PolarHBondContact N-O 3.02Å; V62-L138 PolarHBondContact O-N 2.76Å; V64-L138 HydrophobicContact CG2-CD1 3.94Å; L72-L138 HydrophobicContact CD2-CD1 4.15Å; L103-L138 HydrophobicContact CD1-CD1 4Å; L103-L138 HydrophobicContact CD2-CD1 4.21Å; I109-L138 HydrophobicContact CG2-CD2 4.31Å; V112-L138 HydrophobicContact CB-CD2 4.35Å; V112-L138 HydrophobicContact CG1-CD2 4.17Å; V112-L138 HydrophobicContact CG2-CD2 3.73Å; L129-L138 HydrophobicContact CD2-CD2 3.81Å; V136-L138 HydrophobicContact CG1-CD2 3.71Å; V136-L138 HydrophobicContact CG1-CG 4.12Å; L138-V140 HydrophobicContact CB-CG1 4.05Å
139	E	95	Very high	80.7	Confident	46 Å²	46	66.8 Å²	66.8	22%	0.215	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.8	163.3	-172.4	-173.1	157.2	0	0	107.6	K59 L110 A111	K59-E139 WeakPolarHBondContact CD-OE1 3.13Å; K59-E139 WeakPolarHBondContact CE-OE1 3.16Å; K59-E139 IonicContact NZ-OE1 3.19Å; K59-E139 PolarHBondContact NZ-OE1 2.83Å; L110-E139 HydrophobicContact CB-CB 4.34Å; L110-E139 HydrophobicContact CB-CG 4.2Å; L110-E139 WeakPolarHBondContact CB-O 3.3Å; L110-E139 HydrophobicContact CD1-CG 4.34Å; L110-E139 PolarHBondContact N-O 2.69Å; A111-E139 HydrophobicContact CB-CB 3.94Å; A111-E139 PolarHBondContact N-O 2.66Å; A111-E139 PolarHBondContact O-N 3.38Å
140	V	94.2	Very high	78.9	Confident	0 Å²	0	68 Å²	68	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	154	-178.2	-59.5	0	0	0	0	112	K59 R60 V62 L103 D107 A108 I109 L138	K59-V140 CarbonylContact C-O 3.54Å; K59-V140 WeakPolarHBondContact CA-O 3.47Å; R60-V140 HydrophobicContact CB-CG2 4.1Å; R60-V140 PolarHBondContact N-O 2.73Å; R60-V140 PolarHBondContact O-N 2.79Å; V62-V140 HydrophobicContact CG2-CG2 3.94Å; L103-V140 HydrophobicContact CD2-CG1 3.89Å; L103-V140 HydrophobicContact CD2-CG2 4.22Å; D107-V140 HydrophobicContact CB-CB 4.17Å; A108-V140 CarbonylContact O-C 3.56Å; A108-V140 WeakPolarHBondContact O-CA 3.42Å; I109-V140 HydrophobicContact CG1-CG1 4.36Å; L138-V140 HydrophobicContact CB-CG1 4.05Å
141	K	90.9	Very high	76.9	Confident	64 Å²	64	62.7 Å²	62.7	28%	0.278	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	125.7	171.5	178.3	-179.4	176.3	174.9	0	109.4	N57 A108 L110 I143	N57-K141 VanDerWaalsContact CA-CE 3.42Å; N57-K141 WeakPolarHBondContact O-CE 3.34Å; A108-K141 PolarHBondContact N-O 3.08Å; A108-K141 PolarHBondContact O-N 3.47Å; L110-K141 HydrophobicContact CD1-CB 3.98Å; L110-K141 HydrophobicContact CG-CB 4.42Å; K141-I143 PolarHBondContact O-N 2.96Å
142	Y	86.7	Confident	75	Confident	14 Å²	14	62.3 Å²	62.3	6%	0.055	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	115.3	175.6	-168.2	-105	0	0	0	109.8	A51 V56 N57 V105 D107 R144	A51-Y142 HydrophobicContact CB-CD1 3.83Å; A51-Y142 HydrophobicContact CB-CD2 3.59Å; A51-Y142 HydrophobicContact CB-CE1 3.94Å; A51-Y142 HydrophobicContact CB-CE2 3.71Å; A51-Y142 HydrophobicContact CB-CG 3.64Å; V56-Y142 HydrophobicContact CG2-CD1 4.28Å; N57-Y142 PolarHBondContact N-O 3.05Å; V105-Y142 WeakPolarHBondContact O-CE2 3.35Å; D107-Y142 WeakPolarHBondContact OD1-CA 3.33Å; D107-Y142 WeakPolarHBondContact OD1-CB 3.34Å; D107-Y142 WeakPolarHBondContact OD1-CD2 3.3Å; D107-Y142 PolarHBondContact OD1-N 2.83Å; Y142-R144 HydrophobicContact CD1-CG 4.18Å; Y142-R144 HydrophobicContact CE1-CG 3.76Å
143	I	80.8	Confident	73.5	Confident	39 Å²	39	67.7 Å²	67.7	20%	0.2	32%	0.317	C	S	.	.			trans	-99.6	114.7	175.5	-57.2	177.5	0	0	0	106.5	P85 G106 A108 K141 E145 V146	P85-I143 HydrophobicContact CG-CD1 4.39Å; G106-I143 PolarHBondContact O-N 2.8Å; A108-I143 HydrophobicContact CB-CD1 3.55Å; A108-I143 HydrophobicContact CB-CG1 4.13Å; K141-I143 PolarHBondContact O-N 2.96Å; I143-E145 HydrophobicContact CG2-CB 4.27Å; I143-E145 PolarHBondContact O-N 2.88Å; I143-V146 HydrophobicContact CB-CB 4.45Å; I143-V146 HydrophobicContact CB-CG1 3.8Å; I143-V146 HydrophobicContact CB-CG2 3.86Å; I143-V146 HydrophobicContact CD1-CG1 4.23Å; I143-V146 HydrophobicContact CG2-CB 4.35Å; I143-V146 HydrophobicContact CG2-CG1 3.58Å; I143-V146 HydrophobicContact CG2-CG2 4.18Å; I143-V146 WeakPolarHBondContact O-CG2 3.47Å
144	R	68	Low	72.5	Confident	114 Å²	114	65.9 Å²	65.9	43%	0.43	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-65.3	-32.2	175.7	-93.8	-173.9	173.9	-177.4	-4	111.8	E53 V56 Y142 V146	E53-R144 VanDerWaalsContact CG-NH2 3.28Å; E53-R144 IonicContact OE1-CZ 3.21Å; E53-R144 IonicContact OE1-NH1 3.1Å; E53-R144 IonicContact OE1-NH2 3.41Å; E53-R144 PolarHBondContact OE1-NH2 3.39Å; V56-R144 HydrophobicContact CB-CG 4.45Å; V56-R144 HydrophobicContact CG1-CB 4.21Å; V56-R144 HydrophobicContact CG1-CG 3.73Å; V56-R144 HydrophobicContact CG2-CG 3.86Å; Y142-R144 HydrophobicContact CD1-CG 4.18Å; Y142-R144 HydrophobicContact CE1-CG 3.76Å; R144-V146 VanDerWaalsContact C-N 3.28Å; R144-V146 PolarHBondContact O-N 3.13Å
145	E	63.7	Low	71.8	Confident	154 Å²	154	58.9 Å²	58.9	72%	0.72	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-84.8	12	-172.2	-62.3	177.2	-169.8	0	0	114.2	I143 P148	I143-E145 HydrophobicContact CG2-CB 4.27Å; I143-E145 PolarHBondContact O-N 2.88Å; E145-P148 VanDerWaalsContact O-CD 3.26Å; E145-P148 WeakPolarHBondContact O-CD 3.48Å
146	V	60.8	Low	71.3	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.024	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-91.7	-1.1	177.6	-75.3	0	0	0	0	114.9	L87 G106 I143 R144 P148 Y149 F150	L87-V146 HydrophobicContact CD1-CB 3.95Å; L87-V146 HydrophobicContact CD1-CG1 3.59Å; L87-V146 HydrophobicContact CD2-CB 4.15Å; L87-V146 HydrophobicContact CD2-CG1 3.59Å; L87-V146 HydrophobicContact CD2-CG2 4.18Å; L87-V146 HydrophobicContact CG-CG1 4.26Å; G106-V146 VanDerWaalsContact O-CG2 3.3Å; G106-V146 WeakPolarHBondContact O-CG2 3.34Å; I143-V146 HydrophobicContact CB-CB 4.45Å; I143-V146 HydrophobicContact CB-CG1 3.8Å; I143-V146 HydrophobicContact CB-CG2 3.86Å; I143-V146 HydrophobicContact CD1-CG1 4.23Å; I143-V146 HydrophobicContact CG2-CB 4.35Å; I143-V146 HydrophobicContact CG2-CG1 3.58Å; I143-V146 HydrophobicContact CG2-CG2 4.18Å; I143-V146 WeakPolarHBondContact O-CG2 3.47Å; R144-V146 VanDerWaalsContact C-N 3.28Å; R144-V146 PolarHBondContact O-N 3.13Å; V146-P148 VanDerWaalsContact C-N 3.27Å; V146-Y149 VanDerWaalsContact CA-CD2 3.48Å; V146-Y149 HydrophobicContact CB-CD2 3.64Å; V146-Y149 HydrophobicContact CB-CE2 4.21Å; V146-Y149 HydrophobicContact CG1-CD2 3.51Å; V146-Y149 HydrophobicContact CG1-CE2 3.7Å; V146-Y149 WeakPolarHBondContact O-CB 3.37Å; V146-Y149 WeakPolarHBondContact O-CD2 3.25Å; V146-Y149 PolarHBondContact O-N 2.67Å; V146-F150 HydrophobicContact CB-CD2 4.49Å; V146-F150 HydrophobicContact CB-CE2 3.68Å; V146-F150 HydrophobicContact CB-CZ 4.3Å; V146-F150 HydrophobicContact CG2-CE2 3.53Å; V146-F150 HydrophobicContact CG2-CZ 4.15Å; V146-F150 WeakPolarHBondContact O-CD2 3.25Å; V146-F150 WeakPolarHBondContact O-CE2 3.47Å
147	R	52.6	Low	70.4	Confident	151 Å²	151	60.8 Å²	60.8	57%	0.57	28%	0.277	S	S	*	.	H	α-helix	trans	-48.5	-39.7	172.7	-67.2	-167.2	-175.2	-175.2	1.3	114.3	Y149 F150	R147-Y149 PolarHBondContact O-N 2.96Å; R147-Y149 VanDerWaalsContact O-N 3.12Å; R147-F150 PolarHBondContact O-N 2.86Å
148	P	49.6	Very low	69.6	Low	26 Å²	26	60.6 Å²	60.6	17%	0.169	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-21.4	176.6	-22.5	34	0	0	0	114.3	E145 V146 A178	E145-P148 VanDerWaalsContact O-CD 3.26Å; E145-P148 WeakPolarHBondContact O-CD 3.48Å; V146-P148 VanDerWaalsContact C-N 3.27Å; P148-A178 HydrophobicContact CB-CB 4.25Å
149	Y	51.3	Low	69	Low	66 Å²	66	61.2 Å²	61.2	26%	0.259	28%	0.278	S	S	.	.	H	α-helix	trans	-89.9	-17.9	-177	-54.2	-64.1	0	0	0	113.7	M84 L87 V146 R147	M84-Y149 HydrophobicContact CE-CD1 3.17Å; M84-Y149 HydrophobicContact CE-CE1 3.89Å; M84-Y149 HydrophobicContact CE-CG 3.65Å; M84-Y149 HydrophobicContact CG-CD1 4.43Å; M84-Y149 HydrophobicContact CG-CG 4.42Å; M84-Y149 HydrophobicContact SD-CD1 3.97Å; M84-Y149 HydrophobicContact SD-CG 3.82Å; L87-Y149 HydrophobicContact CD1-CD2 4.06Å; L87-Y149 HydrophobicContact CD1-CG 4.39Å; V146-Y149 VanDerWaalsContact CA-CD2 3.48Å; V146-Y149 HydrophobicContact CB-CD2 3.64Å; V146-Y149 HydrophobicContact CB-CE2 4.21Å; V146-Y149 HydrophobicContact CG1-CD2 3.51Å; V146-Y149 HydrophobicContact CG1-CE2 3.7Å; V146-Y149 WeakPolarHBondContact O-CB 3.37Å; V146-Y149 WeakPolarHBondContact O-CD2 3.25Å; V146-Y149 PolarHBondContact O-N 2.67Å; R147-Y149 PolarHBondContact O-N 2.96Å; R147-Y149 VanDerWaalsContact O-N 3.12Å
150	F	52.6	Low	68.5	Low	41 Å²	41	61.8 Å²	61.8	18%	0.18	29%	0.286	C	S	.	.	H	α-helix	trans	-88.1	-25.9	177.6	-59	-67.5	0	0	0	112.1	K77 L87 I88 S89 V146 R147	K77-F150 HydrophobicContact CD-CD1 4.43Å; K77-F150 PolarHBondContact NZ-O 2.86Å; L87-F150 HydrophobicContact CB-CE1 3.93Å; L87-F150 HydrophobicContact CB-CZ 3.78Å; L87-F150 HydrophobicContact CD1-CZ 4.15Å; L87-F150 HydrophobicContact CG-CZ 4.38Å; I88-F150 WeakPolarHBondContact O-CE1 3.33Å; I88-F150 VanDerWaalsContact O-CZ 3.26Å; I88-F150 WeakPolarHBondContact O-CZ 3.48Å; S89-F150 VanDerWaalsContact CA-CE1 3.44Å; V146-F150 HydrophobicContact CB-CD2 4.49Å; V146-F150 HydrophobicContact CB-CE2 3.68Å; V146-F150 HydrophobicContact CB-CZ 4.3Å; V146-F150 HydrophobicContact CG2-CE2 3.53Å; V146-F150 HydrophobicContact CG2-CZ 4.15Å; V146-F150 WeakPolarHBondContact O-CD2 3.25Å; V146-F150 WeakPolarHBondContact O-CE2 3.47Å; R147-F150 PolarHBondContact O-N 2.86Å
151	C	47.5	Very low	68.2	Low	54 Å²	54	62.1 Å²	62.1	37%	0.365	29%	0.288	S	S	.	.	S	Bend	trans	-73.4	125.8	173.3	-147.5	0	0	0	0	109.9	Q153	C151-Q153 PolarHBondContact O-N 2.95Å
152	K	47.5	Very low	67.8	Low	186 Å²	186	61.4 Å²	61.4	81%	0.809	29%	0.287	S	S	*	.	S	Bend	trans	-54	137.2	163.3	-74.7	175.7	177.9	172.9	0	106.9	S154	K152-S154 PolarHBondContact O-N 2.82Å
153	Q	51.6	Low	67	Low	122 Å²	122	65 Å²	65	57%	0.57	31%	0.307	S	S	*	.	S	Bend	trans	-7.8	100.4	174	-159.6	172.3	6.2	0	0	112.3	C151 I155	C151-Q153 PolarHBondContact O-N 2.95Å; Q153-I155 PolarHBondContact O-N 3.41Å
154	S	64.9	Low	66.3	Low	6 Å²	6	66.7 Å²	66.7	4%	0.042	32%	0.316	C	S	.	.			trans	-48.6	125.8	-177.1	158.9	0	0	0	0	108.9	I34 K152 L156 Q157 A178	I34-S154 WeakPolarHBondContact CD1-OG 3.38Å; K152-S154 PolarHBondContact O-N 2.82Å; S154-L156 PolarHBondContact O-N 3.21Å; S154-L156 PolarHBondContact OG-N 3.43Å; S154-Q157 WeakPolarHBondContact O-CB 3.49Å; S154-Q157 PolarHBondContact O-N 2.89Å; S154-A178 WeakPolarHBondContact CB-O 3.29Å; S154-A178 PolarHBondContact OG-O 2.94Å
155	I	76	Confident	65.6	Low	19 Å²	19	64.5 Å²	64.5	10%	0.097	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-52.1	-25.7	179.5	56	132.8	0	0	0	112.1	V12 H19 V21 I34 Q153 Q157 E158	V12-I155 HydrophobicContact CG1-CD1 4.1Å; H19-I155 HydrophobicContact CB-CD1 3.36Å; V21-I155 HydrophobicContact CG1-CD1 4.45Å; I34-I155 HydrophobicContact CD1-CD1 4.38Å; I34-I155 HydrophobicContact CD1-CG1 3.41Å; I34-I155 VanDerWaalsContact CD1-CG1 3.41Å; I34-I155 HydrophobicContact CG1-CD1 4.37Å; I34-I155 HydrophobicContact CG1-CG1 3.9Å; Q153-I155 PolarHBondContact O-N 3.41Å; I155-Q157 VanDerWaalsContact C-N 3.29Å; I155-Q157 PolarHBondContact O-N 2.97Å; I155-E158 WeakPolarHBondContact O-CB 3.21Å; I155-E158 PolarHBondContact O-N 3.25Å
156	L	79.2	Confident	64.7	Low	2 Å²	2	65.1 Å²	65.1	1%	0.01	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-69.5	-24.1	177.5	-65	-176	0	0	0	113.4	V21 L32 I34 S154 E158 I159 D179 K181	V21-L156 HydrophobicContact CG1-CD2 4.1Å; L32-L156 HydrophobicContact CB-CD1 4.2Å; L32-L156 HydrophobicContact CB-CD2 3.95Å; L32-L156 HydrophobicContact CD2-CD2 4.18Å; L32-L156 WeakPolarHBondContact O-CD1 3.25Å; I34-L156 HydrophobicContact CD1-CD1 4.42Å; I34-L156 HydrophobicContact CD1-CG 4.04Å; I34-L156 HydrophobicContact CG1-CD1 3.61Å; I34-L156 HydrophobicContact CG1-CD2 4.41Å; I34-L156 HydrophobicContact CG1-CG 3.55Å; S154-L156 PolarHBondContact O-N 3.21Å; S154-L156 PolarHBondContact OG-N 3.43Å; L156-E158 PolarHBondContact O-N 3.43Å; L156-I159 HydrophobicContact CD2-CD1 3.71Å; L156-I159 PolarHBondContact O-N 3.06Å; L156-D179 VanDerWaalsContact CD1-O 3.31Å; L156-D179 WeakPolarHBondContact CD1-O 3.49Å; L156-K181 HydrophobicContact CB-CB 4.1Å; L156-K181 HydrophobicContact CD2-CB 4.5Å
157	Q	74.1	Confident	64.1	Low	105 Å²	105	67.9 Å²	67.9	49%	0.491	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-70.7	-19.1	174	-66.3	-174.8	-13.4	0	0	112.6	S154 I155	S154-Q157 WeakPolarHBondContact O-CB 3.49Å; S154-Q157 PolarHBondContact O-N 2.89Å; I155-Q157 VanDerWaalsContact C-N 3.29Å; I155-Q157 PolarHBondContact O-N 2.97Å
158	E	78	Confident	63.6	Low	58 Å²	58	66.2 Å²	66.2	27%	0.271	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-22.9	177.6	-68.1	170.6	-118.5	0	0	112.6	R15 I155 L156 S160	R15-E158 WeakPolarHBondContact CD-OE2 3.43Å; R15-E158 VanDerWaalsContact CG-OE2 3.28Å; R15-E158 WeakPolarHBondContact CG-OE2 3.45Å; R15-E158 IonicContact CZ-OE1 2.78Å; R15-E158 IonicContact CZ-OE2 2.73Å; R15-E158 IonicContact NE-OE1 3.18Å; R15-E158 PolarHBondContact NE-OE1 3.32Å; R15-E158 IonicContact NE-OE2 2.66Å; R15-E158 PolarHBondContact NE-OE2 3.26Å; R15-E158 IonicContact NH1-OE1 2.69Å; R15-E158 PolarHBondContact NH1-OE1 3.03Å; R15-E158 IonicContact NH2-OE1 3.39Å; R15-E158 PolarHBondContact NH2-OE1 2.85Å; R15-E158 IonicContact NH2-OE2 2.63Å; R15-E158 PolarHBondContact NH2-OE2 3.19Å; I155-E158 WeakPolarHBondContact O-CB 3.21Å; I155-E158 PolarHBondContact O-N 3.25Å; L156-E158 PolarHBondContact O-N 3.43Å; E158-S160 PolarHBondContact O-N 2.87Å; E158-S160 PolarHBondContact O-OG 2.9Å
159	I	84.6	Confident	63.1	Low	15 Å²	15	75.8 Å²	75.8	8%	0.077	39%	0.387	C	S	.	.	S	Bend	trans	-65.2	104.4	169.8	-58.4	179.5	0	0	0	107.4	V12 L32 L156 K181 I216	V12-I159 HydrophobicContact CG1-CD1 4.33Å; V12-I159 HydrophobicContact CG2-CD1 3.85Å; L32-I159 HydrophobicContact CD2-CD1 4.36Å; L156-I159 HydrophobicContact CD2-CD1 3.71Å; L156-I159 PolarHBondContact O-N 3.06Å; I159-K181 HydrophobicContact CG2-CG 4.41Å; I159-K181 WeakPolarHBondContact O-CE 3.34Å; I159-K181 PolarHBondContact O-NZ 3.25Å; I159-I216 HydrophobicContact CG2-CD1 3.48Å; I159-I216 VanDerWaalsContact CG2-CD1 3.48Å; I159-I216 HydrophobicContact CG2-CG1 3.73Å
160	S	84.7	Confident	62.5	Low	57 Å²	57	77.1 Å²	77.1	40%	0.399	41%	0.406	S	S	.	.			trans	-86.2	146.5	179.4	-60	0	0	0	0	110.7	E158 H214	E158-S160 PolarHBondContact O-N 2.87Å; E158-S160 PolarHBondContact O-OG 2.9Å; S160-H214 WeakPolarHBondContact O-CB 3.47Å
161	W	88	Confident	62	Low	8 Å²	8	79.1 Å²	79.1	3%	0.03	42%	0.422	C	S	.	.			trans	-142.8	158.4	173.2	-155.6	-107	0	0	0	110.6	D163 D164 I183 A188 I207 G208 S209 H214 I216	W161-D163 PolarHBondContact O-N 3.5Å; W161-D163 VanDerWaalsContact O-N 3.12Å; W161-D164 PolarHBondContact N-OD2 2.74Å; W161-D164 WeakPolarHBondContact O-CB 3.31Å; W161-D164 PolarHBondContact O-N 2.71Å; W161-D164 VanDerWaalsContact O-N 3.11Å; W161-I183 HydrophobicContact CB-CD1 4.15Å; W161-I183 HydrophobicContact CD2-CD1 3.98Å; W161-I183 HydrophobicContact CD2-CG2 3.95Å; W161-I183 HydrophobicContact CE3-CD1 4.05Å; W161-I183 HydrophobicContact CE3-CG2 4.23Å; W161-I183 HydrophobicContact CG-CD1 4.05Å; W161-I183 HydrophobicContact CH2-CG2 3.85Å; W161-I183 HydrophobicContact CZ2-CG2 3.52Å; W161-I183 HydrophobicContact CZ3-CG2 4.2Å; W161-A188 HydrophobicContact CZ2-CB 4.11Å; W161-I207 HydrophobicContact CH2-CG2 3.86Å; W161-I207 HydrophobicContact CZ2-CG2 4.47Å; W161-G208 WeakPolarHBondContact CH2-O 3.47Å; W161-S209 VanDerWaalsContact CZ2-CA 3.42Å; W161-H214 HydrophobicContact CE3-CB 4.06Å; W161-H214 HydrophobicContact CZ3-CB 4.33Å; W161-I216 HydrophobicContact CE3-CD1 3.82Å; W161-I216 HydrophobicContact CE3-CG1 4.32Å; W161-I216 HydrophobicContact CZ3-CD1 3.72Å; W161-I216 HydrophobicContact CZ3-CG1 3.96Å
162	D	82.6	Confident	61.8	Low	49 Å²	49	83.4 Å²	83.4	26%	0.262	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-55.9	-36.3	-171	-67	-12.2	0	0	0	113.4	D164 S209 P210 S211 H214	D162-D164 PolarHBondContact O-N 2.82Å; D162-S209 WeakPolarHBondContact OD1-CB 3.48Å; D162-S209 PolarHBondContact OD1-OG 3.18Å; D162-S209 WeakPolarHBondContact OD2-CB 3.49Å; D162-S209 PolarHBondContact OD2-OG 3.29Å; D162-P210 VanDerWaalsContact OD2-CD 3.3Å; D162-P210 WeakPolarHBondContact OD2-CD 3.49Å; D162-S211 VanDerWaalsContact CG-OG 3.22Å; D162-S211 WeakPolarHBondContact OD1-CB 3.39Å; D162-S211 PolarHBondContact OD1-OG 3.5Å; D162-S211 VanDerWaalsContact OD2-CB 3.24Å; D162-S211 WeakPolarHBondContact OD2-CB 3.47Å; D162-S211 PolarHBondContact OD2-N 3.03Å; D162-S211 PolarHBondContact OD2-OG 2.83Å; D162-H214 IonicContact OD1-CD2 2.79Å; D162-H214 PolarHBondContact OD1-CD2 2.8Å
163	D	69.8	Low	61.5	Low	90 Å²	90	85.3 Å²	85.3	48%	0.481	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-80	-6.8	-176.4	-83.4	-19.4	0	0	0	115.1	W161 A165 M166	W161-D163 PolarHBondContact O-N 3.5Å; W161-D163 VanDerWaalsContact O-N 3.12Å; D163-A165 PolarHBondContact O-N 3.41Å; D163-A165 VanDerWaalsContact O-N 3.08Å; D163-M166 PolarHBondContact O-N 2.95Å
164	D	65.9	Low	61.2	Low	73 Å²	73	82.7 Å²	82.7	39%	0.39	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-60.3	-26.1	-178.3	-71.4	-35.6	0	0	0	112	W161 D162 K181	W161-D164 PolarHBondContact N-OD2 2.74Å; W161-D164 WeakPolarHBondContact O-CB 3.31Å; W161-D164 PolarHBondContact O-N 2.71Å; W161-D164 VanDerWaalsContact O-N 3.11Å; D162-D164 PolarHBondContact O-N 2.82Å; D164-K181 IonicContact OD1-NZ 2.83Å; D164-K181 PolarHBondContact OD1-NZ 3.18Å; D164-K181 IonicContact OD2-NZ 3.83Å; D164-K181 PolarHBondContact OD2-NZ 3.19Å
165	A	52.1	Low	60.2	Low	69 Å²	69	87.7 Å²	87.7	57%	0.57	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-68.4	-33.1	177.2	0	0	0	0	0	113.6	D163 T168	D163-A165 PolarHBondContact O-N 3.41Å; D163-A165 VanDerWaalsContact O-N 3.08Å; A165-T168 PolarHBondContact O-OG1 2.91Å
166	M	46	Very low	58.6	Low	167 Å²	167	89.7 Å²	89.7	82%	0.823	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.4	-179.4	-102.7	71.5	-155.5	0	0	113	D163 T168	D163-M166 PolarHBondContact O-N 2.95Å; M166-T168 VanDerWaalsContact C-N 3.31Å; M166-T168 PolarHBondContact O-N 2.82Å
167	S	47.8	Very low	57.5	Low	62 Å²	62	94.4 Å²	94.4	43%	0.434	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	11	-175.9	-172.4	0	0	0	0	114.3	R169 Q174	S167-R169 PolarHBondContact O-N 2.86Å; S167-Q174 PolarHBondContact OG-NE2 2.8Å
168	T	41.4	Very low	56.6	Low	115 Å²	115	90 Å²	90	71%	0.706	47%	0.469	S	S	*	.			trans	-71.5	4.3	-174.1	48.4	0	0	0	0	115.9	A165 M166 S170	A165-T168 PolarHBondContact O-OG1 2.91Å; M166-T168 VanDerWaalsContact C-N 3.31Å; M166-T168 PolarHBondContact O-N 2.82Å; T168-S170 VanDerWaalsContact C-N 3.33Å; T168-S170 PolarHBondContact O-N 2.82Å
169	R	40.2	Very low	56.1	Low	227 Å²	227	88.3 Å²	88.3	86%	0.857	46%	0.462	S	S	*	.	S	Bend	trans	-81.3	79.9	167.9	-74.6	-172.2	-178.2	-177.8	2.1	111.1	S167 T171 Q174	S167-R169 PolarHBondContact O-N 2.86Å; R169-T171 PolarHBondContact O-N 3.49Å; R169-T171 VanDerWaalsContact O-N 3.09Å; R169-Q174 PolarHBondContact O-OE1 3.1Å; R169-Q174 VanDerWaalsContact O-OE1 3.1Å
170	S	37.8	Very low	55.8	Low	94 Å²	94	90.8 Å²	90.8	66%	0.657	48%	0.475	S	S	*	.			trans	-57.1	106.5	-178.9	67.1	0	0	0	0	112.7	T168	T168-S170 VanDerWaalsContact C-N 3.33Å; T168-S170 PolarHBondContact O-N 2.82Å
171	T	42.1	Very low	55.8	Low	84 Å²	84	88.7 Å²	88.7	52%	0.515	46%	0.459	S	S	.	.			trans	-103.4	148.8	162.1	56.9	0	0	0	0	109.7	R169 R173 Q174	R169-T171 PolarHBondContact O-N 3.49Å; R169-T171 VanDerWaalsContact O-N 3.09Å; T171-R173 PolarHBondContact O-N 2.88Å; T171-Q174 PolarHBondContact O-N 3.1Å
172	L	43.1	Very low	55.9	Low	144 Å²	144	91.2 Å²	91.2	75%	0.754	47%	0.472	S	S	*	.	H	α-helix	trans	-49.2	-29.1	176.2	-82.9	148.5	0	0	0	113	R175	L172-R175 PolarHBondContact O-N 3.48Å
173	R	40.8	Very low	56.4	Low	225 Å²	225	88.9 Å²	88.9	85%	0.849	46%	0.46	S	S	*	.	H	α-helix	trans	-69.1	-26	176.3	-72.1	-176.7	174.7	-179.3	-1.6	114.6	T171	T171-R173 PolarHBondContact O-N 2.88Å
174	Q	45.2	Very low	57.5	Low	67 Å²	67	86.2 Å²	86.2	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-76.1	-23.3	176.4	-85.1	171.9	-33.2	0	0	112.9	S167 R169 T171 A176 K177	S167-Q174 PolarHBondContact OG-NE2 2.8Å; R169-Q174 PolarHBondContact O-OE1 3.1Å; R169-Q174 VanDerWaalsContact O-OE1 3.1Å; T171-Q174 PolarHBondContact O-N 3.1Å; Q174-A176 VanDerWaalsContact C-N 3.3Å; Q174-A176 PolarHBondContact O-N 3.26Å; Q174-K177 WeakPolarHBondContact O-CA 3.34Å; Q174-K177 VanDerWaalsContact O-CB 3.28Å; Q174-K177 WeakPolarHBondContact O-CB 3.04Å; Q174-K177 PolarHBondContact O-N 3.31Å
175	R	44.6	Very low	58.9	Low	112 Å²	112	82.8 Å²	82.8	42%	0.423	43%	0.429	S	S	.	.	H	α-helix	trans	-72.8	-23.1	179.6	-72.2	-179.2	-178	179.3	-4	113.2	L172 K177 A178	L172-R175 PolarHBondContact O-N 3.48Å; R175-K177 PolarHBondContact O-N 3.38Å; R175-A178 VanDerWaalsContact O-CB 3.26Å; R175-A178 WeakPolarHBondContact O-CB 3.42Å; R175-A178 PolarHBondContact O-N 2.91Å; R175-A178 VanDerWaalsContact O-N 3.1Å
176	A	43.3	Very low	60.8	Low	60 Å²	60	82.8 Å²	82.8	50%	0.496	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-68	-18	167.2	0	0	0	0	0	112.7	Q174 A178	Q174-A176 VanDerWaalsContact C-N 3.3Å; Q174-A176 PolarHBondContact O-N 3.26Å; A176-A178 VanDerWaalsContact C-N 3.26Å; A176-A178 PolarHBondContact O-N 2.98Å
177	K	54.6	Low	63	Low	101 Å²	101	78.5 Å²	78.5	44%	0.439	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-82.7	8.3	169.1	-69.1	-174.8	169.5	-176.1	0	113.2	Q174 R175 D179 L180	Q174-K177 WeakPolarHBondContact O-CA 3.34Å; Q174-K177 VanDerWaalsContact O-CB 3.28Å; Q174-K177 WeakPolarHBondContact O-CB 3.04Å; Q174-K177 PolarHBondContact O-N 3.31Å; R175-K177 PolarHBondContact O-N 3.38Å; K177-D179 PolarHBondContact O-N 3.42Å; K177-D179 VanDerWaalsContact O-N 3.1Å; K177-L180 HydrophobicContact CB-CB 4.28Å; K177-L180 HydrophobicContact CG-CD1 4.35Å; K177-L180 CarbonylContact O-C 3.57Å; K177-L180 PolarHBondContact O-N 3.02Å
178	A	56	Low	65.3	Low	12 Å²	12	75.7 Å²	75.7	10%	0.099	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-55.1	-31.6	176.6	0	0	0	0	0	112.3	P148 S154 R175 A176 L180	P148-A178 HydrophobicContact CB-CB 4.25Å; S154-A178 WeakPolarHBondContact CB-O 3.29Å; S154-A178 PolarHBondContact OG-O 2.94Å; R175-A178 VanDerWaalsContact O-CB 3.26Å; R175-A178 WeakPolarHBondContact O-CB 3.42Å; R175-A178 PolarHBondContact O-N 2.91Å; R175-A178 VanDerWaalsContact O-N 3.1Å; A176-A178 VanDerWaalsContact C-N 3.26Å; A176-A178 PolarHBondContact O-N 2.98Å; A178-L180 VanDerWaalsContact C-N 3.29Å; A178-L180 PolarHBondContact O-N 2.89Å
179	D	67	Low	67.8	Low	24 Å²	24	72.3 Å²	72.3	13%	0.128	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-88.8	6.8	179.1	-58.9	-17.3	0	0	0	112.9	A33 Q36 L156 K177	A33-D179 VanDerWaalsContact CA-O 3.27Å; A33-D179 WeakPolarHBondContact CA-O 2.99Å; Q36-D179 PolarHBondContact NE2-OD2 2.65Å; Q36-D179 VanDerWaalsContact NE2-OD2 3.13Å; L156-D179 VanDerWaalsContact CD1-O 3.31Å; L156-D179 WeakPolarHBondContact CD1-O 3.49Å; K177-D179 PolarHBondContact O-N 3.42Å; K177-D179 VanDerWaalsContact O-N 3.1Å
180	L	77.9	Confident	70.4	Confident	66 Å²	66	62.8 Å²	62.8	35%	0.346	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.6	-176.3	-64.8	173.7	0	0	0	111.2	L31 L32 A33 K177 A178	L31-L180 HydrophobicContact CD2-CD2 3.96Å; L31-L180 HydrophobicContact CG-CD2 4.37Å; L32-L180 CarbonylContact O-C 3.48Å; L32-L180 VanDerWaalsContact O-CA 3.27Å; L32-L180 WeakPolarHBondContact O-CA 3.27Å; A33-L180 HydrophobicContact CB-CD2 3.47Å; A33-L180 VanDerWaalsContact CB-CD2 3.47Å; K177-L180 HydrophobicContact CB-CB 4.28Å; K177-L180 HydrophobicContact CG-CD1 4.35Å; K177-L180 CarbonylContact O-C 3.57Å; K177-L180 PolarHBondContact O-N 3.02Å; A178-L180 VanDerWaalsContact C-N 3.29Å; A178-L180 PolarHBondContact O-N 2.89Å
181	K	86.3	Confident	72.9	Confident	13 Å²	13	62.5 Å²	62.5	6%	0.057	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131	166.6	-178.2	71.9	-178.4	-171.8	0	109.2	L31 L32 L156 I159 D164 I183	L31-K181 CarbonylContact C-O 3.59Å; L31-K181 WeakPolarHBondContact CA-O 3.17Å; L32-K181 HydrophobicContact CB-CB 4.26Å; L32-K181 HydrophobicContact CD1-CB 4Å; L32-K181 HydrophobicContact CD1-CG 4.08Å; L32-K181 PolarHBondContact N-O 2.88Å; L32-K181 PolarHBondContact O-N 2.99Å; L156-K181 HydrophobicContact CB-CB 4.1Å; L156-K181 HydrophobicContact CD2-CB 4.5Å; I159-K181 HydrophobicContact CG2-CG 4.41Å; I159-K181 WeakPolarHBondContact O-CE 3.34Å; I159-K181 PolarHBondContact O-NZ 3.25Å; D164-K181 IonicContact OD1-NZ 2.83Å; D164-K181 PolarHBondContact OD1-NZ 3.18Å; D164-K181 IonicContact OD2-NZ 3.83Å; D164-K181 PolarHBondContact OD2-NZ 3.19Å; K181-I183 HydrophobicContact CD-CD1 4.15Å; K181-I183 VanDerWaalsContact CE-CD1 3.5Å; K181-I183 HydrophobicContact CG-CD1 3.57Å; K181-I183 HydrophobicContact CG-CG1 4.13Å
182	I	89.3	Confident	75.4	Confident	62 Å²	62	60.6 Å²	60.6	32%	0.318	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.9	176	-56.9	175	0	0	0	107	T29 L31	T29-I182 HydrophobicContact CG2-CG2 3.88Å; L31-I182 HydrophobicContact CD1-CG1 4.34Å
183	I	92.6	Very high	77.7	Confident	0 Å²	0	54 Å²	54	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	104.3	-179.7	-56.6	-59.6	0	0	0	108.4	T29 L30 L32 W161 K181 L185 I216	T29-I183 CarbonylContact C-O 3.59Å; T29-I183 VanDerWaalsContact CA-O 3.27Å; T29-I183 WeakPolarHBondContact CA-O 3.26Å; L30-I183 HydrophobicContact CB-CB 4.23Å; L30-I183 PolarHBondContact N-O 2.97Å; L30-I183 PolarHBondContact O-N 2.76Å; L32-I183 HydrophobicContact CD1-CD1 4.41Å; L32-I183 HydrophobicContact CD1-CG1 3.52Å; W161-I183 HydrophobicContact CB-CD1 4.15Å; W161-I183 HydrophobicContact CD2-CD1 3.98Å; W161-I183 HydrophobicContact CD2-CG2 3.95Å; W161-I183 HydrophobicContact CE3-CD1 4.05Å; W161-I183 HydrophobicContact CE3-CG2 4.23Å; W161-I183 HydrophobicContact CG-CD1 4.05Å; W161-I183 HydrophobicContact CH2-CG2 3.85Å; W161-I183 HydrophobicContact CZ2-CG2 3.52Å; W161-I183 HydrophobicContact CZ3-CG2 4.2Å; K181-I183 HydrophobicContact CD-CD1 4.15Å; K181-I183 VanDerWaalsContact CE-CD1 3.5Å; K181-I183 HydrophobicContact CG-CD1 3.57Å; K181-I183 HydrophobicContact CG-CG1 4.13Å; I183-L185 PolarHBondContact O-N 3.01Å; I183-I216 HydrophobicContact CD1-CD1 3.48Å; I183-I216 VanDerWaalsContact CD1-CD1 3.48Å; I183-I216 HydrophobicContact CG1-CD1 3.77Å; I183-I216 HydrophobicContact CG2-CD1 4.43Å
184	P	93.7	Very high	79.9	Confident	34 Å²	34	44.3 Å²	44.3	22%	0.221	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	133.5	170.2	-22.6	33	0	0	0	111.4
185	L	94.7	Very high	81.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.235	C	C	.	.			trans	-95	-15.3	-177.1	-61.9	176.8	0	0	0	113.3	L25 T28 L30 I183 M187 A188 I233 C236 M237 L240	L25-L185 HydrophobicContact CD1-CD1 3.47Å; L25-L185 VanDerWaalsContact CD1-CD1 3.47Å; T28-L185 PolarHBondContact O-N 3.25Å; L30-L185 HydrophobicContact CB-CD2 4.16Å; I183-L185 PolarHBondContact O-N 3.01Å; L185-M187 PolarHBondContact O-N 2.96Å; L185-A188 WeakPolarHBondContact O-CB 3.5Å; L185-A188 PolarHBondContact O-N 3.42Å; L185-I233 HydrophobicContact CD2-CG2 4.27Å; L185-C236 HydrophobicContact CD1-CB 4.23Å; L185-M237 HydrophobicContact CB-CE 4.44Å; L185-M237 HydrophobicContact CB-CG 4.11Å; L185-M237 HydrophobicContact CD2-CE 3.63Å; L185-L240 HydrophobicContact CB-CD1 3.67Å
186	K	92.9	Very high	83.4	Confident	70 Å²	70	48.1 Å²	48.1	30%	0.304	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	124.6	179.4	-172.7	172.3	179.2	180	0	109.8	A188 L240 E247	K186-A188 PolarHBondContact O-N 3.29Å; K186-A188 VanDerWaalsContact O-N 3.14Å; K186-L240 HydrophobicContact CB-CB 4.37Å; K186-L240 HydrophobicContact CB-CD1 4.37Å; K186-L240 HydrophobicContact CG-CB 4.46Å; K186-E247 IonicContact NZ-OE1 2.74Å; K186-E247 PolarHBondContact NZ-OE1 2.59Å; K186-E247 IonicContact NZ-OE2 2.64Å; K186-E247 PolarHBondContact NZ-OE2 3.19Å
187	M	92.6	Very high	85.4	Confident	76 Å²	76	47.4 Å²	47.4	37%	0.374	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	8.9	-174.3	-57.9	178.6	65.6	0	0	115.8	L185 P210 M241 W263	L185-M187 PolarHBondContact O-N 2.96Å; M187-P210 HydrophobicContact CB-CB 3.99Å; M187-P210 HydrophobicContact CB-CG 3.97Å; M187-P210 WeakPolarHBondContact O-CA 3.28Å; M187-M241 HydrophobicContact CB-SD 4.49Å; M187-M241 HydrophobicContact CG-SD 4.11Å; M187-W263 WeakPolarHBondContact O-CZ2 3.46Å; M187-W263 PolarHBondContact O-NE1 3.49Å
188	A	94.8	Very high	87	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.033	25%	0.248	C	C	.	.			trans	-70.2	163	168.6	0	0	0	0	0	110.1	W161 L185 K186 I207 G208 M237 W263	W161-A188 HydrophobicContact CZ2-CB 4.11Å; L185-A188 WeakPolarHBondContact O-CB 3.5Å; L185-A188 PolarHBondContact O-N 3.42Å; K186-A188 PolarHBondContact O-N 3.29Å; K186-A188 VanDerWaalsContact O-N 3.14Å; A188-I207 HydrophobicContact CB-CG2 4.34Å; A188-G208 WeakPolarHBondContact CA-O 3.42Å; A188-G208 WeakPolarHBondContact CB-O 3.27Å; A188-M237 HydrophobicContact CB-CE 3.62Å; A188-M237 HydrophobicContact CB-SD 4.48Å; A188-W263 PolarHBondContact O-NE1 3.43Å
189	Y	93.7	Very high	88.7	Confident	44 Å²	44	47.1 Å²	47.1	17%	0.173	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.8	170.9	59.6	-87	0	0	0	111.2	I207 G208 S209 R212 I215 W263	Y189-I207 CarbonylContact O-C 3.58Å; Y189-I207 WeakPolarHBondContact O-CA 3.06Å; Y189-G208 WeakPolarHBondContact CD1-O 3.32Å; Y189-G208 VanDerWaalsContact CE1-C 3.47Å; Y189-G208 VanDerWaalsContact CZ-CA 3.45Å; Y189-G208 PolarHBondContact N-O 3.08Å; Y189-G208 PolarHBondContact O-N 3.39Å; Y189-S209 VanDerWaalsContact CE1-O 3.3Å; Y189-S209 WeakPolarHBondContact CE1-O 3.41Å; Y189-R212 HydrophobicContact CE1-CB 4.25Å; Y189-R212 HydrophobicContact CE1-CG 3.85Å; Y189-I215 WeakPolarHBondContact OH-CG1 3.45Å; Y189-W263 VanDerWaalsContact CB-CD1 3.47Å; Y189-W263 HydrophobicContact CD1-CD2 4.22Å; Y189-W263 HydrophobicContact CD1-CG 4.48Å; Y189-W263 HydrophobicContact CG-CG 4.44Å
190	L	94.9	Very high	89.7	Confident	26 Å²	26	53.1 Å²	53.1	14%	0.136	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136	-178.2	-179.8	73.7	0	0	0	109.4	E206 I207 F230 I233 N234 M237	L190-E206 CarbonylContact C-O 3.56Å; L190-E206 WeakPolarHBondContact CA-O 3.35Å; L190-I207 HydrophobicContact CD1-CD1 4.35Å; L190-I207 HydrophobicContact CD1-CG1 3.57Å; L190-F230 HydrophobicContact CB-CE2 4.42Å; L190-F230 HydrophobicContact CD1-CD2 4.26Å; L190-F230 HydrophobicContact CD2-CB 4.49Å; L190-F230 HydrophobicContact CD2-CD1 4.4Å; L190-F230 HydrophobicContact CD2-CD2 3.46Å; L190-F230 VanDerWaalsContact CD2-CD2 3.46Å; L190-F230 HydrophobicContact CD2-CE2 3.61Å; L190-F230 HydrophobicContact CD2-CG 3.89Å; L190-F230 HydrophobicContact CD2-CZ 4.14Å; L190-F230 WeakPolarHBondContact CD2-O 3.48Å; L190-F230 HydrophobicContact CG-CD2 3.59Å; L190-F230 HydrophobicContact CG-CE2 3.55Å; L190-F230 HydrophobicContact CG-CG 4.49Å; L190-F230 HydrophobicContact CG-CZ 4.41Å; L190-I233 HydrophobicContact CD1-CD1 4.49Å; L190-I233 HydrophobicContact CD1-CG2 4.15Å; L190-I233 HydrophobicContact CD2-CB 3.97Å; L190-I233 HydrophobicContact CD2-CG2 3.96Å; L190-N234 HydrophobicContact CD2-CB 3.92Å; L190-M237 HydrophobicContact CB-CE 4.19Å; L190-M237 HydrophobicContact CB-SD 3.78Å
191	F	91.5	Very high	90.3	Very high	88 Å²	88	55.7 Å²	55.7	39%	0.386	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.4	175.8	178.6	-103.8	0	0	0	110.8	I205 E206	F191-I205 WeakPolarHBondContact O-CA 3.5Å; F191-E206 HydrophobicContact CB-CB 4.46Å; F191-E206 PolarHBondContact N-O 3.01Å; F191-E206 PolarHBondContact O-N 3.27Å
192	R	93.8	Very high	90.7	Very high	45 Å²	45	59.8 Å²	59.8	17%	0.17	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.1	174.8	-168.9	65	169.9	91.1	11.6	109.3	Q202 M204 S223 S227 F230	R192-Q202 PolarHBondContact NH1-O 3.41Å; R192-Q202 PolarHBondContact NH2-O 3.19Å; R192-M204 PolarHBondContact NH1-O 3.39Å; R192-S223 PolarHBondContact NH2-O 2.86Å; R192-S227 PolarHBondContact NH2-OG 3.26Å; R192-F230 HydrophobicContact CB-CD2 3.86Å; R192-F230 HydrophobicContact CB-CE2 3.9Å
193	G	91.8	Very high	91	Very high	6 Å²	6	59.6 Å²	59.6	6%	0.062	31%	0.305	C	S	.	.	S	Bend	trans	116.9	-160.7	-171.1	0	0	0	0	0	111.3	D199 M204	G193-D199 WeakPolarHBondContact CA-OD2 3.36Å; G193-M204 PolarHBondContact N-O 2.97Å; G193-M204 CarbonylContact O-C 3.55Å
194	S	87.6	Confident	91.2	Very high	20 Å²	20	59.8 Å²	59.8	14%	0.14	31%	0.307	C	S	.	.			trans	-137.7	144	169.5	176	0	0	0	0	110.8	I196 H197 E206	S194-I196 VanDerWaalsContact C-N 3.34Å; S194-I196 PolarHBondContact OG-N 2.74Å; S194-H197 WeakPolarHBondContact CB-O 3.47Å; S194-H197 WeakPolarHBondContact OG-CB 3.35Å; S194-H197 PolarHBondContact OG-CD2 2.98Å; S194-H197 VanDerWaalsContact OG-CD2 3.3Å; S194-H197 PolarHBondContact OG-N 2.86Å; S194-E206 VanDerWaalsContact CA-CD 3.46Å; S194-E206 WeakPolarHBondContact CA-OE1 3.44Å; S194-E206 WeakPolarHBondContact CB-OE1 3.48Å; S194-E206 PolarHBondContact OG-OE1 3.42Å
195	L	81.2	Confident	91.4	Very high	120 Å²	120	58.2 Å²	58.2	63%	0.628	30%	0.296	S	S	*	.	S	Bend	trans	-76.2	-22.4	173.6	-66.9	173.3	0	0	0	113	E206 I215	L195-E206 WeakPolarHBondContact CG-OE2 3.14Å; L195-E206 PolarHBondContact N-OE1 3.34Å; L195-E206 PolarHBondContact N-OE2 3.42Å; L195-E206 VanDerWaalsContact N-OE2 3.07Å; L195-I215 HydrophobicContact CD1-CD1 4.12Å
196	I	82.3	Confident	91.4	Very high	139 Å²	139	58.3 Å²	58.3	71%	0.713	30%	0.297	S	S	*	.	S	Bend	trans	-116.7	-33.3	-171.3	-58.5	169.7	0	0	0	111.4	S194	S194-I196 VanDerWaalsContact C-N 3.34Å; S194-I196 PolarHBondContact OG-N 2.74Å
197	H	84.3	Confident	91.5	Very high	45 Å²	45	55 Å²	55	21%	0.208	28%	0.282	C	S	.	.	S	Bend	trans	-102.8	141.9	-173.9	-55	-69.4	0	0	0	111.9	F13 S194 D199 M204	F13-H197 AromaticContact CD1-CE1 3.63Å; F13-H197 AromaticContact CD1-NE2 3.39Å; F13-H197 WeakPolarHBondContact CD1-NE2 3.46Å; F13-H197 AromaticContact CE1-CE1 3.36Å; F13-H197 WeakPolarHBondContact CE1-CE1 3.28Å; F13-H197 AromaticContact CE1-NE2 3.59Å; F13-H197 AromaticContact CE2-CE1 3.88Å; F13-H197 AromaticContact CG-CE1 3.99Å; F13-H197 AromaticContact CG-NE2 3.76Å; F13-H197 AromaticContact CZ-CE1 3.46Å; F13-H197 VanDerWaalsContact CZ-CE1 3.46Å; F13-H197 WeakPolarHBondContact CZ-CE1 3.43Å; S194-H197 WeakPolarHBondContact CB-O 3.47Å; S194-H197 WeakPolarHBondContact OG-CB 3.35Å; S194-H197 PolarHBondContact OG-CD2 2.98Å; S194-H197 VanDerWaalsContact OG-CD2 3.3Å; S194-H197 PolarHBondContact OG-N 2.86Å; H197-D199 PolarHBondContact O-N 3.09Å; H197-M204 HydrophobicContact CB-CE 3.65Å; H197-M204 HydrophobicContact CB-SD 3.86Å; H197-M204 WeakPolarHBondContact O-CE 3.5Å
198	A	88	Confident	91.6	Very high	85 Å²	85	51.4 Å²	51.4	70%	0.702	26%	0.264	S	S	*	.			trans	-64.8	122.8	172.3	0	0	0	0	0	110.6	M204	A198-M204 WeakPolarHBondContact O-CE 3.42Å
199	D	90.9	Very high	91.6	Very high	22 Å²	22	51.2 Å²	51.2	12%	0.118	26%	0.263	C	S	.	.			trans	-111.5	54.5	179.2	-157.5	11.3	0	0	0	113.1	G193 H197 E201 Q202 R203 M204	G193-D199 WeakPolarHBondContact CA-OD2 3.36Å; H197-D199 PolarHBondContact O-N 3.09Å; D199-E201 PolarHBondContact O-N 2.95Å; D199-Q202 PolarHBondContact O-N 2.83Å; D199-Q202 PolarHBondContact O-NE2 2.73Å; D199-Q202 WeakPolarHBondContact OD1-CA 3.19Å; D199-Q202 PolarHBondContact OD1-N 3.2Å; D199-Q202 WeakPolarHBondContact OD2-CA 3.43Å; D199-R203 PolarHBondContact OD1-N 3.38Å; D199-R203 PolarHBondContact OD2-N 3.25Å; D199-M204 HydrophobicContact CB-CE 3.25Å; D199-M204 PolarHBondContact OD1-N 2.65Å; D199-M204 WeakPolarHBondContact OD2-CB 3.49Å; D199-M204 PolarHBondContact OD2-N 2.93Å
200	N	88.5	Confident	91.5	Very high	151 Å²	151	50.9 Å²	50.9	81%	0.807	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.7	-176.2	-66.5	-24.6	0	0	0	112.6
201	E	91.9	Very high	91.2	Very high	119 Å²	119	52 Å²	52	56%	0.556	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	3	-179.2	-63.7	175.6	165.9	0	0	112.9	D199 R203	D199-E201 PolarHBondContact O-N 2.95Å; E201-R203 VanDerWaalsContact C-N 3.35Å; E201-R203 HydrophobicContact CB-CG 3.8Å; E201-R203 WeakPolarHBondContact O-CG 3.28Å; E201-R203 PolarHBondContact O-N 3.42Å; E201-R203 IonicContact OE2-CZ 3.72Å; E201-R203 IonicContact OE2-NE 2.66Å; E201-R203 PolarHBondContact OE2-NE 2.97Å; E201-R203 IonicContact OE2-NH2 2.74Å; E201-R203 PolarHBondContact OE2-NH2 2.84Å
202	Q	94.1	Very high	91.1	Very high	99 Å²	99	54.6 Å²	54.6	46%	0.463	28%	0.283	S	S	.	.			trans	52.9	48.7	-179.9	-62.1	-69.9	-61.3	0	0	111.8	R192 D199 S223	R192-Q202 PolarHBondContact NH1-O 3.41Å; R192-Q202 PolarHBondContact NH2-O 3.19Å; D199-Q202 PolarHBondContact O-N 2.83Å; D199-Q202 PolarHBondContact O-NE2 2.73Å; D199-Q202 WeakPolarHBondContact OD1-CA 3.19Å; D199-Q202 PolarHBondContact OD1-N 3.2Å; D199-Q202 WeakPolarHBondContact OD2-CA 3.43Å; Q202-S223 WeakPolarHBondContact CB-OG 3.28Å; Q202-S223 VanDerWaalsContact O-CA 3.25Å; Q202-S223 WeakPolarHBondContact O-CA 3.36Å; Q202-S223 WeakPolarHBondContact O-CB 3.47Å; Q202-S223 PolarHBondContact O-OG 2.95Å; Q202-S223 VanDerWaalsContact O-OG 3.08Å
203	R	96.3	Very high	90.9	Very high	58 Å²	58	62.2 Å²	62.2	22%	0.219	31%	0.312	C	S	.	.			trans	-109.5	-0.2	-175.8	-60.2	-164.5	-69.8	148.5	-8.1	113.7	D199 E201 R219 C220 A221 A226	D199-R203 PolarHBondContact OD1-N 3.38Å; D199-R203 PolarHBondContact OD2-N 3.25Å; E201-R203 VanDerWaalsContact C-N 3.35Å; E201-R203 HydrophobicContact CB-CG 3.8Å; E201-R203 WeakPolarHBondContact O-CG 3.28Å; E201-R203 PolarHBondContact O-N 3.42Å; E201-R203 IonicContact OE2-CZ 3.72Å; E201-R203 IonicContact OE2-NE 2.66Å; E201-R203 PolarHBondContact OE2-NE 2.97Å; E201-R203 IonicContact OE2-NH2 2.74Å; E201-R203 PolarHBondContact OE2-NH2 2.84Å; R203-R219 HydrophobicContact CB-CG 4.3Å; R203-C220 PolarHBondContact NH1-O 3.47Å; R203-C220 PolarHBondContact O-N 3.07Å; R203-A221 WeakPolarHBondContact CD-O 3.33Å; R203-A221 PolarHBondContact NH1-O 3.24Å; R203-A226 WeakPolarHBondContact O-CB 3.41Å
204	M	96.5	Very high	90.9	Very high	5 Å²	5	64.5 Å²	64.5	3%	0.025	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	146.6	-174.3	-63.2	-171.3	-71.1	0	0	113.7	W18 R192 G193 H197 A198 D199 T217 F218 R219	W18-M204 HydrophobicContact CH2-CG 4.45Å; W18-M204 HydrophobicContact CH2-SD 3.75Å; W18-M204 HydrophobicContact CZ2-SD 3.9Å; R192-M204 PolarHBondContact NH1-O 3.39Å; G193-M204 PolarHBondContact N-O 2.97Å; G193-M204 CarbonylContact O-C 3.55Å; H197-M204 HydrophobicContact CB-CE 3.65Å; H197-M204 HydrophobicContact CB-SD 3.86Å; H197-M204 WeakPolarHBondContact O-CE 3.5Å; A198-M204 WeakPolarHBondContact O-CE 3.42Å; D199-M204 HydrophobicContact CB-CE 3.25Å; D199-M204 PolarHBondContact OD1-N 2.65Å; D199-M204 WeakPolarHBondContact OD2-CB 3.49Å; D199-M204 PolarHBondContact OD2-N 2.93Å; M204-T217 HydrophobicContact SD-CG2 4.12Å; M204-F218 CarbonylContact C-O 3.41Å; M204-F218 WeakPolarHBondContact CA-O 3.34Å; M204-F218 WeakPolarHBondContact CB-O 3.48Å; M204-R219 HydrophobicContact CG-CB 4.23Å; M204-R219 HydrophobicContact CG-CG 4.36Å
205	I	96.7	Very high	91.2	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.6	168.5	60.3	178.6	0	0	0	108.3	F191 F218 A226 W229 F230 I233	F191-I205 WeakPolarHBondContact O-CA 3.5Å; I205-F218 HydrophobicContact CD1-CB 4.28Å; I205-F218 HydrophobicContact CD1-CD2 4.48Å; I205-F218 HydrophobicContact CG1-CB 3.68Å; I205-F218 HydrophobicContact CG1-CD2 4.16Å; I205-F218 HydrophobicContact CG1-CG 4.32Å; I205-F218 PolarHBondContact N-O 2.87Å; I205-F218 PolarHBondContact O-N 2.76Å; I205-A226 HydrophobicContact CG2-CB 4.34Å; I205-W229 HydrophobicContact CD1-CB 3.98Å; I205-F230 HydrophobicContact CG2-CB 4.13Å; I205-F230 HydrophobicContact CG2-CD2 4.45Å; I205-I233 HydrophobicContact CD1-CD1 3.94Å
206	E	95.5	Very high	91.8	Very high	3 Å²	3	61.6 Å²	61.6	1%	0.014	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.7	177.2	-79.4	-175.6	172.9	0	0	110.5	L190 F191 S194 L195 I215 I216 T217	L190-E206 CarbonylContact C-O 3.56Å; L190-E206 WeakPolarHBondContact CA-O 3.35Å; F191-E206 HydrophobicContact CB-CB 4.46Å; F191-E206 PolarHBondContact N-O 3.01Å; F191-E206 PolarHBondContact O-N 3.27Å; S194-E206 VanDerWaalsContact CA-CD 3.46Å; S194-E206 WeakPolarHBondContact CA-OE1 3.44Å; S194-E206 WeakPolarHBondContact CB-OE1 3.48Å; S194-E206 PolarHBondContact OG-OE1 3.42Å; L195-E206 WeakPolarHBondContact CG-OE2 3.14Å; L195-E206 PolarHBondContact N-OE1 3.34Å; L195-E206 PolarHBondContact N-OE2 3.42Å; L195-E206 VanDerWaalsContact N-OE2 3.07Å; E206-I215 HydrophobicContact CB-CG2 4.03Å; E206-I215 HydrophobicContact CG-CG2 4.07Å; E206-I216 WeakPolarHBondContact CA-O 3.39Å; E206-T217 HydrophobicContact CG-CG2 3.78Å; E206-T217 WeakPolarHBondContact CG-OG1 3.32Å; E206-T217 PolarHBondContact OE1-OG1 3.14Å
207	I	95.5	Very high	92.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.6	174	-57.5	175.8	0	0	0	108	L30 W161 A188 Y189 L190 I215 I216 F218 I233 M237	L30-I207 HydrophobicContact CD2-CD1 3.55Å; W161-I207 HydrophobicContact CH2-CG2 3.86Å; W161-I207 HydrophobicContact CZ2-CG2 4.47Å; A188-I207 HydrophobicContact CB-CG2 4.34Å; Y189-I207 CarbonylContact O-C 3.58Å; Y189-I207 WeakPolarHBondContact O-CA 3.06Å; L190-I207 HydrophobicContact CD1-CD1 4.35Å; L190-I207 HydrophobicContact CD1-CG1 3.57Å; I207-I215 CarbonylContact O-C 3.51Å; I207-I215 WeakPolarHBondContact O-CA 3.37Å; I207-I216 PolarHBondContact N-O 3.23Å; I207-I216 PolarHBondContact O-N 3.18Å; I207-F218 HydrophobicContact CD1-CD2 4.34Å; I207-F218 HydrophobicContact CD1-CE2 3.75Å; I207-F218 HydrophobicContact CG1-CE2 4.21Å; I207-I233 HydrophobicContact CD1-CD1 3.96Å; I207-I233 HydrophobicContact CD1-CG2 4.36Å; I207-M237 HydrophobicContact CG2-CE 3.83Å
208	G	94.4	Very high	93	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	147.4	179.6	0	0	0	0	0	113.4	W161 A188 Y189 H214	W161-G208 WeakPolarHBondContact CH2-O 3.47Å; A188-G208 WeakPolarHBondContact CA-O 3.42Å; A188-G208 WeakPolarHBondContact CB-O 3.27Å; Y189-G208 WeakPolarHBondContact CD1-O 3.32Å; Y189-G208 VanDerWaalsContact CE1-C 3.47Å; Y189-G208 VanDerWaalsContact CZ-CA 3.45Å; Y189-G208 PolarHBondContact N-O 3.08Å; Y189-G208 PolarHBondContact O-N 3.39Å; G208-H214 CarbonylContact C-O 3.54Å; G208-H214 VanDerWaalsContact CA-O 3.25Å; G208-H214 WeakPolarHBondContact CA-O 3.34Å
209	S	94	Very high	93.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.24	C	C	.	.			trans	-72.3	156.1	-175.6	74	0	0	0	0	112.1	W161 D162 Y189 S211 R212 R213 H214	W161-S209 VanDerWaalsContact CZ2-CA 3.42Å; D162-S209 WeakPolarHBondContact OD1-CB 3.48Å; D162-S209 PolarHBondContact OD1-OG 3.18Å; D162-S209 WeakPolarHBondContact OD2-CB 3.49Å; D162-S209 PolarHBondContact OD2-OG 3.29Å; Y189-S209 VanDerWaalsContact CE1-O 3.3Å; Y189-S209 WeakPolarHBondContact CE1-O 3.41Å; S209-S211 PolarHBondContact O-N 3.47Å; S209-S211 VanDerWaalsContact O-N 3.09Å; S209-S211 PolarHBondContact OG-OG 3.43Å; S209-R212 WeakPolarHBondContact O-CA 3.39Å; S209-R212 PolarHBondContact O-N 3.46Å; S209-R213 PolarHBondContact OG-N 2.91Å; S209-H214 PolarHBondContact N-O 3.14Å; S209-H214 PolarHBondContact OG-N 3.01Å
210	P	92.2	Very high	93.6	Very high	37 Å²	37	51.2 Å²	51.2	24%	0.24	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-29.7	176.8	-26.5	32.7	0	0	0	114.4	D162 M187 R212 W263	D162-P210 VanDerWaalsContact OD2-CD 3.3Å; D162-P210 WeakPolarHBondContact OD2-CD 3.49Å; M187-P210 HydrophobicContact CB-CB 3.99Å; M187-P210 HydrophobicContact CB-CG 3.97Å; M187-P210 WeakPolarHBondContact O-CA 3.28Å; P210-R212 VanDerWaalsContact C-N 3.31Å; P210-W263 WeakPolarHBondContact O-CH2 3.34Å; P210-W263 WeakPolarHBondContact O-CZ2 3.49Å
211	S	89	Confident	94	Very high	49 Å²	49	47.6 Å²	47.6	34%	0.343	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.4	176.6	76.6	0	0	0	0	114.5	D162 S209 R213	D162-S211 VanDerWaalsContact CG-OG 3.22Å; D162-S211 WeakPolarHBondContact OD1-CB 3.39Å; D162-S211 PolarHBondContact OD1-OG 3.5Å; D162-S211 VanDerWaalsContact OD2-CB 3.24Å; D162-S211 WeakPolarHBondContact OD2-CB 3.47Å; D162-S211 PolarHBondContact OD2-N 3.03Å; D162-S211 PolarHBondContact OD2-OG 2.83Å; S209-S211 PolarHBondContact O-N 3.47Å; S209-S211 VanDerWaalsContact O-N 3.09Å; S209-S211 PolarHBondContact OG-OG 3.43Å; S211-R213 PolarHBondContact O-N 2.86Å; S211-R213 WeakPolarHBondContact OG-CB 3.2Å; S211-R213 VanDerWaalsContact OG-CG 3.29Å; S211-R213 WeakPolarHBondContact OG-CG 3.21Å; S211-R213 PolarHBondContact OG-N 2.69Å
212	R	88.9	Confident	94.2	Very high	144 Å²	144	45.3 Å²	45.3	54%	0.543	22%	0.218	S	C	.	.	S	Bend	trans	59.5	16.2	-170.4	-51.8	-174.8	179.3	179	4.8	115.1	Y189 S209 P210 W263	Y189-R212 HydrophobicContact CE1-CB 4.25Å; Y189-R212 HydrophobicContact CE1-CG 3.85Å; S209-R212 WeakPolarHBondContact O-CA 3.39Å; S209-R212 PolarHBondContact O-N 3.46Å; P210-R212 VanDerWaalsContact C-N 3.31Å; R212-W263 HydrophobicContact CG-CH2 4.11Å; R212-W263 HydrophobicContact CG-CZ3 3.95Å; R212-W263 VanDerWaalsContact NE-CE3 3.34Å; R212-W263 VanDerWaalsContact NH2-CZ3 3.33Å
213	R	89.7	Confident	94.3	Very high	204 Å²	204	42.8 Å²	42.8	77%	0.77	21%	0.212	S	C	*	.	S	Bend	trans	-87.8	-23.3	-179.7	-66.7	178.4	-179.6	-174.3	0.2	113.3	S209 S211	S209-R213 PolarHBondContact OG-N 2.91Å; S211-R213 PolarHBondContact O-N 2.86Å; S211-R213 WeakPolarHBondContact OG-CB 3.2Å; S211-R213 VanDerWaalsContact OG-CG 3.29Å; S211-R213 WeakPolarHBondContact OG-CG 3.21Å; S211-R213 PolarHBondContact OG-N 2.69Å
214	H	91.8	Very high	94.3	Very high	55 Å²	55	44.1 Å²	44.1	26%	0.255	23%	0.23	S	C	.	.			trans	-125.2	134.3	-175.7	-54.1	-58.8	0	0	0	109.6	S160 W161 D162 G208 S209	S160-H214 WeakPolarHBondContact O-CB 3.47Å; W161-H214 HydrophobicContact CE3-CB 4.06Å; W161-H214 HydrophobicContact CZ3-CB 4.33Å; D162-H214 IonicContact OD1-CD2 2.79Å; D162-H214 PolarHBondContact OD1-CD2 2.8Å; G208-H214 CarbonylContact C-O 3.54Å; G208-H214 VanDerWaalsContact CA-O 3.25Å; G208-H214 WeakPolarHBondContact CA-O 3.34Å; S209-H214 PolarHBondContact N-O 3.14Å; S209-H214 PolarHBondContact OG-N 3.01Å
215	I	92.9	Very high	94.4	Very high	72 Å²	72	47.5 Å²	47.5	37%	0.369	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.5	175.4	-60.6	177	0	0	0	106.8	Y189 L195 E206 I207	Y189-I215 WeakPolarHBondContact OH-CG1 3.45Å; L195-I215 HydrophobicContact CD1-CD1 4.12Å; E206-I215 HydrophobicContact CB-CG2 4.03Å; E206-I215 HydrophobicContact CG-CG2 4.07Å; I207-I215 CarbonylContact O-C 3.51Å; I207-I215 WeakPolarHBondContact O-CA 3.37Å
216	I	94.3	Very high	94.4	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.036	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	115.7	175.8	-54.1	172.8	0	0	0	107.3	V12 I159 W161 I183 E206 I207 F218	V12-I216 HydrophobicContact CG2-CG2 3.61Å; I159-I216 HydrophobicContact CG2-CD1 3.48Å; I159-I216 VanDerWaalsContact CG2-CD1 3.48Å; I159-I216 HydrophobicContact CG2-CG1 3.73Å; W161-I216 HydrophobicContact CE3-CD1 3.82Å; W161-I216 HydrophobicContact CE3-CG1 4.32Å; W161-I216 HydrophobicContact CZ3-CD1 3.72Å; W161-I216 HydrophobicContact CZ3-CG1 3.96Å; I183-I216 HydrophobicContact CD1-CD1 3.48Å; I183-I216 VanDerWaalsContact CD1-CD1 3.48Å; I183-I216 HydrophobicContact CG1-CD1 3.77Å; I183-I216 HydrophobicContact CG2-CD1 4.43Å; E206-I216 WeakPolarHBondContact CA-O 3.39Å; I207-I216 PolarHBondContact N-O 3.23Å; I207-I216 PolarHBondContact O-N 3.18Å; I216-F218 HydrophobicContact CB-CE2 4.03Å; I216-F218 HydrophobicContact CB-CZ 4.45Å; I216-F218 HydrophobicContact CG2-CD2 4.09Å; I216-F218 HydrophobicContact CG2-CE1 4.17Å; I216-F218 HydrophobicContact CG2-CE2 3.46Å; I216-F218 VanDerWaalsContact CG2-CE2 3.46Å; I216-F218 HydrophobicContact CG2-CZ 3.52Å
217	T	95.1	Very high	94.4	Very high	11 Å²	11	49.5 Å²	49.5	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.1	175.7	-46.8	0	0	0	0	109.7	F13 W18 M204 E206	F13-T217 PolarHBondContact N-O 3.46Å; F13-T217 VanDerWaalsContact N-O 3.09Å; W18-T217 HydrophobicContact CH2-CG2 3.91Å; M204-T217 HydrophobicContact SD-CG2 4.12Å; E206-T217 HydrophobicContact CG-CG2 3.78Å; E206-T217 WeakPolarHBondContact CG-OG1 3.32Å; E206-T217 PolarHBondContact OE1-OG1 3.14Å
218	F	96.3	Very high	94.5	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	148.2	171.8	-60.1	-88.9	0	0	0	110.6	L10 E11 V12 V23 L30 L32 M204 I205 I207 I216	L10-F218 HydrophobicContact CB-CD1 4.36Å; L10-F218 HydrophobicContact CD1-CB 4.31Å; L10-F218 HydrophobicContact CD1-CD1 4.15Å; L10-F218 HydrophobicContact CD1-CG 4.39Å; E11-F218 CarbonylContact O-C 3.56Å; E11-F218 WeakPolarHBondContact O-CA 2.87Å; V12-F218 HydrophobicContact CB-CD1 4.28Å; V12-F218 HydrophobicContact CB-CE1 4.37Å; V12-F218 HydrophobicContact CG2-CD1 4.4Å; V12-F218 HydrophobicContact CG2-CE1 4.28Å; V23-F218 HydrophobicContact CG2-CD1 4.36Å; V23-F218 HydrophobicContact CG2-CE1 3.99Å; L30-F218 HydrophobicContact CD2-CE1 4.49Å; L30-F218 HydrophobicContact CD2-CE2 3.94Å; L30-F218 HydrophobicContact CD2-CZ 3.65Å; L32-F218 HydrophobicContact CD2-CE1 3.45Å; L32-F218 VanDerWaalsContact CD2-CE1 3.45Å; L32-F218 HydrophobicContact CD2-CZ 3.71Å; L32-F218 HydrophobicContact CG-CE1 4.25Å; L32-F218 HydrophobicContact CG-CZ 4.32Å; M204-F218 CarbonylContact C-O 3.41Å; M204-F218 WeakPolarHBondContact CA-O 3.34Å; M204-F218 WeakPolarHBondContact CB-O 3.48Å; I205-F218 HydrophobicContact CD1-CB 4.28Å; I205-F218 HydrophobicContact CD1-CD2 4.48Å; I205-F218 HydrophobicContact CG1-CB 3.68Å; I205-F218 HydrophobicContact CG1-CD2 4.16Å; I205-F218 HydrophobicContact CG1-CG 4.32Å; I205-F218 PolarHBondContact N-O 2.87Å; I205-F218 PolarHBondContact O-N 2.76Å; I207-F218 HydrophobicContact CD1-CD2 4.34Å; I207-F218 HydrophobicContact CD1-CE2 3.75Å; I207-F218 HydrophobicContact CG1-CE2 4.21Å; I216-F218 HydrophobicContact CB-CE2 4.03Å; I216-F218 HydrophobicContact CB-CZ 4.45Å; I216-F218 HydrophobicContact CG2-CD2 4.09Å; I216-F218 HydrophobicContact CG2-CE1 4.17Å; I216-F218 HydrophobicContact CG2-CE2 3.46Å; I216-F218 VanDerWaalsContact CG2-CE2 3.46Å; I216-F218 HydrophobicContact CG2-CZ 3.52Å
219	R	96.1	Very high	94.6	Very high	57 Å²	57	51.8 Å²	51.8	22%	0.215	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128	168.9	-177.6	173.1	71.9	-163.8	1.6	109.5	E11 W18 R203 M204	E11-R219 HydrophobicContact CB-CB 4.33Å; E11-R219 PolarHBondContact N-O 3.09Å; E11-R219 PolarHBondContact O-N 3.1Å; E11-R219 IonicContact OE1-CZ 3.24Å; E11-R219 IonicContact OE1-NH2 3.17Å; E11-R219 PolarHBondContact OE1-NH2 2.96Å; E11-R219 IonicContact OE2-CZ 3.61Å; E11-R219 IonicContact OE2-NE 2.99Å; E11-R219 PolarHBondContact OE2-NE 3.3Å; E11-R219 IonicContact OE2-NH2 3.67Å; E11-R219 PolarHBondContact OE2-NH2 3.19Å; W18-R219 VanDerWaalsContact CD1-NH1 3.35Å; W18-R219 HydrophobicContact CE3-CB 3.85Å; W18-R219 HydrophobicContact CH2-CB 3.73Å; W18-R219 HydrophobicContact CZ2-CB 4.45Å; W18-R219 HydrophobicContact CZ3-CB 3.4Å; R203-R219 HydrophobicContact CB-CG 4.3Å; M204-R219 HydrophobicContact CG-CB 4.23Å; M204-R219 HydrophobicContact CG-CG 4.36Å
220	C	96.9	Very high	94.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.014	29%	0.285	C	S	.	.			trans	-96.7	169.5	177	-48.5	0	0	0	0	111.3	L10 R203 N222 E225 A226	L10-C220 HydrophobicContact CD2-CB 3.9Å; L10-C220 VanDerWaalsContact CD2-SG 3.52Å; R203-C220 PolarHBondContact NH1-O 3.47Å; R203-C220 PolarHBondContact O-N 3.07Å; C220-N222 VanDerWaalsContact C-N 3.31Å; C220-N222 PolarHBondContact O-N 2.89Å; C220-E225 HydrophobicContact CB-CB 4.06Å; C220-A226 HydrophobicContact CB-CB 3.68Å; C220-A226 WeakPolarHBondContact SG-CA 3.43Å; C220-A226 WeakPolarHBondContact SG-CB 3.48Å
221	A	95.2	Very high	95	Very high	76 Å²	76	58.6 Å²	58.6	63%	0.628	30%	0.302	S	S	*	.	S	Bend	trans	-58.7	-41.1	-179.5	0	0	0	0	0	112.8	R203	R203-A221 WeakPolarHBondContact CD-O 3.33Å; R203-A221 PolarHBondContact NH1-O 3.24Å
222	N	96.5	Very high	95.4	Very high	70 Å²	70	57.3 Å²	57.3	37%	0.374	29%	0.293	S	S	.	.	S	Bend	trans	-152.3	175.3	-179.3	60.6	59.1	0	0	0	111.3	C220 S224 E225 A226	C220-N222 VanDerWaalsContact C-N 3.31Å; C220-N222 PolarHBondContact O-N 2.89Å; N222-S224 PolarHBondContact O-N 2.76Å; N222-S224 WeakPolarHBondContact OD1-CB 3.29Å; N222-S224 PolarHBondContact OD1-N 2.91Å; N222-S224 VanDerWaalsContact OD1-N 3.11Å; N222-E225 PolarHBondContact O-N 2.81Å; N222-E225 PolarHBondContact OD1-N 2.84Å; N222-A226 PolarHBondContact O-N 2.58Å; N222-A226 VanDerWaalsContact O-N 3.13Å
223	S	96.9	Very high	95.7	Very high	46 Å²	46	50.5 Å²	50.5	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-65.3	-36.3	-177.6	-172.1	0	0	0	0	113.4	R192 Q202 A226 S227	R192-S223 PolarHBondContact NH2-O 2.86Å; Q202-S223 WeakPolarHBondContact CB-OG 3.28Å; Q202-S223 VanDerWaalsContact O-CA 3.25Å; Q202-S223 WeakPolarHBondContact O-CA 3.36Å; Q202-S223 WeakPolarHBondContact O-CB 3.47Å; Q202-S223 PolarHBondContact O-OG 2.95Å; Q202-S223 VanDerWaalsContact O-OG 3.08Å; S223-A226 PolarHBondContact O-N 2.94Å; S223-S227 PolarHBondContact O-N 2.81Å; S223-S227 PolarHBondContact O-OG 3.39Å; S223-S227 VanDerWaalsContact O-OG 3.05Å
224	S	97.1	Very high	96	Very high	87 Å²	87	43 Å²	43	61%	0.608	24%	0.243	S	C	*	.	H	α-helix	trans	-63.5	-47.7	177.5	-54.8	0	0	0	0	111.3	N222 A226 S227 V228	N222-S224 PolarHBondContact O-N 2.76Å; N222-S224 WeakPolarHBondContact OD1-CB 3.29Å; N222-S224 PolarHBondContact OD1-N 2.91Å; N222-S224 VanDerWaalsContact OD1-N 3.11Å; S224-A226 VanDerWaalsContact C-N 3.34Å; S224-A226 PolarHBondContact O-N 2.84Å; S224-S227 PolarHBondContact O-N 3.48Å; S224-V228 VanDerWaalsContact O-CG2 3.29Å; S224-V228 WeakPolarHBondContact O-CG2 3.3Å; S224-V228 PolarHBondContact O-N 2.95Å
225	E	96.6	Very high	96.1	Very high	75 Å²	75	43.7 Å²	43.7	35%	0.35	25%	0.253	S	S	.	.	H	α-helix	trans	-58.1	-45.4	175.5	-80.3	-63	147.7	0	0	111.8	C220 N222 S227 V228 W229	C220-E225 HydrophobicContact CB-CB 4.06Å; N222-E225 PolarHBondContact O-N 2.81Å; N222-E225 PolarHBondContact OD1-N 2.84Å; E225-S227 VanDerWaalsContact C-N 3.33Å; E225-S227 PolarHBondContact O-N 2.83Å; E225-V228 PolarHBondContact O-N 2.63Å; E225-W229 WeakPolarHBondContact O-CB 3.46Å; E225-W229 PolarHBondContact O-N 3.11Å
226	A	97.2	Very high	96.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.3	-33.3	179.2	0	0	0	0	0	112.9	R203 I205 C220 N222 S223 S224 F230	R203-A226 WeakPolarHBondContact O-CB 3.41Å; I205-A226 HydrophobicContact CG2-CB 4.34Å; C220-A226 HydrophobicContact CB-CB 3.68Å; C220-A226 WeakPolarHBondContact SG-CA 3.43Å; C220-A226 WeakPolarHBondContact SG-CB 3.48Å; N222-A226 PolarHBondContact O-N 2.58Å; N222-A226 VanDerWaalsContact O-N 3.13Å; S223-A226 PolarHBondContact O-N 2.94Å; S224-A226 VanDerWaalsContact C-N 3.34Å; S224-A226 PolarHBondContact O-N 2.84Å; A226-F230 VanDerWaalsContact O-CB 3.25Å; A226-F230 WeakPolarHBondContact O-CB 3.33Å; A226-F230 PolarHBondContact O-N 3.22Å
227	S	96.9	Very high	96.3	Very high	45 Å²	45	40.7 Å²	40.7	32%	0.315	24%	0.238	S	C	.	.	H	α-helix	trans	-67.3	-39.3	172.6	-64.3	0	0	0	0	112.2	R192 S223 S224 E225 F230 Q231	R192-S227 PolarHBondContact NH2-OG 3.26Å; S223-S227 PolarHBondContact O-N 2.81Å; S223-S227 PolarHBondContact O-OG 3.39Å; S223-S227 VanDerWaalsContact O-OG 3.05Å; S224-S227 PolarHBondContact O-N 3.48Å; E225-S227 VanDerWaalsContact C-N 3.33Å; E225-S227 PolarHBondContact O-N 2.83Å; S227-F230 PolarHBondContact O-N 3.27Å; S227-Q231 WeakPolarHBondContact O-CB 3.44Å; S227-Q231 VanDerWaalsContact O-CG 3.28Å; S227-Q231 WeakPolarHBondContact O-CG 3.48Å; S227-Q231 PolarHBondContact O-N 3.07Å
228	V	96.6	Very high	96.2	Very high	48 Å²	48	45.5 Å²	45.5	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-68.4	-42.5	177.5	170.3	0	0	0	0	111.4	S224 E225 Q231 S232	S224-V228 VanDerWaalsContact O-CG2 3.29Å; S224-V228 WeakPolarHBondContact O-CG2 3.3Å; S224-V228 PolarHBondContact O-N 2.95Å; E225-V228 PolarHBondContact O-N 2.63Å; V228-Q231 PolarHBondContact O-N 2.78Å; V228-S232 WeakPolarHBondContact O-CB 3.42Å; V228-S232 PolarHBondContact O-N 3.43Å; V228-S232 PolarHBondContact O-OG 3Å
229	W	97.5	Very high	96.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-46.1	171.9	-91.8	103	0	0	0	111.8	R6 S8 L10 V23 L25 L30 I205 E225 Q231 S232 I233	R6-W229 HydrophobicContact CB-CH2 4.29Å; R6-W229 HydrophobicContact CB-CZ3 4.48Å; R6-W229 HydrophobicContact CG-CH2 3.83Å; R6-W229 HydrophobicContact CG-CZ2 3.76Å; R6-W229 HydrophobicContact CG-CZ3 4.24Å; S8-W229 WeakPolarHBondContact OG-CZ2 3.25Å; S8-W229 PolarHBondContact OG-NE1 3.36Å; L10-W229 HydrophobicContact CD1-CD2 4.11Å; L10-W229 HydrophobicContact CD1-CG 4.4Å; L10-W229 HydrophobicContact CD1-CZ2 4.39Å; V23-W229 HydrophobicContact CB-CH2 4.09Å; V23-W229 HydrophobicContact CB-CZ2 4.42Å; V23-W229 HydrophobicContact CG1-CH2 3.81Å; V23-W229 HydrophobicContact CG1-CZ3 3.99Å; V23-W229 WeakPolarHBondContact O-CH2 3.12Å; L25-W229 HydrophobicContact CB-CH2 4.49Å; L25-W229 HydrophobicContact CB-CZ3 3.94Å; L30-W229 HydrophobicContact CD1-CZ3 4Å; I205-W229 HydrophobicContact CD1-CB 3.98Å; E225-W229 WeakPolarHBondContact O-CB 3.46Å; E225-W229 PolarHBondContact O-N 3.11Å; W229-Q231 PolarHBondContact O-N 3.21Å; W229-S232 PolarHBondContact O-N 3.19Å; W229-I233 HydrophobicContact CE3-CD1 3.92Å; W229-I233 HydrophobicContact CE3-CG1 4.2Å; W229-I233 WeakPolarHBondContact O-CG1 3.43Å; W229-I233 PolarHBondContact O-N 3.41Å
230	F	97.1	Very high	96	Very high	53 Å²	53	46 Å²	46	23%	0.232	27%	0.272	C	S	.	.	H	α-helix	trans	-56.3	-51.3	176.6	-180	-84.9	0	0	0	111.4	L190 R192 I205 A226 S227 S232 I233 N234	L190-F230 HydrophobicContact CB-CE2 4.42Å; L190-F230 HydrophobicContact CD1-CD2 4.26Å; L190-F230 HydrophobicContact CD2-CB 4.49Å; L190-F230 HydrophobicContact CD2-CD1 4.4Å; L190-F230 HydrophobicContact CD2-CD2 3.46Å; L190-F230 VanDerWaalsContact CD2-CD2 3.46Å; L190-F230 HydrophobicContact CD2-CE2 3.61Å; L190-F230 HydrophobicContact CD2-CG 3.89Å; L190-F230 HydrophobicContact CD2-CZ 4.14Å; L190-F230 WeakPolarHBondContact CD2-O 3.48Å; L190-F230 HydrophobicContact CG-CD2 3.59Å; L190-F230 HydrophobicContact CG-CE2 3.55Å; L190-F230 HydrophobicContact CG-CG 4.49Å; L190-F230 HydrophobicContact CG-CZ 4.41Å; R192-F230 HydrophobicContact CB-CD2 3.86Å; R192-F230 HydrophobicContact CB-CE2 3.9Å; I205-F230 HydrophobicContact CG2-CB 4.13Å; I205-F230 HydrophobicContact CG2-CD2 4.45Å; A226-F230 VanDerWaalsContact O-CB 3.25Å; A226-F230 WeakPolarHBondContact O-CB 3.33Å; A226-F230 PolarHBondContact O-N 3.22Å; S227-F230 PolarHBondContact O-N 3.27Å; F230-S232 VanDerWaalsContact C-N 3.32Å; F230-S232 PolarHBondContact O-N 3.46Å; F230-I233 PolarHBondContact O-N 3.1Å; F230-N234 HydrophobicContact CE1-CB 4.35Å; F230-N234 WeakPolarHBondContact O-CB 3.45Å; F230-N234 PolarHBondContact O-N 3.05Å
231	Q	96.3	Very high	95.8	Very high	128 Å²	128	47.1 Å²	47.1	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-60.7	-40.5	179.1	-73.1	170.7	1	0	0	112.5	S227 V228 W229 S235	S227-Q231 WeakPolarHBondContact O-CB 3.44Å; S227-Q231 VanDerWaalsContact O-CG 3.28Å; S227-Q231 WeakPolarHBondContact O-CG 3.48Å; S227-Q231 PolarHBondContact O-N 3.07Å; V228-Q231 PolarHBondContact O-N 2.78Å; W229-Q231 PolarHBondContact O-N 3.21Å; Q231-S235 WeakPolarHBondContact O-CB 3.45Å; Q231-S235 PolarHBondContact O-N 2.96Å
232	S	96.8	Very high	95.7	Very high	22 Å²	22	48.2 Å²	48.2	15%	0.154	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-48.7	179.7	-54.1	0	0	0	0	111.5	R6 V228 W229 F230 S235 C236	R6-S232 PolarHBondContact NH1-OG 3.47Å; V228-S232 WeakPolarHBondContact O-CB 3.42Å; V228-S232 PolarHBondContact O-N 3.43Å; V228-S232 PolarHBondContact O-OG 3Å; W229-S232 PolarHBondContact O-N 3.19Å; F230-S232 VanDerWaalsContact C-N 3.32Å; F230-S232 PolarHBondContact O-N 3.46Å; S232-S235 PolarHBondContact O-N 3.06Å; S232-C236 PolarHBondContact O-N 3.01Å
233	I	96.7	Very high	95.5	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-44	179.5	-64.1	164.3	0	0	0	110.1	L25 L185 L190 I205 I207 W229 F230 S235 C236 M237	L25-I233 HydrophobicContact CD1-CG1 4.24Å; L25-I233 HydrophobicContact CD2-CG1 4.04Å; L185-I233 HydrophobicContact CD2-CG2 4.27Å; L190-I233 HydrophobicContact CD1-CD1 4.49Å; L190-I233 HydrophobicContact CD1-CG2 4.15Å; L190-I233 HydrophobicContact CD2-CB 3.97Å; L190-I233 HydrophobicContact CD2-CG2 3.96Å; I205-I233 HydrophobicContact CD1-CD1 3.94Å; I207-I233 HydrophobicContact CD1-CD1 3.96Å; I207-I233 HydrophobicContact CD1-CG2 4.36Å; W229-I233 HydrophobicContact CE3-CD1 3.92Å; W229-I233 HydrophobicContact CE3-CG1 4.2Å; W229-I233 WeakPolarHBondContact O-CG1 3.43Å; W229-I233 PolarHBondContact O-N 3.41Å; F230-I233 PolarHBondContact O-N 3.1Å; I233-S235 VanDerWaalsContact C-N 3.31Å; I233-S235 PolarHBondContact O-N 3.42Å; I233-C236 PolarHBondContact O-N 2.82Å; I233-M237 HydrophobicContact CG2-CE 3.62Å; I233-M237 HydrophobicContact CG2-CG 4.24Å; I233-M237 HydrophobicContact CG2-SD 4.08Å; I233-M237 WeakPolarHBondContact O-CG 3.38Å; I233-M237 PolarHBondContact O-N 3.27Å
234	N	95.2	Very high	95.3	Very high	47 Å²	47	47.5 Å²	47.5	25%	0.251	27%	0.266	S	S	.	.	H	α-helix	trans	-58.3	-43.7	178.9	-170.6	70.6	0	0	0	111.4	L190 F230 C236 M237 E238	L190-N234 HydrophobicContact CD2-CB 3.92Å; F230-N234 HydrophobicContact CE1-CB 4.35Å; F230-N234 WeakPolarHBondContact O-CB 3.45Å; F230-N234 PolarHBondContact O-N 3.05Å; N234-C236 PolarHBondContact O-N 3.38Å; N234-M237 PolarHBondContact O-N 3.08Å; N234-E238 VanDerWaalsContact ND2-CD 3.28Å; N234-E238 PolarHBondContact ND2-OE1 3.39Å; N234-E238 WeakPolarHBondContact O-CB 3.3Å; N234-E238 WeakPolarHBondContact O-CG 3.4Å; N234-E238 PolarHBondContact O-N 3.02Å
235	S	95	Very high	95.1	Very high	69 Å²	69	44.4 Å²	44.4	48%	0.483	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-41.2	176.9	-178.1	0	0	0	0	112.7	Q231 S232 I233 S239	Q231-S235 WeakPolarHBondContact O-CB 3.45Å; Q231-S235 PolarHBondContact O-N 2.96Å; S232-S235 PolarHBondContact O-N 3.06Å; I233-S235 VanDerWaalsContact C-N 3.31Å; I233-S235 PolarHBondContact O-N 3.42Å; S235-S239 PolarHBondContact O-N 2.76Å
236	C	95.2	Very high	95	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-45.8	173.8	-64.7	0	0	0	0	111.5	M5 L185 S232 I233 N234 E238 S239 L240	M5-C236 PolarHBondContact SD-SG 3.49Å; L185-C236 HydrophobicContact CD1-CB 4.23Å; S232-C236 PolarHBondContact O-N 3.01Å; I233-C236 PolarHBondContact O-N 2.82Å; N234-C236 PolarHBondContact O-N 3.38Å; C236-E238 PolarHBondContact O-N 3.26Å; C236-S239 PolarHBondContact O-N 2.79Å; C236-L240 WeakPolarHBondContact O-CG 2.96Å; C236-L240 PolarHBondContact O-N 3.48Å
237	M	94.6	Very high	94.8	Very high	10 Å²	10	47 Å²	47	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-42.1	179.3	-73	-175.1	176.1	0	0	112.3	L185 A188 L190 I207 I233 N234 L240 M241	L185-M237 HydrophobicContact CB-CE 4.44Å; L185-M237 HydrophobicContact CB-CG 4.11Å; L185-M237 HydrophobicContact CD2-CE 3.63Å; A188-M237 HydrophobicContact CB-CE 3.62Å; A188-M237 HydrophobicContact CB-SD 4.48Å; L190-M237 HydrophobicContact CB-CE 4.19Å; L190-M237 HydrophobicContact CB-SD 3.78Å; I207-M237 HydrophobicContact CG2-CE 3.83Å; I233-M237 HydrophobicContact CG2-CE 3.62Å; I233-M237 HydrophobicContact CG2-CG 4.24Å; I233-M237 HydrophobicContact CG2-SD 4.08Å; I233-M237 WeakPolarHBondContact O-CG 3.38Å; I233-M237 PolarHBondContact O-N 3.27Å; N234-M237 PolarHBondContact O-N 3.08Å; M237-L240 PolarHBondContact O-N 3.27Å; M237-M241 WeakPolarHBondContact O-CB 3.43Å; M237-M241 VanDerWaalsContact O-CG 3.29Å; M237-M241 WeakPolarHBondContact O-CG 3.49Å; M237-M241 PolarHBondContact O-N 2.93Å
238	E	93.5	Very high	94.5	Very high	111 Å²	111	46.9 Å²	46.9	52%	0.519	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-46.1	176.7	-77	175.6	176.2	0	0	111.5	N234 C236 L240 M241 T242	N234-E238 VanDerWaalsContact ND2-CD 3.28Å; N234-E238 PolarHBondContact ND2-OE1 3.39Å; N234-E238 WeakPolarHBondContact O-CB 3.3Å; N234-E238 WeakPolarHBondContact O-CG 3.4Å; N234-E238 PolarHBondContact O-N 3.02Å; C236-E238 PolarHBondContact O-N 3.26Å; E238-L240 PolarHBondContact O-N 2.86Å; E238-M241 PolarHBondContact O-N 3.09Å; E238-T242 PolarHBondContact O-N 3.39Å; E238-T242 PolarHBondContact O-OG1 3.14Å
239	S	93.7	Very high	94.4	Very high	62 Å²	62	46 Å²	46	43%	0.434	26%	0.255	S	S	.	.	H	α-helix	trans	-58.8	-45.9	174.4	173.3	0	0	0	0	112	S235 C236 M241 T242 Q243	S235-S239 PolarHBondContact O-N 2.76Å; C236-S239 PolarHBondContact O-N 2.79Å; S239-M241 VanDerWaalsContact C-N 3.3Å; S239-M241 PolarHBondContact O-N 3.12Å; S239-T242 WeakPolarHBondContact O-CB 3.46Å; S239-T242 PolarHBondContact O-N 2.87Å; S239-Q243 WeakPolarHBondContact O-CG 3.45Å; S239-Q243 PolarHBondContact O-N 3.31Å; S239-Q243 VanDerWaalsContact O-N 3.1Å
240	L	94.5	Very high	94.2	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-33.9	176.9	-71	169.6	0	0	0	112.5	T28 L185 K186 C236 M237 E238 Q243 A244	T28-L240 HydrophobicContact CG2-CD2 4.19Å; L185-L240 HydrophobicContact CB-CD1 3.67Å; K186-L240 HydrophobicContact CB-CB 4.37Å; K186-L240 HydrophobicContact CB-CD1 4.37Å; K186-L240 HydrophobicContact CG-CB 4.46Å; C236-L240 WeakPolarHBondContact O-CG 2.96Å; C236-L240 PolarHBondContact O-N 3.48Å; M237-L240 PolarHBondContact O-N 3.27Å; E238-L240 PolarHBondContact O-N 2.86Å; L240-Q243 PolarHBondContact O-N 3.23Å; L240-A244 WeakPolarHBondContact O-CB 3.33Å; L240-A244 PolarHBondContact O-N 2.86Å
241	M	93.2	Very high	94	Very high	26 Å²	26	57.6 Å²	57.6	13%	0.128	32%	0.315	C	S	.	.	H	α-helix	trans	-70.3	-37.4	175.5	-76	-58.3	-59.5	0	0	111.9	M187 M237 E238 S239 Q243 A244 N245 M261	M187-M241 HydrophobicContact CB-SD 4.49Å; M187-M241 HydrophobicContact CG-SD 4.11Å; M237-M241 WeakPolarHBondContact O-CB 3.43Å; M237-M241 VanDerWaalsContact O-CG 3.29Å; M237-M241 WeakPolarHBondContact O-CG 3.49Å; M237-M241 PolarHBondContact O-N 2.93Å; E238-M241 PolarHBondContact O-N 3.09Å; S239-M241 VanDerWaalsContact C-N 3.3Å; S239-M241 PolarHBondContact O-N 3.12Å; M241-Q243 VanDerWaalsContact C-N 3.31Å; M241-Q243 PolarHBondContact O-N 3.39Å; M241-A244 PolarHBondContact O-N 3.15Å; M241-N245 WeakPolarHBondContact O-CB 3.29Å; M241-N245 VanDerWaalsContact O-CG 3.26Å; M241-N245 PolarHBondContact O-N 3.09Å; M241-N245 PolarHBondContact O-ND2 3.4Å; M241-M261 VanDerWaalsContact CE-C 3.45Å; M241-M261 HydrophobicContact CE-CB 3.99Å; M241-M261 HydrophobicContact CE-CE 4Å; M241-M261 HydrophobicContact CE-CG 4.06Å; M241-M261 WeakPolarHBondContact CE-O 3.49Å
242	T	93	Very high	93.8	Very high	99 Å²	99	55.1 Å²	55.1	61%	0.607	31%	0.306	S	S	*	.	H	α-helix	trans	-59.5	-44	170.5	-56.8	0	0	0	0	111.1	E238 S239 N245 A246	E238-T242 PolarHBondContact O-N 3.39Å; E238-T242 PolarHBondContact O-OG1 3.14Å; S239-T242 WeakPolarHBondContact O-CB 3.46Å; S239-T242 PolarHBondContact O-N 2.87Å; T242-N245 PolarHBondContact O-N 2.97Å; T242-A246 PolarHBondContact O-N 3.21Å; T242-A246 VanDerWaalsContact O-N 3.09Å
243	Q	92.7	Very high	93.5	Very high	96 Å²	96	57.4 Å²	57.4	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-64	-44.5	175.6	-65.4	174.1	31	0	0	111.7	S239 L240 M241 N245 A246 E247	S239-Q243 WeakPolarHBondContact O-CG 3.45Å; S239-Q243 PolarHBondContact O-N 3.31Å; S239-Q243 VanDerWaalsContact O-N 3.1Å; L240-Q243 PolarHBondContact O-N 3.23Å; M241-Q243 VanDerWaalsContact C-N 3.31Å; M241-Q243 PolarHBondContact O-N 3.39Å; Q243-N245 VanDerWaalsContact C-N 3.33Å; Q243-N245 PolarHBondContact O-N 3.42Å; Q243-A246 PolarHBondContact O-N 2.64Å; Q243-E247 WeakPolarHBondContact O-CG 3.24Å; Q243-E247 PolarHBondContact O-N 2.74Å
244	A	92.9	Very high	92.8	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.033	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-40.6	176.4	0	0	0	0	0	112.2	L240 M241 E247 V248 M261	L240-A244 WeakPolarHBondContact O-CB 3.33Å; L240-A244 PolarHBondContact O-N 2.86Å; M241-A244 PolarHBondContact O-N 3.15Å; A244-E247 PolarHBondContact O-N 3.39Å; A244-V248 WeakPolarHBondContact O-CG2 3.16Å; A244-V248 PolarHBondContact O-N 3.23Å; A244-M261 HydrophobicContact CB-CE 3.85Å
245	N	92.7	Very high	92.4	Very high	23 Å²	23	64.6 Å²	64.6	12%	0.123	38%	0.376	C	S	.	.	H	α-helix	trans	-61.3	-44.4	174.5	-74.8	-30	0	0	0	112	M241 T242 Q243 V248 N249 M261	M241-N245 WeakPolarHBondContact O-CB 3.29Å; M241-N245 VanDerWaalsContact O-CG 3.26Å; M241-N245 PolarHBondContact O-N 3.09Å; M241-N245 PolarHBondContact O-ND2 3.4Å; T242-N245 PolarHBondContact O-N 2.97Å; Q243-N245 VanDerWaalsContact C-N 3.33Å; Q243-N245 PolarHBondContact O-N 3.42Å; N245-V248 PolarHBondContact O-N 2.83Å; N245-N249 PolarHBondContact O-N 3.3Å; N245-N249 PolarHBondContact O-ND2 2.94Å; N245-M261 WeakPolarHBondContact OD1-CB 3.44Å; N245-M261 PolarHBondContact OD1-N 3.47Å
246	A	92.7	Very high	92	Very high	53 Å²	53	66 Å²	66	44%	0.438	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-43.3	176.8	0	0	0	0	0	111.7	T242 Q243 N249 L250	T242-A246 PolarHBondContact O-N 3.21Å; T242-A246 VanDerWaalsContact O-N 3.09Å; Q243-A246 PolarHBondContact O-N 2.64Å; A246-N249 PolarHBondContact O-N 3.35Å; A246-L250 WeakPolarHBondContact O-CG 3.33Å; A246-L250 PolarHBondContact O-N 3.48Å
247	E	93	Very high	91.8	Very high	77 Å²	77	71.7 Å²	71.7	36%	0.36	41%	0.409	S	S	.	.	H	α-helix	trans	-61.5	-44.8	175.7	-72.6	173.8	-155.5	0	0	112.4	K186 Q243 A244 N249 L250 M251	K186-E247 IonicContact NZ-OE1 2.74Å; K186-E247 PolarHBondContact NZ-OE1 2.59Å; K186-E247 IonicContact NZ-OE2 2.64Å; K186-E247 PolarHBondContact NZ-OE2 3.19Å; Q243-E247 WeakPolarHBondContact O-CG 3.24Å; Q243-E247 PolarHBondContact O-N 2.74Å; A244-E247 PolarHBondContact O-N 3.39Å; E247-N249 PolarHBondContact O-N 2.99Å; E247-L250 WeakPolarHBondContact O-CB 2.89Å; E247-L250 PolarHBondContact O-N 3.25Å; E247-M251 VanDerWaalsContact O-CG 3.31Å; E247-M251 WeakPolarHBondContact O-CG 3.44Å; E247-M251 PolarHBondContact O-N 3.32Å
248	V	92.4	Very high	91.6	Very high	41 Å²	41	73 Å²	73	25%	0.248	42%	0.417	C	S	.	.	H	α-helix	trans	-61.8	-44.1	177	169.5	0	0	0	0	110.9	A244 N245 L250 M251 L252 V258 M261	A244-V248 WeakPolarHBondContact O-CG2 3.16Å; A244-V248 PolarHBondContact O-N 3.23Å; N245-V248 PolarHBondContact O-N 2.83Å; V248-L250 VanDerWaalsContact C-N 3.3Å; V248-L250 PolarHBondContact O-N 3.24Å; V248-M251 WeakPolarHBondContact O-CB 3.07Å; V248-M251 PolarHBondContact O-N 3.38Å; V248-M251 VanDerWaalsContact O-N 3.12Å; V248-L252 HydrophobicContact CG1-CD1 3.74Å; V248-L252 HydrophobicContact CG1-CG 4.25Å; V248-L252 WeakPolarHBondContact O-CG 3.33Å; V248-L252 PolarHBondContact O-N 2.94Å; V248-V258 HydrophobicContact CG1-CB 4.3Å; V248-V258 HydrophobicContact CG1-CG2 3.86Å; V248-M261 HydrophobicContact CG2-CE 4.08Å; V248-M261 HydrophobicContact CG2-SD 4.44Å
249	N	93.7	Very high	91.4	Very high	30 Å²	30	76 Å²	76	16%	0.16	43%	0.429	C	S	.	.	H	α-helix	trans	-62.4	-37.3	176.7	-78.5	-37	0	0	0	112.7	N245 A246 E247 L252 G253 G254 V258	N245-N249 PolarHBondContact O-N 3.3Å; N245-N249 PolarHBondContact O-ND2 2.94Å; A246-N249 PolarHBondContact O-N 3.35Å; E247-N249 PolarHBondContact O-N 2.99Å; N249-L252 PolarHBondContact O-N 2.99Å; N249-G253 PolarHBondContact O-N 3.49Å; N249-G254 PolarHBondContact O-N 3.36Å; N249-V258 PolarHBondContact ND2-O 3.24Å; N249-V258 WeakPolarHBondContact OD1-CA 3.46Å; N249-V258 PolarHBondContact OD1-N 2.89Å; N249-V258 PolarHBondContact OD1-O 3.24Å
250	L	93.8	Very high	91.1	Very high	144 Å²	144	81 Å²	81	75%	0.754	45%	0.448	S	S	*	.	H	α-helix	trans	-63.6	-42.7	172.4	-71.4	169.3	0	0	0	111.4	A246 E247 V248 L252 G253	A246-L250 WeakPolarHBondContact O-CG 3.33Å; A246-L250 PolarHBondContact O-N 3.48Å; E247-L250 WeakPolarHBondContact O-CB 2.89Å; E247-L250 PolarHBondContact O-N 3.25Å; V248-L250 VanDerWaalsContact C-N 3.3Å; V248-L250 PolarHBondContact O-N 3.24Å; L250-L252 VanDerWaalsContact C-N 3.34Å; L250-L252 PolarHBondContact O-N 3.34Å; L250-G253 PolarHBondContact O-N 2.72Å
251	M	92.6	Very high	90.7	Very high	152 Å²	152	83.4 Å²	83.4	75%	0.749	46%	0.459	S	S	*	.	H	α-helix	trans	-65.7	-35	177.4	-68.2	177.2	-168.7	0	0	112.9	E247 V248 G253	E247-M251 VanDerWaalsContact O-CG 3.31Å; E247-M251 WeakPolarHBondContact O-CG 3.44Å; E247-M251 PolarHBondContact O-N 3.32Å; V248-M251 WeakPolarHBondContact O-CB 3.07Å; V248-M251 PolarHBondContact O-N 3.38Å; V248-M251 VanDerWaalsContact O-N 3.12Å; M251-G253 VanDerWaalsContact C-N 3.26Å; M251-G253 PolarHBondContact O-N 3.48Å
252	L	92.6	Very high	90.4	Very high	77 Å²	77	84.7 Å²	84.7	40%	0.403	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-0.9	177.3	-65.9	174.4	0	0	0	113.4	V248 N249 L250 G254 M255 V258	V248-L252 HydrophobicContact CG1-CD1 3.74Å; V248-L252 HydrophobicContact CG1-CG 4.25Å; V248-L252 WeakPolarHBondContact O-CG 3.33Å; V248-L252 PolarHBondContact O-N 2.94Å; N249-L252 PolarHBondContact O-N 2.99Å; L250-L252 VanDerWaalsContact C-N 3.34Å; L250-L252 PolarHBondContact O-N 3.34Å; L252-G254 PolarHBondContact O-N 2.88Å; L252-M255 PolarHBondContact O-N 3.12Å; L252-V258 HydrophobicContact CD1-CG2 3.58Å
253	G	90.7	Very high	90	Very high	69 Å²	69	84.4 Å²	84.4	71%	0.711	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	21.6	-174.4	0	0	0	0	0	113.6	N249 L250 M251 M255	N249-G253 PolarHBondContact O-N 3.49Å; L250-G253 PolarHBondContact O-N 2.72Å; M251-G253 VanDerWaalsContact C-N 3.26Å; M251-G253 PolarHBondContact O-N 3.48Å; G253-M255 VanDerWaalsContact C-N 3.33Å; G253-M255 PolarHBondContact O-N 3.4Å
254	G	80	Confident	89.4	Confident	33 Å²	33	87.3 Å²	87.3	34%	0.34	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	1	-179.2	0	0	0	0	0	116.3	N249 L252 E257	N249-G254 PolarHBondContact O-N 3.36Å; L252-G254 PolarHBondContact O-N 2.88Å; G254-E257 PolarHBondContact O-N 3.21Å
255	M	87	Confident	88.5	Confident	166 Å²	166	92.6 Å²	92.6	82%	0.818	52%	0.52	S	S	*	.	S	Bend	trans	-139.3	109.9	-176.9	-71.9	-84.7	-97.3	0	0	111.2	L252 G253	L252-M255 PolarHBondContact O-N 3.12Å; G253-M255 VanDerWaalsContact C-N 3.33Å; G253-M255 PolarHBondContact O-N 3.4Å
256	P	86.5	Confident	87.8	Confident	99 Å²	99	99.5 Å²	99.5	64%	0.643	55%	0.552	S	S	*	*	S	Bend	cis	-69.6	151.4	-2.6	31	-35.2	0	0	0	112.2
257	E	91.1	Very high	86.8	Confident	125 Å²	125	106.2 Å²	106.2	58%	0.584	57%	0.571	S	S	*	*			trans	-80.6	118.3	172	-174.5	-170.5	-160.2	0	0	110.1	G254 K259	G254-E257 PolarHBondContact O-N 3.21Å; E257-K259 HydrophobicContact CG-CG 4.43Å; E257-K259 PolarHBondContact O-N 3.21Å; E257-K259 WeakPolarHBondContact OE2-CE 3.31Å
258	V	91	Very high	86	Confident	37 Å²	37	107.4 Å²	107.4	22%	0.224	58%	0.583	C	S	.	*			trans	-79.8	103.9	169.2	179.3	0	0	0	0	108.6	V248 N249 L252 M261	V248-V258 HydrophobicContact CG1-CB 4.3Å; V248-V258 HydrophobicContact CG1-CG2 3.86Å; N249-V258 PolarHBondContact ND2-O 3.24Å; N249-V258 WeakPolarHBondContact OD1-CA 3.46Å; N249-V258 PolarHBondContact OD1-N 2.89Å; N249-V258 PolarHBondContact OD1-O 3.24Å; L252-V258 HydrophobicContact CD1-CG2 3.58Å; V258-M261 HydrophobicContact CG1-CB 4.36Å
259	K	89.9	Confident	84.7	Confident	174 Å²	174	114 Å²	114	76%	0.757	61%	0.614	S	S	*	*			trans	-79	-32.9	178.9	-64.5	-170.8	176.7	-174.6	0	113.3	E257	E257-K259 HydrophobicContact CG-CG 4.43Å; E257-K259 PolarHBondContact O-N 3.21Å; E257-K259 WeakPolarHBondContact OE2-CE 3.31Å
260	M	86.4	Confident	82.8	Confident	168 Å²	168	123.2 Å²	123.2	83%	0.828	66%	0.663	S	S	*	*			trans	-150.7	131	-176.6	-168.8	173.5	73.3	0	0	109.6
261	M	87.3	Confident	82.2	Confident	59 Å²	59	122.2 Å²	122.2	29%	0.291	66%	0.658	S	S	.	*			trans	-127.4	147.6	168.6	-171.5	173.2	51.7	0	0	107.3	M241 A244 N245 V248 V258	M241-M261 VanDerWaalsContact CE-C 3.45Å; M241-M261 HydrophobicContact CE-CB 3.99Å; M241-M261 HydrophobicContact CE-CE 4Å; M241-M261 HydrophobicContact CE-CG 4.06Å; M241-M261 WeakPolarHBondContact CE-O 3.49Å; A244-M261 HydrophobicContact CB-CE 3.85Å; N245-M261 WeakPolarHBondContact OD1-CB 3.44Å; N245-M261 PolarHBondContact OD1-N 3.47Å; V248-M261 HydrophobicContact CG2-CE 4.08Å; V248-M261 HydrophobicContact CG2-SD 4.44Å; V258-M261 HydrophobicContact CG1-CB 4.36Å
262	G	85.6	Confident	81.7	Confident	53 Å²	53	120.6 Å²	120.6	55%	0.546	65%	0.654	S	S	.	*			trans	172.4	-176.6	178.6	0	0	0	0	0	111.9
263	W	86.1	Confident	81.1	Confident	92 Å²	92	123 Å²	123	35%	0.348	67%	0.667	S	S	.	*			trans	-91.1	131.1	176.6	-64.6	103.7	0	0	0	110.2	M187 A188 Y189 P210 R212	M187-W263 WeakPolarHBondContact O-CZ2 3.46Å; M187-W263 PolarHBondContact O-NE1 3.49Å; A188-W263 PolarHBondContact O-NE1 3.43Å; Y189-W263 VanDerWaalsContact CB-CD1 3.47Å; Y189-W263 HydrophobicContact CD1-CD2 4.22Å; Y189-W263 HydrophobicContact CD1-CG 4.48Å; Y189-W263 HydrophobicContact CG-CG 4.44Å; P210-W263 WeakPolarHBondContact O-CH2 3.34Å; P210-W263 WeakPolarHBondContact O-CZ2 3.49Å; R212-W263 HydrophobicContact CG-CH2 4.11Å; R212-W263 HydrophobicContact CG-CZ3 3.95Å; R212-W263 VanDerWaalsContact NE-CE3 3.34Å; R212-W263 VanDerWaalsContact NH2-CZ3 3.33Å
264	L	80	Confident	80.5	Confident	158 Å²	158	126.2 Å²	126.2	83%	0.827	67%	0.665	S	S	*	*			trans	-100.5	123.9	168.9	-165.9	77	0	0	0	108.1
265	C	73.9	Confident	80.5	Confident	114 Å²	114	132 Å²	132	77%	0.77	69%	0.685	S	S	*	*			trans	-109.8	139.8	169.4	61.9	0	0	0	0	109.6
266	E	78.1	Confident	80.1	Confident	169 Å²	169	129.7 Å²	129.7	79%	0.79	68%	0.676	S	S	*	*			trans	-110.3	127	171.9	-178.3	177.1	-161.5	0	0	107.9	V268	E266-V268 HydrophobicContact CG-CG2 4.39Å; E266-V268 PolarHBondContact O-N 3.44Å
267	K	71.2	Confident	79.7	Confident	193 Å²	193	131.9 Å²	131.9	84%	0.839	68%	0.679	S	S	*	*			trans	-86.7	100.3	170.8	-174.5	179	-179.2	179.4	0	108.2	M269	K267-M269 PolarHBondContact O-N 3.42Å
268	V	75.3	Confident	78.8	Confident	102 Å²	102	132.5 Å²	132.5	62%	0.618	69%	0.686	S	S	*	*			trans	-75.4	122.9	172.2	-170.9	0	0	0	0	108.1	E266 N270	E266-V268 HydrophobicContact CG-CG2 4.39Å; E266-V268 PolarHBondContact O-N 3.44Å; V268-N270 PolarHBondContact O-N 3.36Å
269	M	66.6	Low	77.8	Confident	180 Å²	180	140.4 Å²	140.4	89%	0.887	72%	0.724	S	S	*	*			trans	-74.6	109.5	169.4	-65.9	-170.4	-126.7	0	0	107.7	K267	K267-M269 PolarHBondContact O-N 3.42Å
270	N	52.7	Low	76.7	Confident	223 Å²	223	137.4 Å²	137.4	100%	1.193	72%	0.722	S	S	*	*			trans	-82.4	0	161.4	-77.7	-1.2	0	0	0	109.9	V268	V268-N270 PolarHBondContact O-N 3.36Å

Retrieved 270 of 270 residues in 364.6 ms (Link to these results)

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